smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@H](C(=O)NC[C@H]1Cc2ccccc2CN1)c1cccc([N+](=O)[O-])c1 ZINC001575069785 1088225819 /nfs/dbraw/zinc/22/58/19/1088225819.db2.gz NCYZGGZVUREXLI-SUMWQHHRSA-N 0 3 339.395 2.529 20 5 EFBDHN Cc1cc(F)c([N+](=O)[O-])cc1C(=O)Nc1ccnc([C@H]2CCCN2)n1 ZINC001579609103 1090642560 /nfs/dbraw/zinc/64/25/60/1090642560.db2.gz ZNCSSLAGSPMANO-GFCCVEGCSA-N 0 3 345.334 2.509 20 5 EFBDHN N[C@H](CC1CC1)C(=O)N[C@@H](c1cccc([N+](=O)[O-])c1F)C(F)(F)F ZINC001580122252 1090780384 /nfs/dbraw/zinc/78/03/84/1090780384.db2.gz QCTNNOGTVLEZCM-SKDRFNHKSA-N 0 3 349.284 2.581 20 5 EFBDHN O=C(C[C@@H]1NCc2ccccc21)N1CCc2c1ccc([N+](=O)[O-])c2F ZINC001580523019 1090930975 /nfs/dbraw/zinc/93/09/75/1090930975.db2.gz OLYWWIXPRMWFKD-AWEZNQCLSA-N 0 3 341.342 2.858 20 5 EFBDHN CC(C)(C)[C@H]1CCC[N@@H+]1Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001589104069 1093031298 /nfs/dbraw/zinc/03/12/98/1093031298.db2.gz YPOKRUUXEAEKGK-CQSZACIVSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)(C)[C@H]1CCC[N@H+]1Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001589104069 1093031305 /nfs/dbraw/zinc/03/13/05/1093031305.db2.gz YPOKRUUXEAEKGK-CQSZACIVSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)(C)[C@H]1CCC[N@@H+]1Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001589104069 1093031312 /nfs/dbraw/zinc/03/13/12/1093031312.db2.gz YPOKRUUXEAEKGK-CQSZACIVSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)(C)[C@H]1CCC[N@H+]1Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001589104069 1093031320 /nfs/dbraw/zinc/03/13/20/1093031320.db2.gz YPOKRUUXEAEKGK-CQSZACIVSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)[NH+](CCCNc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])C(C)C ZINC001589696419 1093126842 /nfs/dbraw/zinc/12/68/42/1093126842.db2.gz DCTZZFFZZNTFTL-UHFFFAOYSA-N 0 3 347.423 2.696 20 5 EFBDHN CC(C)[NH+](CCCNc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])C(C)C ZINC001589696419 1093126847 /nfs/dbraw/zinc/12/68/47/1093126847.db2.gz DCTZZFFZZNTFTL-UHFFFAOYSA-N 0 3 347.423 2.696 20 5 EFBDHN CC1(C)CCC[N@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC1 ZINC001590096715 1093266887 /nfs/dbraw/zinc/26/68/87/1093266887.db2.gz JYHIYTUKQGCDQY-UHFFFAOYSA-N 0 3 330.392 2.787 20 5 EFBDHN CC1(C)CCC[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC1 ZINC001590096715 1093266894 /nfs/dbraw/zinc/26/68/94/1093266894.db2.gz JYHIYTUKQGCDQY-UHFFFAOYSA-N 0 3 330.392 2.787 20 5 EFBDHN CC1(C)CCC[N@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])CC1 ZINC001590096715 1093266900 /nfs/dbraw/zinc/26/69/00/1093266900.db2.gz JYHIYTUKQGCDQY-UHFFFAOYSA-N 0 3 330.392 2.787 20 5 EFBDHN CC1(C)CCC[N@@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])CC1 ZINC001590096715 1093266906 /nfs/dbraw/zinc/26/69/06/1093266906.db2.gz JYHIYTUKQGCDQY-UHFFFAOYSA-N 0 3 330.392 2.787 20 5 EFBDHN C[C@H]1CC[N@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC12CCC2 ZINC001590272556 1093354806 /nfs/dbraw/zinc/35/48/06/1093354806.db2.gz QMRBBYCDBVTBLG-LBPRGKRZSA-N 0 3 342.403 2.787 20 5 EFBDHN C[C@H]1CC[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC12CCC2 ZINC001590272556 1093354815 /nfs/dbraw/zinc/35/48/15/1093354815.db2.gz QMRBBYCDBVTBLG-LBPRGKRZSA-N 0 3 342.403 2.787 20 5 EFBDHN C[C@@H]1C[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])[C@@H]2CCCC[C@@H]21 ZINC001590307014 1093367597 /nfs/dbraw/zinc/36/75/97/1093367597.db2.gz DAZBMFOTEXHUNL-LALPHHSUSA-N 0 3 342.403 2.785 20 5 EFBDHN C[C@@H]1C[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])[C@@H]2CCCC[C@@H]21 ZINC001590307014 1093367606 /nfs/dbraw/zinc/36/76/06/1093367606.db2.gz DAZBMFOTEXHUNL-LALPHHSUSA-N 0 3 342.403 2.785 20 5 EFBDHN C[C@@H]1C[N@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])[C@@H]2CCCC[C@@H]21 ZINC001590307014 1093367609 /nfs/dbraw/zinc/36/76/09/1093367609.db2.gz DAZBMFOTEXHUNL-LALPHHSUSA-N 0 3 342.403 2.785 20 5 EFBDHN C[C@@H]1C[N@@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])[C@@H]2CCCC[C@@H]21 ZINC001590307014 1093367618 /nfs/dbraw/zinc/36/76/18/1093367618.db2.gz DAZBMFOTEXHUNL-LALPHHSUSA-N 0 3 342.403 2.785 20 5 EFBDHN CC[C@@H]1CCCC[C@@H]1[NH2+]Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001590510186 1093466260 /nfs/dbraw/zinc/46/62/60/1093466260.db2.gz FNNRTRHLHASGDR-RISCZKNCSA-N 0 3 330.392 2.833 20 5 EFBDHN CC[C@@H]1CCCC[C@@H]1[NH2+]Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001590510186 1093466267 /nfs/dbraw/zinc/46/62/67/1093466267.db2.gz FNNRTRHLHASGDR-RISCZKNCSA-N 0 3 330.392 2.833 20 5 EFBDHN Cc1cc(NC[C@H]2COC3(CCCC3)O2)c2cc([N+](=O)[O-])ccc2n1 ZINC000782965191 1094605795 /nfs/dbraw/zinc/60/57/95/1094605795.db2.gz GZQUHBHSRRIJAM-AWEZNQCLSA-N 0 3 343.383 2.971 20 5 EFBDHN NCc1nn(-c2nc(C3CC3)nc(Cl)c2[N+](=O)[O-])c2ccccc12 ZINC001167695135 1095777226 /nfs/dbraw/zinc/77/72/26/1095777226.db2.gz CXGARAJPAFAXPQ-UHFFFAOYSA-N 0 3 344.762 2.713 20 5 EFBDHN Cc1c(-n2nc(CN)c3ccccc32)ccc([N+](=O)[O-])c1[N+](=O)[O-] ZINC001167697566 1095983882 /nfs/dbraw/zinc/98/38/82/1095983882.db2.gz GGJSLXAMYVXNHA-UHFFFAOYSA-N 0 3 327.300 2.609 20 5 EFBDHN CCOC(=O)c1ccc(-n2nc(CN)c3ccccc32)c([N+](=O)[O-])c1 ZINC001167698197 1095997394 /nfs/dbraw/zinc/99/73/94/1095997394.db2.gz PRYFAKUOWKGWNH-UHFFFAOYSA-N 0 3 340.339 2.569 20 5 EFBDHN CC[N@H+](Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])C1CC(C)(C)C1 ZINC001604319283 1096805044 /nfs/dbraw/zinc/80/50/44/1096805044.db2.gz FANWNKYVTAQDIK-UHFFFAOYSA-N 0 3 330.392 2.785 20 5 EFBDHN CC[N@@H+](Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])C1CC(C)(C)C1 ZINC001604319283 1096805056 /nfs/dbraw/zinc/80/50/56/1096805056.db2.gz FANWNKYVTAQDIK-UHFFFAOYSA-N 0 3 330.392 2.785 20 5 EFBDHN CC[N@H+](Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])C1CC(C)(C)C1 ZINC001604319283 1096805072 /nfs/dbraw/zinc/80/50/72/1096805072.db2.gz FANWNKYVTAQDIK-UHFFFAOYSA-N 0 3 330.392 2.785 20 5 EFBDHN CC[N@@H+](Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])C1CC(C)(C)C1 ZINC001604319283 1096805083 /nfs/dbraw/zinc/80/50/83/1096805083.db2.gz FANWNKYVTAQDIK-UHFFFAOYSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)(C)[C@@H]1CCC[N@@H+]1Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001609074617 1098132847 /nfs/dbraw/zinc/13/28/47/1098132847.db2.gz VHBHGYYGHFYHJS-AWEZNQCLSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)(C)[C@@H]1CCC[N@H+]1Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001609074617 1098132852 /nfs/dbraw/zinc/13/28/52/1098132852.db2.gz VHBHGYYGHFYHJS-AWEZNQCLSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)(C)[C@@H]1CCC[N@@H+]1Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001609074617 1098132856 /nfs/dbraw/zinc/13/28/56/1098132856.db2.gz VHBHGYYGHFYHJS-AWEZNQCLSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)(C)[C@@H]1CCC[N@H+]1Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001609074617 1098132859 /nfs/dbraw/zinc/13/28/59/1098132859.db2.gz VHBHGYYGHFYHJS-AWEZNQCLSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)[C@@H]1CCCC[N@@H+]1Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001609090704 1098139591 /nfs/dbraw/zinc/13/95/91/1098139591.db2.gz CIISHWRDCKZVOV-AWEZNQCLSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)[C@@H]1CCCC[N@H+]1Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001609090704 1098139593 /nfs/dbraw/zinc/13/95/93/1098139593.db2.gz CIISHWRDCKZVOV-AWEZNQCLSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)[C@@H]1CCCC[N@@H+]1Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001609090704 1098139597 /nfs/dbraw/zinc/13/95/97/1098139597.db2.gz CIISHWRDCKZVOV-AWEZNQCLSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)[C@@H]1CCCC[N@H+]1Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001609090704 1098139600 /nfs/dbraw/zinc/13/96/00/1098139600.db2.gz CIISHWRDCKZVOV-AWEZNQCLSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@@H](C)[N@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001609162712 1098175643 /nfs/dbraw/zinc/17/56/43/1098175643.db2.gz IJSQQQNKDFWBKZ-VXGBXAGGSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@@H](C)[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001609162712 1098175648 /nfs/dbraw/zinc/17/56/48/1098175648.db2.gz IJSQQQNKDFWBKZ-VXGBXAGGSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@@H](C)[N@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001609162712 1098175653 /nfs/dbraw/zinc/17/56/53/1098175653.db2.gz IJSQQQNKDFWBKZ-VXGBXAGGSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@@H](C)[N@@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001609162712 1098175658 /nfs/dbraw/zinc/17/56/58/1098175658.db2.gz IJSQQQNKDFWBKZ-VXGBXAGGSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@@H]([N@H+](C)Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001609163423 1098178359 /nfs/dbraw/zinc/17/83/59/1098178359.db2.gz ZMZCRPLMLLXJFA-BXUZGUMPSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@@H]([N@@H+](C)Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001609163423 1098178360 /nfs/dbraw/zinc/17/83/60/1098178360.db2.gz ZMZCRPLMLLXJFA-BXUZGUMPSA-N 0 3 330.392 2.785 20 5 EFBDHN CCC1(CC)CC[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001609197055 1098194989 /nfs/dbraw/zinc/19/49/89/1098194989.db2.gz NMAQUGFUYMSYPG-UHFFFAOYSA-N 0 3 330.392 2.787 20 5 EFBDHN CCC1(CC)CC[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001609197055 1098194993 /nfs/dbraw/zinc/19/49/93/1098194993.db2.gz NMAQUGFUYMSYPG-UHFFFAOYSA-N 0 3 330.392 2.787 20 5 EFBDHN CCC1(CC)CC[N@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001609197055 1098194995 /nfs/dbraw/zinc/19/49/95/1098194995.db2.gz NMAQUGFUYMSYPG-UHFFFAOYSA-N 0 3 330.392 2.787 20 5 EFBDHN CCC1(CC)CC[N@@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001609197055 1098194997 /nfs/dbraw/zinc/19/49/97/1098194997.db2.gz NMAQUGFUYMSYPG-UHFFFAOYSA-N 0 3 330.392 2.787 20 5 EFBDHN CC[NH+](CC)CCC[C@@H](C)Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1 ZINC001609223212 1098211876 /nfs/dbraw/zinc/21/18/76/1098211876.db2.gz ZFZNBDNOLXSZRY-GFCCVEGCSA-N 0 3 347.423 2.697 20 5 EFBDHN CC[NH+](CC)CCC[C@@H](C)Nc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1 ZINC001609223212 1098211881 /nfs/dbraw/zinc/21/18/81/1098211881.db2.gz ZFZNBDNOLXSZRY-GFCCVEGCSA-N 0 3 347.423 2.697 20 5 EFBDHN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N1CCCN(C(C)(C)C)CC1 ZINC000843778173 1100287794 /nfs/dbraw/zinc/28/77/94/1100287794.db2.gz BOQLAAHHGNVNGI-UHFFFAOYSA-N 0 3 337.395 2.989 20 5 EFBDHN CC(C)[C@H]1N(C[C@H](O)c2cccc([N+](=O)[O-])c2)CC12CCOCC2 ZINC000840776243 1101671623 /nfs/dbraw/zinc/67/16/23/1101671623.db2.gz HWMWMTPCUAWCHJ-DLBZAZTESA-N 0 3 334.416 2.765 20 5 EFBDHN CCN1CCN(Cc2cccc([N+](=O)[O-])c2Br)C[C@H]1C ZINC000300489528 1104234907 /nfs/dbraw/zinc/23/49/07/1104234907.db2.gz ZGGNWAFHVBBAOR-LLVKDONJSA-N 0 3 342.237 2.883 20 5 EFBDHN Cc1ccc(C(=O)N2CCC(NCc3csc([N+](=O)[O-])c3)CC2)o1 ZINC000989902042 1106799996 /nfs/dbraw/zinc/79/99/96/1106799996.db2.gz IYVHANGLJIBJLX-UHFFFAOYSA-N 0 3 349.412 2.952 20 5 EFBDHN O=C(CC1CCC1)N1CCC(NCc2csc([N+](=O)[O-])c2)CC1 ZINC000990612890 1108386024 /nfs/dbraw/zinc/38/60/24/1108386024.db2.gz YCQPTESMNFAUOT-UHFFFAOYSA-N 0 3 337.445 2.927 20 5 EFBDHN O=C(/C=C\C1CC1)N1CCC(NCc2csc([N+](=O)[O-])c2)CC1 ZINC000990613192 1108389591 /nfs/dbraw/zinc/38/95/91/1108389591.db2.gz YOBFJYQAKYXIHO-ARJAWSKDSA-N 0 3 335.429 2.703 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCO[C@@H]1CCOC1 ZINC000927082652 1108821712 /nfs/dbraw/zinc/82/17/12/1108821712.db2.gz GZOFBEIDTRSVEC-DGCLKSJQSA-N 0 3 326.418 2.773 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCCO[C@H]1CCOC1 ZINC000927082651 1108821866 /nfs/dbraw/zinc/82/18/66/1108821866.db2.gz GZOFBEIDTRSVEC-AAEUAGOBSA-N 0 3 326.418 2.773 20 5 EFBDHN COc1ccc(CNCCOC2CCSCC2)cc1[N+](=O)[O-] ZINC000898442915 1108946342 /nfs/dbraw/zinc/94/63/42/1108946342.db2.gz UQWODIHOAOPHLA-UHFFFAOYSA-N 0 3 326.418 2.605 20 5 EFBDHN CCCN(C)CC(=O)N(CC)CCNc1ccc(C)cc1[N+](=O)[O-] ZINC001106810433 1111869352 /nfs/dbraw/zinc/86/93/52/1111869352.db2.gz IZCHLCBCUSSVIP-UHFFFAOYSA-N 0 3 336.436 2.505 20 5 EFBDHN CN(CCN(C)C1CC1)C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000186765538 529902756 /nfs/dbraw/zinc/90/27/56/529902756.db2.gz WXPGPLWLLPJLGF-UHFFFAOYSA-N 0 3 333.413 2.976 20 5 EFBDHN CCCN(CCN1CCCC1)C(=O)c1cccc(OC)c1[N+](=O)[O-] ZINC000344746687 283241581 /nfs/dbraw/zinc/24/15/81/283241581.db2.gz JFTOUEBBFFPTHK-UHFFFAOYSA-N 0 3 335.404 2.551 20 5 EFBDHN C[C@@H](NC(=O)N(C)CC1(N(C)C)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000189725310 237190001 /nfs/dbraw/zinc/19/00/01/237190001.db2.gz ADWVCXHLCGSGFV-CYBMUJFWSA-N 0 3 334.420 2.782 20 5 EFBDHN O=[N+]([O-])c1cnc(NCc2ccc(CN3CCC(O)CC3)cc2)s1 ZINC000190324991 238391607 /nfs/dbraw/zinc/39/16/07/238391607.db2.gz NHYBJXBYAFQDBQ-UHFFFAOYSA-N 0 3 348.428 2.620 20 5 EFBDHN Cc1nn(C)c(NC[C@H]2CCCN2Cc2ccccc2)c1[N+](=O)[O-] ZINC000265091812 201214156 /nfs/dbraw/zinc/21/41/56/201214156.db2.gz AORCXRHYCCECOI-OAHLLOKOSA-N 0 3 329.404 2.713 20 5 EFBDHN O=C(NCCN1CCCCCC1)c1cc([N+](=O)[O-])ccc1Cl ZINC000298342168 201352931 /nfs/dbraw/zinc/35/29/31/201352931.db2.gz IXEGJQSSHYBMPP-UHFFFAOYSA-N 0 3 325.796 2.854 20 5 EFBDHN C[C@H](C(=O)NCCc1ccc([N+](=O)[O-])cc1)[C@H](N)c1ccccc1 ZINC000163575397 201418114 /nfs/dbraw/zinc/41/81/14/201418114.db2.gz PWDBETYBLVUUAA-GUYCJALGSA-N 0 3 327.384 2.590 20 5 EFBDHN COc1cccc(C(=O)NC[C@@H](c2ccccc2)N(C)C)c1[N+](=O)[O-] ZINC000193819024 240127268 /nfs/dbraw/zinc/12/72/68/240127268.db2.gz PUVQVJRKNNYHAN-HNNXBMFYSA-N 0 3 343.383 2.636 20 5 EFBDHN C[C@H]1CCNC(=O)[C@H]1NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000193679828 240263145 /nfs/dbraw/zinc/26/31/45/240263145.db2.gz BMXOWXKZCGHBOI-ZBEGNZNMSA-N 0 3 345.424 2.938 20 5 EFBDHN CCn1nc(C)c([N+](=O)[O-])c1NC[C@H](c1cccc(F)c1)N(C)C ZINC000195334490 240935914 /nfs/dbraw/zinc/93/59/14/240935914.db2.gz DIUWPPASFXYHFC-CQSZACIVSA-N 0 3 335.383 2.974 20 5 EFBDHN Cn1ccc(CCNCc2ccc(-c3ccccc3[N+](=O)[O-])o2)n1 ZINC000354656223 242008405 /nfs/dbraw/zinc/00/84/05/242008405.db2.gz QHWGDQMSANWFMC-UHFFFAOYSA-N 0 3 326.356 2.921 20 5 EFBDHN CO[C@@](C)([C@H](C)NCc1cc([N+](=O)[O-])cc2c1OCOC2)C1CC1 ZINC000411936503 243032454 /nfs/dbraw/zinc/03/24/54/243032454.db2.gz CHUXLYDCVGGLFB-GTNSWQLSSA-N 0 3 336.388 2.755 20 5 EFBDHN C[C@H](c1cccc(O)c1)N(C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000245820710 243160142 /nfs/dbraw/zinc/16/01/42/243160142.db2.gz VXKZQWKGLYKZDO-CXAGYDPISA-N 0 3 346.383 2.733 20 5 EFBDHN CC(C)Oc1cc(C(=O)NCC2(N(C)C)CCC2)ccc1[N+](=O)[O-] ZINC000412283362 243243593 /nfs/dbraw/zinc/24/35/93/243243593.db2.gz XIMUIZUMCSEVFT-UHFFFAOYSA-N 0 3 335.404 2.596 20 5 EFBDHN CN1CCC[C@@]2(CCN(C(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000412366827 243290046 /nfs/dbraw/zinc/29/00/46/243290046.db2.gz RSYDQJZDWOWVDY-YQVWRLOYSA-N 0 3 343.427 2.643 20 5 EFBDHN O=C(NCC1CCN(c2ccncc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000070928492 203083997 /nfs/dbraw/zinc/08/39/97/203083997.db2.gz FAPCSBQUNPGHLO-UHFFFAOYSA-N 0 3 340.383 2.636 20 5 EFBDHN COc1ccc(CNC[C@H](CO)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000414534643 244217137 /nfs/dbraw/zinc/21/71/37/244217137.db2.gz VJNPPJOEZQCCGY-CQSZACIVSA-N 0 3 334.347 2.608 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@@H](CO)c1ccc(F)cc1 ZINC000414524594 244211250 /nfs/dbraw/zinc/21/12/50/244211250.db2.gz IINHEZVNGNJQSS-HNNXBMFYSA-N 0 3 348.374 2.998 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@H](CO)c1ccc(F)cc1 ZINC000414524595 244211352 /nfs/dbraw/zinc/21/13/52/244211352.db2.gz IINHEZVNGNJQSS-OAHLLOKOSA-N 0 3 348.374 2.998 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H](CO)[C@H]2CCCOC2)o1 ZINC000414557375 244233507 /nfs/dbraw/zinc/23/35/07/244233507.db2.gz NNVQSSWVUKFEIH-BBRMVZONSA-N 0 3 346.383 2.732 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@H](CO)[C@@H]3CCCOC3)o2)cc1 ZINC000414569725 244238744 /nfs/dbraw/zinc/23/87/44/244238744.db2.gz ZSEWNHLCMCTGHN-RHSMWYFYSA-N 0 3 346.383 2.732 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@H](CO)[C@H]3CCCOC3)o2)cc1 ZINC000414569727 244239592 /nfs/dbraw/zinc/23/95/92/244239592.db2.gz ZSEWNHLCMCTGHN-WMLDXEAASA-N 0 3 346.383 2.732 20 5 EFBDHN Cc1ccc(NC(=O)NC[C@@H]2NCCc3ccccc32)cc1[N+](=O)[O-] ZINC000414668762 244286461 /nfs/dbraw/zinc/28/64/61/244286461.db2.gz ZHPFLYNRBFKRBO-INIZCTEOSA-N 0 3 340.383 2.912 20 5 EFBDHN COc1cc(C(=O)N(C)C(C)(C)CN2CCCC2)cc([N+](=O)[O-])c1C ZINC000416109271 244513819 /nfs/dbraw/zinc/51/38/19/244513819.db2.gz REQREITZFNARFJ-UHFFFAOYSA-N 0 3 349.431 2.858 20 5 EFBDHN Cc1c(CN(CCC(N)=O)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000076798980 203365045 /nfs/dbraw/zinc/36/50/45/203365045.db2.gz GHJXNGXYBGUBJR-UHFFFAOYSA-N 0 3 327.384 2.781 20 5 EFBDHN C[C@H](O)CN(CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000104684126 204114924 /nfs/dbraw/zinc/11/49/24/204114924.db2.gz ZDVHMOLZDNNINC-AWEZNQCLSA-N 0 3 349.431 2.573 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2cnc(CCN3CCN(C4CC4)CC3)o2)c1 ZINC000104678958 204115006 /nfs/dbraw/zinc/11/50/06/204115006.db2.gz VYDFSQOCBPJTFI-UHFFFAOYSA-N 0 3 342.399 2.572 20 5 EFBDHN CO[C@H]1CCCN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000104694651 204116662 /nfs/dbraw/zinc/11/66/62/204116662.db2.gz PDORWEORRGLJAV-HNNXBMFYSA-N 0 3 331.372 2.903 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000110995843 204330669 /nfs/dbraw/zinc/33/06/69/204330669.db2.gz UYTQUWBNIWBURP-CQSZACIVSA-N 0 3 337.445 2.678 20 5 EFBDHN CCC(CC)[C@@H](O)CNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000111404200 204355775 /nfs/dbraw/zinc/35/57/75/204355775.db2.gz UZMZYILHEZGZIY-KRWDZBQOSA-N 0 3 346.431 2.882 20 5 EFBDHN O=C(c1cc([N+](=O)[O-])c[nH]1)N(CCN1CCCCCC1)C1CCC1 ZINC000359809264 296186134 /nfs/dbraw/zinc/18/61/34/296186134.db2.gz RYTBAGSJQMJZPS-UHFFFAOYSA-N 0 3 334.420 2.794 20 5 EFBDHN C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000126100576 205040890 /nfs/dbraw/zinc/04/08/90/205040890.db2.gz FGEHPMZTDFKWJW-YOEHRIQHSA-N 0 3 348.447 2.586 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N[C@@H]2C[C@H](C)N(C3CC3)C2)cc1[N+](=O)[O-] ZINC000126504271 205058742 /nfs/dbraw/zinc/05/87/42/205058742.db2.gz ULZUEVFEXWPSMS-KCQAQPDRSA-N 0 3 346.431 2.889 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)[C@@H](C2CC2)N2CCCC2)cc1[N+](=O)[O-] ZINC000127648729 205110915 /nfs/dbraw/zinc/11/09/15/205110915.db2.gz ICXKSMORPQZHKF-CXAGYDPISA-N 0 3 331.416 2.955 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000127691292 205111839 /nfs/dbraw/zinc/11/18/39/205111839.db2.gz AYKUGRPDBDDKPY-CQSZACIVSA-N 0 3 330.388 2.690 20 5 EFBDHN CN(C)Cc1cccc(CNC(=O)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000153349738 205841200 /nfs/dbraw/zinc/84/12/00/205841200.db2.gz FLVFIYTYGFQNPS-UHFFFAOYSA-N 0 3 341.411 2.905 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@@H](C)[C@@H](CO)SC)cc1[N+](=O)[O-] ZINC000153909731 205892660 /nfs/dbraw/zinc/89/26/60/205892660.db2.gz QMKXIYZITLRQQT-ZIBATOQPSA-N 0 3 328.434 2.757 20 5 EFBDHN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CC[C@H](N2CCCCC2)C1 ZINC000264616088 296210319 /nfs/dbraw/zinc/21/03/19/296210319.db2.gz QRPUNWHRXRJXHG-ZDUSSCGKSA-N 0 3 337.807 2.949 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC(C)(C)CN(C)C ZINC000457217814 296212090 /nfs/dbraw/zinc/21/20/90/296212090.db2.gz HOZHGXYTTSSDOI-LLVKDONJSA-N 0 3 325.434 2.532 20 5 EFBDHN CN(C[C@H]1CCCN1C)C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000421710383 246075574 /nfs/dbraw/zinc/07/55/74/246075574.db2.gz KHWZFJAZJVROMT-CYBMUJFWSA-N 0 3 337.395 2.564 20 5 EFBDHN Cn1cnc([N+](=O)[O-])c1Nc1cccc(CN2CCSCC2)c1 ZINC000264181374 246147568 /nfs/dbraw/zinc/14/75/68/246147568.db2.gz YUUNAZRQFAEXKN-UHFFFAOYSA-N 0 3 333.417 2.621 20 5 EFBDHN NC(=O)[C@@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000157071263 206115414 /nfs/dbraw/zinc/11/54/14/206115414.db2.gz ZYEHYRMPXAFGKV-SNVBAGLBSA-N 0 3 349.774 2.815 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN(C)CCc1nccs1 ZINC000157541096 206141414 /nfs/dbraw/zinc/14/14/14/206141414.db2.gz PJPXCPGGMCJJKW-UHFFFAOYSA-N 0 3 348.428 2.863 20 5 EFBDHN CN(CCn1cc([N+](=O)[O-])cn1)Cc1ccc(Br)cc1 ZINC000157371905 206133016 /nfs/dbraw/zinc/13/30/16/206133016.db2.gz PCRSIFDNOHSFCB-UHFFFAOYSA-N 0 3 339.193 2.686 20 5 EFBDHN CCN(Cc1ccc(Br)c([N+](=O)[O-])c1)CC(C)(C)O ZINC000159434078 206246220 /nfs/dbraw/zinc/24/62/20/206246220.db2.gz HKEQMSWQHJZMTK-UHFFFAOYSA-N 0 3 331.210 2.950 20 5 EFBDHN NC(=O)CC1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000159770717 206262108 /nfs/dbraw/zinc/26/21/08/206262108.db2.gz HEDQMQAJKCETLE-UHFFFAOYSA-N 0 3 343.383 2.942 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCN1CCCCC[C@@H]1c1ccco1 ZINC000159836690 206265712 /nfs/dbraw/zinc/26/57/12/206265712.db2.gz YTMVXHDVLDMDBM-OAHLLOKOSA-N 0 3 331.372 2.967 20 5 EFBDHN COCC(C)(C)N1CCN(C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000425353235 247056107 /nfs/dbraw/zinc/05/61/07/247056107.db2.gz PUEUVMIXUNAVLR-VURMDHGXSA-N 0 3 333.432 2.651 20 5 EFBDHN O=[N+]([O-])c1cc(Br)ccc1CN[C@H]1CCC[C@@H]1CCO ZINC000425468845 247096121 /nfs/dbraw/zinc/09/61/21/247096121.db2.gz DAALANKSJKDZQR-MFKMUULPSA-N 0 3 343.221 2.998 20 5 EFBDHN O=[N+]([O-])c1cc(Br)ccc1CN[C@H]1CCC[C@H]1CCO ZINC000425468843 247096970 /nfs/dbraw/zinc/09/69/70/247096970.db2.gz DAALANKSJKDZQR-GWCFXTLKSA-N 0 3 343.221 2.998 20 5 EFBDHN O=C(N[C@H]1CCN(C2CC2)C1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000426468851 247283588 /nfs/dbraw/zinc/28/35/88/247283588.db2.gz OHEHVNICNCYAKD-AWEZNQCLSA-N 0 3 344.415 2.506 20 5 EFBDHN O=[N+]([O-])c1ccc(NCCCN2CCC(O)CC2)cc1C(F)(F)F ZINC000160795002 206313984 /nfs/dbraw/zinc/31/39/84/206313984.db2.gz HIHYNZVUKLCNQS-UHFFFAOYSA-N 0 3 347.337 2.872 20 5 EFBDHN CCO[C@H]1C[C@H](O)C12CCN(Cc1cccc([N+](=O)[O-])c1C)CC2 ZINC000266019956 248035315 /nfs/dbraw/zinc/03/53/15/248035315.db2.gz RAJZTHWTZPFRSC-IRXDYDNUSA-N 0 3 334.416 2.655 20 5 EFBDHN C[C@H](NC(=O)NC[C@@H]1CCCCN1C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000433566144 248072073 /nfs/dbraw/zinc/07/20/73/248072073.db2.gz YJHNFAVZKYAXNH-GUYCJALGSA-N 0 3 346.431 2.972 20 5 EFBDHN COc1ccc(CNC[C@](C)(O)c2cc(C)oc2C)cc1[N+](=O)[O-] ZINC000266163957 248142433 /nfs/dbraw/zinc/14/24/33/248142433.db2.gz OMRIPOFLRYVZLK-KRWDZBQOSA-N 0 3 334.372 2.811 20 5 EFBDHN CCn1cc([C@H]2OCCC[C@@H]2NCc2ccc([N+](=O)[O-])cc2)cn1 ZINC000433938625 248105602 /nfs/dbraw/zinc/10/56/02/248105602.db2.gz BPLNPGGMIDUMJW-DLBZAZTESA-N 0 3 330.388 2.821 20 5 EFBDHN COc1ccc(OCCN(C)[C@H](CO)c2ccccc2)c([N+](=O)[O-])c1 ZINC000266544274 248353220 /nfs/dbraw/zinc/35/32/20/248353220.db2.gz RAQQMPAADRDPJK-QGZVFWFLSA-N 0 3 346.383 2.648 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H](C(=O)NCC2CC2)C1 ZINC000266553969 248357693 /nfs/dbraw/zinc/35/76/93/248357693.db2.gz VIMBEPJXHXIJSP-HIFRSBDPSA-N 0 3 331.416 2.894 20 5 EFBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H](C(=O)NCC2CC2)C1 ZINC000266553971 248357790 /nfs/dbraw/zinc/35/77/90/248357790.db2.gz VIMBEPJXHXIJSP-ZFWWWQNUSA-N 0 3 331.416 2.894 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCC(c2ccnn2CCO)CC1 ZINC000441543557 250040752 /nfs/dbraw/zinc/04/07/52/250040752.db2.gz RHKXCUHSZDWYBD-CQSZACIVSA-N 0 3 344.415 2.724 20 5 EFBDHN C[C@@H]1CCN(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@@H](C)C1 ZINC000443642989 250214924 /nfs/dbraw/zinc/21/49/24/250214924.db2.gz QDGLIIKNVDUWBI-KGLIPLIRSA-N 0 3 331.416 2.852 20 5 EFBDHN O=[N+]([O-])c1cnc(NCc2ccc(OCCN3CCCC3)cc2)s1 ZINC000443510020 250201405 /nfs/dbraw/zinc/20/14/05/250201405.db2.gz NDVBBMWSNJGUAK-UHFFFAOYSA-N 0 3 348.428 2.560 20 5 EFBDHN CN1CC=C(CNC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CC1 ZINC000444290364 250282698 /nfs/dbraw/zinc/28/26/98/250282698.db2.gz OJOMNVPLWHVAPS-UHFFFAOYSA-N 0 3 347.418 2.673 20 5 EFBDHN CC1(C)CCCN(CCNC(=O)Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000444619619 250318487 /nfs/dbraw/zinc/31/84/87/250318487.db2.gz YTVFCWAGECVTHB-UHFFFAOYSA-N 0 3 337.395 2.515 20 5 EFBDHN O=C1C[C@H](N[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)[C@@H]2CCCCN12 ZINC000367203078 284843795 /nfs/dbraw/zinc/84/37/95/284843795.db2.gz BPZFEAPNFGLJHF-IKGGRYGDSA-N 0 3 329.400 2.715 20 5 EFBDHN COc1nccc(CN[C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])n1 ZINC000449373559 251001448 /nfs/dbraw/zinc/00/14/48/251001448.db2.gz RYORVFKZNFDYOU-CJNGLKHVSA-N 0 3 342.399 2.894 20 5 EFBDHN CN(C)C(=O)C1(NC/C=C\c2ccccc2[N+](=O)[O-])CCCCC1 ZINC000449461989 251033891 /nfs/dbraw/zinc/03/38/91/251033891.db2.gz RGOIITVGXHHLDZ-NTMALXAHSA-N 0 3 331.416 2.989 20 5 EFBDHN O=[N+]([O-])c1cc(CN2CCC[C@@H]2[C@H]2CCC[C@H]2O)c2c(c1)COCO2 ZINC000449477933 251041000 /nfs/dbraw/zinc/04/10/00/251041000.db2.gz XLWKEVFMOQSBCZ-BRWVUGGUSA-N 0 3 348.399 2.587 20 5 EFBDHN COc1cc(C[NH2+][C@H](C(C)C)[C@@H](CO)C(C)C)c([N+](=O)[O-])cc1[O-] ZINC000449508388 251047764 /nfs/dbraw/zinc/04/77/64/251047764.db2.gz HDYLYADBYDVHBV-SUMWQHHRSA-N 0 3 340.420 2.688 20 5 EFBDHN Cc1ccncc1CN[C@@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000449519724 251051574 /nfs/dbraw/zinc/05/15/74/251051574.db2.gz CKKJSPFVXBCOBB-ZDUSSCGKSA-N 0 3 328.372 2.805 20 5 EFBDHN COCCn1cc(CN2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000449503105 251045972 /nfs/dbraw/zinc/04/59/72/251045972.db2.gz STPFHSXOGFMPNY-KRWDZBQOSA-N 0 3 344.415 2.817 20 5 EFBDHN CO[C@@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@H]1O ZINC000449570658 251069945 /nfs/dbraw/zinc/06/99/45/251069945.db2.gz IEJWSLIZWPFOFG-HUUCEWRRSA-N 0 3 334.397 2.515 20 5 EFBDHN CN(CCn1ccc([N+](=O)[O-])n1)Cc1ccc(OC(F)(F)F)cc1 ZINC000176204225 207200311 /nfs/dbraw/zinc/20/03/11/207200311.db2.gz XWZKULZKEBXJII-UHFFFAOYSA-N 0 3 344.293 2.822 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CC[C@@H](CSc3ccccc3)C2)n1 ZINC000176270794 207209735 /nfs/dbraw/zinc/20/97/35/207209735.db2.gz HYXGEPCFAZNNTJ-CQSZACIVSA-N 0 3 332.429 2.906 20 5 EFBDHN CN(C)[C@]1(CNc2nccc3c2cccc3[N+](=O)[O-])CCSC1 ZINC000450361644 251359641 /nfs/dbraw/zinc/35/96/41/251359641.db2.gz DEIUEFRJBPMPNJ-INIZCTEOSA-N 0 3 332.429 2.992 20 5 EFBDHN Cc1nc(Nc2cccc3c2OCC[C@H]3N(C)C)ncc1[N+](=O)[O-] ZINC000450491220 251398263 /nfs/dbraw/zinc/39/82/63/251398263.db2.gz OBFWSXZGKBQOEE-CYBMUJFWSA-N 0 3 329.360 2.822 20 5 EFBDHN Cc1cc(C(=O)NC2CCN(CCOC(C)C)CC2)cc([N+](=O)[O-])c1 ZINC000176674139 207248963 /nfs/dbraw/zinc/24/89/63/207248963.db2.gz TXAJHULUKGIDTF-UHFFFAOYSA-N 0 3 349.431 2.522 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N2CC[C@H]3CC[C@@H](C2)N3C)cc1[N+](=O)[O-] ZINC000176749436 207256052 /nfs/dbraw/zinc/25/60/52/207256052.db2.gz AMUIEFMMCSRLDY-IMJJTQAJSA-N 0 3 346.431 2.842 20 5 EFBDHN C[C@@H]1C[C@@H](NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CN1C1CC1 ZINC000177186462 207302998 /nfs/dbraw/zinc/30/29/98/207302998.db2.gz LXQZNFCZYIJVNF-BXUZGUMPSA-N 0 3 344.415 2.524 20 5 EFBDHN COc1ccc(CN[C@@H](CO)Cc2ccc(C)c(C)c2)cc1[N+](=O)[O-] ZINC000453627735 252056449 /nfs/dbraw/zinc/05/64/49/252056449.db2.gz MRNFECLQLDPAGB-QGZVFWFLSA-N 0 3 344.411 2.913 20 5 EFBDHN Cc1noc(CCCN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000268702599 252153880 /nfs/dbraw/zinc/15/38/80/252153880.db2.gz VNYSRDMOCSPERT-UHFFFAOYSA-N 0 3 346.387 2.762 20 5 EFBDHN CC(C)C[C@@H](CN1CCCC1)NC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000454290180 252202754 /nfs/dbraw/zinc/20/27/54/252202754.db2.gz NBXYXWNISHPSGN-INIZCTEOSA-N 0 3 348.447 2.905 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000177763516 207392450 /nfs/dbraw/zinc/39/24/50/207392450.db2.gz BHTKDPNZXAGAOD-HIFRSBDPSA-N 0 3 349.456 2.772 20 5 EFBDHN O=[N+]([O-])c1ccc(Cl)c(CN2CCNC[C@@H]2c2ccncc2)c1 ZINC000262085185 285116065 /nfs/dbraw/zinc/11/60/65/285116065.db2.gz UERFPEIOZFUEHG-MRXNPFEDSA-N 0 3 332.791 2.790 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H](CO)[C@H]2CCCOC2)o1 ZINC000414557383 285159106 /nfs/dbraw/zinc/15/91/06/285159106.db2.gz NNVQSSWVUKFEIH-XJKSGUPXSA-N 0 3 346.383 2.732 20 5 EFBDHN CN(C)CCN(C(=O)NCCc1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000468022833 256013396 /nfs/dbraw/zinc/01/33/96/256013396.db2.gz RVRUOIAXAXAOGE-UHFFFAOYSA-N 0 3 348.447 2.653 20 5 EFBDHN CC1(C)C[C@@H](N[C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C(C)(C)O1 ZINC000119720459 221385402 /nfs/dbraw/zinc/38/54/02/221385402.db2.gz WKDFMEQZANSQDJ-LSDHHAIUSA-N 0 3 347.415 2.636 20 5 EFBDHN CC1(C)C[C@H](N[C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C(C)(C)O1 ZINC000119719994 221385461 /nfs/dbraw/zinc/38/54/61/221385461.db2.gz WKDFMEQZANSQDJ-CABCVRRESA-N 0 3 347.415 2.636 20 5 EFBDHN C[C@@H]1C[C@@H](NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)CCN1C ZINC000343452122 142000405 /nfs/dbraw/zinc/00/04/05/142000405.db2.gz RCLQQNKREGUWGQ-HIFRSBDPSA-N 0 3 346.431 2.752 20 5 EFBDHN CO[C@@H]1[C@H](C)[C@@H](N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1(C)C ZINC000344473468 142023376 /nfs/dbraw/zinc/02/33/76/142023376.db2.gz LRGZWWACCSLDKE-YIKOMLBNSA-N 0 3 335.404 2.571 20 5 EFBDHN C[C@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)CCN(C2CCC2)C1 ZINC000344740292 142070862 /nfs/dbraw/zinc/07/08/62/142070862.db2.gz LIMZSXZSBKIJJF-CYBMUJFWSA-N 0 3 349.406 2.609 20 5 EFBDHN CCCN(CCN1CCCC1)C(=O)c1cc([N+](=O)[O-])ccc1OC ZINC000344743611 142071455 /nfs/dbraw/zinc/07/14/55/142071455.db2.gz FOTXIKDMRHEHGG-UHFFFAOYSA-N 0 3 335.404 2.551 20 5 EFBDHN CC(C)N1CCCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CC1 ZINC000346079487 142144327 /nfs/dbraw/zinc/14/43/27/142144327.db2.gz FFHXGQFNRLSESB-UHFFFAOYSA-N 0 3 325.796 2.805 20 5 EFBDHN C[C@@H]1C[C@H]1N1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000346152981 142156190 /nfs/dbraw/zinc/15/61/90/142156190.db2.gz FKUFKWURNFBULZ-HWWQOWPSSA-N 0 3 335.379 2.536 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCN([C@@H]2C[C@H]2C)C[C@@H](C)C1 ZINC000346165843 142158721 /nfs/dbraw/zinc/15/87/21/142158721.db2.gz RHIPCYWWIWVWKC-SUYBPPKGSA-N 0 3 331.416 2.706 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCN([C@@H]2C[C@@H]2C)C[C@@H](C)C1 ZINC000346165840 142159137 /nfs/dbraw/zinc/15/91/37/142159137.db2.gz RHIPCYWWIWVWKC-HACGYAERSA-N 0 3 331.416 2.706 20 5 EFBDHN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)CN(C)C ZINC000346221399 142170475 /nfs/dbraw/zinc/17/04/75/142170475.db2.gz LLCDIQICSVKCKE-LLVKDONJSA-N 0 3 325.434 2.775 20 5 EFBDHN C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000347426568 142214361 /nfs/dbraw/zinc/21/43/61/142214361.db2.gz BUOQVRGWQBAWGY-OLZOCXBDSA-N 0 3 344.415 2.926 20 5 EFBDHN COc1cc([C@@H](C)NCCC(=O)Nc2ccccc2[N+](=O)[O-])ccn1 ZINC000347664029 142253256 /nfs/dbraw/zinc/25/32/56/142253256.db2.gz OQRQNFWIHYYADC-GFCCVEGCSA-N 0 3 344.371 2.678 20 5 EFBDHN CCO[C@H]1C[C@@H](N(C)CCn2cc([N+](=O)[O-])cn2)C12CCCCC2 ZINC000350039514 142393741 /nfs/dbraw/zinc/39/37/41/142393741.db2.gz IDMSNYCSDGSMHP-CVEARBPZSA-N 0 3 336.436 2.851 20 5 EFBDHN CN(C)C(=O)C[C@H](NCCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000341446696 145053802 /nfs/dbraw/zinc/05/38/02/145053802.db2.gz BPKBBEQJVNWRHC-SFHVURJKSA-N 0 3 341.411 2.947 20 5 EFBDHN CCC1CCC(NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000342340221 145104049 /nfs/dbraw/zinc/10/40/49/145104049.db2.gz HOSYNFISHQLGOC-UHFFFAOYSA-N 0 3 340.445 2.927 20 5 EFBDHN Cc1ccsc1CN(C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000342345834 145105436 /nfs/dbraw/zinc/10/54/36/145105436.db2.gz PNYNMSPQIKTLDJ-CYBMUJFWSA-N 0 3 336.413 2.836 20 5 EFBDHN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N(C)CCN(C)C ZINC000342347680 145106417 /nfs/dbraw/zinc/10/64/17/145106417.db2.gz KKBGGPJVTYCGQB-UHFFFAOYSA-N 0 3 325.434 2.729 20 5 EFBDHN C[C@H]1CN(C2CC2)C[C@H]1NC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000342361671 145108504 /nfs/dbraw/zinc/10/85/04/145108504.db2.gz LRWJQUMSDWSMKB-BLLLJJGKSA-N 0 3 346.431 2.612 20 5 EFBDHN C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)CSc1ccccc1[N+](=O)[O-] ZINC000342446524 145128030 /nfs/dbraw/zinc/12/80/30/145128030.db2.gz SCWPRQHWWWAAGI-UONOGXRCSA-N 0 3 349.456 2.772 20 5 EFBDHN C[C@@H]1C[C@H](NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])CN1C1CC1 ZINC000342592928 145155095 /nfs/dbraw/zinc/15/50/95/145155095.db2.gz JMBXWHOKXQPQKH-OLZOCXBDSA-N 0 3 331.416 2.614 20 5 EFBDHN C[C@@H]1[C@@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CCCN1C ZINC000342650348 145166006 /nfs/dbraw/zinc/16/60/06/145166006.db2.gz HQUFVXWWYJVUGJ-YGRLFVJLSA-N 0 3 340.811 2.530 20 5 EFBDHN C[C@@H]1C[C@@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CCN1C ZINC000342655659 145167485 /nfs/dbraw/zinc/16/74/85/145167485.db2.gz NCZFBUODTBJLRJ-PWSUYJOCSA-N 0 3 340.811 2.530 20 5 EFBDHN CCC[C@H]1CN(c2c([N+](=O)[O-])ncn2C)CCN1Cc1ccccc1 ZINC000342788651 145193915 /nfs/dbraw/zinc/19/39/15/145193915.db2.gz PFGAWAJYPPZGJD-INIZCTEOSA-N 0 3 343.431 2.819 20 5 EFBDHN CCCN(CCN1CCCCC1)C(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000342800781 145196574 /nfs/dbraw/zinc/19/65/74/145196574.db2.gz ZBAKUIJDZLDQTM-UHFFFAOYSA-N 0 3 333.432 2.862 20 5 EFBDHN CCCN(CCN1CCCCC1)C(=O)COc1ccccc1[N+](=O)[O-] ZINC000342802467 145196642 /nfs/dbraw/zinc/19/66/42/145196642.db2.gz MRWIOHPZNCJCHA-UHFFFAOYSA-N 0 3 349.431 2.698 20 5 EFBDHN C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000342889750 145215910 /nfs/dbraw/zinc/21/59/10/145215910.db2.gz ZMEMNAVJDVGIEJ-OLZOCXBDSA-N 0 3 344.415 2.926 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CN1CC[C@H]1Cc1ccccc1 ZINC000343563507 145239280 /nfs/dbraw/zinc/23/92/80/145239280.db2.gz ZMSCVGHZUXCLPN-DLBZAZTESA-N 0 3 342.395 2.652 20 5 EFBDHN CCCN1CCC[C@H]1CNC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000343581213 145244786 /nfs/dbraw/zinc/24/47/86/145244786.db2.gz WKDWJIOFWNYPIT-AWEZNQCLSA-N 0 3 337.445 2.678 20 5 EFBDHN Cc1cc(N[C@H]2CCCN(C)[C@@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000343598877 145248542 /nfs/dbraw/zinc/24/85/42/145248542.db2.gz IHSTUYFIEBLRFR-CJNGLKHVSA-N 0 3 341.415 2.677 20 5 EFBDHN C[C@@H]1CCN(C)CCN1C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000343763614 145288503 /nfs/dbraw/zinc/28/85/03/145288503.db2.gz GWTDYEYYTISNNY-SNVBAGLBSA-N 0 3 326.784 2.806 20 5 EFBDHN O=[N+]([O-])c1cccc(CN[C@@H](Cc2ccccc2)[C@@H](O)C(F)F)c1 ZINC000344316957 145420088 /nfs/dbraw/zinc/42/00/88/145420088.db2.gz KQKBRVMIGVVVEY-JKSUJKDBSA-N 0 3 336.338 2.922 20 5 EFBDHN O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCCN(C2CCCC2)CC1 ZINC000349108383 146053957 /nfs/dbraw/zinc/05/39/57/146053957.db2.gz LRXNSTWADLXBGW-UHFFFAOYSA-N 0 3 335.379 2.824 20 5 EFBDHN Cc1c(Br)c(N(C)CCN(C)C2CC2)ncc1[N+](=O)[O-] ZINC000351586640 146152799 /nfs/dbraw/zinc/15/27/99/146152799.db2.gz NIMBBOVEQNHNHL-UHFFFAOYSA-N 0 3 343.225 2.591 20 5 EFBDHN C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000351744748 146192796 /nfs/dbraw/zinc/19/27/96/146192796.db2.gz XCIHQYYXDXASGC-ABAIWWIYSA-N 0 3 336.367 2.824 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](NC[C@H](O)[C@@H]2CCOC2)c2ccccc2)c1 ZINC000352846540 146331895 /nfs/dbraw/zinc/33/18/95/146331895.db2.gz ABWVWFQSFBPIFN-NZSAHSFTSA-N 0 3 342.395 2.671 20 5 EFBDHN COc1cc2c(cc1CNCCc1ccc([N+](=O)[O-])cc1)OCO2 ZINC000353156335 146410363 /nfs/dbraw/zinc/41/03/63/146410363.db2.gz RSPAMOOGRPAVKL-UHFFFAOYSA-N 0 3 330.340 2.664 20 5 EFBDHN CCn1ncnc1CN[C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000355578749 147002201 /nfs/dbraw/zinc/00/22/01/147002201.db2.gz FVQWBMFSDUJFPI-HIFRSBDPSA-N 0 3 329.404 2.707 20 5 EFBDHN COC(=O)COc1ccc(CN2CCC[C@H](C)[C@@H]2C)cc1[N+](=O)[O-] ZINC000355765155 147056559 /nfs/dbraw/zinc/05/65/59/147056559.db2.gz YBPPSHRZJQPICH-STQMWFEESA-N 0 3 336.388 2.767 20 5 EFBDHN COC(=O)COc1ccc(CN2CCC[C@@H](C)[C@@H]2C)cc1[N+](=O)[O-] ZINC000355765151 147056742 /nfs/dbraw/zinc/05/67/42/147056742.db2.gz YBPPSHRZJQPICH-OLZOCXBDSA-N 0 3 336.388 2.767 20 5 EFBDHN Cc1cc(N2CCN(C)[C@H](C)[C@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000356791000 147336183 /nfs/dbraw/zinc/33/61/83/147336183.db2.gz IVAKKADADCVELJ-ZIAGYGMSSA-N 0 3 341.415 2.889 20 5 EFBDHN O=C(CC(F)(F)F)N1CCC(NCc2cccc([N+](=O)[O-])c2)CC1 ZINC000356860459 147356526 /nfs/dbraw/zinc/35/65/26/147356526.db2.gz DCACKQDPHYEPAJ-UHFFFAOYSA-N 0 3 345.321 2.628 20 5 EFBDHN Cc1c(CNC(=O)N[C@@H](C)CN2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000358584021 147844910 /nfs/dbraw/zinc/84/49/10/147844910.db2.gz PTLWRXLVPCQYIP-KGLIPLIRSA-N 0 3 348.447 2.823 20 5 EFBDHN CC[C@H](C)N[C@H](CNC(=O)Cc1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000359530688 148111797 /nfs/dbraw/zinc/11/17/97/148111797.db2.gz DKNJSTASPUCXTB-XJKSGUPXSA-N 0 3 345.399 2.976 20 5 EFBDHN CO[C@@]1(CNCc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCOC1 ZINC000359645325 148150050 /nfs/dbraw/zinc/15/00/50/148150050.db2.gz LMUALIALUVHCTE-QGZVFWFLSA-N 0 3 332.356 2.750 20 5 EFBDHN Cc1cc(NCc2ccnc(OCCN(C)C)c2)c(F)cc1[N+](=O)[O-] ZINC000360073504 148264506 /nfs/dbraw/zinc/26/45/06/148264506.db2.gz OXLNPPMDURIWGZ-UHFFFAOYSA-N 0 3 348.378 2.990 20 5 EFBDHN Cc1cc(OCC(=O)NC[C@H](C)N2CCCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000360229258 148305346 /nfs/dbraw/zinc/30/53/46/148305346.db2.gz ZYWXFIUHLUUBHN-GJZGRUSLSA-N 0 3 349.431 2.661 20 5 EFBDHN Cc1cc(OCC(=O)NC[C@H](C)N2CCCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000360229257 148305395 /nfs/dbraw/zinc/30/53/95/148305395.db2.gz ZYWXFIUHLUUBHN-CABCVRRESA-N 0 3 349.431 2.661 20 5 EFBDHN Cc1ccnc(NCCc2ccc(OCCN(C)C)cc2)c1[N+](=O)[O-] ZINC000360278108 148317876 /nfs/dbraw/zinc/31/78/76/148317876.db2.gz HJYRZTFYTDULSM-UHFFFAOYSA-N 0 3 344.415 2.893 20 5 EFBDHN Cc1cc(N2CC[C@@H](N3CCN(C(C)C)CC3)C2)ccc1[N+](=O)[O-] ZINC000364071129 149060915 /nfs/dbraw/zinc/06/09/15/149060915.db2.gz KXTWMURCJIQZBX-QGZVFWFLSA-N 0 3 332.448 2.508 20 5 EFBDHN NC(=O)c1ccc(CN2CC[C@H](c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000368490390 150131465 /nfs/dbraw/zinc/13/14/65/150131465.db2.gz ALURRKUHVONURR-HNNXBMFYSA-N 0 3 325.368 2.683 20 5 EFBDHN Cc1ccc([C@@H](C)N[C@@H]2CCN(c3cnn(C)c3)C2)cc1[N+](=O)[O-] ZINC000372785901 151062576 /nfs/dbraw/zinc/06/25/76/151062576.db2.gz VYAQLYNHSYYISK-UKRRQHHQSA-N 0 3 329.404 2.566 20 5 EFBDHN COc1ccc(OCCN2CCC(c3cn[nH]c3)CC2)c([N+](=O)[O-])c1 ZINC000374129940 151288458 /nfs/dbraw/zinc/28/84/58/151288458.db2.gz IQYQERBKYNSJTA-UHFFFAOYSA-N 0 3 346.387 2.585 20 5 EFBDHN CC[C@@H](N[C@@H]1CCN(c2cnn(C)c2)C1)c1cccc([N+](=O)[O-])c1 ZINC000378170437 152024597 /nfs/dbraw/zinc/02/45/97/152024597.db2.gz SCOKGWWOOAAOQC-RHSMWYFYSA-N 0 3 329.404 2.648 20 5 EFBDHN C[C@@H](NC(=O)N1CCCC12CCN(C)CC2)c1cccc([N+](=O)[O-])c1 ZINC000408072383 152149228 /nfs/dbraw/zinc/14/92/28/152149228.db2.gz RWVZGNJQJNIBEW-CQSZACIVSA-N 0 3 346.431 2.926 20 5 EFBDHN Cc1c(CNC(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)cccc1[N+](=O)[O-] ZINC000408331330 152177488 /nfs/dbraw/zinc/17/74/88/152177488.db2.gz QQKAQEGZPVYLQG-RDJZCZTQSA-N 0 3 346.431 2.529 20 5 EFBDHN C[C@@H](CN1CCCCC1)Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000170639587 286833396 /nfs/dbraw/zinc/83/33/96/286833396.db2.gz GKGPXUDHXUYYSM-LBPRGKRZSA-N 0 3 332.404 2.766 20 5 EFBDHN CC[C@@H]1CN([C@H](C)c2cc([N+](=O)[O-])ccc2C)CCN1C[C@H](C)O ZINC000245516338 287210421 /nfs/dbraw/zinc/21/04/21/287210421.db2.gz FUVLGVOVVQUHBN-ARFHVFGLSA-N 0 3 335.448 2.741 20 5 EFBDHN Cc1c(CN(C)C[C@@H](O)COCc2ccccc2)cccc1[N+](=O)[O-] ZINC000114189609 544570707 /nfs/dbraw/zinc/57/07/07/544570707.db2.gz NESURPOTBFOQSN-GOSISDBHSA-N 0 3 344.411 2.913 20 5 EFBDHN CCCCNC(=O)C1CCN(CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000051183165 292636001 /nfs/dbraw/zinc/63/60/01/292636001.db2.gz ZYHPTVTXXVGBQB-UHFFFAOYSA-N 0 3 349.431 2.602 20 5 EFBDHN COc1cccc(C(=O)Nc2cccc(CN(C)C)c2)c1[N+](=O)[O-] ZINC000193998498 265357153 /nfs/dbraw/zinc/35/71/53/265357153.db2.gz DJMJGADOMDHNQN-UHFFFAOYSA-N 0 3 329.356 2.917 20 5 EFBDHN CN(C)CCOc1ccccc1CNC(=O)c1ccc([N+](=O)[O-])s1 ZINC000194964999 265399907 /nfs/dbraw/zinc/39/99/07/265399907.db2.gz OQCIPIHDDPFVKL-UHFFFAOYSA-N 0 3 349.412 2.527 20 5 EFBDHN CC(C)N1C[C@@H](N[C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1=O ZINC000271536612 266002731 /nfs/dbraw/zinc/00/27/31/266002731.db2.gz SRFVMRWAAOXEJT-JKSUJKDBSA-N 0 3 331.416 2.515 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@H]2CCN(Cc3ccccc3)C[C@@H]2CO)cc1 ZINC000271564253 266009136 /nfs/dbraw/zinc/00/91/36/266009136.db2.gz APAIDXOBNRDHGO-APWZRJJASA-N 0 3 341.411 2.890 20 5 EFBDHN Cc1cc(C2CCN(CCOc3ccccc3[N+](=O)[O-])CC2)n[nH]1 ZINC000271607403 266020098 /nfs/dbraw/zinc/02/00/98/266020098.db2.gz JOSYOLAYGUBXIW-UHFFFAOYSA-N 0 3 330.388 2.885 20 5 EFBDHN Cc1cc(C2CCN(CCOc3ccccc3[N+](=O)[O-])CC2)[nH]n1 ZINC000271607403 266020099 /nfs/dbraw/zinc/02/00/99/266020099.db2.gz JOSYOLAYGUBXIW-UHFFFAOYSA-N 0 3 330.388 2.885 20 5 EFBDHN COc1cccc([C@H](C)NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000271620684 266023629 /nfs/dbraw/zinc/02/36/29/266023629.db2.gz CYFPERRGEXNYDW-XJKSGUPXSA-N 0 3 346.383 2.694 20 5 EFBDHN CO[C@@H]1[C@H](C)[C@H](N[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1(C)C ZINC000271854641 266079205 /nfs/dbraw/zinc/07/92/05/266079205.db2.gz UQDVQAWFJNVTJZ-FDRIWYBQSA-N 0 3 335.404 2.571 20 5 EFBDHN CO[C@@H]1[C@H](C)[C@@H](N[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1(C)C ZINC000271854649 266079437 /nfs/dbraw/zinc/07/94/37/266079437.db2.gz UQDVQAWFJNVTJZ-YIKOMLBNSA-N 0 3 335.404 2.571 20 5 EFBDHN Cc1cc([C@@H](NCCn2cc([N+](=O)[O-])ccc2=O)C2CC2)ccc1F ZINC000272084549 266146989 /nfs/dbraw/zinc/14/69/89/266146989.db2.gz MCPXIYQIAJMVSB-SFHVURJKSA-N 0 3 345.374 2.945 20 5 EFBDHN C[C@H](C1CCN(C)CC1)N(C)C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000272126887 266162022 /nfs/dbraw/zinc/16/20/22/266162022.db2.gz ATLSZTDWGVHFSE-GFCCVEGCSA-N 0 3 344.415 2.878 20 5 EFBDHN CN1CC[C@@H]2CCN(c3ccc([N+](=O)[O-])c(OC(F)F)c3)[C@H]2C1 ZINC000272258851 266206620 /nfs/dbraw/zinc/20/66/20/266206620.db2.gz ZUYLTJIGWKKGEQ-MFKMUULPSA-N 0 3 327.331 2.727 20 5 EFBDHN CC[C@H](NC(=O)N1CC[C@H]2CCN(C)C[C@@H]21)c1cccc([N+](=O)[O-])c1 ZINC000272633256 266334315 /nfs/dbraw/zinc/33/43/15/266334315.db2.gz XFWVLGAIWPVNDR-COXVUDFISA-N 0 3 346.431 2.782 20 5 EFBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])NCC(=O)NCC1CC1 ZINC000272644847 266337659 /nfs/dbraw/zinc/33/76/59/266337659.db2.gz OTTHLZRNAZGSBE-ZDUSSCGKSA-N 0 3 337.445 2.581 20 5 EFBDHN COc1ccc(NC(=O)N2CCCN(C(C)C)CC2)cc1[N+](=O)[O-] ZINC000272778321 266379742 /nfs/dbraw/zinc/37/97/42/266379742.db2.gz DGUHILDOYNUCSR-UHFFFAOYSA-N 0 3 336.392 2.551 20 5 EFBDHN Cc1cc(NC[C@H]2CC(=O)N(C3CC3)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000272884831 266407702 /nfs/dbraw/zinc/40/77/02/266407702.db2.gz WJPXQDMLIPMWNE-GFCCVEGCSA-N 0 3 340.383 2.874 20 5 EFBDHN COc1ccc([C@@H](CN2CCCC2)Nc2c([N+](=O)[O-])ncn2C)cc1 ZINC000273193013 266463008 /nfs/dbraw/zinc/46/30/08/266463008.db2.gz DAKDJUWKOPIIKI-OAHLLOKOSA-N 0 3 345.403 2.586 20 5 EFBDHN COc1ccc([C@@H](C)NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1 ZINC000273225394 266468514 /nfs/dbraw/zinc/46/85/14/266468514.db2.gz VNVYMFLHXBKHEN-HIFRSBDPSA-N 0 3 346.383 2.694 20 5 EFBDHN C[C@@H](C1CCN(C)CC1)N(C)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000273391631 266491568 /nfs/dbraw/zinc/49/15/68/266491568.db2.gz DOHAOQYKHLAGJG-AWEZNQCLSA-N 0 3 348.447 2.509 20 5 EFBDHN CCC(O)(CC)CCNCc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000276191655 266939175 /nfs/dbraw/zinc/93/91/75/266939175.db2.gz HBYYKFUNSSPLLH-UHFFFAOYSA-N 0 3 326.393 2.643 20 5 EFBDHN CS[C@@H]1CN(c2nc3ccccc3cc2[N+](=O)[O-])C[C@@H]1N(C)C ZINC000276683680 267035270 /nfs/dbraw/zinc/03/52/70/267035270.db2.gz VGYIYNZFPOJHFC-LSDHHAIUSA-N 0 3 332.429 2.625 20 5 EFBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])N[C@@H](C)C(=O)N(C)C ZINC000276911465 267075014 /nfs/dbraw/zinc/07/50/14/267075014.db2.gz PBLNMMYPCXIFKN-RYUDHWBXSA-N 0 3 325.434 2.532 20 5 EFBDHN CO[C@H]1CCCC[C@@H]1NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000276940780 267081664 /nfs/dbraw/zinc/08/16/64/267081664.db2.gz JVOQZVFDDTZHHE-JSGCOSHPSA-N 0 3 341.795 2.734 20 5 EFBDHN O=c1[nH]c(CC(F)(F)F)c([O-])n1-c1ccc([N+](=O)[O-])cc1Cl ZINC000277247518 267137907 /nfs/dbraw/zinc/13/79/07/267137907.db2.gz HTMABIAVUHHGQT-SSDOTTSWSA-N 0 3 337.641 2.625 20 5 EFBDHN O=C1NC(CC(F)(F)F)C(=O)N1c1ccc([N+](=O)[O-])cc1Cl ZINC000277247518 267137911 /nfs/dbraw/zinc/13/79/11/267137911.db2.gz HTMABIAVUHHGQT-SSDOTTSWSA-N 0 3 337.641 2.625 20 5 EFBDHN C[C@H]1CN(C2CC2)C[C@H]1Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000277510724 267189234 /nfs/dbraw/zinc/18/92/34/267189234.db2.gz ACMAUKBKEAVJCW-GZMMTYOYSA-N 0 3 330.310 2.903 20 5 EFBDHN C[C@@H]1CN(C2CC2)C[C@@H]1Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000277510729 267189792 /nfs/dbraw/zinc/18/97/92/267189792.db2.gz ACMAUKBKEAVJCW-KCJUWKMLSA-N 0 3 330.310 2.903 20 5 EFBDHN O=C(NC[C@@H]1CCCCN1C1CC1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000277947990 267306602 /nfs/dbraw/zinc/30/66/02/267306602.db2.gz OUHQOQSLFZRJGU-AWEZNQCLSA-N 0 3 342.399 2.823 20 5 EFBDHN O=[N+]([O-])c1ccc(CN2CC[C@H](N3CCCCC3)C2)c([N+](=O)[O-])c1 ZINC000278240795 267377289 /nfs/dbraw/zinc/37/72/89/267377289.db2.gz NUOWZKQRQGWJAJ-HNNXBMFYSA-N 0 3 334.376 2.563 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CCC[C@H]2C[C@@H](O)c2ccco2)c1 ZINC000269642216 273086949 /nfs/dbraw/zinc/08/69/49/273086949.db2.gz JSRNQHOTULLMKC-USXIJHARSA-N 0 3 346.383 2.809 20 5 EFBDHN C[C@H](N[C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])c1ncnn1C ZINC000276737433 273141983 /nfs/dbraw/zinc/14/19/83/273141983.db2.gz YZLHPTBASAFHNO-KCQAQPDRSA-N 0 3 329.404 2.785 20 5 EFBDHN C[C@H](N[C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])c1ncnn1C ZINC000276737428 273142006 /nfs/dbraw/zinc/14/20/06/273142006.db2.gz YZLHPTBASAFHNO-GZBFAFLISA-N 0 3 329.404 2.785 20 5 EFBDHN C[C@@H](CN1CCCC1=O)N[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000278989606 273163888 /nfs/dbraw/zinc/16/38/88/273163888.db2.gz DSRBRFWIRSNIEX-LRDDRELGSA-N 0 3 331.416 2.918 20 5 EFBDHN Cc1nc2n(n1)C[C@H](N[C@@H]1CC(C)(C)c3ccc([N+](=O)[O-])cc31)CC2 ZINC000279044391 273169875 /nfs/dbraw/zinc/16/98/75/273169875.db2.gz JPDFBJCVTBLJPF-MLGOLLRUSA-N 0 3 341.415 2.822 20 5 EFBDHN CC1(C)C[C@H](NCC2(C(N)=O)CCCC2)c2cc([N+](=O)[O-])ccc21 ZINC000279084962 273174892 /nfs/dbraw/zinc/17/48/92/273174892.db2.gz MZGRJLDUPLZTQP-HNNXBMFYSA-N 0 3 331.416 2.953 20 5 EFBDHN CC(C)N(C)CC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000279284604 273197851 /nfs/dbraw/zinc/19/78/51/273197851.db2.gz JBUXGMKVZKRSKQ-UHFFFAOYSA-N 0 3 333.310 2.570 20 5 EFBDHN C[C@]1(C(N)=O)CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000280128628 273294011 /nfs/dbraw/zinc/29/40/11/273294011.db2.gz CGLZWJMIMFSMLE-KRWDZBQOSA-N 0 3 329.356 2.552 20 5 EFBDHN Cc1c(CN(C)[C@H](CC(N)=O)c2ccccc2)cccc1[N+](=O)[O-] ZINC000280532896 273337943 /nfs/dbraw/zinc/33/79/43/273337943.db2.gz PASZVYQEQATCSL-QGZVFWFLSA-N 0 3 327.384 2.952 20 5 EFBDHN CN(CCOc1ccc([N+](=O)[O-])cc1)[C@H](CC(N)=O)c1ccccc1 ZINC000280626949 273348170 /nfs/dbraw/zinc/34/81/70/273348170.db2.gz XBXHHXITHPZAQT-QGZVFWFLSA-N 0 3 343.383 2.522 20 5 EFBDHN COc1ccc(NC(=O)CCN2CCC(C)=C(C)C2)c([N+](=O)[O-])c1 ZINC000280703963 273357433 /nfs/dbraw/zinc/35/74/33/273357433.db2.gz ISADHDDISJDJSY-UHFFFAOYSA-N 0 3 333.388 2.974 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)NC1CCN(C(C)C)CC1 ZINC000281260297 273416914 /nfs/dbraw/zinc/41/69/14/273416914.db2.gz VHWRNTYEEXIYMB-UHFFFAOYSA-N 0 3 335.404 2.596 20 5 EFBDHN COCC[C@@H](CO)NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000282301849 273543102 /nfs/dbraw/zinc/54/31/02/273543102.db2.gz RWEKYOIEQDALFW-LBPRGKRZSA-N 0 3 336.413 2.810 20 5 EFBDHN CN(C)CCN(Cc1ccccn1)c1ncc(Cl)cc1[N+](=O)[O-] ZINC000154202407 273795759 /nfs/dbraw/zinc/79/57/59/273795759.db2.gz RFBNZDWYIROQIN-UHFFFAOYSA-N 0 3 335.795 2.606 20 5 EFBDHN CN(C)c1cccnc1CN[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000353633051 273822527 /nfs/dbraw/zinc/82/25/27/273822527.db2.gz VRXOPMJQQRLXPI-CJNGLKHVSA-N 0 3 344.419 2.526 20 5 EFBDHN CCO[C@@H]1C[C@H](N[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)[C@@]12CCCO2 ZINC000284897733 273903977 /nfs/dbraw/zinc/90/39/77/273903977.db2.gz CDAGXGOVMNMILS-BEMMVCDISA-N 0 3 335.404 2.554 20 5 EFBDHN COCC(C)(C)N1CCN(c2nccc3c2cccc3[N+](=O)[O-])CC1 ZINC000425276525 274017157 /nfs/dbraw/zinc/01/71/57/274017157.db2.gz HBJGOBKJPHAGKF-UHFFFAOYSA-N 0 3 344.415 2.690 20 5 EFBDHN C[C@H]1COCC[C@@H]1CNCc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000285617831 274038793 /nfs/dbraw/zinc/03/87/93/274038793.db2.gz WGUSRGAGMZTARD-WDEREUQCSA-N 0 3 330.331 2.958 20 5 EFBDHN COc1cc(C[NH2+]CCCc2cccc(C)n2)c([N+](=O)[O-])cc1[O-] ZINC000285720869 274060749 /nfs/dbraw/zinc/06/07/49/274060749.db2.gz WYFUSSFPLYXJHD-UHFFFAOYSA-N 0 3 331.372 2.735 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(C)cc1NC1CCN(C2CC2)CC1 ZINC000285994492 274113817 /nfs/dbraw/zinc/11/38/17/274113817.db2.gz CZFKUQKOPIEBJU-UHFFFAOYSA-N 0 3 333.388 2.729 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1C[C@@H](N2CCOCC2)C[C@@H]1C ZINC000286144401 274142241 /nfs/dbraw/zinc/14/22/41/274142241.db2.gz VQVHGFRAXOSANQ-ZOBUZTSGSA-N 0 3 333.432 2.759 20 5 EFBDHN C[C@@H](C(=O)N(C)CCc1ccccc1[N+](=O)[O-])N1CCCCCC1 ZINC000359145397 274191252 /nfs/dbraw/zinc/19/12/52/274191252.db2.gz UYEXPUYCGXWFDQ-HNNXBMFYSA-N 0 3 333.432 2.860 20 5 EFBDHN C[C@@H]1CCCC[C@H]1N(C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000192629752 274287399 /nfs/dbraw/zinc/28/73/99/274287399.db2.gz JLGBTXJUOUJHEK-CZUORRHYSA-N 0 3 331.416 2.994 20 5 EFBDHN C[C@@H](CN(C)C)NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000286973572 274312721 /nfs/dbraw/zinc/31/27/21/274312721.db2.gz CSQHICSXNSCUIO-QMMMGPOBSA-N 0 3 334.298 2.685 20 5 EFBDHN CS[C@@H]1CN(c2c(F)cccc2[N+](=O)[O-])C[C@H]1N1CCCC1 ZINC000287107554 274344324 /nfs/dbraw/zinc/34/43/24/274344324.db2.gz ZLOBGVCQSWODIC-ZIAGYGMSSA-N 0 3 325.409 2.750 20 5 EFBDHN C[C@H](C(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@H](N)c1ccccc1 ZINC000150845156 274457844 /nfs/dbraw/zinc/45/78/44/274457844.db2.gz DUWHQDSAAKHFDK-SJCJKPOMSA-N 0 3 325.368 2.820 20 5 EFBDHN CCCN(CCN1CCCC1)C(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000287635483 274461562 /nfs/dbraw/zinc/46/15/62/274461562.db2.gz ZTJICTFXJDKLGR-UHFFFAOYSA-N 0 3 333.432 2.780 20 5 EFBDHN CCn1c(C)nc([N+](=O)[O-])c1NC[C@H](c1cccc(OC)c1)N(C)C ZINC000288264400 274559787 /nfs/dbraw/zinc/55/97/87/274559787.db2.gz YTYPMENEICESQP-OAHLLOKOSA-N 0 3 347.419 2.843 20 5 EFBDHN COc1cc(CN[C@@H]2COc3c(C)cccc3C2)c([N+](=O)[O-])cc1O ZINC000289789508 274822306 /nfs/dbraw/zinc/82/23/06/274822306.db2.gz YOURUGVKNLMOME-AWEZNQCLSA-N 0 3 344.367 2.711 20 5 EFBDHN O=[N+]([O-])c1cc2c(ncnc2N2CCN(C3CCCC3)CC2)s1 ZINC000408100731 275034124 /nfs/dbraw/zinc/03/41/24/275034124.db2.gz CTHWISXEUGGEPM-UHFFFAOYSA-N 0 3 333.417 2.664 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CNCCNC(=O)c1ccco1 ZINC000344818949 275398607 /nfs/dbraw/zinc/39/86/07/275398607.db2.gz GBARCCABFSLAQE-RAXLEYEMSA-N 0 3 329.356 2.611 20 5 EFBDHN CCN1CC[C@H]2OCCN(Cc3c(Cl)cccc3[N+](=O)[O-])[C@H]2C1 ZINC000339378169 276235328 /nfs/dbraw/zinc/23/53/28/276235328.db2.gz CNTJRMGJNONXRP-JKSUJKDBSA-N 0 3 339.823 2.543 20 5 EFBDHN CCN(CCNC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)C1CC1 ZINC000176082903 276347486 /nfs/dbraw/zinc/34/74/86/276347486.db2.gz YXNKGQLOHGXGBD-CYBMUJFWSA-N 0 3 334.420 2.748 20 5 EFBDHN CN(C)C[C@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2)c2ccccc2O1 ZINC000370502286 276769696 /nfs/dbraw/zinc/76/96/96/276769696.db2.gz BYTXANIYKJQLEC-HNNXBMFYSA-N 0 3 341.367 2.564 20 5 EFBDHN CN(C)CC1(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCC1 ZINC000341994883 276781731 /nfs/dbraw/zinc/78/17/31/276781731.db2.gz MRPXDJRYJXPRFP-UHFFFAOYSA-N 0 3 345.321 2.828 20 5 EFBDHN CN(C)CCOC1CCN(c2nc3ccccc3cc2[N+](=O)[O-])CC1 ZINC000352359091 276791871 /nfs/dbraw/zinc/79/18/71/276791871.db2.gz BTYHEJKJEKFOHJ-UHFFFAOYSA-N 0 3 344.415 2.690 20 5 EFBDHN CN(C)CCOC1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000349255554 276791879 /nfs/dbraw/zinc/79/18/79/276791879.db2.gz WNGVIBQKCSZYPS-UHFFFAOYSA-N 0 3 327.812 2.795 20 5 EFBDHN COc1cccc(CN(CCN(C)C)c2ncc(C)cc2[N+](=O)[O-])c1 ZINC000189628006 277453651 /nfs/dbraw/zinc/45/36/51/277453651.db2.gz RDBNQYXYCNWZEE-UHFFFAOYSA-N 0 3 344.415 2.875 20 5 EFBDHN COCC[C@H](Cc1ccco1)NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000344331877 277553716 /nfs/dbraw/zinc/55/37/16/277553716.db2.gz XRBOYKVMRWWTOD-CQSZACIVSA-N 0 3 334.372 2.934 20 5 EFBDHN CC(C)c1ccc(CN[C@H]2CC(=O)N3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000337845143 278037410 /nfs/dbraw/zinc/03/74/10/278037410.db2.gz HLUUYQBKRZSFTE-HOTGVXAUSA-N 0 3 331.416 2.961 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N[C@H](C)c1nnc2ccccn21 ZINC000449067257 279382828 /nfs/dbraw/zinc/38/28/28/279382828.db2.gz JVHQXJVKMSNPGA-CHWSQXEVSA-N 0 3 325.372 2.919 20 5 EFBDHN NC(=O)C1CCN(Cc2cc(=O)oc3ccc4ccccc4c23)CC1 ZINC000007435306 279558943 /nfs/dbraw/zinc/55/89/43/279558943.db2.gz VJXVXWKGXCMOBN-UHFFFAOYSA-N 0 3 336.391 2.644 20 5 EFBDHN C[C@H]1[C@H](C)N(Cc2ccc(Br)cc2[N+](=O)[O-])CCN1C ZINC000425454864 280112197 /nfs/dbraw/zinc/11/21/97/280112197.db2.gz GYANVPRAJZIJHH-QWRGUYRKSA-N 0 3 342.237 2.882 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@@H](N(C)C)C1 ZINC000184727882 280158893 /nfs/dbraw/zinc/15/88/93/280158893.db2.gz AHJAFGKIJNFOAH-DOTOQJQBSA-N 0 3 333.432 2.716 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CC[C@H](N2CCCC2)C1 ZINC000094094371 280397793 /nfs/dbraw/zinc/39/77/93/280397793.db2.gz BTSHCBCHWPDQCP-HNNXBMFYSA-N 0 3 331.416 2.830 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCCC12CCN(C)CC2 ZINC000372608033 280662296 /nfs/dbraw/zinc/66/22/96/280662296.db2.gz FYLYIONKOZFUJZ-UHFFFAOYSA-N 0 3 332.404 2.995 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCCN(C2CCCC2)CC1 ZINC000194741040 281256996 /nfs/dbraw/zinc/25/69/96/281256996.db2.gz HUNGWKQWRABPPF-UHFFFAOYSA-N 0 3 331.416 2.994 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCN([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000346257712 281257063 /nfs/dbraw/zinc/25/70/63/281257063.db2.gz HBZMVHMCJIPUJO-JGGQBBKZSA-N 0 3 331.416 2.706 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1NCCc2ccccc21 ZINC000261604762 281257838 /nfs/dbraw/zinc/25/78/38/281257838.db2.gz CKZXBVQVLCYNSZ-HNNXBMFYSA-N 0 3 325.368 2.520 20 5 EFBDHN CN1CCC(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000065308486 292683455 /nfs/dbraw/zinc/68/34/55/292683455.db2.gz MOQAAXXXWBLJQH-UHFFFAOYSA-N 0 3 346.412 2.542 20 5 EFBDHN C[C@@H]1[C@H](N2CCCC2)CCN1C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000376486113 289043566 /nfs/dbraw/zinc/04/35/66/289043566.db2.gz GVEWLDUNSYLIMN-BXUZGUMPSA-N 0 3 337.807 2.947 20 5 EFBDHN COc1cc(CN[C@H]2C[C@](C)(OC)C2(C)C)c([N+](=O)[O-])cc1OC ZINC000072926673 292721313 /nfs/dbraw/zinc/72/13/13/292721313.db2.gz XJPFOQMZXRQHFZ-RDJZCZTQSA-N 0 3 338.404 2.905 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCCN1CC ZINC000128101269 293091246 /nfs/dbraw/zinc/09/12/46/293091246.db2.gz MACMYXUVNPDUGR-ZDUSSCGKSA-N 0 3 337.445 2.921 20 5 EFBDHN CN(CCN1CCCC1)C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000129673395 293141683 /nfs/dbraw/zinc/14/16/83/293141683.db2.gz FJGNUYCGUYXKSK-UHFFFAOYSA-N 0 3 345.321 2.781 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)NC1CCN(CC)CC1 ZINC000130897461 293181532 /nfs/dbraw/zinc/18/15/32/293181532.db2.gz WEMQQKWRWNZGFI-UHFFFAOYSA-N 0 3 337.445 2.921 20 5 EFBDHN COc1cc(C(=O)NC[C@@H](c2ccccc2)N(C)C)ccc1[N+](=O)[O-] ZINC000133235740 293250641 /nfs/dbraw/zinc/25/06/41/293250641.db2.gz YENDSIGMQXSZJM-INIZCTEOSA-N 0 3 343.383 2.636 20 5 EFBDHN C[C@@H]1CN(C[C@H]2CCCN2CCc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000249835959 297027010 /nfs/dbraw/zinc/02/70/10/297027010.db2.gz WHQCLXPZWFAFCB-JTDSTZFVSA-N 0 3 347.459 2.711 20 5 EFBDHN Cc1cc([N+](=O)[O-])cc(C(=O)N2C[C@H](N3CCCC3)C[C@@H]2C)c1F ZINC000290060006 293989147 /nfs/dbraw/zinc/98/91/47/293989147.db2.gz YDUXNRMHDQATDT-GXTWGEPZSA-N 0 3 335.379 2.741 20 5 EFBDHN COc1cc(CNCCc2ccccc2[N+](=O)[O-])cc(OC)c1O ZINC000290361320 294066762 /nfs/dbraw/zinc/06/67/62/294066762.db2.gz MTWQHNCDGHUXNO-UHFFFAOYSA-N 0 3 332.356 2.650 20 5 EFBDHN CN(C)CCOc1ccccc1CNc1ccc([N+](=O)[O-])c(N)c1F ZINC000290525773 294111394 /nfs/dbraw/zinc/11/13/94/294111394.db2.gz GTPNZAYXTIJZJG-UHFFFAOYSA-N 0 3 348.378 2.869 20 5 EFBDHN Cc1nc(CCNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])n[nH]1 ZINC000290931345 294223461 /nfs/dbraw/zinc/22/34/61/294223461.db2.gz SAIODBZRCVLXMJ-UHFFFAOYSA-N 0 3 330.175 2.660 20 5 EFBDHN Cc1n[nH]c(CCNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])n1 ZINC000290931345 294223463 /nfs/dbraw/zinc/22/34/63/294223463.db2.gz SAIODBZRCVLXMJ-UHFFFAOYSA-N 0 3 330.175 2.660 20 5 EFBDHN CCN(Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C[C@@H](C)OC ZINC000291129110 294284288 /nfs/dbraw/zinc/28/42/88/294284288.db2.gz WCODRFWCPVPRIH-CYBMUJFWSA-N 0 3 332.404 2.852 20 5 EFBDHN CCCCN(C)C[C@@H](C)Nc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000291188442 294304283 /nfs/dbraw/zinc/30/42/83/294304283.db2.gz SMACCSCDJHMDJE-LLVKDONJSA-N 0 3 333.392 2.776 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCN2CC[C@@](CO)(c3ccccc3)C2)cc1 ZINC000291230738 294318579 /nfs/dbraw/zinc/31/85/79/294318579.db2.gz MHVUTRZVNDFECO-LJQANCHMSA-N 0 3 342.395 2.610 20 5 EFBDHN CCN1CCC(Nc2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])CC1 ZINC000291701374 294456913 /nfs/dbraw/zinc/45/69/13/294456913.db2.gz UJTJPXMYBVLIDJ-UHFFFAOYSA-N 0 3 334.420 2.629 20 5 EFBDHN CC(C)(NC[C@H](O)COc1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000292065812 294568403 /nfs/dbraw/zinc/56/84/03/294568403.db2.gz CZGDJSMDNAPAIX-ZDUSSCGKSA-N 0 3 348.374 2.999 20 5 EFBDHN Cc1cccc(C(=O)N2CCN(C3CCC3)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000293699327 295030322 /nfs/dbraw/zinc/03/03/22/295030322.db2.gz NEPSGCCNPUNFBA-ZDUSSCGKSA-N 0 3 331.416 2.850 20 5 EFBDHN COc1ccc(C(=O)N2CCN(C3CCC3)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000293780011 295048015 /nfs/dbraw/zinc/04/80/15/295048015.db2.gz WATCZWOBLRAWFN-ZDUSSCGKSA-N 0 3 347.415 2.550 20 5 EFBDHN Cc1cccc(C(=O)NCCN[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000293842795 295061942 /nfs/dbraw/zinc/06/19/42/295061942.db2.gz SYKXQNDMFYIBMP-ZDUSSCGKSA-N 0 3 342.399 2.566 20 5 EFBDHN C[C@H](NCCCN(C)CC(F)(F)F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000293870517 295067833 /nfs/dbraw/zinc/06/78/33/295067833.db2.gz UXIUOROJLUBIOE-JTQLQIEISA-N 0 3 334.342 2.712 20 5 EFBDHN CN1CCC[C@@]2(CCN(C(=O)c3ccc([N+](=O)[O-])c(Cl)c3)C2)C1 ZINC000293918541 295079179 /nfs/dbraw/zinc/07/91/79/295079179.db2.gz IINACAOTIUYFKI-MRXNPFEDSA-N 0 3 337.807 2.806 20 5 EFBDHN CSc1ccc([C@@H](CNc2ncc([N+](=O)[O-])cn2)N(C)C)cc1 ZINC000293994612 295095306 /nfs/dbraw/zinc/09/53/06/295095306.db2.gz JCEFXTLQYHOKSZ-CQSZACIVSA-N 0 3 333.417 2.822 20 5 EFBDHN CN1CCC[C@@]2(CCN(C(=O)c3c(Cl)cccc3[N+](=O)[O-])C2)C1 ZINC000294101613 295111272 /nfs/dbraw/zinc/11/12/72/295111272.db2.gz KSURYMUTSVMDKI-MRXNPFEDSA-N 0 3 337.807 2.806 20 5 EFBDHN O=C(CCC(=O)c1cccc([N+](=O)[O-])c1)NCCCN1CCCCC1 ZINC000294314580 295145898 /nfs/dbraw/zinc/14/58/98/295145898.db2.gz HDZWYDDEDOPLEX-UHFFFAOYSA-N 0 3 347.415 2.550 20 5 EFBDHN CC(C)(CCC(=O)N[C@H](CN1CCCC1)c1ccccc1)[N+](=O)[O-] ZINC000294491949 295175322 /nfs/dbraw/zinc/17/53/22/295175322.db2.gz PPKSOPCILFUROI-MRXNPFEDSA-N 0 3 333.432 2.775 20 5 EFBDHN CC(C)(CCC(=O)NC[C@@H](c1ccccc1)N1CCCC1)[N+](=O)[O-] ZINC000294553662 295184868 /nfs/dbraw/zinc/18/48/68/295184868.db2.gz WBCWPROJGVWPJH-INIZCTEOSA-N 0 3 333.432 2.775 20 5 EFBDHN C[C@@H]1CC[C@H](C)[C@@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000294928960 295247186 /nfs/dbraw/zinc/24/71/86/295247186.db2.gz BYJXVYCWDZCVKA-WWGRRREGSA-N 0 3 340.445 2.783 20 5 EFBDHN Cc1cc(Cl)c(C(=O)N2CCC[C@@H](N(C)C)C2)cc1[N+](=O)[O-] ZINC000295021471 295258768 /nfs/dbraw/zinc/25/87/68/295258768.db2.gz HLNSCYHQLMFKOJ-LLVKDONJSA-N 0 3 325.796 2.723 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)CCC(C)(C)[N+](=O)[O-] ZINC000295124858 295271032 /nfs/dbraw/zinc/27/10/32/295271032.db2.gz HLIPLWKORXNSKP-WBVHZDCISA-N 0 3 347.459 2.849 20 5 EFBDHN CN(CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC(C)(C)CO ZINC000295314542 295298995 /nfs/dbraw/zinc/29/89/95/295298995.db2.gz WAJRFMBJIKYAAZ-UHFFFAOYSA-N 0 3 333.388 2.743 20 5 EFBDHN C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)CCN(C2CC2)C1 ZINC000295339229 295303197 /nfs/dbraw/zinc/30/31/97/295303197.db2.gz MKZPFTILNFYHJP-LLVKDONJSA-N 0 3 337.807 2.805 20 5 EFBDHN C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)CCN(C2CC2)C1 ZINC000295339235 295303301 /nfs/dbraw/zinc/30/33/01/295303301.db2.gz MKZPFTILNFYHJP-NSHDSACASA-N 0 3 337.807 2.805 20 5 EFBDHN C[C@@H]1CN(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CCN(C2CC2)C1 ZINC000295386010 295311504 /nfs/dbraw/zinc/31/15/04/295311504.db2.gz PZMVFHMFEBLURK-NSHDSACASA-N 0 3 337.807 2.805 20 5 EFBDHN C[C@@H]1[C@H](CC(F)(F)F)C[C@H](C)N1CCn1cc([N+](=O)[O-])ccc1=O ZINC000295598243 295346930 /nfs/dbraw/zinc/34/69/30/295346930.db2.gz CCGLTMIXWRDMQY-TUAOUCFPSA-N 0 3 347.337 2.808 20 5 EFBDHN Cc1nc(N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)ncc1[N+](=O)[O-] ZINC000295714635 295364826 /nfs/dbraw/zinc/36/48/26/295364826.db2.gz SJVAWVCMFTZLRR-DZGCQCFKSA-N 0 3 327.388 2.768 20 5 EFBDHN Cc1nc(N[C@H]2CCN(Cc3ccccc3)[C@H]2C)ncc1[N+](=O)[O-] ZINC000295714649 295364845 /nfs/dbraw/zinc/36/48/45/295364845.db2.gz SJVAWVCMFTZLRR-ZFWWWQNUSA-N 0 3 327.388 2.768 20 5 EFBDHN CC(C)(C[C@H]1CCCN(CCOc2ccc([N+](=O)[O-])cc2)C1)C(N)=O ZINC000295772495 295373965 /nfs/dbraw/zinc/37/39/65/295373965.db2.gz YQKUYSLSTDPHML-CQSZACIVSA-N 0 3 349.431 2.587 20 5 EFBDHN COc1ccccc1[C@@H]1CCCN1CCn1cc([N+](=O)[O-])ccc1=O ZINC000090525515 295387934 /nfs/dbraw/zinc/38/79/34/295387934.db2.gz JYEMQPJYRDAAKX-INIZCTEOSA-N 0 3 343.383 2.602 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)c([N+](=O)[O-])c1 ZINC000295908141 295395078 /nfs/dbraw/zinc/39/50/78/295395078.db2.gz HHGLSPHGRFDDPT-YUELXQCFSA-N 0 3 333.344 2.550 20 5 EFBDHN C[C@H](C(=O)N1CCC[C@H]1CN1CCCC1)c1ccc([N+](=O)[O-])cc1F ZINC000185128906 298040045 /nfs/dbraw/zinc/04/00/45/298040045.db2.gz IPKKPKPLUVNXAX-ZFWWWQNUSA-N 0 3 349.406 2.924 20 5 EFBDHN C[C@H]1CN(C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)CCN(C2CC2)C1 ZINC000452171386 300183596 /nfs/dbraw/zinc/18/35/96/300183596.db2.gz KMYVDURTNCRBCN-GFCCVEGCSA-N 0 3 342.399 2.632 20 5 EFBDHN CC(C)(C)OC(=O)NCC1(CNCc2ccccc2[N+](=O)[O-])CC1 ZINC000298260344 310973007 /nfs/dbraw/zinc/97/30/07/310973007.db2.gz FLKVZIQFMFUKKR-UHFFFAOYSA-N 0 3 335.404 2.989 20 5 EFBDHN CCO[C@@H]1C[C@H](NCc2ccc(OC)c([N+](=O)[O-])c2)[C@@H]1SC ZINC000298601688 311006965 /nfs/dbraw/zinc/00/69/65/311006965.db2.gz ZEYBRRCNDKPTIF-GLQYFDAESA-N 0 3 326.418 2.602 20 5 EFBDHN CCO[C@@H]1C[C@@H](NCc2ccc(OC)c([N+](=O)[O-])c2)[C@@H]1SC ZINC000298601683 311007025 /nfs/dbraw/zinc/00/70/25/311007025.db2.gz ZEYBRRCNDKPTIF-DFBGVHRSSA-N 0 3 326.418 2.602 20 5 EFBDHN CNC(=O)c1ccc(NC[C@H](c2ccccc2)N(C)C)c([N+](=O)[O-])c1 ZINC000299058235 311046406 /nfs/dbraw/zinc/04/64/06/311046406.db2.gz KLVGHFMAVXNELT-QGZVFWFLSA-N 0 3 342.399 2.669 20 5 EFBDHN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1CN1CCCC1 ZINC000299497062 311090742 /nfs/dbraw/zinc/09/07/42/311090742.db2.gz HEBNJUALWCIZQW-HNNXBMFYSA-N 0 3 349.456 2.774 20 5 EFBDHN CCN1CCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000299617256 311103285 /nfs/dbraw/zinc/10/32/85/311103285.db2.gz KRZALGWBRDVCMN-UHFFFAOYSA-N 0 3 326.784 2.808 20 5 EFBDHN O=[N+]([O-])c1ccc2nc(N3CCN(c4ccncc4)CC3)ccc2c1 ZINC000301071486 311117164 /nfs/dbraw/zinc/11/71/64/311117164.db2.gz FUSUUBBMIOBEHR-UHFFFAOYSA-N 0 3 335.367 2.865 20 5 EFBDHN CC1CCN(CCNc2ccc([N+](=O)[O-])cc2N2CCOC2=O)CC1 ZINC000301372852 311134302 /nfs/dbraw/zinc/13/43/02/311134302.db2.gz UIXZWZCXCNOIEA-UHFFFAOYSA-N 0 3 348.403 2.695 20 5 EFBDHN CCN1CCN([C@H](C)CNc2cc(C)c([N+](=O)[O-])cc2Cl)CC1 ZINC000301502082 311141207 /nfs/dbraw/zinc/14/12/07/311141207.db2.gz FIEIEGUGBCJWQS-CYBMUJFWSA-N 0 3 340.855 2.995 20 5 EFBDHN O=[N+]([O-])c1ccccc1N[C@H]1CN(Cc2ccccc2)CC[C@@H]1CO ZINC000301742462 311155923 /nfs/dbraw/zinc/15/59/23/311155923.db2.gz YSMVNUFAEQSZSD-AEFFLSMTSA-N 0 3 341.411 2.890 20 5 EFBDHN O=[N+]([O-])c1ccc(NC[C@@H]2C[C@H](O)CN2Cc2ccccc2)cc1 ZINC000301840644 311161924 /nfs/dbraw/zinc/16/19/24/311161924.db2.gz AWSGUAVARLCTFW-ROUUACIJSA-N 0 3 327.384 2.642 20 5 EFBDHN O=[N+]([O-])c1ccccc1NC[C@@H]1C[C@H](O)CN1Cc1ccccc1 ZINC000301885884 311164942 /nfs/dbraw/zinc/16/49/42/311164942.db2.gz PRHDQUYDMNGAPB-HOTGVXAUSA-N 0 3 327.384 2.642 20 5 EFBDHN COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2CCN(C3CCCC3)C2)c1 ZINC000302106342 311178095 /nfs/dbraw/zinc/17/80/95/311178095.db2.gz SCTSETHDBYGEGV-CYBMUJFWSA-N 0 3 333.388 2.810 20 5 EFBDHN Cc1cc(N[C@H](C)[C@H](C)N2CCOCC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302212663 311184815 /nfs/dbraw/zinc/18/48/15/311184815.db2.gz YYDQZYBDNUARCZ-KGLIPLIRSA-N 0 3 344.415 2.973 20 5 EFBDHN CN1CCN(CCC(C)(C)Nc2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC000302239327 311186711 /nfs/dbraw/zinc/18/67/11/311186711.db2.gz HLYRTAABSNMWAR-UHFFFAOYSA-N 0 3 342.390 2.701 20 5 EFBDHN CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000302406788 311189194 /nfs/dbraw/zinc/18/91/94/311189194.db2.gz GANBHAQUBLNDSH-IBGZPJMESA-N 0 3 341.411 2.668 20 5 EFBDHN CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000302493998 311191505 /nfs/dbraw/zinc/19/15/05/311191505.db2.gz ZZSQOMSOGIXBIQ-IBGZPJMESA-N 0 3 341.411 2.668 20 5 EFBDHN C[C@@H](NC(=O)[C@H]1CNCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000325645743 311243319 /nfs/dbraw/zinc/24/33/19/311243319.db2.gz XJRCYPTUJRREGT-PXAZEXFGSA-N 0 3 325.368 2.659 20 5 EFBDHN Cc1c(CNC[C@H](O)COc2ccccc2F)cccc1[N+](=O)[O-] ZINC000326467538 311244115 /nfs/dbraw/zinc/24/41/15/311244115.db2.gz SAIUCOQNMCBNJB-AWEZNQCLSA-N 0 3 334.347 2.572 20 5 EFBDHN CC(C)N(C)C(=O)C1CCN(CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000330463013 311318530 /nfs/dbraw/zinc/31/85/30/311318530.db2.gz ZGASMGKJFTWODH-UHFFFAOYSA-N 0 3 333.432 2.716 20 5 EFBDHN CC(C)c1ccc(CN2CCN(C[C@@H](C)O)C[C@H]2C)cc1[N+](=O)[O-] ZINC000330516296 311320226 /nfs/dbraw/zinc/32/02/26/311320226.db2.gz IFRSDUOOQGZECC-HUUCEWRRSA-N 0 3 335.448 2.605 20 5 EFBDHN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CC[C@@H](N2CCCCC2)C1 ZINC000330802596 311336184 /nfs/dbraw/zinc/33/61/84/311336184.db2.gz HLJXLDGFXCVDRH-CQSZACIVSA-N 0 3 337.807 2.949 20 5 EFBDHN C[C@H](C(=O)N(C)CCc1cccc([N+](=O)[O-])c1)N1CCCCCC1 ZINC000331472265 311380967 /nfs/dbraw/zinc/38/09/67/311380967.db2.gz OHTNRRUCIBXYBR-OAHLLOKOSA-N 0 3 333.432 2.860 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H](c2ccnc(N)n2)C1 ZINC000331495639 311383030 /nfs/dbraw/zinc/38/30/30/311383030.db2.gz GSJWFBPMPXFYND-OLZOCXBDSA-N 0 3 327.388 2.738 20 5 EFBDHN CCN(CCN1CCCCCC1)C(=O)c1cc([N+](=O)[O-])cnc1C ZINC000332004591 311443663 /nfs/dbraw/zinc/44/36/63/311443663.db2.gz OKDLTLVNKLAPQC-UHFFFAOYSA-N 0 3 334.420 2.636 20 5 EFBDHN CC[C@@H](NCc1cc([N+](=O)[O-])cc2c1OCOC2)C1CCOCC1 ZINC000332148880 311461954 /nfs/dbraw/zinc/46/19/54/311461954.db2.gz MNAOQEVXCWNZLW-MRXNPFEDSA-N 0 3 336.388 2.756 20 5 EFBDHN CC[C@@H]1C[C@@H](CN2CCN(c3ccccc3[N+](=O)[O-])CC2)CCO1 ZINC000332399345 311499032 /nfs/dbraw/zinc/49/90/32/311499032.db2.gz RNAXZFMCLOMHOW-JKSUJKDBSA-N 0 3 333.432 2.922 20 5 EFBDHN CC(C)c1nc2n(n1)C[C@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000332644782 311530211 /nfs/dbraw/zinc/53/02/11/311530211.db2.gz MBJDVLLJUUKQBB-QWHCGFSZSA-N 0 3 329.404 2.975 20 5 EFBDHN C[C@H]1COCCN1CCN[C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417317976 312208463 /nfs/dbraw/zinc/20/84/63/312208463.db2.gz XTCWELBZRWJJNH-KSSFIOAISA-N 0 3 333.432 2.673 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](NC[C@H](O)COCC1CC1)CCCC2 ZINC000417345118 312211745 /nfs/dbraw/zinc/21/17/45/312211745.db2.gz TVFFPPRLGBRDLV-FUHWJXTLSA-N 0 3 334.416 2.739 20 5 EFBDHN CN(C)C(=O)c1ccccc1CN(C)CCc1cccc([N+](=O)[O-])c1 ZINC000418047419 312316238 /nfs/dbraw/zinc/31/62/38/312316238.db2.gz SMHINWOGQNUZCT-UHFFFAOYSA-N 0 3 341.411 2.971 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N(C)C[C@H]2CCCN2C)cc1[N+](=O)[O-] ZINC000420811164 312395349 /nfs/dbraw/zinc/39/53/49/312395349.db2.gz SUUTYXSCZURLRX-DZGCQCFKSA-N 0 3 334.420 2.700 20 5 EFBDHN CCc1ccccc1[C@H](N)CNC(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000423955331 312488685 /nfs/dbraw/zinc/48/86/85/312488685.db2.gz CDKZFWJRBLNUPX-CYBMUJFWSA-N 0 3 333.413 2.957 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](c3ccccc3F)[C@H](N)C2)c1 ZINC000424023084 312498139 /nfs/dbraw/zinc/49/81/39/312498139.db2.gz AHMUJNDRETWZRW-GOEBONIOSA-N 0 3 343.358 2.609 20 5 EFBDHN Cc1cc(C(=O)N2C[C@@H](c3ccccc3F)[C@H](N)C2)ccc1[N+](=O)[O-] ZINC000424041378 312501917 /nfs/dbraw/zinc/50/19/17/312501917.db2.gz SVPGLBPPWOCEKL-GOEBONIOSA-N 0 3 343.358 2.609 20 5 EFBDHN CCOc1ccc(C(=O)N2C[C@H](N)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000424068083 312506481 /nfs/dbraw/zinc/50/64/81/312506481.db2.gz AHXBDEUADSFUCV-CQSZACIVSA-N 0 3 341.367 2.524 20 5 EFBDHN CC1(C)C[C@H](NCCN2CCSCC2)c2cc([N+](=O)[O-])ccc21 ZINC000433180517 312598148 /nfs/dbraw/zinc/59/81/48/312598148.db2.gz VSVNLRDLLCAFAQ-INIZCTEOSA-N 0 3 335.473 2.956 20 5 EFBDHN CS[C@@H]1CN(c2nccc3c2cccc3[N+](=O)[O-])C[C@@H]1N(C)C ZINC000450409085 312692491 /nfs/dbraw/zinc/69/24/91/312692491.db2.gz XANVNZWDGGKEEO-LSDHHAIUSA-N 0 3 332.429 2.625 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN[C@@H]3[C@H]4CCO[C@H]4C34CCCC4)nc2c1 ZINC000450863040 312761105 /nfs/dbraw/zinc/76/11/05/312761105.db2.gz PROGPKONWGTXGR-CSMYWGQOSA-N 0 3 342.399 2.908 20 5 EFBDHN CCOC(=O)c1cc(N2CCN([C@H](C)CC)CC2)ccc1[N+](=O)[O-] ZINC000450865972 312761940 /nfs/dbraw/zinc/76/19/40/312761940.db2.gz XDIYBAKTBVDNDF-CYBMUJFWSA-N 0 3 335.404 2.692 20 5 EFBDHN COC1([C@H](C)NCc2ccc([N+](=O)[O-])cc2Cl)CCOCC1 ZINC000453200326 312878785 /nfs/dbraw/zinc/87/87/85/312878785.db2.gz QSTMZDUSUKXXRX-NSHDSACASA-N 0 3 328.796 2.922 20 5 EFBDHN CCOc1ccc([C@@H](C)NCCN2C[C@H]3CC[C@@H](C2)O3)cc1[N+](=O)[O-] ZINC000453365906 312892975 /nfs/dbraw/zinc/89/29/75/312892975.db2.gz WQCSQBWTAIGUDC-BMFZPTHFSA-N 0 3 349.431 2.507 20 5 EFBDHN C[C@@H](CC1CCOCC1)CN1CCN(c2ncccc2[N+](=O)[O-])CC1 ZINC000453578094 312911471 /nfs/dbraw/zinc/91/14/71/312911471.db2.gz PXTLRYYCKMTCQC-HNNXBMFYSA-N 0 3 348.447 2.565 20 5 EFBDHN C[C@@H]1CC[C@H](C)N1CC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000469671488 313124575 /nfs/dbraw/zinc/12/45/75/313124575.db2.gz SQPQQOXYYSVWIA-GASCZTMLSA-N 0 3 333.432 2.907 20 5 EFBDHN CC(C)[C@@H]1CN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)CCN1C ZINC000487059139 313361631 /nfs/dbraw/zinc/36/16/31/313361631.db2.gz ISKVRFYNFIMFNS-ZDUSSCGKSA-N 0 3 329.347 2.973 20 5 EFBDHN COc1ccc(C)cc1CN1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000489019202 313536124 /nfs/dbraw/zinc/53/61/24/313536124.db2.gz USVHKOKSMQDTFU-UHFFFAOYSA-N 0 3 330.388 2.945 20 5 EFBDHN O=C(/C=C\c1ccccc1[N+](=O)[O-])N1CCN(C2CCCC2)CC1 ZINC000490577449 313659481 /nfs/dbraw/zinc/65/94/81/313659481.db2.gz RUTXNNAJVDFVMO-KTKRTIGZSA-N 0 3 329.400 2.695 20 5 EFBDHN CN1CCC2(CCCN2C(=O)/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000492284890 313936190 /nfs/dbraw/zinc/93/61/90/313936190.db2.gz SXHWLWVNLUGAOP-FPLPWBNLSA-N 0 3 329.400 2.695 20 5 EFBDHN CCOC(=O)N1CC[C@H](NC/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000492511594 314019791 /nfs/dbraw/zinc/01/97/91/314019791.db2.gz QQGZVUBKOOXHFI-GLNPCMGASA-N 0 3 333.388 2.819 20 5 EFBDHN C[C@H]1C[C@H]1N1CCN(C(=O)/C=C\c2cccc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000492797564 314128680 /nfs/dbraw/zinc/12/86/80/314128680.db2.gz JGQBISKUDHZITL-RLQUKKMNSA-N 0 3 343.427 2.797 20 5 EFBDHN C[C@@H]1C[C@H]1N1CCN(C(=O)/C=C/c2cccc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000492797561 314128976 /nfs/dbraw/zinc/12/89/76/314128976.db2.gz JGQBISKUDHZITL-IVQNNMQUSA-N 0 3 343.427 2.797 20 5 EFBDHN C[C@@H]1CN(C(=O)/C=C\c2ccccc2[N+](=O)[O-])CCN(C2CCC2)C1 ZINC000492799584 314130031 /nfs/dbraw/zinc/13/00/31/314130031.db2.gz MUGJVSLOCWYOPV-KVPUOBJLSA-N 0 3 343.427 2.941 20 5 EFBDHN CCOC(=O)N1CCC[C@H]([C@H](C)NCc2ccccc2[N+](=O)[O-])C1 ZINC000495544975 314751402 /nfs/dbraw/zinc/75/14/02/314751402.db2.gz WHVAGIJZFOSNJP-ZFWWWQNUSA-N 0 3 335.404 2.941 20 5 EFBDHN C[C@H](CC(N)=O)NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000498365687 315403614 /nfs/dbraw/zinc/40/36/14/315403614.db2.gz SVAFULOEKXQJGJ-SECBINFHSA-N 0 3 337.763 2.862 20 5 EFBDHN CC[C@H]1C[C@@]1(NCCn1cc([N+](=O)[O-])ccc1=O)c1cccc(C)c1 ZINC000502590038 315436001 /nfs/dbraw/zinc/43/60/01/315436001.db2.gz BKNDJSXXBFTTKN-KXBFYZLASA-N 0 3 341.411 2.980 20 5 EFBDHN C[C@@H]1CN(C(=O)NCc2cccc([N+](=O)[O-])c2)CCN(C2CCC2)C1 ZINC000521242325 316010784 /nfs/dbraw/zinc/01/07/84/316010784.db2.gz HVZDJWKYIQVOJT-AWEZNQCLSA-N 0 3 346.431 2.611 20 5 EFBDHN C[C@H]1CN(C(=O)NCc2cccc([N+](=O)[O-])c2)CCN(C2CCC2)C1 ZINC000521242329 316010929 /nfs/dbraw/zinc/01/09/29/316010929.db2.gz HVZDJWKYIQVOJT-CQSZACIVSA-N 0 3 346.431 2.611 20 5 EFBDHN CNc1ccc(C(=O)N(CCN(C)C)c2ccccc2)cc1[N+](=O)[O-] ZINC000521803242 316043648 /nfs/dbraw/zinc/04/36/48/316043648.db2.gz RQEHWAVPYOFNPI-UHFFFAOYSA-N 0 3 342.399 2.845 20 5 EFBDHN Cc1c(CN2CCC(N3CCOC[C@@H]3C)CC2)cccc1[N+](=O)[O-] ZINC000521965190 316055449 /nfs/dbraw/zinc/05/54/49/316055449.db2.gz PPPUCLNDVCVABL-AWEZNQCLSA-N 0 3 333.432 2.588 20 5 EFBDHN C[C@H]1CCN(CCNCc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000524771446 316173863 /nfs/dbraw/zinc/17/38/63/316173863.db2.gz QOHMHMTTZRXABW-NSHDSACASA-N 0 3 329.347 2.628 20 5 EFBDHN C[C@@H](O)CN(CCOc1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000525486706 316217138 /nfs/dbraw/zinc/21/71/38/316217138.db2.gz DPBCCKUOSPGJLS-OAHLLOKOSA-N 0 3 330.384 2.857 20 5 EFBDHN COC(=O)CCC1CCN(CCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000530764445 317177135 /nfs/dbraw/zinc/17/71/35/317177135.db2.gz XQTQXTMGCJBGOU-UHFFFAOYSA-N 0 3 336.388 2.639 20 5 EFBDHN COC(=O)CC1(NCc2cc([N+](=O)[O-])ccc2OC)CCCCC1 ZINC000532723913 317435326 /nfs/dbraw/zinc/43/53/26/317435326.db2.gz KEWUUZLFSDLTEN-UHFFFAOYSA-N 0 3 336.388 2.959 20 5 EFBDHN Cn1cc(CN2CCC(CCO)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000535782044 317610952 /nfs/dbraw/zinc/61/09/52/317610952.db2.gz ALHMJTVZVDVXFT-UHFFFAOYSA-N 0 3 344.415 2.590 20 5 EFBDHN CCc1ccc([C@@H](CO)NCCOc2ccccc2[N+](=O)[O-])cc1 ZINC000541985066 317800925 /nfs/dbraw/zinc/80/09/25/317800925.db2.gz REMOZPSYBPPHFJ-MRXNPFEDSA-N 0 3 330.384 2.859 20 5 EFBDHN Cc1ccc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000549152376 318167761 /nfs/dbraw/zinc/16/77/61/318167761.db2.gz QLIZKMVMWSYSJC-KRWDZBQOSA-N 0 3 330.384 2.741 20 5 EFBDHN O=C(c1ccc(F)cc1[N+](=O)[O-])N1CCCN(CC2CCC2)CC1 ZINC000549719590 318180587 /nfs/dbraw/zinc/18/05/87/318180587.db2.gz CGBCSJAWIVCRMI-UHFFFAOYSA-N 0 3 335.379 2.682 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1CC[C@@H](N2CCCCC2)C1 ZINC000553388948 318281406 /nfs/dbraw/zinc/28/14/06/318281406.db2.gz MYFVTNUFWYNJGA-CQSZACIVSA-N 0 3 347.415 2.754 20 5 EFBDHN Cc1ccccc1OCCNCCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000554525751 318320590 /nfs/dbraw/zinc/32/05/90/318320590.db2.gz AHUJCAXNWPCJSM-UHFFFAOYSA-N 0 3 343.383 2.900 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCCN(CC2CCC2)CC1 ZINC000554845246 318337972 /nfs/dbraw/zinc/33/79/72/318337972.db2.gz YFKUGIXQNXFYOD-UHFFFAOYSA-N 0 3 331.416 2.851 20 5 EFBDHN CC(C)Oc1cc(C(=O)N2CCCC[C@H]2CN(C)C)ccc1[N+](=O)[O-] ZINC000560746912 318573761 /nfs/dbraw/zinc/57/37/61/318573761.db2.gz AHNNMXYELQINJW-HNNXBMFYSA-N 0 3 349.431 2.938 20 5 EFBDHN Cc1c([C@@H](C)NCCC(=O)Nc2ccccn2)cccc1[N+](=O)[O-] ZINC000562018607 318619768 /nfs/dbraw/zinc/61/97/68/318619768.db2.gz BCRYZBYLQOSSOB-CYBMUJFWSA-N 0 3 328.372 2.978 20 5 EFBDHN C[C@@H]1CN(CCCN[C@H]2CCc3c2cccc3[N+](=O)[O-])C[C@@H](C)O1 ZINC000568662581 319307187 /nfs/dbraw/zinc/30/71/87/319307187.db2.gz DGHFCSLJURFVMT-CPUCHLNUSA-N 0 3 333.432 2.671 20 5 EFBDHN CC(C)C[C@@H](CN[C@@H]1CCc2c1cccc2[N+](=O)[O-])N1CCOCC1 ZINC000568780304 319318754 /nfs/dbraw/zinc/31/87/54/319318754.db2.gz WIKLXTFATWPLRJ-MAUKXSAKSA-N 0 3 347.459 2.919 20 5 EFBDHN O=C(NCCN[C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccccc1F ZINC000575195187 319933875 /nfs/dbraw/zinc/93/38/75/319933875.db2.gz DSLYXHGAAMANNR-INIZCTEOSA-N 0 3 343.358 2.741 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2NC[C@H](O)COc1ccccc1 ZINC000576172094 319990999 /nfs/dbraw/zinc/99/09/99/319990999.db2.gz DBBXVXMFZPRJJU-SUMWQHHRSA-N 0 3 328.368 2.612 20 5 EFBDHN O=[N+]([O-])c1ccc(S(=O)(=O)CCN[C@H]2CCCC(F)(F)C2)cc1 ZINC000577622910 320128778 /nfs/dbraw/zinc/12/87/78/320128778.db2.gz XBNXIUMYZBKVIN-NSHDSACASA-N 0 3 348.371 2.536 20 5 EFBDHN CCC1(CC)[C@H](NCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1OC ZINC000181844310 323253139 /nfs/dbraw/zinc/25/31/39/323253139.db2.gz MRFBITYODCYOJA-HUUCEWRRSA-N 0 3 335.404 2.717 20 5 EFBDHN CC[C@@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCCO1 ZINC000182250986 323272518 /nfs/dbraw/zinc/27/25/18/323272518.db2.gz XPKOZHXVEQHYQP-OCCSQVGLSA-N 0 3 341.795 2.734 20 5 EFBDHN CCNC(=O)C(C)(C)CN[C@@H](C)c1ccc(OCC)c([N+](=O)[O-])c1 ZINC000183211505 323323130 /nfs/dbraw/zinc/32/31/30/323323130.db2.gz PJTOECPMHUSLMZ-LBPRGKRZSA-N 0 3 337.420 2.806 20 5 EFBDHN C[C@H](C(=O)NCCN1CCCCCC1)c1ccc([N+](=O)[O-])cc1F ZINC000184941353 323378182 /nfs/dbraw/zinc/37/81/82/323378182.db2.gz HXIKDTFWOXXRFI-ZDUSSCGKSA-N 0 3 337.395 2.830 20 5 EFBDHN CC(C)CN(CCN(C)C)C(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000185001834 323379852 /nfs/dbraw/zinc/37/98/52/323379852.db2.gz UODZHDHEEYVZIQ-ZDUSSCGKSA-N 0 3 339.411 2.884 20 5 EFBDHN C[C@@H](C(=O)N1CCCC[C@@H]1CN(C)C)c1ccc([N+](=O)[O-])cc1F ZINC000185129943 323384191 /nfs/dbraw/zinc/38/41/91/323384191.db2.gz PHHUUSLIGQEOJX-TZMCWYRMSA-N 0 3 337.395 2.780 20 5 EFBDHN C[C@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccc([N+](=O)[O-])cc1 ZINC000296531143 323545588 /nfs/dbraw/zinc/54/55/88/323545588.db2.gz DCEJVLKPSHLDKP-MEDUHNTESA-N 0 3 331.328 2.887 20 5 EFBDHN Cc1cc(F)c(NC(=O)N(CCN(C)C)C(C)C)cc1[N+](=O)[O-] ZINC000296803855 323629912 /nfs/dbraw/zinc/62/99/12/323629912.db2.gz QXCKSIGBZXJFGC-UHFFFAOYSA-N 0 3 326.372 2.846 20 5 EFBDHN O=[N+]([O-])c1cc(I)cc(CNCCCF)c1 ZINC000379437039 323738141 /nfs/dbraw/zinc/73/81/41/323738141.db2.gz HYBDBFNCGUGXCL-UHFFFAOYSA-N 0 3 338.120 2.649 20 5 EFBDHN Cc1cccc2c1CC[C@H]2NC[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000578859589 323826598 /nfs/dbraw/zinc/82/65/98/323826598.db2.gz FFJWFZRPNPTCHY-RHSMWYFYSA-N 0 3 342.395 2.920 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2cccc(Cl)c2)c1 ZINC000579812838 324036560 /nfs/dbraw/zinc/03/65/60/324036560.db2.gz KYNUEJAXYPBXQX-HNNXBMFYSA-N 0 3 336.775 2.778 20 5 EFBDHN CCc1ccccc1CNC[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000581007378 324285769 /nfs/dbraw/zinc/28/57/69/324285769.db2.gz NMRDRWDAOMMUMN-MRXNPFEDSA-N 0 3 330.384 2.687 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@H]1CC[C@H](C)C[C@H]1C ZINC000119277465 472541590 /nfs/dbraw/zinc/54/15/90/472541590.db2.gz YPSNCKTVCOQUQR-SCRDCRAPSA-N 0 3 335.404 2.956 20 5 EFBDHN CCC[C@H](NCC1(CS(C)(=O)=O)CC1)c1cccc([N+](=O)[O-])c1 ZINC000090182679 472607510 /nfs/dbraw/zinc/60/75/10/472607510.db2.gz ORBKPBPGZFIPDD-HNNXBMFYSA-N 0 3 340.445 2.850 20 5 EFBDHN C[C@@H]1CN(C[C@@H]2CCCN2Cc2ccccc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000139074819 473226252 /nfs/dbraw/zinc/22/62/52/473226252.db2.gz FJUMTTWTHWXPTR-INMHGKMJSA-N 0 3 333.432 2.668 20 5 EFBDHN C[C@@]1(O)CCCN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000124300688 473229995 /nfs/dbraw/zinc/22/99/95/473229995.db2.gz VWMIXLDGNNBTNY-QGZVFWFLSA-N 0 3 331.372 2.639 20 5 EFBDHN C[C@@H](C(=O)N(C)Cc1ccccc1[N+](=O)[O-])[C@@H](N)c1ccccc1 ZINC000095965558 473232927 /nfs/dbraw/zinc/23/29/27/473232927.db2.gz OHLRARAZESRZDZ-CXAGYDPISA-N 0 3 327.384 2.889 20 5 EFBDHN CN(CCN1CCc2ncc([N+](=O)[O-])cc2C1)Cc1ccc(F)cc1 ZINC000161669173 473251700 /nfs/dbraw/zinc/25/17/00/473251700.db2.gz MMELIENNONQCQC-UHFFFAOYSA-N 0 3 344.390 2.619 20 5 EFBDHN C[C@H]1C[C@@H](Nc2ncc(Br)cc2[N+](=O)[O-])CCN1C ZINC000161674193 473252496 /nfs/dbraw/zinc/25/24/96/473252496.db2.gz OUWQLAXZSYIRBD-WPRPVWTQSA-N 0 3 329.198 2.647 20 5 EFBDHN Cc1cc(C(=O)N2CCC[C@@H]2CN2CCCCC2)cc([N+](=O)[O-])c1 ZINC000171041230 473261493 /nfs/dbraw/zinc/26/14/93/473261493.db2.gz UJZJRUXAFCZRFW-MRXNPFEDSA-N 0 3 331.416 2.994 20 5 EFBDHN COc1cc(C(=O)NC[C@H](C)N2CCC(C)CC2)cc([N+](=O)[O-])c1C ZINC000190406885 473262406 /nfs/dbraw/zinc/26/24/06/473262406.db2.gz VGWHEJUDWZZSKG-ZDUSSCGKSA-N 0 3 349.431 2.762 20 5 EFBDHN COc1ccc(OCCN2CCSC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000190410958 473264914 /nfs/dbraw/zinc/26/49/14/473264914.db2.gz OGDUFKAEGJIPQA-LBPRGKRZSA-N 0 3 326.418 2.667 20 5 EFBDHN O=C(Cc1ccccc1[N+](=O)[O-])N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000143087658 473271793 /nfs/dbraw/zinc/27/17/93/473271793.db2.gz QQCCBSQHHVXKDZ-QGZVFWFLSA-N 0 3 339.395 2.528 20 5 EFBDHN Cc1ccc([C@@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]2)N2CCCC2)cc1 ZINC000143254611 473273599 /nfs/dbraw/zinc/27/35/99/473273599.db2.gz GGPGYEAWHFPEEI-QGZVFWFLSA-N 0 3 342.399 2.798 20 5 EFBDHN CN1CCC[C@@H](CNc2ncc([N+](=O)[O-])cc2Br)C1 ZINC000081941382 473275794 /nfs/dbraw/zinc/27/57/94/473275794.db2.gz CUEGLZNBRRAMIP-VIFPVBQESA-N 0 3 329.198 2.506 20 5 EFBDHN Cc1ccc(CN(C)C)cc1NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000177066995 473299528 /nfs/dbraw/zinc/29/95/28/473299528.db2.gz YTICHWHUKBTGIG-UHFFFAOYSA-N 0 3 328.372 2.799 20 5 EFBDHN Cc1ccc(C(=O)NCCCCN2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000083026337 473312894 /nfs/dbraw/zinc/31/28/94/473312894.db2.gz FUTDPFISTPECFV-GASCZTMLSA-N 0 3 349.431 2.522 20 5 EFBDHN CN(C)CCN(Cc1ccccc1F)C(=O)c1ccccc1[N+](=O)[O-] ZINC000112820893 473316786 /nfs/dbraw/zinc/31/67/86/473316786.db2.gz FRAYHKLNHNNHPN-UHFFFAOYSA-N 0 3 345.374 2.938 20 5 EFBDHN C[C@H](CN1CCC[C@@H](C)C1)NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000148403620 473317800 /nfs/dbraw/zinc/31/78/00/473317800.db2.gz MCXJMPQONAQNKZ-CHWSQXEVSA-N 0 3 344.415 2.926 20 5 EFBDHN O=[N+]([O-])c1ccc2oc(CN3CC[C@@H](N4CCCCC4)C3)nc2c1 ZINC000083171095 473327046 /nfs/dbraw/zinc/32/70/46/473327046.db2.gz OEDDQHSZGINVFM-CQSZACIVSA-N 0 3 330.388 2.796 20 5 EFBDHN C[C@@H](C(=O)N1CCC[C@H]1CN1CCCC1)c1ccc([N+](=O)[O-])cc1F ZINC000185128923 473337700 /nfs/dbraw/zinc/33/77/00/473337700.db2.gz IPKKPKPLUVNXAX-HIFRSBDPSA-N 0 3 349.406 2.924 20 5 EFBDHN COc1ccc(OC)c([C@H](O)CN[C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000125032216 473344395 /nfs/dbraw/zinc/34/43/95/473344395.db2.gz DIGHBXPMTHQKGR-SJKOYZFVSA-N 0 3 346.383 2.996 20 5 EFBDHN C[C@@H](C(=O)N1CC[C@H](N2CCCC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000185170800 473350550 /nfs/dbraw/zinc/35/05/50/473350550.db2.gz FEWKSDJUTQJXHE-OCCSQVGLSA-N 0 3 335.379 2.534 20 5 EFBDHN C[C@@H](C(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@H](N)c1ccccc1 ZINC000150845183 473365590 /nfs/dbraw/zinc/36/55/90/473365590.db2.gz DUWHQDSAAKHFDK-PXAZEXFGSA-N 0 3 325.368 2.820 20 5 EFBDHN CCc1[nH]nc(C(=O)Nc2cccc(CN(CC)CC)c2)c1[N+](=O)[O-] ZINC000171370911 473372950 /nfs/dbraw/zinc/37/29/50/473372950.db2.gz FOMDYBYOWSVCOT-UHFFFAOYSA-N 0 3 345.403 2.974 20 5 EFBDHN O=[N+]([O-])c1ccc2ncnc(NC[C@H]3CCCCN3C3CC3)c2c1 ZINC000617976656 469863165 /nfs/dbraw/zinc/86/31/65/469863165.db2.gz ISGVHRIRCQQFLD-CQSZACIVSA-N 0 3 327.388 2.967 20 5 EFBDHN Cc1c(CC(=O)NCCN(C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000162755797 473379715 /nfs/dbraw/zinc/37/97/15/473379715.db2.gz FGONJOQODPHWKZ-UHFFFAOYSA-N 0 3 341.411 2.694 20 5 EFBDHN COc1cc(C(=O)N2CCC[C@H]2CN2CCCC2)cc([N+](=O)[O-])c1C ZINC000190750040 473382521 /nfs/dbraw/zinc/38/25/21/473382521.db2.gz NOHOINCOTMLZKQ-HNNXBMFYSA-N 0 3 347.415 2.612 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)CN1C[C@@H](C)C[C@H](C)C1 ZINC000346954004 475986346 /nfs/dbraw/zinc/98/63/46/475986346.db2.gz MZERYEFBMOZZKK-KCQAQPDRSA-N 0 3 333.432 2.999 20 5 EFBDHN CO[C@@H](CN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000338545724 476000675 /nfs/dbraw/zinc/00/06/75/476000675.db2.gz IXMFQDVAKXYRSU-WBVHZDCISA-N 0 3 342.399 2.864 20 5 EFBDHN O=[N+]([O-])c1ccn(C2CCN(CCOCc3ccccc3)CC2)n1 ZINC000595481035 478810859 /nfs/dbraw/zinc/81/08/59/478810859.db2.gz NANDLAXMMSZHEM-UHFFFAOYSA-N 0 3 330.388 2.645 20 5 EFBDHN Cc1ccc(C(=O)NC[C@@H](c2ccccc2)N(C)C)cc1[N+](=O)[O-] ZINC000003294997 471441826 /nfs/dbraw/zinc/44/18/26/471441826.db2.gz LWYPBQSLBNZWSI-KRWDZBQOSA-N 0 3 327.384 2.936 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCN(CC2CC2)C1 ZINC000613233640 479930391 /nfs/dbraw/zinc/93/03/91/479930391.db2.gz ACZWAUMSGCOMJN-IRXDYDNUSA-N 0 3 345.443 2.764 20 5 EFBDHN CN(C)Cc1ccc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000008430975 471687995 /nfs/dbraw/zinc/68/79/95/471687995.db2.gz KXBNZAMQIMIDRA-UHFFFAOYSA-N 0 3 327.384 2.515 20 5 EFBDHN CSc1ccc(C(=O)NC2CCN(C3CC3)CC2)cc1[N+](=O)[O-] ZINC000014528165 471873634 /nfs/dbraw/zinc/87/36/34/471873634.db2.gz IASZEJJULDKROG-UHFFFAOYSA-N 0 3 335.429 2.673 20 5 EFBDHN CC(C)CN(C(=O)COc1ccccc1[N+](=O)[O-])C1CCN(C)CC1 ZINC000053231060 471986036 /nfs/dbraw/zinc/98/60/36/471986036.db2.gz KTKHYGGTUMDRGV-UHFFFAOYSA-N 0 3 349.431 2.552 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000067140049 471996252 /nfs/dbraw/zinc/99/62/52/471996252.db2.gz IGLLXLLHBKOBGS-QGZVFWFLSA-N 0 3 341.411 2.806 20 5 EFBDHN CNC(=O)c1ccc(NC[C@@H](c2cccs2)N(C)C)c([N+](=O)[O-])c1 ZINC000053550035 472018697 /nfs/dbraw/zinc/01/86/97/472018697.db2.gz PGVJUMUDITVPIT-AWEZNQCLSA-N 0 3 348.428 2.731 20 5 EFBDHN CNC(=O)c1ccc(NC[C@H](C)N2CCCC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000053561616 472019842 /nfs/dbraw/zinc/01/98/42/472019842.db2.gz MCCSNDSDJJWQNC-STQMWFEESA-N 0 3 334.420 2.629 20 5 EFBDHN CNC(=O)c1ccc(N2CCN(CCC(C)(C)C)CC2)c([N+](=O)[O-])c1 ZINC000053576823 472021454 /nfs/dbraw/zinc/02/14/54/472021454.db2.gz BWLCDMPPGRXWFQ-UHFFFAOYSA-N 0 3 348.447 2.513 20 5 EFBDHN CN(C)Cc1ccccc1NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000024643392 472062142 /nfs/dbraw/zinc/06/21/42/472062142.db2.gz RYEZDBLARITZMI-UHFFFAOYSA-N 0 3 329.356 2.674 20 5 EFBDHN C[C@@H](CNC(=O)NCc1cccc([N+](=O)[O-])c1)N1CCC[C@H](C)C1 ZINC000067724772 472079909 /nfs/dbraw/zinc/07/99/09/472079909.db2.gz DZBCVDRMUOIHDV-KBPBESRZSA-N 0 3 334.420 2.514 20 5 EFBDHN CCN(CC)[C@@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]1)c1ccsc1 ZINC000042075231 472111032 /nfs/dbraw/zinc/11/10/32/472111032.db2.gz HNRIYEFRTPVSBE-AWEZNQCLSA-N 0 3 336.417 2.797 20 5 EFBDHN C[C@H]1CCC[C@@H](N(C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000026476353 472138718 /nfs/dbraw/zinc/13/87/18/472138718.db2.gz WXMJDZFVWGJXIG-DZGCQCFKSA-N 0 3 331.416 2.994 20 5 EFBDHN CC(C)[C@@H](CNc1c([N+](=O)[O-])ncn1C)N1CCc2ccccc2C1 ZINC000026727831 472146012 /nfs/dbraw/zinc/14/60/12/472146012.db2.gz KLEYBEJRESQDQM-MRXNPFEDSA-N 0 3 343.431 2.823 20 5 EFBDHN CN(C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CCc2ccccc21 ZINC000042626984 472151920 /nfs/dbraw/zinc/15/19/20/472151920.db2.gz HQIKAGHFDVKPHB-QFBILLFUSA-N 0 3 342.395 2.954 20 5 EFBDHN C[C@@H](CNC(=O)CCOc1ccccc1[N+](=O)[O-])N1CCCC[C@H]1C ZINC000055362648 472173477 /nfs/dbraw/zinc/17/34/77/472173477.db2.gz FEJSPPHWCZIMLV-CABCVRRESA-N 0 3 349.431 2.743 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)CN2CCCCC2)c1 ZINC000027757650 472194695 /nfs/dbraw/zinc/19/46/95/472194695.db2.gz TXENMHHVBBEUBJ-GFCCVEGCSA-N 0 3 337.445 2.921 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCN(C3CC3)C2)c1 ZINC000075849356 472206277 /nfs/dbraw/zinc/20/62/77/472206277.db2.gz OMQXOLXFXTZZQW-NSHDSACASA-N 0 3 335.429 2.531 20 5 EFBDHN CC(C)N1CCCN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CC1 ZINC000068777934 472239775 /nfs/dbraw/zinc/23/97/75/472239775.db2.gz AFXHTIWDBUBPCE-UHFFFAOYSA-N 0 3 330.388 2.632 20 5 EFBDHN CCCNC(=O)C1CCN(CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000055901080 472253506 /nfs/dbraw/zinc/25/35/06/472253506.db2.gz NCAZGYKOAXRONT-UHFFFAOYSA-N 0 3 349.431 2.602 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[C@@H]2CC[C@H](C1)N2C ZINC000085636001 472262672 /nfs/dbraw/zinc/26/26/72/472262672.db2.gz ROLFGJYTLLJREL-UONOGXRCSA-N 0 3 332.404 2.912 20 5 EFBDHN CC(C)N1CCCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000069081857 472288433 /nfs/dbraw/zinc/28/84/33/472288433.db2.gz MHCBLLMJTUOAKP-UHFFFAOYSA-N 0 3 345.403 2.561 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)N(CCN(C)C)Cc1ccco1 ZINC000088229866 472349837 /nfs/dbraw/zinc/34/98/37/472349837.db2.gz PJERWAQWLJFCGR-UHFFFAOYSA-N 0 3 331.372 2.700 20 5 EFBDHN CC[C@@H]1CN(C)c2ccccc2CN1CCn1cc([N+](=O)[O-])cn1 ZINC000088562283 472373787 /nfs/dbraw/zinc/37/37/87/472373787.db2.gz KWQPMJOSLALLJN-OAHLLOKOSA-N 0 3 329.404 2.522 20 5 EFBDHN COc1cc(C(=O)NC[C@H]2CCCCN2CC(C)C)ccc1[N+](=O)[O-] ZINC000154194471 472401697 /nfs/dbraw/zinc/40/16/97/472401697.db2.gz CBUXTMMKQIJFFQ-OAHLLOKOSA-N 0 3 349.431 2.844 20 5 EFBDHN CC(C)N1CCCN(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000069776612 472428206 /nfs/dbraw/zinc/42/82/06/472428206.db2.gz OCMKQAMTTPEZAS-CQSZACIVSA-N 0 3 334.420 2.782 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000077140398 472458449 /nfs/dbraw/zinc/45/84/49/472458449.db2.gz UCUXREDVWAYJNL-CQSZACIVSA-N 0 3 342.399 2.660 20 5 EFBDHN CC[C@@H](O)CN(Cc1ccccc1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154661473 472459064 /nfs/dbraw/zinc/45/90/64/472459064.db2.gz WSWHSQKJKWLDLH-MOPGFXCFSA-N 0 3 344.411 2.901 20 5 EFBDHN O=[N+]([O-])c1ccc2nc(NC3CCN([C@H]4CCOC4)CC3)ccc2c1 ZINC000089602993 472467318 /nfs/dbraw/zinc/46/73/18/472467318.db2.gz KAXHFUIRJLBOGL-INIZCTEOSA-N 0 3 342.399 2.808 20 5 EFBDHN Cc1ccc(CN(C)C[C@@H](O)COc2cccc([N+](=O)[O-])c2)s1 ZINC000077211538 472475410 /nfs/dbraw/zinc/47/54/10/472475410.db2.gz FZPFVCSNZKKRIV-CQSZACIVSA-N 0 3 336.413 2.836 20 5 EFBDHN CN(CCOc1cccc([N+](=O)[O-])c1)Cc1ccc2c(c1)OCCO2 ZINC000046056204 472503722 /nfs/dbraw/zinc/50/37/22/472503722.db2.gz OTWXZJSNLYSHGV-UHFFFAOYSA-N 0 3 344.367 2.877 20 5 EFBDHN CN(C)Cc1cccc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000046071991 472507788 /nfs/dbraw/zinc/50/77/88/472507788.db2.gz LXVAWBQHILFOIL-UHFFFAOYSA-N 0 3 328.372 2.978 20 5 EFBDHN CC(C)(NCCOc1ccccc1[N+](=O)[O-])C(=O)NCC1CCCC1 ZINC000155118658 472509909 /nfs/dbraw/zinc/50/99/09/472509909.db2.gz NJPHUWWQLVANME-UHFFFAOYSA-N 0 3 349.431 2.648 20 5 EFBDHN CN(C)CCN(C(=O)COc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000058298001 472540082 /nfs/dbraw/zinc/54/00/82/472540082.db2.gz RWRYXOBBZFHXJR-UHFFFAOYSA-N 0 3 343.383 2.568 20 5 EFBDHN CN(C)c1cccc(CN(C)C[C@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000089921818 472545937 /nfs/dbraw/zinc/54/59/37/472545937.db2.gz FNOAAYLARLSFRP-SFHVURJKSA-N 0 3 329.400 2.826 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000120040225 472620167 /nfs/dbraw/zinc/62/01/67/472620167.db2.gz XNXQXUXIBVKWKX-AWEZNQCLSA-N 0 3 330.388 2.690 20 5 EFBDHN CCOc1ccc(C(=O)NC[C@@H](C)N2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000046953882 472629060 /nfs/dbraw/zinc/62/90/60/472629060.db2.gz GJRJROKHUMNAOK-UONOGXRCSA-N 0 3 349.431 2.844 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H](C(C)C)N1CCOCC1 ZINC000120093232 472629179 /nfs/dbraw/zinc/62/91/79/472629179.db2.gz JMHVACQSORKCQO-MAUKXSAKSA-N 0 3 335.448 2.911 20 5 EFBDHN CC[C@H](NCCn1cc([N+](=O)[O-])cn1)c1ccc(OC)c(OC)c1 ZINC000090539199 472632163 /nfs/dbraw/zinc/63/21/63/472632163.db2.gz RWERDVRESIZFJS-AWEZNQCLSA-N 0 3 334.376 2.549 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](c2ccccc2)N(C)C)c1 ZINC000060063730 472635076 /nfs/dbraw/zinc/63/50/76/472635076.db2.gz RATAAUJDTAXKBD-KRWDZBQOSA-N 0 3 343.383 2.636 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCCN2CCc3ccccc3[C@H]2CO)cc1 ZINC000130888113 472635251 /nfs/dbraw/zinc/63/52/51/472635251.db2.gz VQOQISSJBQUNKW-LJQANCHMSA-N 0 3 342.395 2.955 20 5 EFBDHN CC1(c2ccccc2)CCN(CCn2cc([N+](=O)[O-])ccc2=O)CC1 ZINC000090589248 472639523 /nfs/dbraw/zinc/63/95/23/472639523.db2.gz XFSHSVLLMGKZJM-UHFFFAOYSA-N 0 3 341.411 2.810 20 5 EFBDHN C[C@H]1CCCN(CCNC(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000047146269 472660672 /nfs/dbraw/zinc/66/06/72/472660672.db2.gz BUSUYDYDOMBXOE-ZDUSSCGKSA-N 0 3 337.445 2.535 20 5 EFBDHN CN(C)C[C@@H]1CCCCN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000104412405 472671171 /nfs/dbraw/zinc/67/11/71/472671171.db2.gz FYYNABXVMLNBOF-HNNXBMFYSA-N 0 3 346.431 2.725 20 5 EFBDHN Cc1nn(C)c(NC2CCN(Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000047370110 472698734 /nfs/dbraw/zinc/69/87/34/472698734.db2.gz PXPGOADFWZWNGC-UHFFFAOYSA-N 0 3 329.404 2.713 20 5 EFBDHN C[C@@H]1CC[C@@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000120517482 472702814 /nfs/dbraw/zinc/70/28/14/472702814.db2.gz TUWVYDRLGKFGAL-XJKCOSOUSA-N 0 3 340.445 2.783 20 5 EFBDHN Cc1ccc(NC(=O)COc2ccccc2[N+](=O)[O-])c(CN(C)C)c1 ZINC000072840896 472725550 /nfs/dbraw/zinc/72/55/50/472725550.db2.gz AIJSXJPWGAKVAM-UHFFFAOYSA-N 0 3 343.383 2.982 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@@H](O)Cc1ccccc1 ZINC000105493153 472753521 /nfs/dbraw/zinc/75/35/21/472753521.db2.gz LZQNCOXDCAGBDW-KRWDZBQOSA-N 0 3 330.384 2.687 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CCN(C)C[C@@H]2C)c1 ZINC000120885591 472763337 /nfs/dbraw/zinc/76/33/37/472763337.db2.gz NUQJJRVSENFZDI-FZMZJTMJSA-N 0 3 337.445 2.729 20 5 EFBDHN C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000120925198 472770297 /nfs/dbraw/zinc/77/02/97/472770297.db2.gz QHSAYQKWIHJYNJ-NHYWBVRUSA-N 0 3 339.823 2.589 20 5 EFBDHN CC(C)c1nc2n(n1)C[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000105873922 472793662 /nfs/dbraw/zinc/79/36/62/472793662.db2.gz ZNHHKZHYCJUJMW-GXTWGEPZSA-N 0 3 329.404 2.975 20 5 EFBDHN O=c1cc(CN[C@@H]2CCc3ncnn3C2)c2c(ccc3ccccc32)o1 ZINC000105870828 472794669 /nfs/dbraw/zinc/79/46/69/472794669.db2.gz WSCXGKWYKBQZBV-OAHLLOKOSA-N 0 3 346.390 2.642 20 5 EFBDHN CCc1nn(C)c(NCCN(C)Cc2ccc(F)cc2)c1[N+](=O)[O-] ZINC000091733175 472799382 /nfs/dbraw/zinc/79/93/82/472799382.db2.gz ZPAKTBDYYPVHTQ-UHFFFAOYSA-N 0 3 335.383 2.574 20 5 EFBDHN CCc1nn(C)c(N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000091739531 472800376 /nfs/dbraw/zinc/80/03/76/472800376.db2.gz BDDLKVLPXRTQRG-DZGCQCFKSA-N 0 3 343.431 2.966 20 5 EFBDHN CCc1nn(C)c(N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000091739534 472800990 /nfs/dbraw/zinc/80/09/90/472800990.db2.gz BDDLKVLPXRTQRG-ZFWWWQNUSA-N 0 3 343.431 2.966 20 5 EFBDHN CC(C)(C)N1CCCN(C(=O)/C=C/c2cccc([N+](=O)[O-])c2)CC1 ZINC000063726410 472806310 /nfs/dbraw/zinc/80/63/10/472806310.db2.gz AGIXCXDFZJXGBE-CMDGGOBGSA-N 0 3 331.416 2.941 20 5 EFBDHN CCOc1ccc(C(=O)N2CCCN(C(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000063726706 472807809 /nfs/dbraw/zinc/80/78/09/472807809.db2.gz OHSIRDQJVMXNSY-UHFFFAOYSA-N 0 3 349.431 2.940 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CCC(OCc3ccccc3F)CC2)c1 ZINC000091862199 472818845 /nfs/dbraw/zinc/81/88/45/472818845.db2.gz VUFVQSZXHLBJKQ-UHFFFAOYSA-N 0 3 348.378 2.612 20 5 EFBDHN COC[C@@H](NCc1ccc(Br)c([N+](=O)[O-])c1)C1CC1 ZINC000121361629 472842079 /nfs/dbraw/zinc/84/20/79/472842079.db2.gz IOCTUOHFJLQCRC-GFCCVEGCSA-N 0 3 329.194 2.872 20 5 EFBDHN CCN1CCC[C@@H]1CNC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000079337968 472850115 /nfs/dbraw/zinc/85/01/15/472850115.db2.gz XURAJPRPFQPIRT-LLVKDONJSA-N 0 3 345.321 2.828 20 5 EFBDHN CCc1cc(N2CCCN(C)CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000064904551 472885088 /nfs/dbraw/zinc/88/50/88/472885088.db2.gz IVIHJWVONRYJCU-UHFFFAOYSA-N 0 3 341.415 2.756 20 5 EFBDHN C[C@H](CN1CCC[C@H](C)C1)NC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000073827663 472885597 /nfs/dbraw/zinc/88/55/97/472885597.db2.gz MFWIZNCMWDLYBK-LSDHHAIUSA-N 0 3 348.447 2.557 20 5 EFBDHN C[C@@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)CCN1Cc1ccccc1 ZINC000079553983 472886338 /nfs/dbraw/zinc/88/63/38/472886338.db2.gz WVHFTCFDAAJSHB-UKRRQHHQSA-N 0 3 342.399 2.706 20 5 EFBDHN CCN1CCC(Nc2ncc(Br)cc2[N+](=O)[O-])CC1 ZINC000048552700 472887946 /nfs/dbraw/zinc/88/79/46/472887946.db2.gz DEXQAOXNOFXYQO-UHFFFAOYSA-N 0 3 329.198 2.649 20 5 EFBDHN C[C@H](CNC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)N(C)C1CC1 ZINC000121672192 472889345 /nfs/dbraw/zinc/88/93/45/472889345.db2.gz DTERJOACXUKGQF-CYBMUJFWSA-N 0 3 346.431 2.752 20 5 EFBDHN Cc1cc([N+](=O)[O-])cnc1N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000092642474 472948826 /nfs/dbraw/zinc/94/88/26/472948826.db2.gz FPAXKCXOIDXNKG-GJZGRUSLSA-N 0 3 348.447 2.624 20 5 EFBDHN Cc1cc([N+](=O)[O-])cnc1N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000092642472 472949783 /nfs/dbraw/zinc/94/97/83/472949783.db2.gz FPAXKCXOIDXNKG-GASCZTMLSA-N 0 3 348.447 2.624 20 5 EFBDHN CC(C)C[C@H](CN[C@H](C)c1ccc([N+](=O)[O-])cc1)N1CCOCC1 ZINC000122140839 472980342 /nfs/dbraw/zinc/98/03/42/472980342.db2.gz JGYJHRGJRLUMNV-CRAIPNDOSA-N 0 3 335.448 2.992 20 5 EFBDHN CC(C)(NC(=O)N[C@H]1CCN(CC2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000080146210 472983421 /nfs/dbraw/zinc/98/34/21/472983421.db2.gz YLXZCGSTHQKMLV-HNNXBMFYSA-N 0 3 346.431 2.613 20 5 EFBDHN C[C@@H](CS(=O)(=O)c1ccccc1)NCCc1ccc([N+](=O)[O-])cc1 ZINC000122346277 473004569 /nfs/dbraw/zinc/00/45/69/473004569.db2.gz PIHNYZNHTHJAGK-AWEZNQCLSA-N 0 3 348.424 2.589 20 5 EFBDHN Cc1cc(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)cc([N+](=O)[O-])c1 ZINC000122409595 473011679 /nfs/dbraw/zinc/01/16/79/473011679.db2.gz GEGCXFVEIZNMRX-GOSISDBHSA-N 0 3 341.411 2.806 20 5 EFBDHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1cccc([N+](=O)[O-])c1 ZINC000065939887 473030081 /nfs/dbraw/zinc/03/00/81/473030081.db2.gz PYTVOWWSXFBGPG-UHFFFAOYSA-N 0 3 345.374 2.938 20 5 EFBDHN CN(CCc1ccc([N+](=O)[O-])cc1)C[C@H]1COc2ccccc2O1 ZINC000051505620 473053280 /nfs/dbraw/zinc/05/32/80/473053280.db2.gz KVSOQHPNCHFYTC-INIZCTEOSA-N 0 3 328.368 2.909 20 5 EFBDHN C[C@@H]1CN(C[C@@H]2CCCN2CCc2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1 ZINC000066377613 473085778 /nfs/dbraw/zinc/08/57/78/473085778.db2.gz WHQCLXPZWFAFCB-MDZRGWNJSA-N 0 3 347.459 2.711 20 5 EFBDHN CNC(=O)[C@H]1CCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000093360819 473095035 /nfs/dbraw/zinc/09/50/35/473095035.db2.gz PQOWVCCCIQPCRH-ZDUSSCGKSA-N 0 3 343.383 2.813 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H](C)N1CCCC1 ZINC000052641297 473136108 /nfs/dbraw/zinc/13/61/08/473136108.db2.gz GXQWYJTVVVLVHV-CHWSQXEVSA-N 0 3 337.445 2.676 20 5 EFBDHN NC(=O)C[C@@H]1CCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000093808797 473146416 /nfs/dbraw/zinc/14/64/16/473146416.db2.gz CXAWNTBJGXVICN-ZDUSSCGKSA-N 0 3 343.383 2.942 20 5 EFBDHN CN(C)CCNC(=O)c1cccc(CNc2ccsc2[N+](=O)[O-])c1 ZINC000066816412 473157673 /nfs/dbraw/zinc/15/76/73/473157673.db2.gz ADIJOQDSGPQFFR-UHFFFAOYSA-N 0 3 348.428 2.560 20 5 EFBDHN Cc1ccc(NC(=O)N2CCC(N3CC=CC3)CC2)cc1[N+](=O)[O-] ZINC000136695197 473172584 /nfs/dbraw/zinc/17/25/84/473172584.db2.gz XVEHHUZDROZQDU-UHFFFAOYSA-N 0 3 330.388 2.771 20 5 EFBDHN CC(=O)Nc1cccc([C@@H](C)NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000136914379 473184948 /nfs/dbraw/zinc/18/49/48/473184948.db2.gz ZPZRIJVNXPCZCW-XIKOKIGWSA-N 0 3 343.383 2.937 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000110995802 473189320 /nfs/dbraw/zinc/18/93/20/473189320.db2.gz KLDSFJOUPOMZEN-KRWDZBQOSA-N 0 3 348.447 2.778 20 5 EFBDHN CCN1CCN(CCCNc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000075469732 473189361 /nfs/dbraw/zinc/18/93/61/473189361.db2.gz GERAJZQXODLASW-UHFFFAOYSA-N 0 3 326.828 2.688 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CN2CCC[C@@H]2c2ccncc2)c1 ZINC000125446096 473411337 /nfs/dbraw/zinc/41/13/37/473411337.db2.gz QQVGLHMLDOWVIC-SJLPKXTDSA-N 0 3 343.383 2.567 20 5 EFBDHN COc1ccc(C(=O)N[C@H](C)CN2CCCCCC2)cc1[N+](=O)[O-] ZINC000185414648 473419612 /nfs/dbraw/zinc/41/96/12/473419612.db2.gz IIAYRSWYZHIVRN-CYBMUJFWSA-N 0 3 335.404 2.598 20 5 EFBDHN COC(=O)[C@H](C)CN(C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000114063575 473437320 /nfs/dbraw/zinc/43/73/20/473437320.db2.gz XQGKZSWDKPNCLM-GFCCVEGCSA-N 0 3 347.371 2.533 20 5 EFBDHN C[C@@H](C(=O)NCCc1ccc([N+](=O)[O-])cc1)[C@@H](N)c1ccccc1 ZINC000163575697 473455880 /nfs/dbraw/zinc/45/58/80/473455880.db2.gz PWDBETYBLVUUAA-CXAGYDPISA-N 0 3 327.384 2.590 20 5 EFBDHN C[C@@H](C(=O)NCCc1ccc([N+](=O)[O-])cc1)[C@H](N)c1ccccc1 ZINC000163575483 473456344 /nfs/dbraw/zinc/45/63/44/473456344.db2.gz PWDBETYBLVUUAA-DYVFJYSZSA-N 0 3 327.384 2.590 20 5 EFBDHN CCS(=O)(=O)CCCCCN[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000191046070 473465085 /nfs/dbraw/zinc/46/50/85/473465085.db2.gz ZSEOAOKYTZZXOY-CYBMUJFWSA-N 0 3 328.434 2.850 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCN(CCO)[C@H]2CCc3ccccc32)cc1 ZINC000114467043 473469824 /nfs/dbraw/zinc/46/98/24/473469824.db2.gz KGSMXBLTEPQKBI-IBGZPJMESA-N 0 3 342.395 2.955 20 5 EFBDHN COc1cc(CNC[C@@](C)(O)c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000114508291 473477405 /nfs/dbraw/zinc/47/74/05/473477405.db2.gz LRGWVZDFRYGPHW-GOSISDBHSA-N 0 3 346.383 2.609 20 5 EFBDHN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NCCN1CCCCCC1 ZINC000114678530 473491799 /nfs/dbraw/zinc/49/17/99/473491799.db2.gz IEEFJCPLEBSTRO-UHFFFAOYSA-N 0 3 348.447 2.779 20 5 EFBDHN NC(=O)[C@@H](NCCCCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000151824972 473497128 /nfs/dbraw/zinc/49/71/28/473497128.db2.gz IEJDJXMWQZIDSQ-KRWDZBQOSA-N 0 3 327.384 2.734 20 5 EFBDHN CN1CCN(CCOc2ccc([N+](=O)[O-])cc2)C2(CCCCC2)C1 ZINC000178399372 473504994 /nfs/dbraw/zinc/50/49/94/473504994.db2.gz QOLRONOAECDKAU-UHFFFAOYSA-N 0 3 333.432 2.924 20 5 EFBDHN COCC[C@@](C)(O)CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000172071698 473514667 /nfs/dbraw/zinc/51/46/67/473514667.db2.gz NQLSLCXDELCWEH-QGZVFWFLSA-N 0 3 334.372 2.732 20 5 EFBDHN CC(C)COC(=O)N1CCC(NCc2ccccc2[N+](=O)[O-])CC1 ZINC000152001315 473515032 /nfs/dbraw/zinc/51/50/32/473515032.db2.gz RQRJLDMYBVORDB-UHFFFAOYSA-N 0 3 335.404 2.941 20 5 EFBDHN CCN1CCC(Nc2ncc([N+](=O)[O-])c(C)c2Br)CC1 ZINC000165733087 473515931 /nfs/dbraw/zinc/51/59/31/473515931.db2.gz CBCVBJNWYXEINF-UHFFFAOYSA-N 0 3 343.225 2.957 20 5 EFBDHN O=[N+]([O-])c1cccc(CN2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)c1 ZINC000152207704 473536432 /nfs/dbraw/zinc/53/64/32/473536432.db2.gz LPIHCFVMVUTYDQ-AWEZNQCLSA-N 0 3 327.388 2.970 20 5 EFBDHN O=[N+]([O-])c1cccc(CN2CCC[C@H](c3nc(C4CC4)n[nH]3)C2)c1 ZINC000152207704 473536438 /nfs/dbraw/zinc/53/64/38/473536438.db2.gz LPIHCFVMVUTYDQ-AWEZNQCLSA-N 0 3 327.388 2.970 20 5 EFBDHN CC[C@@H]1CCCCN1CCNC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000172154168 473537021 /nfs/dbraw/zinc/53/70/21/473537021.db2.gz AZHVYHBSNQZJCK-OAHLLOKOSA-N 0 3 334.420 2.659 20 5 EFBDHN Cc1ccoc1C(=O)NCCCN[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000178657735 473543305 /nfs/dbraw/zinc/54/33/05/473543305.db2.gz WHDAQTCNXVHCDS-ZDUSSCGKSA-N 0 3 331.372 2.967 20 5 EFBDHN COc1cc(C(=O)NC[C@H](CC(C)C)N(C)C)cc([N+](=O)[O-])c1C ZINC000191675734 473567499 /nfs/dbraw/zinc/56/74/99/473567499.db2.gz WNWUJJBHOXCOBU-AWEZNQCLSA-N 0 3 337.420 2.618 20 5 EFBDHN CN(C[C@H]1CCCN(C)C1)C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000115442506 473570567 /nfs/dbraw/zinc/57/05/67/473570567.db2.gz BWBPWCYUUJRVFM-NSHDSACASA-N 0 3 325.796 2.662 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCCN(C2CCCC2)CC1 ZINC000172417373 473604950 /nfs/dbraw/zinc/60/49/50/473604950.db2.gz NDLWHWMULWFRGF-UHFFFAOYSA-N 0 3 347.415 2.694 20 5 EFBDHN Cc1cc(C(=O)N2CCCN(C3CCCC3)CC2)ccc1[N+](=O)[O-] ZINC000172422545 473606279 /nfs/dbraw/zinc/60/62/79/473606279.db2.gz DUJKXBZRWGBSQM-UHFFFAOYSA-N 0 3 331.416 2.994 20 5 EFBDHN CC[C@H]1CN(C)c2ccccc2CN1CCn1ccc([N+](=O)[O-])n1 ZINC000127433323 473612916 /nfs/dbraw/zinc/61/29/16/473612916.db2.gz SKSSWNMAYMLQQV-HNNXBMFYSA-N 0 3 329.404 2.522 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN[C@H]2CCO[C@H]2c2ccc(Cl)cc2)c1 ZINC000192043594 473614044 /nfs/dbraw/zinc/61/40/44/473614044.db2.gz OXNJEBQKGQDMGL-GJZGRUSLSA-N 0 3 336.779 2.565 20 5 EFBDHN Cc1cc(OC[C@@H](O)CN(C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000153623970 473634059 /nfs/dbraw/zinc/63/40/59/473634059.db2.gz YAFGSHBGTGYCCZ-INIZCTEOSA-N 0 3 330.384 2.775 20 5 EFBDHN CC(C)C[C@@H]1OCCC[C@H]1NCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000186340055 473655170 /nfs/dbraw/zinc/65/51/70/473655170.db2.gz RSTAYKLOAQVTEM-ZBFHGGJFSA-N 0 3 335.404 2.717 20 5 EFBDHN Cc1ccc(OC[C@H](O)CN(C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000154064622 473664955 /nfs/dbraw/zinc/66/49/55/473664955.db2.gz UBZFGBADGHHDNI-MRXNPFEDSA-N 0 3 330.384 2.775 20 5 EFBDHN CCN(CC)Cc1cccc(NC(=O)c2c([N+](=O)[O-])c(C)nn2C)c1 ZINC000127937902 473665604 /nfs/dbraw/zinc/66/56/04/473665604.db2.gz FRSUGOXKEKFRTG-UHFFFAOYSA-N 0 3 345.403 2.731 20 5 EFBDHN CCn1nc(C)c([N+](=O)[O-])c1N1CCN(CC2CCCCC2)CC1 ZINC000192540483 473690591 /nfs/dbraw/zinc/69/05/91/473690591.db2.gz AEGDXFIYEMKKHC-UHFFFAOYSA-N 0 3 335.452 2.822 20 5 EFBDHN C[C@@H](NCCn1ccc([N+](=O)[O-])n1)c1cccc(OC(F)F)c1 ZINC000179574450 473696594 /nfs/dbraw/zinc/69/65/94/473696594.db2.gz HWSMLMSACVCTJU-SNVBAGLBSA-N 0 3 326.303 2.744 20 5 EFBDHN O=C(NCCN[C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccco1 ZINC000192629244 473697888 /nfs/dbraw/zinc/69/78/88/473697888.db2.gz GLDUPYUSJGDHQO-OAHLLOKOSA-N 0 3 329.356 2.585 20 5 EFBDHN CC1(C)CCC[C@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000186607549 473698545 /nfs/dbraw/zinc/69/85/45/473698545.db2.gz ORJKSXWRRIWJNJ-CQSZACIVSA-N 0 3 326.418 2.537 20 5 EFBDHN C[C@H]1Cc2ccccc2CN1C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000172908506 473701786 /nfs/dbraw/zinc/70/17/86/473701786.db2.gz MNWLVIFHRQXYIN-KSSFIOAISA-N 0 3 342.395 2.781 20 5 EFBDHN CC(C)Oc1cccc([C@@H](C)NCCn2cc([N+](=O)[O-])ccc2=O)c1 ZINC000179664582 473706115 /nfs/dbraw/zinc/70/61/15/473706115.db2.gz CKUZECZAVCFBSF-CQSZACIVSA-N 0 3 345.399 2.895 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[C@@H](CN2CCOCC2)C1 ZINC000245517212 473714764 /nfs/dbraw/zinc/71/47/64/473714764.db2.gz GWEQRNSGQZEIMN-CVEARBPZSA-N 0 3 333.432 2.618 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CN[C@H](CCCO)c2ccccc2)c1 ZINC000179743033 473716977 /nfs/dbraw/zinc/71/69/77/473716977.db2.gz YRGIIGBAKRKLAM-MSOLQXFVSA-N 0 3 330.384 2.732 20 5 EFBDHN Cc1nn(C)c(N[C@H]2CN(Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000274060803 473721354 /nfs/dbraw/zinc/72/13/54/473721354.db2.gz AHOHGDKISVCTMP-DOMZBBRYSA-N 0 3 329.404 2.569 20 5 EFBDHN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc2c(c1)CNCC2 ZINC000269188738 473725004 /nfs/dbraw/zinc/72/50/04/473725004.db2.gz GRGNQLFDEHQCRD-UHFFFAOYSA-N 0 3 340.383 2.559 20 5 EFBDHN C[C@H](CNC(=O)Cc1cccc([N+](=O)[O-])c1)N(C)Cc1ccccc1 ZINC000173012975 473725419 /nfs/dbraw/zinc/72/54/19/473725419.db2.gz VJZWJEOFWZDRAB-OAHLLOKOSA-N 0 3 341.411 2.774 20 5 EFBDHN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc2c(c1)CNCC2 ZINC000269205948 473731663 /nfs/dbraw/zinc/73/16/63/473731663.db2.gz LWUIXZOIQKNQLE-UHFFFAOYSA-N 0 3 325.368 2.812 20 5 EFBDHN COc1ccc([C@H](CNc2ncccc2[N+](=O)[O-])N(C)C)cc1OC ZINC000192905978 473746309 /nfs/dbraw/zinc/74/63/09/473746309.db2.gz UOLHKAUPYPMGJI-AWEZNQCLSA-N 0 3 346.387 2.722 20 5 EFBDHN COc1ccc(CNC(=O)[C@H](C)[C@H](N)c2ccccc2)cc1[N+](=O)[O-] ZINC000269259279 473752573 /nfs/dbraw/zinc/75/25/73/473752573.db2.gz QEEPLGPYINFIJE-PXAZEXFGSA-N 0 3 343.383 2.556 20 5 EFBDHN CC[C@@H](NC[C@@H]1COC2(CCOCC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000179998466 473773780 /nfs/dbraw/zinc/77/37/80/473773780.db2.gz HLCZKWNSORJGJI-HZPDHXFCSA-N 0 3 336.388 2.558 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H]2CCCN(C(C)C)C2)c1 ZINC000281664240 473799028 /nfs/dbraw/zinc/79/90/28/473799028.db2.gz STEMOESSGCCHDK-OAHLLOKOSA-N 0 3 349.431 2.661 20 5 EFBDHN C[C@@H](NCCc1nnc2n1CCCCC2)c1cccc([N+](=O)[O-])c1 ZINC000173308744 473801558 /nfs/dbraw/zinc/80/15/58/473801558.db2.gz VRLJBJHHKWVLIL-CYBMUJFWSA-N 0 3 329.404 2.806 20 5 EFBDHN C[C@H](NCCc1nnc2n1CCCCC2)c1cccc([N+](=O)[O-])c1 ZINC000173308731 473801787 /nfs/dbraw/zinc/80/17/87/473801787.db2.gz VRLJBJHHKWVLIL-ZDUSSCGKSA-N 0 3 329.404 2.806 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)c1 ZINC000246257258 473807622 /nfs/dbraw/zinc/80/76/22/473807622.db2.gz KNUZYVPYNTZQRQ-WFASDCNBSA-N 0 3 349.456 2.873 20 5 EFBDHN Cc1c(CN2CC[C@@H]3[C@@H](CCC(=O)N3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000246282912 473816478 /nfs/dbraw/zinc/81/64/78/473816478.db2.gz NVFFJICULGKUOK-MAUKXSAKSA-N 0 3 343.427 2.879 20 5 EFBDHN CN1CCN(CCNc2ccc([N+](=O)[O-])cc2Cl)CC1(C)C ZINC000281719822 473818218 /nfs/dbraw/zinc/81/82/18/473818218.db2.gz VFGFGYROHPVGPI-UHFFFAOYSA-N 0 3 326.828 2.686 20 5 EFBDHN C[C@@H]1c2ccccc2CCN1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000246287713 473818591 /nfs/dbraw/zinc/81/85/91/473818591.db2.gz BLEWYGBFFYMVTR-RHSMWYFYSA-N 0 3 342.395 2.954 20 5 EFBDHN C[C@H](NC[C@@H](O)COCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000173382997 473821402 /nfs/dbraw/zinc/82/14/02/473821402.db2.gz XNEIQMOCCVGWML-KBXCAEBGSA-N 0 3 330.384 2.823 20 5 EFBDHN CC(C)(O)CN(Cc1ccccc1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000180223666 473831152 /nfs/dbraw/zinc/83/11/52/473831152.db2.gz SBZNVEWOMGMEPD-GOSISDBHSA-N 0 3 344.411 2.901 20 5 EFBDHN COc1cc(OC)cc([C@@H](O)CN[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173426406 473835167 /nfs/dbraw/zinc/83/51/67/473835167.db2.gz UKYMBBWIBAZPFL-SGTLLEGYSA-N 0 3 346.383 2.996 20 5 EFBDHN CN(C)c1ccccc1CN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173466974 473846105 /nfs/dbraw/zinc/84/61/05/473846105.db2.gz BSCFABQEGYVXDQ-HNNXBMFYSA-N 0 3 341.415 2.742 20 5 EFBDHN O=C(Cc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1CN1CCCCC1 ZINC000173476477 473848480 /nfs/dbraw/zinc/84/84/80/473848480.db2.gz CMFMJFWUQBTPQS-QGZVFWFLSA-N 0 3 331.416 2.614 20 5 EFBDHN C[C@H]1[C@@H](N2CCCC2)CCN1C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000288108732 473849664 /nfs/dbraw/zinc/84/96/64/473849664.db2.gz IOZMGSHBKZIRHR-NHYWBVRUSA-N 0 3 337.807 2.947 20 5 EFBDHN C[C@@H](NCc1ccc(NS(C)(=O)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000263861353 473880955 /nfs/dbraw/zinc/88/09/55/473880955.db2.gz VXKYZLZKGQWMCS-GFCCVEGCSA-N 0 3 349.412 2.817 20 5 EFBDHN CCN(Cc1ccccc1)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000194361566 473885960 /nfs/dbraw/zinc/88/59/60/473885960.db2.gz SSYVHOMQUJYCHH-MRXNPFEDSA-N 0 3 330.384 2.857 20 5 EFBDHN O=[N+]([O-])c1cc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)c2c(c1)COCO2 ZINC000269936450 473925150 /nfs/dbraw/zinc/92/51/50/473925150.db2.gz OCVBHCRSKCOFDI-UAGQMJEPSA-N 0 3 346.383 2.509 20 5 EFBDHN O=[N+]([O-])c1cc(CN[C@@H]2[C@H]3CCO[C@H]3C23CCC3)c2c(c1)COCO2 ZINC000269936442 473925409 /nfs/dbraw/zinc/92/54/09/473925409.db2.gz OCVBHCRSKCOFDI-DJIMGWMZSA-N 0 3 346.383 2.509 20 5 EFBDHN C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000288389057 473927555 /nfs/dbraw/zinc/92/75/55/473927555.db2.gz MDJVOWQJZOFACH-DGCLKSJQSA-N 0 3 337.807 2.947 20 5 EFBDHN C[C@H]1C[C@H](N2CCCC2)CN1C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000288462650 473949683 /nfs/dbraw/zinc/94/96/83/473949683.db2.gz QBLFDIUCUUYEIF-AAEUAGOBSA-N 0 3 337.807 2.947 20 5 EFBDHN COc1cc(CNC[C@H]2CCCSC2)c([N+](=O)[O-])cc1OC ZINC000288479287 473955146 /nfs/dbraw/zinc/95/51/46/473955146.db2.gz PRZRACSGBCWLIN-LLVKDONJSA-N 0 3 326.418 2.845 20 5 EFBDHN C[C@@H](N[C@@H]1CCCC12CCOCC2)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000282146497 473959670 /nfs/dbraw/zinc/95/96/70/473959670.db2.gz SHIKMFFGTSXLSZ-CZUORRHYSA-N 0 3 347.415 2.861 20 5 EFBDHN CN(C)C1(CN(C)C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CCC1 ZINC000188042230 473961976 /nfs/dbraw/zinc/96/19/76/473961976.db2.gz FOWDOAHNMDQADZ-UHFFFAOYSA-N 0 3 325.796 2.805 20 5 EFBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])NCC(=O)N(C)CC ZINC000274815998 473971325 /nfs/dbraw/zinc/97/13/25/473971325.db2.gz WMSJPSIEEMMIIR-LBPRGKRZSA-N 0 3 325.434 2.533 20 5 EFBDHN CN(C)[C@@H]1CCC[C@H]1NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000613662830 480073256 /nfs/dbraw/zinc/07/32/56/480073256.db2.gz IGFIZNXJUOYMLX-RTBURBONSA-N 0 3 349.434 2.894 20 5 EFBDHN COCCN1CC[C@H](NC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000264436742 473990690 /nfs/dbraw/zinc/99/06/90/473990690.db2.gz BITNYULBYOPZTM-INIZCTEOSA-N 0 3 349.434 2.839 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)NCCN2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000247009217 474033877 /nfs/dbraw/zinc/03/38/77/474033877.db2.gz LFYWCEAAMBALCY-HIFRSBDPSA-N 0 3 348.447 2.995 20 5 EFBDHN CC(C)(C)[C@@H](CCO)NCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000181477283 474039568 /nfs/dbraw/zinc/03/95/68/474039568.db2.gz SLUOWHUCINHGMY-CYBMUJFWSA-N 0 3 343.811 2.573 20 5 EFBDHN C[S@](=O)C1(CNCc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000282431137 474063095 /nfs/dbraw/zinc/06/30/95/474063095.db2.gz RHOZJDGCRRGFPQ-QHCPKHFHSA-N 0 3 334.397 2.856 20 5 EFBDHN COCCN1CC[C@@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000264619660 474063518 /nfs/dbraw/zinc/06/35/18/474063518.db2.gz RIFNSUYIDKRQBQ-OAHLLOKOSA-N 0 3 345.399 2.665 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCCN2CCC[C@H]2[C@@H](O)C(F)(F)F)cc1 ZINC000264679171 474085120 /nfs/dbraw/zinc/08/51/20/474085120.db2.gz CALYOCMJOBBPPS-UONOGXRCSA-N 0 3 348.321 2.751 20 5 EFBDHN C[C@@H](CN(C)Cc1ccccc1)NC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000182069255 474091743 /nfs/dbraw/zinc/09/17/43/474091743.db2.gz GXRKHUAZFSAPSF-ZDUSSCGKSA-N 0 3 345.374 2.984 20 5 EFBDHN C[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccccc1[N+](=O)[O-] ZINC000182093635 474099239 /nfs/dbraw/zinc/09/92/39/474099239.db2.gz AHCRDQXRNUDXPA-CQSZACIVSA-N 0 3 327.384 2.845 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CCC(OCCc3ccccc3)CC2)c1 ZINC000174834715 474104699 /nfs/dbraw/zinc/10/46/99/474104699.db2.gz IVCSEMJWNMEOBU-UHFFFAOYSA-N 0 3 344.415 2.515 20 5 EFBDHN CO[C@@H]1CCCC[C@H]1NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000275209637 474104964 /nfs/dbraw/zinc/10/49/64/474104964.db2.gz JMCQISHHNZRVJI-ZIAGYGMSSA-N 0 3 341.795 2.734 20 5 EFBDHN CSc1ccc(C(=O)N2CCC[C@H]3CN(C)CC[C@H]32)cc1[N+](=O)[O-] ZINC000247303346 474112855 /nfs/dbraw/zinc/11/28/55/474112855.db2.gz PMRUSLNELAIKJD-UONOGXRCSA-N 0 3 349.456 2.873 20 5 EFBDHN CCN(Cc1cccs1)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182178663 474115682 /nfs/dbraw/zinc/11/56/82/474115682.db2.gz AYVKLNJWGFWGCN-CYBMUJFWSA-N 0 3 336.413 2.918 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000264753536 474116589 /nfs/dbraw/zinc/11/65/89/474116589.db2.gz SUXAHSMUJVHDRB-GFCCVEGCSA-N 0 3 337.445 2.921 20 5 EFBDHN CN(C[C@@H](O)COc1ccccc1[N+](=O)[O-])[C@@H]1CCc2ccccc21 ZINC000182201204 474121259 /nfs/dbraw/zinc/12/12/59/474121259.db2.gz VVDBITHFEITYEH-NVXWUHKLSA-N 0 3 342.395 2.954 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1N1CCC(N2CCN(C(C)C)CC2)CC1 ZINC000270463438 474129027 /nfs/dbraw/zinc/12/90/27/474129027.db2.gz LUGBZPQOXFTTSG-UHFFFAOYSA-N 0 3 346.475 2.898 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1N1CCC(N2CCN(C(C)C)CC2)CC1 ZINC000270461955 474129640 /nfs/dbraw/zinc/12/96/40/474129640.db2.gz LIYGEKPMHCUVBT-UHFFFAOYSA-N 0 3 346.475 2.898 20 5 EFBDHN C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000247372866 474131973 /nfs/dbraw/zinc/13/19/73/474131973.db2.gz KYFPCEHUGADUFJ-ZWNOBZJWSA-N 0 3 325.796 2.660 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)NCc2ccc(CN(C)C)cc2)c1 ZINC000175020012 474133566 /nfs/dbraw/zinc/13/35/66/474133566.db2.gz KTBTURUJGXPJOT-UHFFFAOYSA-N 0 3 327.384 2.895 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@H]2CCCN2C[C@H]1C ZINC000247474387 474156611 /nfs/dbraw/zinc/15/66/11/474156611.db2.gz RZZCWYXMSBROOI-VNHYZAJKSA-N 0 3 349.456 2.771 20 5 EFBDHN CN(CCOCCO)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000282691566 474158525 /nfs/dbraw/zinc/15/85/25/474158525.db2.gz JAIZSIIPKRUDQX-UHFFFAOYSA-N 0 3 336.413 2.764 20 5 EFBDHN O=[N+]([O-])c1cnc(N[C@H]2CCN3CCCC[C@@H]23)c(Br)c1 ZINC000223863187 474192411 /nfs/dbraw/zinc/19/24/11/474192411.db2.gz GUZWNNRFQLMBRR-RYUDHWBXSA-N 0 3 341.209 2.791 20 5 EFBDHN CCOC1CC(CCNCc2cc(OC)c(OC)cc2[N+](=O)[O-])C1 ZINC000188785839 474195763 /nfs/dbraw/zinc/19/57/63/474195763.db2.gz YUHNFZUMZJORKQ-UHFFFAOYSA-N 0 3 338.404 2.907 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)C[C@H]2CCCN2CC)c1 ZINC000282832095 474211266 /nfs/dbraw/zinc/21/12/66/474211266.db2.gz LQJDEIJGCJKDMZ-CYBMUJFWSA-N 0 3 335.404 2.550 20 5 EFBDHN C[C@H]1CN(Cc2cc(Cl)ccc2[N+](=O)[O-])CCN1CC(C)(C)O ZINC000275519448 474218580 /nfs/dbraw/zinc/21/85/80/474218580.db2.gz IVYOYYCCXZVZLT-LBPRGKRZSA-N 0 3 341.839 2.525 20 5 EFBDHN CN(C)CCc1ccccc1NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000275564091 474237300 /nfs/dbraw/zinc/23/73/00/474237300.db2.gz DRFIWMFTHJCSJM-UHFFFAOYSA-N 0 3 343.383 2.716 20 5 EFBDHN CC(=O)c1ccc(NC2CCN(C[C@@H]3CCOC3)CC2)c([N+](=O)[O-])c1 ZINC000265503895 474237486 /nfs/dbraw/zinc/23/74/86/474237486.db2.gz NPHQFSGBKMFURN-AWEZNQCLSA-N 0 3 347.415 2.710 20 5 EFBDHN CCC(CC)N(CC)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000289392061 474252706 /nfs/dbraw/zinc/25/27/06/474252706.db2.gz KCXJNUNVEBXXDM-UHFFFAOYSA-N 0 3 337.376 2.773 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)CC2(N(C)C)CCC2)c1 ZINC000282971741 474259165 /nfs/dbraw/zinc/25/91/65/474259165.db2.gz AYMHBKIDSVNQIR-UHFFFAOYSA-N 0 3 335.404 2.550 20 5 EFBDHN COc1ccc(CN[C@@H](CO)Cc2cccc(C)c2)cc1[N+](=O)[O-] ZINC000189027314 474269368 /nfs/dbraw/zinc/26/93/68/474269368.db2.gz JAGPCUDHCPTQKM-MRXNPFEDSA-N 0 3 330.384 2.605 20 5 EFBDHN O=C(Nc1ccccc1)N1CC[C@@H](NCc2cccc([N+](=O)[O-])c2)C1 ZINC000283035799 474280959 /nfs/dbraw/zinc/28/09/59/474280959.db2.gz QULGALLZUYXDSX-MRXNPFEDSA-N 0 3 340.383 2.991 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC(Cn2ccnn2)CC1 ZINC000182929566 474289729 /nfs/dbraw/zinc/28/97/29/474289729.db2.gz BVUAPAMOWUFBFB-CQSZACIVSA-N 0 3 329.404 2.968 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N(C)CCCN1CCN(C)CC1 ZINC000182955606 474296124 /nfs/dbraw/zinc/29/61/24/474296124.db2.gz ZVWYPLCPUPYBCK-INIZCTEOSA-N 0 3 334.464 2.534 20 5 EFBDHN O=[N+]([O-])c1ccccc1N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000265753909 474323138 /nfs/dbraw/zinc/32/31/38/474323138.db2.gz DDKOIYGHFDWNQO-IRXDYDNUSA-N 0 3 341.411 2.890 20 5 EFBDHN C[C@@H](c1cccc(O)c1)N(C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248448299 474326533 /nfs/dbraw/zinc/32/65/33/474326533.db2.gz HQMRLWPMASTTGT-XJKSGUPXSA-N 0 3 346.383 2.733 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000265827632 474352490 /nfs/dbraw/zinc/35/24/90/474352490.db2.gz SDSCTLOVFRKERV-INIZCTEOSA-N 0 3 333.432 2.863 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2cnc(CCN(CCO)C3CCC3)o2)c1 ZINC000275898396 474354441 /nfs/dbraw/zinc/35/44/41/474354441.db2.gz ULHHPTXPUBPESP-UHFFFAOYSA-N 0 3 331.372 2.639 20 5 EFBDHN CC(C)N1CCCN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000265839197 474357484 /nfs/dbraw/zinc/35/74/84/474357484.db2.gz VKMWPLOVWDFFMX-UHFFFAOYSA-N 0 3 333.432 2.815 20 5 EFBDHN CCCc1[nH]nc(C(=O)Nc2ccccc2CCN(C)C)c1[N+](=O)[O-] ZINC000275914160 474360726 /nfs/dbraw/zinc/36/07/26/474360726.db2.gz SVIUHEOYBLMZAM-UHFFFAOYSA-N 0 3 345.403 2.627 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@@H]1CC[C@@H](C)C[C@@H]1C ZINC000248588655 474368600 /nfs/dbraw/zinc/36/86/00/474368600.db2.gz YPSNCKTVCOQUQR-MBNYWOFBSA-N 0 3 335.404 2.956 20 5 EFBDHN C[C@H]1CN(C)CC[C@H]1N(C)C(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000265933195 474391162 /nfs/dbraw/zinc/39/11/62/474391162.db2.gz DZGFRIUWEMWEBG-GXFFZTMASA-N 0 3 325.796 2.660 20 5 EFBDHN CCOc1ccc([C@@H](C)NCC2(C(N)=O)CCCC2)cc1[N+](=O)[O-] ZINC000271061958 474392301 /nfs/dbraw/zinc/39/23/01/474392301.db2.gz CICGIVQIIHUDTO-GFCCVEGCSA-N 0 3 335.404 2.690 20 5 EFBDHN C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000265941292 474395779 /nfs/dbraw/zinc/39/57/79/474395779.db2.gz HSUXNBNJJPUEOP-BXUZGUMPSA-N 0 3 331.372 2.753 20 5 EFBDHN C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000265941293 474396062 /nfs/dbraw/zinc/39/60/62/474396062.db2.gz HSUXNBNJJPUEOP-FZMZJTMJSA-N 0 3 331.372 2.753 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](C)N2CCC(C)CC2)c1 ZINC000283452978 474408009 /nfs/dbraw/zinc/40/80/09/474408009.db2.gz LAGYFCOIHODNNH-CQSZACIVSA-N 0 3 349.431 2.844 20 5 EFBDHN COc1cc(CN(C)CCc2cccc([N+](=O)[O-])c2)cc(OC)c1O ZINC000289763237 474414084 /nfs/dbraw/zinc/41/40/84/474414084.db2.gz QMBIIXDUNRNRMF-UHFFFAOYSA-N 0 3 346.383 2.992 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CCC(OCCc3ccccc3)CC2)n1 ZINC000176219202 474414166 /nfs/dbraw/zinc/41/41/66/474414166.db2.gz WCTQCXBDMCYVSI-UHFFFAOYSA-N 0 3 344.415 2.515 20 5 EFBDHN COCC1(O)CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000271165404 474414935 /nfs/dbraw/zinc/41/49/35/474414935.db2.gz FNLRTEVROOVEJA-UHFFFAOYSA-N 0 3 346.383 2.828 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)NCCN(C)Cc2ccccc2)c1 ZINC000266051135 474416375 /nfs/dbraw/zinc/41/63/75/474416375.db2.gz OKSGKUSOGWBMEP-UHFFFAOYSA-N 0 3 327.384 2.765 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](C)N2CCC[C@@H](C)C2)c1 ZINC000283578886 474441467 /nfs/dbraw/zinc/44/14/67/474441467.db2.gz WHUAWSSTYZMCOG-ZIAGYGMSSA-N 0 3 349.431 2.844 20 5 EFBDHN CCN(CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCOC(C)(C)C1 ZINC000289821911 474443214 /nfs/dbraw/zinc/44/32/14/474443214.db2.gz OEKVVYZMSQJIQK-MRXNPFEDSA-N 0 3 349.431 2.837 20 5 EFBDHN CO[C@H]1COC[C@@H]1NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000289828319 474446490 /nfs/dbraw/zinc/44/64/90/474446490.db2.gz OCGFPZZQMSQRCL-ZFWWWQNUSA-N 0 3 334.397 2.827 20 5 EFBDHN COCCOCCOCCN(C)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000276216155 474455957 /nfs/dbraw/zinc/45/59/57/474455957.db2.gz IFWKJLIEMGUAJK-OAHLLOKOSA-N 0 3 340.420 2.576 20 5 EFBDHN CCC(CC)(CNCc1cc(OC)c(F)cc1[N+](=O)[O-])C(=O)OC ZINC000184269683 474494872 /nfs/dbraw/zinc/49/48/72/474494872.db2.gz OESYGJMTEMSHOK-UHFFFAOYSA-N 0 3 342.367 2.812 20 5 EFBDHN C[C@H](NC[C@@H](O)COc1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000266825316 474495542 /nfs/dbraw/zinc/49/55/42/474495542.db2.gz CTQYZJRZPIULMD-BLLLJJGKSA-N 0 3 334.347 2.824 20 5 EFBDHN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@H]2CCN(C)C[C@@H]21 ZINC000289949649 474498788 /nfs/dbraw/zinc/49/87/88/474498788.db2.gz XPDQMGZWEJTXRW-BBRMVZONSA-N 0 3 332.404 2.715 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@@](C)(CO)C1CCCCC1 ZINC000266871556 474510836 /nfs/dbraw/zinc/51/08/36/474510836.db2.gz QDOJFSFJKMUSPW-SFHVURJKSA-N 0 3 349.431 2.763 20 5 EFBDHN COc1ccc(CNC[C@]2(CO)C[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000289997711 474520478 /nfs/dbraw/zinc/52/04/78/474520478.db2.gz XWOGIMZCNBEBLN-APWZRJJASA-N 0 3 342.395 2.859 20 5 EFBDHN NC[C@@H](C(=O)NCCCCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000238022384 474524004 /nfs/dbraw/zinc/52/40/04/474524004.db2.gz MILMVEVEBGGBKB-GOSISDBHSA-N 0 3 341.411 2.776 20 5 EFBDHN C[C@H](CO)N(Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CCCC1 ZINC000276418085 474535422 /nfs/dbraw/zinc/53/54/22/474535422.db2.gz HYMWOIZKFLSVDF-GFCCVEGCSA-N 0 3 336.388 2.587 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1C(=O)NCc1ccccc1CN(C)C ZINC000184545404 474543187 /nfs/dbraw/zinc/54/31/87/474543187.db2.gz ZAUDOCXTLLYBIV-UHFFFAOYSA-N 0 3 327.384 2.895 20 5 EFBDHN C[C@H](N[C@@H](CO)C[C@H](O)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000271447668 474552027 /nfs/dbraw/zinc/55/20/27/474552027.db2.gz DAKHQXSWECLWGM-XCRHUMRWSA-N 0 3 330.384 2.730 20 5 EFBDHN C[C@H](N[C@H](CO)C[C@H](O)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000271476117 474563326 /nfs/dbraw/zinc/56/33/26/474563326.db2.gz IBRZFNMWMJTFLD-OWQGQXMQSA-N 0 3 330.384 2.730 20 5 EFBDHN C[C@H](N[C@@H](CO)C[C@H](O)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000271476123 474563862 /nfs/dbraw/zinc/56/38/62/474563862.db2.gz IBRZFNMWMJTFLD-XCRHUMRWSA-N 0 3 330.384 2.730 20 5 EFBDHN Cc1cc(F)c(NC(=O)N2C[C@H]3CCCN3C[C@@H]2C)cc1[N+](=O)[O-] ZINC000284081529 474567018 /nfs/dbraw/zinc/56/70/18/474567018.db2.gz RMAVHXWCLLWXFM-NWDGAFQWSA-N 0 3 336.367 2.743 20 5 EFBDHN COc1cccc([C@H](O)CN[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000284100740 474572199 /nfs/dbraw/zinc/57/21/99/474572199.db2.gz MUKYKKWYLOZJFY-APPDUMDISA-N 0 3 331.372 2.570 20 5 EFBDHN CCC(CC)(CC(=O)OC)NCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000284146044 474582464 /nfs/dbraw/zinc/58/24/64/474582464.db2.gz PDVVEPGLCAAKFI-UHFFFAOYSA-N 0 3 339.348 2.715 20 5 EFBDHN C[C@H](CNC(=O)NCc1ccccc1[N+](=O)[O-])N1CCC[C@H](C)C1 ZINC000249510119 474582812 /nfs/dbraw/zinc/58/28/12/474582812.db2.gz NVAWJOBVALTHEZ-UONOGXRCSA-N 0 3 334.420 2.514 20 5 EFBDHN C[C@H](CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-])N1CCC[C@@H](C)C1 ZINC000249526185 474586827 /nfs/dbraw/zinc/58/68/27/474586827.db2.gz UFVLEKFZAGSIAF-HUUCEWRRSA-N 0 3 348.447 2.857 20 5 EFBDHN COCCCCN(CCn1ccc([N+](=O)[O-])n1)Cc1ccccc1 ZINC000267106504 474591165 /nfs/dbraw/zinc/59/11/65/474591165.db2.gz WBFFJKODKZKAIS-UHFFFAOYSA-N 0 3 332.404 2.720 20 5 EFBDHN CN1CCC(O)(CNC(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000267121144 474595006 /nfs/dbraw/zinc/59/50/06/474595006.db2.gz OBFWZRNILWBCFD-UHFFFAOYSA-N 0 3 349.434 2.575 20 5 EFBDHN O=C(CN1CCC[C@H]1C1CCC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000609120988 480114330 /nfs/dbraw/zinc/11/43/30/480114330.db2.gz FFNNDHXDBMTAPF-INIZCTEOSA-N 0 3 329.400 2.748 20 5 EFBDHN C[C@H](CNC(=O)NCc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](C)C1 ZINC000249689807 474603130 /nfs/dbraw/zinc/60/31/30/474603130.db2.gz PGYBJYMDINXRQB-ZIAGYGMSSA-N 0 3 334.420 2.514 20 5 EFBDHN COc1ccc(NC(=O)N[C@@H](C)CN2CCCCC2)cc1[N+](=O)[O-] ZINC000272874164 474630854 /nfs/dbraw/zinc/63/08/54/474630854.db2.gz VIJZKWWHJXORCN-LBPRGKRZSA-N 0 3 336.392 2.599 20 5 EFBDHN Cc1cc(N[C@@H](C)CN2CCOCC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000272881258 474633020 /nfs/dbraw/zinc/63/30/20/474633020.db2.gz VKUZKZHFUOMCFD-ZDUSSCGKSA-N 0 3 330.388 2.584 20 5 EFBDHN CN(C[C@H]1CCCN(C)C1)c1ncc([N+](=O)[O-])cc1Br ZINC000267280502 474636727 /nfs/dbraw/zinc/63/67/27/474636727.db2.gz VDNOLRKLIFPQBN-JTQLQIEISA-N 0 3 343.225 2.530 20 5 EFBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNC[C@@H](CO)[C@H]1CCOC1 ZINC000291679326 474648006 /nfs/dbraw/zinc/64/80/06/474648006.db2.gz XDOHQYNQNOUBAL-ONGXEEELSA-N 0 3 349.214 2.636 20 5 EFBDHN COCC1(CNCc2cc(Cl)ccc2[N+](=O)[O-])CCOCC1 ZINC000291687513 474649831 /nfs/dbraw/zinc/64/98/31/474649831.db2.gz IOYMMIZTERVESX-UHFFFAOYSA-N 0 3 328.796 2.781 20 5 EFBDHN CSc1ccc(C(=O)N[C@@H](C)C2=CCN(C)CC2)cc1[N+](=O)[O-] ZINC000272961626 474651190 /nfs/dbraw/zinc/65/11/90/474651190.db2.gz NMHNXXNDMFXEPZ-NSHDSACASA-N 0 3 335.429 2.697 20 5 EFBDHN Cn1nccc1N1CCC[C@@H](NCc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000278464979 474651305 /nfs/dbraw/zinc/65/13/05/474651305.db2.gz FYDNWNBOOIKXAE-CQSZACIVSA-N 0 3 349.822 2.740 20 5 EFBDHN C[C@H](CNCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000278510941 474671948 /nfs/dbraw/zinc/67/19/48/474671948.db2.gz PWYBDOCISIECQB-CQSZACIVSA-N 0 3 348.424 2.762 20 5 EFBDHN Cc1nn(C[C@H]2CN(Cc3ccccc3)CCCO2)c(C)c1[N+](=O)[O-] ZINC000278510240 474672377 /nfs/dbraw/zinc/67/23/77/474672377.db2.gz DYZNJMDPRFZGRJ-QGZVFWFLSA-N 0 3 344.415 2.699 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@H](Cc2ccccc2)[C@@H](O)C(F)F)cc1 ZINC000344349215 474674436 /nfs/dbraw/zinc/67/44/36/474674436.db2.gz VODZLJRQTOOGLG-HZPDHXFCSA-N 0 3 336.338 2.922 20 5 EFBDHN CN(CCNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000273079155 474705885 /nfs/dbraw/zinc/70/58/85/474705885.db2.gz AOKHGRVMADOAEJ-UHFFFAOYSA-N 0 3 343.836 2.551 20 5 EFBDHN COc1ccc(OCCN2CCC[C@H]2[C@@H]2CCCO2)c([N+](=O)[O-])c1 ZINC000284663338 474712219 /nfs/dbraw/zinc/71/22/19/474712219.db2.gz GOHMJIIVAACFBR-HOCLYGCPSA-N 0 3 336.388 2.626 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@@H](C(C)C)C1(CO)CCC1 ZINC000292926796 474717930 /nfs/dbraw/zinc/71/79/30/474717930.db2.gz CEDGFPAFVKDZBZ-KRWDZBQOSA-N 0 3 349.431 2.619 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CC[C@H](Oc3ccc(Cl)cc3)C2)n1 ZINC000292945679 474728966 /nfs/dbraw/zinc/72/89/66/474728966.db2.gz DNWJYPCTLOCEAL-AWEZNQCLSA-N 0 3 336.779 2.598 20 5 EFBDHN COC1(CNCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCOCC1 ZINC000278599711 474729205 /nfs/dbraw/zinc/72/92/05/474729205.db2.gz CBWPCVOXLYUYKX-UHFFFAOYSA-N 0 3 348.321 2.899 20 5 EFBDHN COc1ccc(CNC[C@H](O)CCc2ccccc2)cc1[N+](=O)[O-] ZINC000273126340 474730342 /nfs/dbraw/zinc/73/03/42/474730342.db2.gz LSPUVHMIXLJCKE-MRXNPFEDSA-N 0 3 330.384 2.687 20 5 EFBDHN CC(C)[C@H](NCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C1(CO)CCC1 ZINC000292962620 474737002 /nfs/dbraw/zinc/73/70/02/474737002.db2.gz FUFGQSUEYNDVSP-HNNXBMFYSA-N 0 3 337.376 2.780 20 5 EFBDHN COc1ccc(OCCN2CCCO[C@@H](C(C)C)C2)c([N+](=O)[O-])c1 ZINC000293008263 474763270 /nfs/dbraw/zinc/76/32/70/474763270.db2.gz DIOZRTTUDWPXAJ-QGZVFWFLSA-N 0 3 338.404 2.729 20 5 EFBDHN CN(C)C[C@@H]1CCCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000268070204 474780676 /nfs/dbraw/zinc/78/06/76/474780676.db2.gz AFULZZIAUUJPOO-ZDUSSCGKSA-N 0 3 333.413 2.976 20 5 EFBDHN CO[C@@H]1CCCC[C@H]1N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000278708017 474786403 /nfs/dbraw/zinc/78/64/03/474786403.db2.gz QRWWSEWGNJIFPX-JGGQBBKZSA-N 0 3 335.404 2.777 20 5 EFBDHN COc1ccc([C@H](C)NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1 ZINC000273225391 474788261 /nfs/dbraw/zinc/78/82/61/474788261.db2.gz VNVYMFLHXBKHEN-DZGCQCFKSA-N 0 3 346.383 2.694 20 5 EFBDHN CC(C)N1C[C@@H](C)[C@H](NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC000268138434 474818403 /nfs/dbraw/zinc/81/84/03/474818403.db2.gz PEUAMFHRQDRZPY-BXUZGUMPSA-N 0 3 330.388 2.535 20 5 EFBDHN CSc1ccc(C(=O)N[C@H]2CN(C3CC3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000268149356 474827411 /nfs/dbraw/zinc/82/74/11/474827411.db2.gz FYGSWRZATSTREU-GWCFXTLKSA-N 0 3 335.429 2.529 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@H](COC)[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000278787044 474834839 /nfs/dbraw/zinc/83/48/39/474834839.db2.gz LZHFRVZJRFDBDC-BJJXKVORSA-N 0 3 338.404 2.838 20 5 EFBDHN C[C@H]1CN(C)CC[C@H]1N(C)c1ncc([N+](=O)[O-])cc1Br ZINC000268162495 474836299 /nfs/dbraw/zinc/83/62/99/474836299.db2.gz OUWKYCCWVAKXPE-JOYOIKCWSA-N 0 3 343.225 2.529 20 5 EFBDHN Cc1ccc([C@@H]2C[C@H](C)N(CCn3cc([N+](=O)[O-])ccc3=O)C2)cc1 ZINC000278809511 474846601 /nfs/dbraw/zinc/84/66/01/474846601.db2.gz ZYYVWLJZFINDRD-DOTOQJQBSA-N 0 3 341.411 2.943 20 5 EFBDHN CS[C@H]1CN(C(=O)c2cccc(C)c2[N+](=O)[O-])C[C@H]1N1CCCC1 ZINC000273438403 474896160 /nfs/dbraw/zinc/89/61/60/474896160.db2.gz AQWMRMSHENZOON-CABCVRRESA-N 0 3 349.456 2.555 20 5 EFBDHN CN(Cc1ccc(Br)c([N+](=O)[O-])c1)C1(CO)CCC1 ZINC000292210261 474906908 /nfs/dbraw/zinc/90/69/08/474906908.db2.gz UBNJMVHLAKJNNY-UHFFFAOYSA-N 0 3 329.194 2.704 20 5 EFBDHN C[C@@H](NCCOCC(F)(F)C(F)F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000285168394 474914830 /nfs/dbraw/zinc/91/48/30/474914830.db2.gz MUUILENUSLUNAX-MRVPVSSYSA-N 0 3 339.289 2.745 20 5 EFBDHN CN1CC[C@]2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)C2)C1 ZINC000292245065 474922443 /nfs/dbraw/zinc/92/24/43/474922443.db2.gz OMVVYCJLGMKBCU-KRWDZBQOSA-N 0 3 345.424 2.977 20 5 EFBDHN C[C@H](C1CCN(C)CC1)N(C)C(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000273485461 474923901 /nfs/dbraw/zinc/92/39/01/474923901.db2.gz RJHUGLSTOWPMJH-LLVKDONJSA-N 0 3 338.383 2.928 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)CCN(C)Cc1occc1C ZINC000292289393 474943128 /nfs/dbraw/zinc/94/31/28/474943128.db2.gz MBFOBJZVUSMOII-UHFFFAOYSA-N 0 3 347.371 2.965 20 5 EFBDHN CN1CC[C@]2(CCN(c3cc(Br)ccc3[N+](=O)[O-])C2)C1 ZINC000292304833 474949845 /nfs/dbraw/zinc/94/98/45/474949845.db2.gz NYRRKRCFWIRPOL-AWEZNQCLSA-N 0 3 340.221 2.889 20 5 EFBDHN CNC(=O)[C@H]1CCC[C@H]1NCc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339125412 474952799 /nfs/dbraw/zinc/95/27/99/474952799.db2.gz VJWGUTJUSSMBKK-WCQYABFASA-N 0 3 345.321 2.618 20 5 EFBDHN C[C@@H](NC[C@@H](O)CCc1ccccc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000285270455 474952765 /nfs/dbraw/zinc/95/27/65/474952765.db2.gz QTBIUMNAYDGHIU-CJNGLKHVSA-N 0 3 329.400 2.821 20 5 EFBDHN C[C@H]1CN(Cc2ccccc2)CCN(c2ccc(N)c([N+](=O)[O-])n2)C1 ZINC000323978858 474959375 /nfs/dbraw/zinc/95/93/75/474959375.db2.gz DKCBBUOPGLZSJF-AWEZNQCLSA-N 0 3 341.415 2.530 20 5 EFBDHN CS[C@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2C)C[C@H]1N1CCCC1 ZINC000273549653 474959464 /nfs/dbraw/zinc/95/94/64/474959464.db2.gz VFVDPABRXALRPE-CVEARBPZSA-N 0 3 349.456 2.555 20 5 EFBDHN COCc1ccc(CN2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc1 ZINC000339133153 474964467 /nfs/dbraw/zinc/96/44/67/474964467.db2.gz UMGVDCKDXQHKER-UHFFFAOYSA-N 0 3 330.388 2.775 20 5 EFBDHN C[C@@H]1C[C@@H](N(C)c2ncc([N+](=O)[O-])cn2)CCN1Cc1ccccc1 ZINC000273590471 474978741 /nfs/dbraw/zinc/97/87/41/474978741.db2.gz HFOIUFPBBMVILM-ZBFHGGJFSA-N 0 3 341.415 2.874 20 5 EFBDHN Cc1cc(C(=O)N2CCN(C3CCC3)C[C@H](C)C2)cc([N+](=O)[O-])c1 ZINC000292378695 474992255 /nfs/dbraw/zinc/99/22/55/474992255.db2.gz MTYZIUGLUNTRIV-AWEZNQCLSA-N 0 3 331.416 2.850 20 5 EFBDHN Cc1ccc([C@H](CNc2ncc([N+](=O)[O-])cn2)N2CCCC2)cc1 ZINC000273617123 474992697 /nfs/dbraw/zinc/99/26/97/474992697.db2.gz NSBBKYSLMFLMKH-INIZCTEOSA-N 0 3 327.388 2.942 20 5 EFBDHN O=[N+]([O-])c1cnc(NCC2CCN(Cc3cccs3)CC2)nc1 ZINC000273627532 474995931 /nfs/dbraw/zinc/99/59/31/474995931.db2.gz PUMKAQPORRAQTL-UHFFFAOYSA-N 0 3 333.417 2.770 20 5 EFBDHN CCN1CCC[C@@H]1CNC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000279846611 474996106 /nfs/dbraw/zinc/99/61/06/474996106.db2.gz DBCJYRVAZLECNE-LLVKDONJSA-N 0 3 343.786 2.530 20 5 EFBDHN Cc1c(C(=O)NC[C@H]2NCCc3ccccc32)cccc1[N+](=O)[O-] ZINC000261624995 475001943 /nfs/dbraw/zinc/00/19/43/475001943.db2.gz GPOZBLRLPAQRPI-MRXNPFEDSA-N 0 3 325.368 2.520 20 5 EFBDHN CN1CC[C@]2(CCN(c3cc(C(F)(F)F)ncc3[N+](=O)[O-])C2)C1 ZINC000292417098 475015244 /nfs/dbraw/zinc/01/52/44/475015244.db2.gz WEVYDPNREKVYGF-ZDUSSCGKSA-N 0 3 330.310 2.541 20 5 EFBDHN COCCN1CC[C@H](Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000328513553 475030676 /nfs/dbraw/zinc/03/06/76/475030676.db2.gz ORGUEAJHAFKQJF-NSHDSACASA-N 0 3 333.310 2.746 20 5 EFBDHN CCOc1cc(CN2C[C@@H](C)[C@](C)(C(=O)OC)C2)ccc1[N+](=O)[O-] ZINC000337479059 475054104 /nfs/dbraw/zinc/05/41/04/475054104.db2.gz ZTBJPMMFHANZKA-SJKOYZFVSA-N 0 3 336.388 2.625 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCN2CCNC[C@@H]2c2cccc(F)c2)c1 ZINC000261764306 475055464 /nfs/dbraw/zinc/05/54/64/475055464.db2.gz OJDXXZZNEUWJOU-GOSISDBHSA-N 0 3 345.374 2.759 20 5 EFBDHN CCN(CC)[C@H](CNC(=O)c1ccc([N+](=O)[O-])n1C)c1ccccc1 ZINC000345292772 475066066 /nfs/dbraw/zinc/06/60/66/475066066.db2.gz ILSCGZYVMGORNX-MRXNPFEDSA-N 0 3 344.415 2.746 20 5 EFBDHN C[C@@H](NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)C1=CCN(C)CC1 ZINC000273863869 475089556 /nfs/dbraw/zinc/08/95/56/475089556.db2.gz OLBPDGLKIWZXKZ-GFCCVEGCSA-N 0 3 349.406 2.778 20 5 EFBDHN COC[C@H](O)CN[C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000268965112 475099022 /nfs/dbraw/zinc/09/90/22/475099022.db2.gz YOIHUTNWXSIGJV-NWDGAFQWSA-N 0 3 336.413 2.981 20 5 EFBDHN CCN1CCCC[C@H]1CNc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000281221196 475121825 /nfs/dbraw/zinc/12/18/25/475121825.db2.gz RFJCNJPAKZNPOT-LBPRGKRZSA-N 0 3 331.376 2.530 20 5 EFBDHN Cc1ccc([C@H](O)CN[C@@H](C)CC(=O)Nc2cccc([N+](=O)[O-])c2)o1 ZINC000269003466 475122891 /nfs/dbraw/zinc/12/28/91/475122891.db2.gz PURIXINPNRWBQL-XHDPSFHLSA-N 0 3 347.371 2.537 20 5 EFBDHN Cc1ccc([C@@H](O)CN[C@H](C)CC(=O)Nc2cccc([N+](=O)[O-])c2)o1 ZINC000269003463 475122932 /nfs/dbraw/zinc/12/29/32/475122932.db2.gz PURIXINPNRWBQL-ABAIWWIYSA-N 0 3 347.371 2.537 20 5 EFBDHN C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)NC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000292625667 475123000 /nfs/dbraw/zinc/12/30/00/475123000.db2.gz OUUQBJLGPZLJMH-WFASDCNBSA-N 0 3 346.431 2.612 20 5 EFBDHN O=[N+]([O-])c1cccc(Cl)c1N1CCC(CN2CCOCC2)CC1 ZINC000292636745 475127511 /nfs/dbraw/zinc/12/75/11/475127511.db2.gz YPKGPLSSDNUDDN-UHFFFAOYSA-N 0 3 339.823 2.797 20 5 EFBDHN CSc1ccc([C@@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]2)N(C)C)cc1 ZINC000341569662 475154317 /nfs/dbraw/zinc/15/43/17/475154317.db2.gz XDGDWFXYXQRIQA-OAHLLOKOSA-N 0 3 348.428 2.678 20 5 EFBDHN CC[C@H]1CN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CCCO1 ZINC000281334133 475175306 /nfs/dbraw/zinc/17/53/06/475175306.db2.gz JMPOIACFSNKDFG-ZDUSSCGKSA-N 0 3 339.367 2.563 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CN2CCC[C@@H](c3ccncc3)C2)c1 ZINC000296089786 475192272 /nfs/dbraw/zinc/19/22/72/475192272.db2.gz WLXWDKUDODYRFS-AEFFLSMTSA-N 0 3 327.384 2.903 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CN2CCC[C@H](c3ccncc3)C2)c1 ZINC000296089795 475192390 /nfs/dbraw/zinc/19/23/90/475192390.db2.gz WLXWDKUDODYRFS-WMZOPIPTSA-N 0 3 327.384 2.903 20 5 EFBDHN CN1CCC[C@@]2(CCN(c3cc(C(F)(F)F)ncc3[N+](=O)[O-])C2)C1 ZINC000292796304 475200151 /nfs/dbraw/zinc/20/01/51/475200151.db2.gz MZFSIXLNKDSTMN-CQSZACIVSA-N 0 3 344.337 2.931 20 5 EFBDHN CCn1cc([C@H](C)NCCC(=O)Nc2cc([N+](=O)[O-])ccc2F)cn1 ZINC000296116938 475201714 /nfs/dbraw/zinc/20/17/14/475201714.db2.gz QTBUUILCTJLVQZ-NSHDSACASA-N 0 3 349.366 2.630 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@]2(C1)CCCN(C)C2 ZINC000296127597 475204966 /nfs/dbraw/zinc/20/49/66/475204966.db2.gz IQTNFEHZOUGOIN-KRWDZBQOSA-N 0 3 348.403 2.553 20 5 EFBDHN COc1cc([C@H](C)NCCn2cc([N+](=O)[O-])cn2)ccc1OC(C)C ZINC000341653852 475207900 /nfs/dbraw/zinc/20/79/00/475207900.db2.gz FGXFIKGJXXRHPA-ZDUSSCGKSA-N 0 3 348.403 2.938 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCN(CC2CC2)C1 ZINC000609382414 480154556 /nfs/dbraw/zinc/15/45/56/480154556.db2.gz AWSBIALNBKPBQA-GXTWGEPZSA-N 0 3 349.456 2.676 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCN(C2CC2)C1 ZINC000361159167 475232311 /nfs/dbraw/zinc/23/23/11/475232311.db2.gz ISGMEYZDVBPDNU-GJZGRUSLSA-N 0 3 331.416 2.516 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCN(CC2CC2)C1 ZINC000609382421 480155152 /nfs/dbraw/zinc/15/51/52/480155152.db2.gz AWSBIALNBKPBQA-JSGCOSHPSA-N 0 3 349.456 2.676 20 5 EFBDHN COc1ccc2c(c1)CCN(C[C@@H](O)c1cccc([N+](=O)[O-])c1)CC2 ZINC000361176615 475246303 /nfs/dbraw/zinc/24/63/03/475246303.db2.gz FLTSHPZOVYIXNT-LJQANCHMSA-N 0 3 342.395 2.738 20 5 EFBDHN CCO[C@@H]1C[C@H](N(C)CCn2ccc([N+](=O)[O-])n2)C12CCCCC2 ZINC000357904925 475249446 /nfs/dbraw/zinc/24/94/46/475249446.db2.gz BNQVIFRCBQOIQY-LSDHHAIUSA-N 0 3 336.436 2.851 20 5 EFBDHN COCCOC[C@@H]1CCN(C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000347354035 475258723 /nfs/dbraw/zinc/25/87/23/475258723.db2.gz HZKWQGPTNQFGFK-IUYQLWOBSA-N 0 3 334.416 2.983 20 5 EFBDHN COc1c(C(=O)NC[C@@H](C)N2CCCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000354566219 475259322 /nfs/dbraw/zinc/25/93/22/475259322.db2.gz LLQCALJGIUYRPB-QWHCGFSZSA-N 0 3 335.404 2.596 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)C[C@H]1CCCN(C)C1 ZINC000361202553 475265469 /nfs/dbraw/zinc/26/54/69/475265469.db2.gz QKDVYFVQTZPUCC-DLBZAZTESA-N 0 3 347.459 2.964 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC[C@]2(CNC(=O)C2)C1 ZINC000347367815 475271639 /nfs/dbraw/zinc/27/16/39/475271639.db2.gz MSSFVIMAYXHZCY-PIJNTSGSSA-N 0 3 329.400 2.600 20 5 EFBDHN NC(=O)C[C@@H](NC/C=C/c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000339529947 475277366 /nfs/dbraw/zinc/27/73/66/475277366.db2.gz FDNGKSCDXZDXJK-VGZDNEPHSA-N 0 3 325.368 2.814 20 5 EFBDHN CN(CCNc1ncnc2cccc([N+](=O)[O-])c21)Cc1ccccc1 ZINC000347403406 475300813 /nfs/dbraw/zinc/30/08/13/475300813.db2.gz UUPIVOTWTSNXDI-UHFFFAOYSA-N 0 3 337.383 2.504 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CN2CC3(CCOCC3)[C@H]2C2CC2)c1 ZINC000296421809 475307849 /nfs/dbraw/zinc/30/78/49/475307849.db2.gz XZTRWWSUIXYQOL-DLBZAZTESA-N 0 3 332.400 2.519 20 5 EFBDHN Cc1c(CNC(=O)[C@H]2CCCN2C2CCCC2)cccc1[N+](=O)[O-] ZINC000331634508 475358308 /nfs/dbraw/zinc/35/83/08/475358308.db2.gz QTLKWOYVCSBUSF-QGZVFWFLSA-N 0 3 331.416 2.926 20 5 EFBDHN C[C@H](NC(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000296590055 475385505 /nfs/dbraw/zinc/38/55/05/475385505.db2.gz WZBMFWCTCNKYEH-MBNYWOFBSA-N 0 3 332.404 2.580 20 5 EFBDHN C[C@@H]1C[C@@H](NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)CCN1C ZINC000358094057 475394574 /nfs/dbraw/zinc/39/45/74/475394574.db2.gz MVYTYFPOESNGMY-NEPJUHHUSA-N 0 3 337.395 2.610 20 5 EFBDHN Cc1ccccc1OC[C@H](O)CN(C)CCc1ccccc1[N+](=O)[O-] ZINC000352543297 475397843 /nfs/dbraw/zinc/39/78/43/475397843.db2.gz COTZJBTUYIIKEV-QGZVFWFLSA-N 0 3 344.411 2.817 20 5 EFBDHN O=[N+]([O-])c1ccccc1C[C@@H](NCc1nnc(C2CC2)[nH]1)C1CC1 ZINC000296628760 475402173 /nfs/dbraw/zinc/40/21/73/475402173.db2.gz XHGBWLDRILOZEH-CQSZACIVSA-N 0 3 327.388 2.701 20 5 EFBDHN O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]Cc1nnc(C2CC2)[n-]1)C1CC1 ZINC000296628760 475402190 /nfs/dbraw/zinc/40/21/90/475402190.db2.gz XHGBWLDRILOZEH-CQSZACIVSA-N 0 3 327.388 2.701 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H](C)N1CCCC[C@H]1C ZINC000348116482 475402816 /nfs/dbraw/zinc/40/28/16/475402816.db2.gz JZWIFBNEQXWELS-ZIAGYGMSSA-N 0 3 349.431 2.986 20 5 EFBDHN C[C@@H]1[C@H](NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)CCCN1C ZINC000345756436 475424081 /nfs/dbraw/zinc/42/40/81/475424081.db2.gz SLEWFQXVEVGIIG-IUODEOHRSA-N 0 3 334.420 2.612 20 5 EFBDHN C[C@H]1[C@H](NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)CCCN1C ZINC000345756438 475425117 /nfs/dbraw/zinc/42/51/17/475425117.db2.gz SLEWFQXVEVGIIG-SWLSCSKDSA-N 0 3 334.420 2.612 20 5 EFBDHN C[C@@H]1[C@H](NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)CCCN1C ZINC000345763172 475429431 /nfs/dbraw/zinc/42/94/31/475429431.db2.gz XJBLDGLVTDSOAY-CXAGYDPISA-N 0 3 346.431 2.752 20 5 EFBDHN C[C@H]1[C@@H](NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)CCCN1C ZINC000345763174 475429530 /nfs/dbraw/zinc/42/95/30/475429530.db2.gz XJBLDGLVTDSOAY-GUYCJALGSA-N 0 3 346.431 2.752 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)ccc1CN[C@@H](C1CC1)[C@]1(CO)CCCO1 ZINC000339768247 475484412 /nfs/dbraw/zinc/48/44/12/475484412.db2.gz VDIWVHBHXFZFIX-JKSUJKDBSA-N 0 3 340.807 2.658 20 5 EFBDHN CNC(=O)[C@@H]1CCC[C@H]1NCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000345828290 475488144 /nfs/dbraw/zinc/48/81/44/475488144.db2.gz IYIWRSIVVMEIRC-UKRRQHHQSA-N 0 3 343.383 2.859 20 5 EFBDHN COc1cc(C(=O)NC[C@@H](C)N2CCCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000337999755 475494662 /nfs/dbraw/zinc/49/46/62/475494662.db2.gz LDKKEASVESTYGB-CHWSQXEVSA-N 0 3 335.404 2.596 20 5 EFBDHN CCOc1cccc(N2CCC(OCCN(C)C)CC2)c1[N+](=O)[O-] ZINC000358263044 475539499 /nfs/dbraw/zinc/53/94/99/475539499.db2.gz ZSDSWTRFJKJNMW-UHFFFAOYSA-N 0 3 337.420 2.541 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21 ZINC000332184052 475546993 /nfs/dbraw/zinc/54/69/93/475546993.db2.gz ATXJKJVFTFAMPI-ZBFHGGJFSA-N 0 3 331.416 2.768 20 5 EFBDHN O=C(CN(CC1CC1)C1CCC1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000361572238 475559242 /nfs/dbraw/zinc/55/92/42/475559242.db2.gz RGJVKDJNFZZWFL-UHFFFAOYSA-N 0 3 347.371 2.527 20 5 EFBDHN CCN1CCC(N(C)C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CC1 ZINC000332208224 475559584 /nfs/dbraw/zinc/55/95/84/475559584.db2.gz JDBQWZBDNQMDNQ-UHFFFAOYSA-N 0 3 330.388 2.632 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@H]2CCOC[C@H]2OCC)cc1[N+](=O)[O-] ZINC000354968423 475566989 /nfs/dbraw/zinc/56/69/89/475566989.db2.gz AIGXEPQBBPYCTB-RVSPLBMKSA-N 0 3 338.404 2.838 20 5 EFBDHN Cc1nc(N(C)C[C@@H]2CCN(Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000296996285 475568845 /nfs/dbraw/zinc/56/88/45/475568845.db2.gz FRGZECGRODPHIN-INIZCTEOSA-N 0 3 341.415 2.652 20 5 EFBDHN COC(=O)[C@@H]1CSCCN([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000332258414 475577509 /nfs/dbraw/zinc/57/75/09/475577509.db2.gz ZZQDZDRCTWRTHQ-STQMWFEESA-N 0 3 338.429 2.802 20 5 EFBDHN CC(C)c1ccc(CN2CCO[C@@H]3CCN(C)C[C@H]32)cc1[N+](=O)[O-] ZINC000332320512 475599363 /nfs/dbraw/zinc/59/93/63/475599363.db2.gz RFLFLQZZCZOJGR-QZTJIDSGSA-N 0 3 333.432 2.623 20 5 EFBDHN C[C@@H]1CSC[C@@H]1NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000352789289 475627929 /nfs/dbraw/zinc/62/79/29/475627929.db2.gz BQUVZMPWGYCBCK-PELKAZGASA-N 0 3 329.809 2.528 20 5 EFBDHN C[C@H]1CSC[C@@H]1NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000352803192 475639844 /nfs/dbraw/zinc/63/98/44/475639844.db2.gz XXMXRRRQTVLQGD-KWQFWETISA-N 0 3 329.809 2.528 20 5 EFBDHN COc1cc(CN2C[C@H]3CCCCN3C[C@@H]2C)c([N+](=O)[O-])cc1F ZINC000332524395 475658870 /nfs/dbraw/zinc/65/88/70/475658870.db2.gz RBMSBONXKLFTSK-GXTWGEPZSA-N 0 3 337.395 2.801 20 5 EFBDHN CN1CC[C@@H]2[C@H](CCCN2C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C1 ZINC000342954405 475661338 /nfs/dbraw/zinc/66/13/38/475661338.db2.gz BSKQZGCOKSBVTR-IUODEOHRSA-N 0 3 342.399 2.632 20 5 EFBDHN CCCN1CCC[C@@H]1CNCc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000353125429 475700656 /nfs/dbraw/zinc/70/06/56/475700656.db2.gz LCFOPABOALTNMR-CQSZACIVSA-N 0 3 337.420 2.576 20 5 EFBDHN CC(C)(C)[C@@H]1NC(=O)CC[C@H]1NC/C=C\c1ccccc1[N+](=O)[O-] ZINC000353147431 475719351 /nfs/dbraw/zinc/71/93/51/475719351.db2.gz YQXSVXLKEORFMY-WLTZEOLESA-N 0 3 331.416 2.891 20 5 EFBDHN CC(C)(C(=O)N1CC[C@@H](N2CCCCC2)C1)c1ccccc1[N+](=O)[O-] ZINC000340055313 475720477 /nfs/dbraw/zinc/72/04/77/475720477.db2.gz VLYYXQRZYDRFOK-OAHLLOKOSA-N 0 3 345.443 2.959 20 5 EFBDHN C[C@H](N[C@H]1CCC[C@@H]1OC(F)F)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000348521498 475721393 /nfs/dbraw/zinc/72/13/93/475721393.db2.gz QIIXKFLQXCINPG-GAFUQQFSSA-N 0 3 343.330 2.672 20 5 EFBDHN COc1cc(C(=O)NC[C@@H](C)N2CCCC[C@@H]2C)cc([N+](=O)[O-])c1C ZINC000358499787 475728003 /nfs/dbraw/zinc/72/80/03/475728003.db2.gz UAYSVNYTWBBRMR-QWHCGFSZSA-N 0 3 349.431 2.905 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN[C@H]3CCC[C@H]3OC(F)F)nc2c1 ZINC000348540235 475739876 /nfs/dbraw/zinc/73/98/76/475739876.db2.gz UYPDZYIIVKNBCV-CMPLNLGQSA-N 0 3 326.303 2.721 20 5 EFBDHN C[C@H](CNC(=O)NCCc1ccc([N+](=O)[O-])cc1)N1CCCC[C@H]1C ZINC000338304513 475764993 /nfs/dbraw/zinc/76/49/93/475764993.db2.gz OYFONNBVPLSBNS-HUUCEWRRSA-N 0 3 348.447 2.699 20 5 EFBDHN Cc1c(CNC(=O)NC[C@@H](C)N2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000358557180 475770026 /nfs/dbraw/zinc/77/00/26/475770026.db2.gz KEBUEKSPXWFUIF-ZIAGYGMSSA-N 0 3 348.447 2.823 20 5 EFBDHN C[C@H](NC(=O)N(C)[C@@H]1CCN(C)C[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000297544075 475801064 /nfs/dbraw/zinc/80/10/64/475801064.db2.gz JCZOLLYUXZDMGR-HEHGZKQESA-N 0 3 334.420 2.637 20 5 EFBDHN Cc1ccc([C@@H](C)NCCC(=O)Nc2cccnc2)cc1[N+](=O)[O-] ZINC000361860506 475816963 /nfs/dbraw/zinc/81/69/63/475816963.db2.gz MVARVWIOIDTFSL-CYBMUJFWSA-N 0 3 328.372 2.978 20 5 EFBDHN CC(C)CN(CCN(C)C)C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000355334019 475837837 /nfs/dbraw/zinc/83/78/37/475837837.db2.gz KQYOFYLAPJXTKH-UHFFFAOYSA-N 0 3 327.812 2.908 20 5 EFBDHN CC(C)N1CCCN(C(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000297655604 475846350 /nfs/dbraw/zinc/84/63/50/475846350.db2.gz ODKZXXQELWQTQW-AWEZNQCLSA-N 0 3 334.420 2.782 20 5 EFBDHN CN(CCc1cccc([N+](=O)[O-])c1)Cc1ccc2c(c1)oc(=O)n2C ZINC000353359992 475898187 /nfs/dbraw/zinc/89/81/87/475898187.db2.gz DVHQDVUGOJPWTE-UHFFFAOYSA-N 0 3 341.367 2.714 20 5 EFBDHN COc1cc(CNCCc2nc(C)oc2C)c([N+](=O)[O-])cc1OC ZINC000346838263 475900378 /nfs/dbraw/zinc/90/03/78/475900378.db2.gz YLMCECLSUVKVKG-UHFFFAOYSA-N 0 3 335.360 2.549 20 5 EFBDHN Cc1cc(CN(C)C)cc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)c1 ZINC000340332846 475955063 /nfs/dbraw/zinc/95/50/63/475955063.db2.gz HELFCXKQPSDEGE-UHFFFAOYSA-N 0 3 346.362 2.938 20 5 EFBDHN O=C(N[C@@H]1CCN(CC2CCCC2)C1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000362060938 475970564 /nfs/dbraw/zinc/97/05/64/475970564.db2.gz QTKCYQILCRTSLQ-OAHLLOKOSA-N 0 3 335.379 2.728 20 5 EFBDHN C[C@H]1CCN(C)CCN1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000353456392 475984855 /nfs/dbraw/zinc/98/48/55/475984855.db2.gz VVHDRVREDBCHQU-AWEZNQCLSA-N 0 3 343.431 2.521 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NCCN2[C@H](C)CCC[C@H]2C)c1 ZINC000338535920 475991788 /nfs/dbraw/zinc/99/17/88/475991788.db2.gz LAPXWGRVVQORCS-ZIAGYGMSSA-N 0 3 349.431 2.986 20 5 EFBDHN CC(C)n1nccc1[C@H]1OCC[C@H]1NCc1ccc([N+](=O)[O-])cc1 ZINC000343406321 476034857 /nfs/dbraw/zinc/03/48/57/476034857.db2.gz UVIZLXMZRXUXPZ-WBVHZDCISA-N 0 3 330.388 2.992 20 5 EFBDHN CCn1ccnc1[C@@H]1OCC[C@H]1NC/C=C\c1ccccc1[N+](=O)[O-] ZINC000343409026 476039392 /nfs/dbraw/zinc/03/93/92/476039392.db2.gz ZSNHXVJGPMBQHY-OZLAXVTRSA-N 0 3 342.399 2.944 20 5 EFBDHN CCCCN(C)CCN[C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000353519005 476040769 /nfs/dbraw/zinc/04/07/69/476040769.db2.gz LTRHOJUPUUUGNC-QGZVFWFLSA-N 0 3 345.447 2.739 20 5 EFBDHN C[C@@H]1[C@@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCCN1C ZINC000343425356 476053267 /nfs/dbraw/zinc/05/32/67/476053267.db2.gz YQCZJEDZQSTKNN-RNCFNFMXSA-N 0 3 345.321 2.826 20 5 EFBDHN CC[C@H](NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CCOCC1 ZINC000343431020 476058701 /nfs/dbraw/zinc/05/87/01/476058701.db2.gz QZKHLDYKVKPRPB-HNNXBMFYSA-N 0 3 346.387 2.940 20 5 EFBDHN COC(=O)COc1ccc(CN(C)[C@H](C)C2(C)CC2)cc1[N+](=O)[O-] ZINC000355754935 476058831 /nfs/dbraw/zinc/05/88/31/476058831.db2.gz ILZYSGPRIRJNIN-GFCCVEGCSA-N 0 3 336.388 2.767 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCCN(C)[C@@H]1C ZINC000343438778 476065656 /nfs/dbraw/zinc/06/56/56/476065656.db2.gz LOPVKZNEJNOOJE-RISCZKNCSA-N 0 3 337.445 2.919 20 5 EFBDHN C[C@@H]1[C@@H](Nc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CCCN1C ZINC000343451712 476073545 /nfs/dbraw/zinc/07/35/45/476073545.db2.gz GDIJWKNILMVXEB-HIFRSBDPSA-N 0 3 326.400 2.973 20 5 EFBDHN Cc1cc(NCCOCCN(C)C)c([N+](=O)[O-])cc1C(F)(F)F ZINC000338689195 476114167 /nfs/dbraw/zinc/11/41/67/476114167.db2.gz NYBGFYVSCPXEKL-UHFFFAOYSA-N 0 3 335.326 2.912 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@@H]2CCO[C@@]3(CCSC3)C2)c(F)c1 ZINC000350311729 476129792 /nfs/dbraw/zinc/12/97/92/476129792.db2.gz KCRIGXBFNJGKDO-DOMZBBRYSA-N 0 3 326.393 2.878 20 5 EFBDHN Cc1ccc(CNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000338717648 476130734 /nfs/dbraw/zinc/13/07/34/476130734.db2.gz YZYKPOFMBRAXOF-UHFFFAOYSA-N 0 3 337.383 2.989 20 5 EFBDHN Cc1ccc(CCCN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1 ZINC000353646090 476153277 /nfs/dbraw/zinc/15/32/77/476153277.db2.gz BSAFVMARJYASPQ-MRXNPFEDSA-N 0 3 341.415 2.812 20 5 EFBDHN Cc1cc(N2C[C@@H](C)N(C)[C@H](C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000338784461 476183242 /nfs/dbraw/zinc/18/32/42/476183242.db2.gz KAYRGOUHUSWMFL-ZIAGYGMSSA-N 0 3 341.415 2.889 20 5 EFBDHN COc1ccc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1C ZINC000353705502 476205046 /nfs/dbraw/zinc/20/50/46/476205046.db2.gz FRRDPRFAKKNCIF-OAHLLOKOSA-N 0 3 342.399 2.993 20 5 EFBDHN CN1CCCC(C)(C)[C@H]1CNC(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000347257590 476210520 /nfs/dbraw/zinc/21/05/20/476210520.db2.gz JOZOZZUQGLQLRB-CQSZACIVSA-N 0 3 338.383 2.976 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)CCN1C ZINC000340697209 476213209 /nfs/dbraw/zinc/21/32/09/476213209.db2.gz QBWREZPIOLSPDC-VHSXEESVSA-N 0 3 345.321 2.826 20 5 EFBDHN CN1CCC2(CCCN2C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000362386731 476213514 /nfs/dbraw/zinc/21/35/14/476213514.db2.gz VVYXXBMQFLPUPB-UHFFFAOYSA-N 0 3 337.807 2.949 20 5 EFBDHN C[C@@H](CNC(=O)Nc1cc(F)cc([N+](=O)[O-])c1)N1CCC[C@@H](C)C1 ZINC000347297915 476240551 /nfs/dbraw/zinc/24/05/51/476240551.db2.gz IDJCJRIANXJUGB-NEPJUHHUSA-N 0 3 338.383 2.976 20 5 EFBDHN CC(C)[C@@H]1CCCCN1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000303733082 476247185 /nfs/dbraw/zinc/24/71/85/476247185.db2.gz ZXDOBFSXQGHOMC-INIZCTEOSA-N 0 3 331.416 2.994 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CNCCO)o2)c(Br)c1 ZINC000304225909 476270722 /nfs/dbraw/zinc/27/07/22/476270722.db2.gz LAEFCQITBAORBY-UHFFFAOYSA-N 0 3 341.161 2.699 20 5 EFBDHN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCN1CCCC1 ZINC000357245728 476303485 /nfs/dbraw/zinc/30/34/85/476303485.db2.gz JISSCINDLQJYBK-UHFFFAOYSA-N 0 3 337.445 2.923 20 5 EFBDHN O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2NCc2cnn3ccccc23)n1 ZINC000353864434 476305391 /nfs/dbraw/zinc/30/53/91/476305391.db2.gz IZMZKMVHDGKHIK-GDBMZVCRSA-N 0 3 340.387 2.713 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)C1CCN(C)CC1 ZINC000360580244 476308357 /nfs/dbraw/zinc/30/83/57/476308357.db2.gz FQROBEIBUQOSBX-OAHLLOKOSA-N 0 3 333.432 2.716 20 5 EFBDHN COC(=O)[C@H]1CC12CCN(C/C=C\c1ccccc1[N+](=O)[O-])CC2 ZINC000353898720 476317278 /nfs/dbraw/zinc/31/72/78/476317278.db2.gz KRTPQYKWOCBYRA-ZDTYVGOBSA-N 0 3 330.384 2.883 20 5 EFBDHN COc1ccc(CNC(=O)c2ccccc2CN(C)C)cc1[N+](=O)[O-] ZINC000362586466 476319043 /nfs/dbraw/zinc/31/90/43/476319043.db2.gz HGMLMVDTGLNPRO-UHFFFAOYSA-N 0 3 343.383 2.595 20 5 EFBDHN CN(C)[C@H](CNc1ncnc2cccc([N+](=O)[O-])c21)c1ccccc1 ZINC000357336422 476336375 /nfs/dbraw/zinc/33/63/75/476336375.db2.gz MDLJDAUGRURDMK-MRXNPFEDSA-N 0 3 337.383 2.675 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCCN(C)[C@H]1C ZINC000360800575 476395942 /nfs/dbraw/zinc/39/59/42/476395942.db2.gz OFJKIOZRJCQXGS-YSVLISHTSA-N 0 3 333.432 2.762 20 5 EFBDHN CN(CCN(C)C1CC1)C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000354083311 476413083 /nfs/dbraw/zinc/41/30/83/476413083.db2.gz RGEASMABGXVHJD-UHFFFAOYSA-N 0 3 345.321 2.780 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@H]2CCN(C)C[C@@H]21 ZINC000360944823 476494382 /nfs/dbraw/zinc/49/43/82/476494382.db2.gz PENLEPBXHMMYCX-RYRKJORJSA-N 0 3 345.443 2.716 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCN(C3CCCC3)C2)c1 ZINC000374816438 476541182 /nfs/dbraw/zinc/54/11/82/476541182.db2.gz SABQTEFYQLVFLV-CYBMUJFWSA-N 0 3 347.415 2.740 20 5 EFBDHN CS[C@@H]1CN(c2cc([N+](=O)[O-])ccc2C(C)=O)C[C@H]1N1CCCC1 ZINC000361016495 476546154 /nfs/dbraw/zinc/54/61/54/476546154.db2.gz ZIYAMDSXHNAYKH-IAGOWNOFSA-N 0 3 349.456 2.813 20 5 EFBDHN O=[N+]([O-])c1ccccc1CNc1cccc(CN2CC[C@@H](O)C2)c1 ZINC000361043852 476562808 /nfs/dbraw/zinc/56/28/08/476562808.db2.gz IOYIMPZPVUYWGM-QGZVFWFLSA-N 0 3 327.384 2.774 20 5 EFBDHN C[C@H]1CCC[C@H](C)N(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000357735606 476567161 /nfs/dbraw/zinc/56/71/61/476567161.db2.gz YLXOMFAKZVJPOU-KBPBESRZSA-N 0 3 331.416 2.994 20 5 EFBDHN Cc1cc(N[C@H]2CCN(C)[C@@H](C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000361066824 476579981 /nfs/dbraw/zinc/57/99/81/476579981.db2.gz PVAHRXKBRAIUJV-ZFWWWQNUSA-N 0 3 341.415 2.677 20 5 EFBDHN O=[N+]([O-])c1ccc(CNc2cccc(CN3CC[C@H](O)C3)c2)c(F)c1 ZINC000361074111 476583642 /nfs/dbraw/zinc/58/36/42/476583642.db2.gz ARFPUERFXJLMOD-KRWDZBQOSA-N 0 3 345.374 2.913 20 5 EFBDHN O=[N+]([O-])c1cc(CNc2cccc(CN3CC[C@H](O)C3)c2)cs1 ZINC000361074545 476584067 /nfs/dbraw/zinc/58/40/67/476584067.db2.gz CFRWLYYVUMQMPH-HNNXBMFYSA-N 0 3 333.413 2.835 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCN([C@H]2CCCN(C)C2)CC1 ZINC000374916798 476592578 /nfs/dbraw/zinc/59/25/78/476592578.db2.gz PSVYAQXTUKIVEP-AEFFLSMTSA-N 0 3 346.475 2.676 20 5 EFBDHN C[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)CCN1C ZINC000361113566 476609606 /nfs/dbraw/zinc/60/96/06/476609606.db2.gz ZNZRZJSLUOIBOC-DZGCQCFKSA-N 0 3 346.431 2.725 20 5 EFBDHN CNc1c(C(=O)NC[C@H](c2ccccc2)N(C)C)cccc1[N+](=O)[O-] ZINC000361118705 476613278 /nfs/dbraw/zinc/61/32/78/476613278.db2.gz WPRHVCVUHVVLIB-MRXNPFEDSA-N 0 3 342.399 2.669 20 5 EFBDHN C[C@@H](C(=O)N1CCCC12CCN(C)CC2)c1ccc([N+](=O)[O-])cc1F ZINC000374968014 476615461 /nfs/dbraw/zinc/61/54/61/476615461.db2.gz GTADEHPFBMUTDD-CYBMUJFWSA-N 0 3 349.406 2.924 20 5 EFBDHN Cc1ccccc1[C@H]([C@@H](C)NC(=O)c1cc([N+](=O)[O-])c[nH]1)N(C)C ZINC000354379661 476623239 /nfs/dbraw/zinc/62/32/39/476623239.db2.gz BVXLRQXJTYRZHN-WBMJQRKESA-N 0 3 330.388 2.653 20 5 EFBDHN Cc1ccccc1[C@H]([C@H](C)NC(=O)c1ccc([N+](=O)[O-])[nH]1)N(C)C ZINC000354383860 476625213 /nfs/dbraw/zinc/62/52/13/476625213.db2.gz GZUWLICUZJLWKQ-LRDDRELGSA-N 0 3 330.388 2.653 20 5 EFBDHN COc1ccc(OCCN[C@@H](C)c2cncc(F)c2)c([N+](=O)[O-])c1 ZINC000361133646 476625919 /nfs/dbraw/zinc/62/59/19/476625919.db2.gz YSGADLHQAYQZIF-NSHDSACASA-N 0 3 335.335 2.867 20 5 EFBDHN CNc1c(C(=O)NCc2ccc(CN(C)C)cc2)cccc1[N+](=O)[O-] ZINC000361140709 476631399 /nfs/dbraw/zinc/63/13/99/476631399.db2.gz GSWAIAKLJDYYTK-UHFFFAOYSA-N 0 3 342.399 2.628 20 5 EFBDHN Cn1ccnc1[C@@H]1CCCN(CCOc2ccccc2[N+](=O)[O-])C1 ZINC000370063047 476653155 /nfs/dbraw/zinc/65/31/55/476653155.db2.gz OEOINPQUVZCSMT-CQSZACIVSA-N 0 3 330.388 2.587 20 5 EFBDHN O=[N+]([O-])c1cc(CNC2(C3CC3)CCOCC2)c2c(c1)COCO2 ZINC000375128236 476683754 /nfs/dbraw/zinc/68/37/54/476683754.db2.gz SLAZRNXKRGSPMG-UHFFFAOYSA-N 0 3 334.372 2.510 20 5 EFBDHN CC1CCN(CCNC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])CC1 ZINC000429837663 476699706 /nfs/dbraw/zinc/69/97/06/476699706.db2.gz MAMMHBFLPKFXQQ-UHFFFAOYSA-N 0 3 333.432 2.721 20 5 EFBDHN C[C@H]1CCCN(CCNC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])C1 ZINC000429844522 476702336 /nfs/dbraw/zinc/70/23/36/476702336.db2.gz VRIYMWWHWYBDAC-AWEZNQCLSA-N 0 3 333.432 2.721 20 5 EFBDHN COC(=O)[C@@H]1CCCC[C@]1(C)NCc1ccc([N+](=O)[O-])cc1OC ZINC000430199039 476779531 /nfs/dbraw/zinc/77/95/31/476779531.db2.gz AVTYLFINGRKMKL-YOEHRIQHSA-N 0 3 336.388 2.815 20 5 EFBDHN COc1cc(C(=O)Nc2ccc3c(c2)CNCC3)cc([N+](=O)[O-])c1C ZINC000422842254 476804569 /nfs/dbraw/zinc/80/45/69/476804569.db2.gz XTVPOAWSWRNXFV-UHFFFAOYSA-N 0 3 341.367 2.810 20 5 EFBDHN CC(C)N1CC[C@@H](N(C)C(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000457064163 476854417 /nfs/dbraw/zinc/85/44/17/476854417.db2.gz CFVPDBQASWJLKO-GFCCVEGCSA-N 0 3 325.796 2.803 20 5 EFBDHN C[C@H]1CN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)CCN(C2CC2)C1 ZINC000452171699 476867644 /nfs/dbraw/zinc/86/76/44/476867644.db2.gz LFRPRRCJNSIIDO-CQSZACIVSA-N 0 3 345.443 2.815 20 5 EFBDHN CC(C)N1CC[C@H](N(C)C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000457089286 476869710 /nfs/dbraw/zinc/86/97/10/476869710.db2.gz SYHJFAHHJRGNNH-HNNXBMFYSA-N 0 3 346.431 2.724 20 5 EFBDHN CC(C)N1CC[C@@H](N(C)C(=O)C(C)(C)c2ccccc2[N+](=O)[O-])C1 ZINC000457089206 476870282 /nfs/dbraw/zinc/87/02/82/476870282.db2.gz LCAGFMNLJPSUNN-CQSZACIVSA-N 0 3 333.432 2.814 20 5 EFBDHN CC(C)N1CC[C@@H](N(C)C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000457093758 476872127 /nfs/dbraw/zinc/87/21/27/476872127.db2.gz OFNLEBRWKSAKBG-OAHLLOKOSA-N 0 3 344.415 2.560 20 5 EFBDHN CC(C)N1CC[C@@H](N(C)C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C1 ZINC000457125263 476889446 /nfs/dbraw/zinc/88/94/46/476889446.db2.gz QJVFFEDHZRHXDJ-CYBMUJFWSA-N 0 3 330.388 2.631 20 5 EFBDHN COC(=O)c1cc(NC(=O)[C@@H](N)CC2CCCCC2)cc([N+](=O)[O-])c1 ZINC000423006832 476889642 /nfs/dbraw/zinc/88/96/42/476889642.db2.gz WOXNESVVFODLEX-HNNXBMFYSA-N 0 3 349.387 2.618 20 5 EFBDHN CC(C)C[C@@H](CN1CCCC1)NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000452340582 476923048 /nfs/dbraw/zinc/92/30/48/476923048.db2.gz CRGLOGOXMOOVTN-HNNXBMFYSA-N 0 3 349.431 2.600 20 5 EFBDHN CN(C)CC(C)(C)NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000457216715 476932081 /nfs/dbraw/zinc/93/20/81/476932081.db2.gz DNFCXWVROXRPPK-UHFFFAOYSA-N 0 3 345.852 2.797 20 5 EFBDHN CN(C)CC(C)(C)NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000457252069 476944652 /nfs/dbraw/zinc/94/46/52/476944652.db2.gz WBPRGHRETPOODO-UHFFFAOYSA-N 0 3 337.423 2.751 20 5 EFBDHN Cc1cc(N)cc(CN[C@@H](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000423489655 477045519 /nfs/dbraw/zinc/04/55/19/477045519.db2.gz WQZRTDQKDDVAOT-ZDUSSCGKSA-N 0 3 342.399 2.992 20 5 EFBDHN CN(C)[C@H](CC(=O)NCCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000416183903 477058973 /nfs/dbraw/zinc/05/89/73/477058973.db2.gz LWFMTNYYKTXXML-GOSISDBHSA-N 0 3 341.411 2.947 20 5 EFBDHN C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000375903508 477072470 /nfs/dbraw/zinc/07/24/70/477072470.db2.gz SFAOZMTZHICJBD-IAQYHMDHSA-N 0 3 337.807 2.947 20 5 EFBDHN C[C@H]1NCCN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])[C@@H]1C ZINC000423614954 477087707 /nfs/dbraw/zinc/08/77/07/477087707.db2.gz QRJBSRXIOBWRAZ-NXEZZACHSA-N 0 3 343.836 2.549 20 5 EFBDHN Cc1cc(OCC(=O)N[C@H](C)CN2CCC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000431834361 477103859 /nfs/dbraw/zinc/10/38/59/477103859.db2.gz RFCJERZFUANXLS-DZGCQCFKSA-N 0 3 349.431 2.519 20 5 EFBDHN O=C(N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)C12CCCN1CCC2 ZINC000452855771 477109358 /nfs/dbraw/zinc/10/93/58/477109358.db2.gz PPOKXJUOVKWUAI-MRXNPFEDSA-N 0 3 343.427 2.929 20 5 EFBDHN CN1CCCC(C)(C)[C@H]1CNC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000447988936 477111898 /nfs/dbraw/zinc/11/18/98/477111898.db2.gz IRKICPODEHTAHM-MRXNPFEDSA-N 0 3 348.447 2.557 20 5 EFBDHN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC1(N(C)C)CC1 ZINC000416308481 477118912 /nfs/dbraw/zinc/11/89/12/477118912.db2.gz RANLJMIUWSIDNA-UHFFFAOYSA-N 0 3 337.445 2.921 20 5 EFBDHN CCN1CCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000411218924 477156144 /nfs/dbraw/zinc/15/61/44/477156144.db2.gz ANQNAWZOAYVUQV-AWEZNQCLSA-N 0 3 335.404 2.596 20 5 EFBDHN CC1CCN(C[C@@H](O)CNc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000432315019 477193797 /nfs/dbraw/zinc/19/37/97/477193797.db2.gz SIDFCTHTAQBYLV-LBPRGKRZSA-N 0 3 327.812 2.753 20 5 EFBDHN Cc1c(CN2CCC[C@@H]2C[C@@H](O)c2cnn(C)c2)cccc1[N+](=O)[O-] ZINC000371333730 477251181 /nfs/dbraw/zinc/25/11/81/477251181.db2.gz BLMYACGLPVOVDG-SJLPKXTDSA-N 0 3 344.415 2.725 20 5 EFBDHN Cc1ccc(CN2CC[C@@H](N3CCN(C(C)C)CC3)C2)cc1[N+](=O)[O-] ZINC000371337964 477253079 /nfs/dbraw/zinc/25/30/79/477253079.db2.gz XNNGLSNCPRXWLW-GOSISDBHSA-N 0 3 346.475 2.504 20 5 EFBDHN C[C@H](CN1CCC[C@H](C)C1)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411604458 477290485 /nfs/dbraw/zinc/29/04/85/477290485.db2.gz NWEDQAKBLCGCNU-IHETXDGRSA-N 0 3 345.443 2.935 20 5 EFBDHN C[C@@H]1COCCN1CCN[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433168293 477314211 /nfs/dbraw/zinc/31/42/11/477314211.db2.gz MGIKHNCTDZULCR-DYVFJYSZSA-N 0 3 333.432 2.628 20 5 EFBDHN CC1(C)C[C@@H](NC[C@H]2CN(C3CC3)CCO2)c2cc([N+](=O)[O-])ccc21 ZINC000433228540 477319137 /nfs/dbraw/zinc/31/91/37/477319137.db2.gz BBIIYXMHAZECQQ-MAUKXSAKSA-N 0 3 345.443 2.770 20 5 EFBDHN CN(CCN1CCCC1)C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000448904547 477334340 /nfs/dbraw/zinc/33/43/40/477334340.db2.gz RIPBFOWCZSQWPX-UHFFFAOYSA-N 0 3 345.321 2.781 20 5 EFBDHN CCc1[nH]nc(C(=O)Nc2ccc(CN(C)C)c(C)c2)c1[N+](=O)[O-] ZINC000458284678 477334966 /nfs/dbraw/zinc/33/49/66/477334966.db2.gz NDFRNXLSTQGRFU-UHFFFAOYSA-N 0 3 331.376 2.503 20 5 EFBDHN Cc1ccc([C@H]2CCCN2CCn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC000367129283 477357446 /nfs/dbraw/zinc/35/74/46/477357446.db2.gz PBMLCCHXPWCQHZ-QGZVFWFLSA-N 0 3 327.384 2.902 20 5 EFBDHN CC(C)Oc1cc(C(=O)NC[C@@H](C)N(C)C2CC2)ccc1[N+](=O)[O-] ZINC000411968320 477400529 /nfs/dbraw/zinc/40/05/29/477400529.db2.gz FVRMAHOPNMPLHN-GFCCVEGCSA-N 0 3 335.404 2.595 20 5 EFBDHN C[C@@H](CNCc1ccccc1[N+](=O)[O-])c1ccc(S(C)(=O)=O)cc1 ZINC000449093205 477435214 /nfs/dbraw/zinc/43/52/14/477435214.db2.gz WQINKXSTBHWKAS-ZDUSSCGKSA-N 0 3 348.424 2.892 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])NCCS(=O)(=O)c1ccccc1 ZINC000449094420 477436788 /nfs/dbraw/zinc/43/67/88/477436788.db2.gz RUBOLGVRZNWCCM-CQSZACIVSA-N 0 3 348.424 2.589 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N[C@@H]1CC(=O)N(c2ccccc2)C1 ZINC000449108016 477441769 /nfs/dbraw/zinc/44/17/69/477441769.db2.gz RVJRQWJBBGFQPH-GOEBONIOSA-N 0 3 339.395 2.921 20 5 EFBDHN O=[N+]([O-])c1cnc(NCC2(N3CCCCC3)CCOCC2)c(F)c1 ZINC000413158288 477545499 /nfs/dbraw/zinc/54/54/99/477545499.db2.gz RNLXYCXKJUQNNN-UHFFFAOYSA-N 0 3 338.383 2.576 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CN2CCC(Cc3cccnc3)CC2)c1 ZINC000367520716 477556001 /nfs/dbraw/zinc/55/60/01/477556001.db2.gz RCNMMTQMATYWSC-IBGZPJMESA-N 0 3 341.411 2.978 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CCN1C ZINC000449942136 477575395 /nfs/dbraw/zinc/57/53/95/477575395.db2.gz RVYXYIHVGROIBC-GXSJLCMTSA-N 0 3 345.321 2.826 20 5 EFBDHN CN1C[C@@H]2CCCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4o3)[C@@H]2C1 ZINC000425060785 477622912 /nfs/dbraw/zinc/62/29/12/477622912.db2.gz XCRVLGOMSMIFSG-SMDDNHRTSA-N 0 3 329.356 2.507 20 5 EFBDHN CCN1CCC(N(C)C(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)CC1 ZINC000413329953 477631211 /nfs/dbraw/zinc/63/12/11/477631211.db2.gz QWJLJOGKYJELLL-UHFFFAOYSA-N 0 3 349.431 2.938 20 5 EFBDHN CC(C)C[C@@H](CN1CCCC1)Nc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000450595037 477647485 /nfs/dbraw/zinc/64/74/85/477647485.db2.gz QBRPGMQJKIYCGD-AWEZNQCLSA-N 0 3 334.420 2.616 20 5 EFBDHN Cc1cc([N+](=O)[O-])cc(Cl)c1NC[C@@H]1CCCN1CCCO ZINC000450594837 477647547 /nfs/dbraw/zinc/64/75/47/477647547.db2.gz LEWMUWXRSYGCHA-LBPRGKRZSA-N 0 3 327.812 2.815 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1N[C@H]1CCCN(CCCO)C1 ZINC000450615130 477655032 /nfs/dbraw/zinc/65/50/32/477655032.db2.gz OCTCPVAAYXRXHJ-LBPRGKRZSA-N 0 3 347.337 2.872 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1N[C@@H]1CCCN(CCCO)C1 ZINC000450615128 477655155 /nfs/dbraw/zinc/65/51/55/477655155.db2.gz OCTCPVAAYXRXHJ-GFCCVEGCSA-N 0 3 347.337 2.872 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@@H]2CCCN(CCCO)C2)cc1C(F)(F)F ZINC000450621880 477657841 /nfs/dbraw/zinc/65/78/41/477657841.db2.gz XZHONTROAISSDO-GFCCVEGCSA-N 0 3 347.337 2.872 20 5 EFBDHN Cc1cc(NCc2n[nH]c(C(C)(C)C)n2)c2cc([N+](=O)[O-])ccc2n1 ZINC000413402595 477663758 /nfs/dbraw/zinc/66/37/58/477663758.db2.gz BRXZAUGASCTGON-UHFFFAOYSA-N 0 3 340.387 2.901 20 5 EFBDHN C[C@H]1CN(Cc2ccccc2)CCN(c2ncccc2[N+](=O)[O-])C1 ZINC000450805120 477723599 /nfs/dbraw/zinc/72/35/99/477723599.db2.gz CKXKQCXDWCQMIT-HNNXBMFYSA-N 0 3 326.400 2.948 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)CN1C[C@H](C)C[C@H](C)C1 ZINC000426915780 477759296 /nfs/dbraw/zinc/75/92/96/477759296.db2.gz HIDSECLTVURSMD-HZSPNIEDSA-N 0 3 349.431 2.700 20 5 EFBDHN CCCN(CCN(C)C)C(=O)[C@H](CC)Cc1ccc([N+](=O)[O-])cc1 ZINC000462621439 477911996 /nfs/dbraw/zinc/91/19/96/477911996.db2.gz HUJLLIGGTLTXSG-MRXNPFEDSA-N 0 3 335.448 2.964 20 5 EFBDHN C[C@@H]1[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2)CCN1Cc1ccccc1 ZINC000494070148 477915329 /nfs/dbraw/zinc/91/53/29/477915329.db2.gz VGKSWBVMKXZVBB-KDOFPFPSSA-N 0 3 339.395 2.988 20 5 EFBDHN C[C@@H]1[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2)CCN1Cc1ccccc1 ZINC000494070150 477916183 /nfs/dbraw/zinc/91/61/83/477916183.db2.gz VGKSWBVMKXZVBB-RDTXWAMCSA-N 0 3 339.395 2.988 20 5 EFBDHN Cc1c([C@@H](C)NC[C@@H](O)COc2ccccc2)cccc1[N+](=O)[O-] ZINC000532453084 477930380 /nfs/dbraw/zinc/93/03/80/477930380.db2.gz URAMVSZFTFFMCN-HUUCEWRRSA-N 0 3 330.384 2.994 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN[C@H](c2ccccc2)C2(CO)CCCC2)c1 ZINC000459521653 477952417 /nfs/dbraw/zinc/95/24/17/477952417.db2.gz FNSQFOUBFGDAIB-QGZVFWFLSA-N 0 3 344.415 2.675 20 5 EFBDHN Cc1cccc(OC[C@H](O)CN(C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000516632377 477965553 /nfs/dbraw/zinc/96/55/53/477965553.db2.gz XWYGZRLOGIUCMF-GOSISDBHSA-N 0 3 344.411 2.817 20 5 EFBDHN COC(=O)c1ccc(CN(C)CCOc2cccc([N+](=O)[O-])c2)cc1 ZINC000532665606 477967254 /nfs/dbraw/zinc/96/72/54/477967254.db2.gz BLDZECXWYXVBEC-UHFFFAOYSA-N 0 3 344.367 2.892 20 5 EFBDHN C[C@@H]1C[C@H]1N1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000494375875 477973520 /nfs/dbraw/zinc/97/35/20/477973520.db2.gz RWLHADYJXPFMBE-WOSRLPQWSA-N 0 3 332.404 2.789 20 5 EFBDHN CN1CCC[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000559649489 477995087 /nfs/dbraw/zinc/99/50/87/477995087.db2.gz GHTUEFPMCIFRFY-SNVBAGLBSA-N 0 3 345.321 2.685 20 5 EFBDHN C[C@@H]1C[C@@H](NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)CCN1C ZINC000494543260 478006917 /nfs/dbraw/zinc/00/69/17/478006917.db2.gz AUMRIONKHJMOBE-HIFRSBDPSA-N 0 3 346.431 2.752 20 5 EFBDHN C[C@H]1CCCC[C@]1(C)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000459615497 478011338 /nfs/dbraw/zinc/01/13/38/478011338.db2.gz PDNNYINCHKCHNL-BBRMVZONSA-N 0 3 340.445 2.927 20 5 EFBDHN CC(C)CN1CCCC[C@@H]1CNC(=O)c1csc([N+](=O)[O-])c1 ZINC000439697017 478017580 /nfs/dbraw/zinc/01/75/80/478017580.db2.gz RQKZQTOFKRAGDW-CYBMUJFWSA-N 0 3 325.434 2.897 20 5 EFBDHN C[C@H]1C[C@H]1N1CCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@@H](C)C1 ZINC000428999572 478030083 /nfs/dbraw/zinc/03/00/83/478030083.db2.gz VDSPKHHVCBKGDJ-DVOMOZLQSA-N 0 3 344.415 2.898 20 5 EFBDHN C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000487517535 478039949 /nfs/dbraw/zinc/03/99/49/478039949.db2.gz OOEHUBYMGFLYJZ-BBRMVZONSA-N 0 3 342.399 2.563 20 5 EFBDHN CO[C@]1(C)C[C@H](NCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1(C)C ZINC000451483477 478043587 /nfs/dbraw/zinc/04/35/87/478043587.db2.gz FGXDDPWQKZVRAU-WMLDXEAASA-N 0 3 335.404 2.635 20 5 EFBDHN CO[C@H]1C[C@@H](NCC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC000451490467 478048140 /nfs/dbraw/zinc/04/81/40/478048140.db2.gz IBNDXISRDBHVHD-OLZOCXBDSA-N 0 3 341.795 2.590 20 5 EFBDHN CO[C@]1(C)C[C@@H](NCC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1(C)C ZINC000451499872 478054837 /nfs/dbraw/zinc/05/48/37/478054837.db2.gz XPGBQGVKGKPOGM-CXAGYDPISA-N 0 3 335.404 2.635 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC[C@@H](N2CCOCC2)C1 ZINC000517245061 478072807 /nfs/dbraw/zinc/07/28/07/478072807.db2.gz QQZIZCHLVISDRQ-NVXWUHKLSA-N 0 3 333.432 2.761 20 5 EFBDHN CC[C@@H]1OCC[C@H]1N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000459773909 478084385 /nfs/dbraw/zinc/08/43/85/478084385.db2.gz KVMQRBFACPKULY-FZQKWOKYSA-N 0 3 341.795 2.732 20 5 EFBDHN C[C@H](CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCCC1 ZINC000533478403 478086565 /nfs/dbraw/zinc/08/65/65/478086565.db2.gz MPVVDTLDZRLVFG-SNVBAGLBSA-N 0 3 345.321 2.828 20 5 EFBDHN CO[C@@H]1C[C@H](NCc2cc([N+](=O)[O-])cc3c2OCOC3)C12CCC2 ZINC000459793201 478096008 /nfs/dbraw/zinc/09/60/08/478096008.db2.gz TUVZOWWLCZFIAF-LSDHHAIUSA-N 0 3 334.372 2.509 20 5 EFBDHN CCOc1cc(CN[C@@H]2Cc3cccc(O)c3C2)ccc1[N+](=O)[O-] ZINC000429310638 478109434 /nfs/dbraw/zinc/10/94/34/478109434.db2.gz URRHTRMNBUNQTG-CQSZACIVSA-N 0 3 328.368 2.956 20 5 EFBDHN CCOc1ccc(C(=O)Nc2ccc3c(c2)CNCC3)cc1[N+](=O)[O-] ZINC000429316274 478110966 /nfs/dbraw/zinc/11/09/66/478110966.db2.gz VSGPVXXUTQUQTN-UHFFFAOYSA-N 0 3 341.367 2.892 20 5 EFBDHN COc1cc(CN[C@@H]([C@@H](CO)C2CC2)C2CC2)c([N+](=O)[O-])cc1F ZINC000451610349 478123109 /nfs/dbraw/zinc/12/31/09/478123109.db2.gz KFPVIPBJHLWMMM-SUMWQHHRSA-N 0 3 338.379 2.629 20 5 EFBDHN Cc1ccoc1CN(C)CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000429377915 478124744 /nfs/dbraw/zinc/12/47/44/478124744.db2.gz GEJRCTSRALXHEA-UHFFFAOYSA-N 0 3 345.355 2.926 20 5 EFBDHN C[C@H]1CN(C2CC2)C[C@@H]1Nc1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000534144694 478127928 /nfs/dbraw/zinc/12/79/28/478127928.db2.gz RIZROCYUNDSVHC-BBRMVZONSA-N 0 3 338.411 2.973 20 5 EFBDHN CCCN(CCN1CCCC1)C(=O)c1ccc(NC)c([N+](=O)[O-])c1 ZINC000561204828 478165013 /nfs/dbraw/zinc/16/50/13/478165013.db2.gz FFQVVYLFYHWLLH-UHFFFAOYSA-N 0 3 334.420 2.585 20 5 EFBDHN COc1cc(N2CCN([C@@H]3C[C@@H]3C)C[C@@H](C)C2)c(F)cc1[N+](=O)[O-] ZINC000488716346 478173751 /nfs/dbraw/zinc/17/37/51/478173751.db2.gz BTZMEGBHBKHMSU-MBNYWOFBSA-N 0 3 337.395 2.909 20 5 EFBDHN CC[C@H]1CN(CC)CCN1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000451727931 478179874 /nfs/dbraw/zinc/17/98/74/478179874.db2.gz CSVAPXCKNLTHCB-HNNXBMFYSA-N 0 3 348.447 2.648 20 5 EFBDHN CC(C)Oc1nc(N2CCN(C3CC3)C[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000518999972 478204496 /nfs/dbraw/zinc/20/44/96/478204496.db2.gz NYQHQSOVQRCMPP-CYBMUJFWSA-N 0 3 334.420 2.698 20 5 EFBDHN C[C@@H]1C[C@H]1N1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000561765878 478204413 /nfs/dbraw/zinc/20/44/13/478204413.db2.gz WRMJFZJIQCSFCN-HDMKZQKVSA-N 0 3 345.443 2.716 20 5 EFBDHN C[C@@H]1C[C@@H]1N1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000561765876 478204559 /nfs/dbraw/zinc/20/45/59/478204559.db2.gz WRMJFZJIQCSFCN-DAYGRLMNSA-N 0 3 345.443 2.716 20 5 EFBDHN CN(C)C[C@H]1CCCCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000519142383 478211925 /nfs/dbraw/zinc/21/19/25/478211925.db2.gz KVOTZVDNCPQGSR-CQSZACIVSA-N 0 3 331.372 2.897 20 5 EFBDHN CCOC(=O)N1CCC[C@H]([C@@H](C)NCc2ccccc2[N+](=O)[O-])C1 ZINC000495544973 478224945 /nfs/dbraw/zinc/22/49/45/478224945.db2.gz WHVAGIJZFOSNJP-HIFRSBDPSA-N 0 3 335.404 2.941 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N[C@H]2CCN(C3CC3)C2)cc1[N+](=O)[O-] ZINC000489540608 478255514 /nfs/dbraw/zinc/25/55/14/478255514.db2.gz IUUKYEJTRSRTQU-JSGCOSHPSA-N 0 3 332.404 2.500 20 5 EFBDHN O=[N+]([O-])c1ccc([C@H]2CCCN(CCOC[C@H]3CCCO3)C2)cc1 ZINC000562545297 478265772 /nfs/dbraw/zinc/26/57/72/478265772.db2.gz RVRRMOOHPGQACF-FUHWJXTLSA-N 0 3 334.416 2.970 20 5 EFBDHN C[C@H](NC(=O)N[C@@H]1CCCN2CCCC[C@H]12)c1cccc([N+](=O)[O-])c1 ZINC000594213264 478277747 /nfs/dbraw/zinc/27/77/47/478277747.db2.gz UCWXUFWEEJIMQI-IAOVAPTHSA-N 0 3 346.431 2.972 20 5 EFBDHN Cc1c(CNC(=O)N[C@@H]2CCCN3CCCC[C@H]23)cccc1[N+](=O)[O-] ZINC000594241861 478297082 /nfs/dbraw/zinc/29/70/82/478297082.db2.gz IQBNGYDCFQTKNT-NVXWUHKLSA-N 0 3 346.431 2.719 20 5 EFBDHN Cc1c(CNC(=O)N[C@@H]2CCCN3CCCC[C@@H]23)cccc1[N+](=O)[O-] ZINC000594241865 478297334 /nfs/dbraw/zinc/29/73/34/478297334.db2.gz IQBNGYDCFQTKNT-WBVHZDCISA-N 0 3 346.431 2.719 20 5 EFBDHN Cc1c(CNC(=O)N[C@H]2CCCN3CCCC[C@@H]23)cccc1[N+](=O)[O-] ZINC000594241863 478297529 /nfs/dbraw/zinc/29/75/29/478297529.db2.gz IQBNGYDCFQTKNT-RDJZCZTQSA-N 0 3 346.431 2.719 20 5 EFBDHN CN(C)CCOCCNC(=O)c1cc2ccccc2c2cccnc12 ZINC000537543423 478308452 /nfs/dbraw/zinc/30/84/52/478308452.db2.gz RSFXSDCMBIFEPZ-UHFFFAOYSA-N 0 3 337.423 2.696 20 5 EFBDHN O=C(NCCc1ccccc1[N+](=O)[O-])Nc1cccc2c1CCNC2 ZINC000520543161 478322526 /nfs/dbraw/zinc/32/25/26/478322526.db2.gz DPUIPBAAUFCNBY-UHFFFAOYSA-N 0 3 340.383 2.605 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@H]1CCc2nc(C)ncc2C1 ZINC000520952303 478355159 /nfs/dbraw/zinc/35/51/59/478355159.db2.gz NUDHJZUSGVVKCE-HNNXBMFYSA-N 0 3 342.399 2.739 20 5 EFBDHN O=C(N[C@H]1CCCN2CCCC[C@@H]12)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000594422339 478376874 /nfs/dbraw/zinc/37/68/74/478376874.db2.gz XVUPHKVOSUHIMN-RDJZCZTQSA-N 0 3 342.399 2.823 20 5 EFBDHN C[C@H](NC(=O)N1CC[C@@H](N2CCCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000590942712 478409410 /nfs/dbraw/zinc/40/94/10/478409410.db2.gz LTRZLPZIHRSBKB-XJKSGUPXSA-N 0 3 332.404 2.536 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2NC[C@@H](O)Cc1cccc(F)c1 ZINC000594505942 478415621 /nfs/dbraw/zinc/41/56/21/478415621.db2.gz FZLAAMXIQVVKTJ-YOEHRIQHSA-N 0 3 330.359 2.914 20 5 EFBDHN CS(=O)(=O)C1(CN[C@@H]2CCc3c2cccc3[N+](=O)[O-])CCCC1 ZINC000594518379 478423780 /nfs/dbraw/zinc/42/37/80/478423780.db2.gz GWUFOPCDAUNOJE-CQSZACIVSA-N 0 3 338.429 2.529 20 5 EFBDHN O=C(CCN1CCOCC12CCCC2)Nc1ccc([N+](=O)[O-])cc1 ZINC000591021889 478434652 /nfs/dbraw/zinc/43/46/52/478434652.db2.gz NPVBKMAOCGOONV-UHFFFAOYSA-N 0 3 333.388 2.568 20 5 EFBDHN C[C@H](N[C@@H]1CCCN2CCCC[C@@H]12)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000594554082 478434699 /nfs/dbraw/zinc/43/46/99/478434699.db2.gz KJRUPRDWGMYSPC-LZWOXQAQSA-N 0 3 346.431 2.528 20 5 EFBDHN C[C@H](N[C@H]1CCCN2CCCC[C@@H]12)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000594554155 478434757 /nfs/dbraw/zinc/43/47/57/478434757.db2.gz OFIGWQQKDJUMSN-JQFCIGGWSA-N 0 3 346.431 2.528 20 5 EFBDHN C[C@H](C(=O)N1CC[C@]2(C1)CCCN(C)C2)c1cccc([N+](=O)[O-])c1 ZINC000570750924 478435552 /nfs/dbraw/zinc/43/55/52/478435552.db2.gz XXFVGBOVVNOQKV-KBXCAEBGSA-N 0 3 331.416 2.643 20 5 EFBDHN C[C@H](C(=O)N1CC[C@@]2(C1)CCCN(C)C2)c1cccc([N+](=O)[O-])c1 ZINC000570750926 478435865 /nfs/dbraw/zinc/43/58/65/478435865.db2.gz XXFVGBOVVNOQKV-KSSFIOAISA-N 0 3 331.416 2.643 20 5 EFBDHN COC(=O)[C@]1(C)CCCN(CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000591054121 478444700 /nfs/dbraw/zinc/44/47/00/478444700.db2.gz RCLVCFKUBQHSRC-QGZVFWFLSA-N 0 3 336.388 2.639 20 5 EFBDHN CCOC(=O)c1ccnc(N[C@@H]2CCCN3CCCC[C@@H]23)c1[N+](=O)[O-] ZINC000594604041 478462021 /nfs/dbraw/zinc/46/20/21/478462021.db2.gz XCTKGUUZLAYVDH-KGLIPLIRSA-N 0 3 348.403 2.595 20 5 EFBDHN COC(=O)c1cc(C)nc(N[C@@H]2CCCN3CCCC[C@H]23)c1[N+](=O)[O-] ZINC000594603783 478462645 /nfs/dbraw/zinc/46/26/45/478462645.db2.gz VTRMBSLUVKXXTK-ZIAGYGMSSA-N 0 3 348.403 2.514 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC[C@]2(CCN(C)C2)C1 ZINC000597710530 478474365 /nfs/dbraw/zinc/47/43/65/478474365.db2.gz OVCXEQSBELSNFK-GOSISDBHSA-N 0 3 331.416 2.770 20 5 EFBDHN CN1CC[C@@]2(C1)CCCN(C(=O)c1c[nH]c3cccc([N+](=O)[O-])c13)C2 ZINC000597710120 478474712 /nfs/dbraw/zinc/47/47/12/478474712.db2.gz HEDLKLLZXZSLDR-GOSISDBHSA-N 0 3 342.399 2.634 20 5 EFBDHN CN1CC[C@]2(C1)CCCN(C(=O)c1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000597714141 478475404 /nfs/dbraw/zinc/47/54/04/478475404.db2.gz GTJIGMCIKWIRFC-INIZCTEOSA-N 0 3 337.807 2.806 20 5 EFBDHN CCc1ccc(C(=O)N2CCC[C@]3(CCN(C)C3)C2)cc1[N+](=O)[O-] ZINC000597713066 478475794 /nfs/dbraw/zinc/47/57/94/478475794.db2.gz BMNZULDXFBXZEX-GOSISDBHSA-N 0 3 331.416 2.715 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)ccc1-n1cc(CCN2CCCCC2)nn1 ZINC000594653499 478479833 /nfs/dbraw/zinc/47/98/33/478479833.db2.gz PCONNWNRNAWABK-UHFFFAOYSA-N 0 3 335.795 2.857 20 5 EFBDHN COC(=O)[C@H]1CCCC[C@]1(C)NCc1cc([N+](=O)[O-])ccc1OC ZINC000540577918 478481997 /nfs/dbraw/zinc/48/19/97/478481997.db2.gz WNFXLISCTOBIMB-PBHICJAKSA-N 0 3 336.388 2.815 20 5 EFBDHN CC(C)(C)[C@@H]1CCN(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000541393082 478555870 /nfs/dbraw/zinc/55/58/70/478555870.db2.gz MFPYJNFESHFOCV-CQSZACIVSA-N 0 3 331.416 2.852 20 5 EFBDHN Cc1ccc(CN2CC[C@@H](CN(C)c3ncc([N+](=O)[O-])cn3)C2)s1 ZINC000594873635 478570485 /nfs/dbraw/zinc/57/04/85/478570485.db2.gz DQOSZHPWWRVUIO-ZDUSSCGKSA-N 0 3 347.444 2.713 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CCCN(C)C2 ZINC000591533951 478576095 /nfs/dbraw/zinc/57/60/95/478576095.db2.gz ZSPWHTRXPAUDIQ-SFHVURJKSA-N 0 3 331.416 2.770 20 5 EFBDHN CC(C)(C)N1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000597923689 478578179 /nfs/dbraw/zinc/57/81/79/478578179.db2.gz OLWTTXNTIKZXBD-GFCCVEGCSA-N 0 3 342.399 2.746 20 5 EFBDHN CC(C)[C@H]1CCC[C@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000541741823 478584736 /nfs/dbraw/zinc/58/47/36/478584736.db2.gz ZDBVJGRJEDURSJ-HZPDHXFCSA-N 0 3 340.445 2.783 20 5 EFBDHN CN(CCCNC(=O)c1c(F)cccc1[N+](=O)[O-])Cc1ccccc1 ZINC000600966502 478589526 /nfs/dbraw/zinc/58/95/26/478589526.db2.gz OULROCGPDFZORC-UHFFFAOYSA-N 0 3 345.374 2.986 20 5 EFBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)[C@@H]1CNCCC1(F)F ZINC000591672882 478606198 /nfs/dbraw/zinc/60/61/98/478606198.db2.gz QIXCUWPSUNXIAX-AWEZNQCLSA-N 0 3 341.358 2.577 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@@H]2CSc3ccccc32)c1 ZINC000591740792 478617058 /nfs/dbraw/zinc/61/70/58/478617058.db2.gz HTXLWMIIOLBGLC-XJKSGUPXSA-N 0 3 346.408 2.771 20 5 EFBDHN CSc1cc(CNCCC(=O)Nc2ccccc2[N+](=O)[O-])ccn1 ZINC000591758206 478621365 /nfs/dbraw/zinc/62/13/65/478621365.db2.gz BUVMSFIYVFJNDY-UHFFFAOYSA-N 0 3 346.412 2.830 20 5 EFBDHN COC(=O)COc1ccc(CNC2(CC(C)C)CC2)cc1[N+](=O)[O-] ZINC000594999660 478624284 /nfs/dbraw/zinc/62/42/84/478624284.db2.gz FOJKRLVCPITTEE-UHFFFAOYSA-N 0 3 336.388 2.815 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NCCCOC[C@H]1CCCO1 ZINC000595003150 478625629 /nfs/dbraw/zinc/62/56/29/478625629.db2.gz FHEUHIIZXPMQOM-DZGCQCFKSA-N 0 3 338.404 2.840 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H]1CCC[C@H](C(=O)N(C)C)C1 ZINC000595007344 478627417 /nfs/dbraw/zinc/62/74/17/478627417.db2.gz HJVOKZCCQRWFON-MELADBBJSA-N 0 3 349.431 2.901 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC1CCN(CC(F)F)CC1 ZINC000595012936 478629933 /nfs/dbraw/zinc/62/99/33/478629933.db2.gz GCHZGTAOAMRDBZ-NSHDSACASA-N 0 3 343.374 2.984 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@@H](CO)Cc1ccco1 ZINC000595018404 478631014 /nfs/dbraw/zinc/63/10/14/478631014.db2.gz NNWWCUHZJNDOOA-OLZOCXBDSA-N 0 3 334.372 2.698 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NCCc1ccc(CO)cc1 ZINC000595026627 478632694 /nfs/dbraw/zinc/63/26/94/478632694.db2.gz NKLWYNGRXSBEOR-ZDUSSCGKSA-N 0 3 330.384 2.989 20 5 EFBDHN C[C@@H](C(=O)N[C@@H](C)CN1CCC[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000582580520 478633623 /nfs/dbraw/zinc/63/36/23/478633623.db2.gz LCGBUWULTMWGNJ-QLFBSQMISA-N 0 3 333.432 2.935 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)N[C@H](CO)Cc1ccc(F)cc1 ZINC000595036593 478637252 /nfs/dbraw/zinc/63/72/52/478637252.db2.gz SMCGUIQBWJIGCZ-DOMZBBRYSA-N 0 3 348.374 2.997 20 5 EFBDHN CC1(C)CCN(CC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000582614985 478642780 /nfs/dbraw/zinc/64/27/80/478642780.db2.gz SQPGXBLCECANHA-UHFFFAOYSA-N 0 3 333.432 2.766 20 5 EFBDHN CCn1cc(CN[C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])nn1 ZINC000595068321 478649891 /nfs/dbraw/zinc/64/98/91/478649891.db2.gz JRFJKWZJKNGGPU-CJNGLKHVSA-N 0 3 329.404 2.707 20 5 EFBDHN COc1ccccc1C[C@@](C)(CO)NCc1ccc(C)c([N+](=O)[O-])c1 ZINC000601153161 478693201 /nfs/dbraw/zinc/69/32/01/478693201.db2.gz KLBIUQGCJTYCDS-IBGZPJMESA-N 0 3 344.411 2.995 20 5 EFBDHN CCOc1cc(CN(C)C2CCC(NC(C)=O)CC2)ccc1[N+](=O)[O-] ZINC000491832222 478701258 /nfs/dbraw/zinc/70/12/58/478701258.db2.gz ORJAYWFFXVMQLB-UHFFFAOYSA-N 0 3 349.431 2.873 20 5 EFBDHN O=C(N[C@@H]1CCN(C2CCCCC2)C1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000598218537 478710075 /nfs/dbraw/zinc/71/00/75/478710075.db2.gz HNSYNSQQHFXEFC-CQSZACIVSA-N 0 3 335.379 2.871 20 5 EFBDHN O=C(N[C@H]1CCN(C2CCCCC2)C1)c1ccc(F)cc1[N+](=O)[O-] ZINC000598220484 478712045 /nfs/dbraw/zinc/71/20/45/478712045.db2.gz PSWPRLPJLJMUNQ-ZDUSSCGKSA-N 0 3 335.379 2.871 20 5 EFBDHN CN(C[C@@H]1CCCN(C)C1)C(=O)/C=C\c1ccc(F)cc1[N+](=O)[O-] ZINC000491870983 478717447 /nfs/dbraw/zinc/71/74/47/478717447.db2.gz WQRMXQNVQIRNRO-FWPCIQOSSA-N 0 3 335.379 2.547 20 5 EFBDHN CC(C)N(CCc1nnn(C(C)(C)C)n1)Cc1ccc([N+](=O)[O-])cc1 ZINC000595296051 478720189 /nfs/dbraw/zinc/72/01/89/478720189.db2.gz WTEGJDPIFKNJQP-UHFFFAOYSA-N 0 3 346.435 2.789 20 5 EFBDHN COc1cc(C(=O)N[C@H](C)CN2CCC(C)CC2)cc([N+](=O)[O-])c1C ZINC000598260996 478730431 /nfs/dbraw/zinc/73/04/31/478730431.db2.gz CBPDBXITLPMGNI-CYBMUJFWSA-N 0 3 349.431 2.762 20 5 EFBDHN C[C@@H](CN1CCC(C)CC1)NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000598264745 478732268 /nfs/dbraw/zinc/73/22/68/478732268.db2.gz QLIWQMVKNDAIOR-ZDUSSCGKSA-N 0 3 344.415 2.926 20 5 EFBDHN C[C@H](CN1CCC(C)CC1)NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000598266409 478733080 /nfs/dbraw/zinc/73/30/80/478733080.db2.gz XNYBWSHXEOYWTB-CYBMUJFWSA-N 0 3 344.415 2.926 20 5 EFBDHN Cc1nn(C)c(N[C@@H]2CCN(Cc3ccc(C)cc3)C2)c1[N+](=O)[O-] ZINC000601250343 478746598 /nfs/dbraw/zinc/74/65/98/478746598.db2.gz LWUBBMDBZZPYDU-OAHLLOKOSA-N 0 3 329.404 2.632 20 5 EFBDHN O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCCN(c2ccncc2)CC1 ZINC000601251175 478747293 /nfs/dbraw/zinc/74/72/93/478747293.db2.gz SFXRSPZYNCUOMG-UHFFFAOYSA-N 0 3 341.371 2.734 20 5 EFBDHN CS[C@H]1CN(Cc2ccc(F)cc2[N+](=O)[O-])C[C@H]1N1CCCC1 ZINC000595433924 478779714 /nfs/dbraw/zinc/77/97/14/478779714.db2.gz WWYIIPNUAFYZHK-CVEARBPZSA-N 0 3 339.436 2.746 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C/CN[C@H](CO)Cc1ccc(F)cc1 ZINC000500229151 478790488 /nfs/dbraw/zinc/79/04/88/478790488.db2.gz NFEDVRRTHNVOGB-RCFWFJCLSA-N 0 3 330.359 2.940 20 5 EFBDHN CN(Cc1ccc(Br)cc1[N+](=O)[O-])C1CCOCC1 ZINC000564880542 478844727 /nfs/dbraw/zinc/84/47/27/478844727.db2.gz RBCUGGDOSAFJEC-UHFFFAOYSA-N 0 3 329.194 2.968 20 5 EFBDHN CC(C)[C@H](NCCOc1ccc([N+](=O)[O-])cc1)[C@H](O)C(F)(F)F ZINC000595485481 478814773 /nfs/dbraw/zinc/81/47/73/478814773.db2.gz SWRSGAQSYGVBAH-STQMWFEESA-N 0 3 336.310 2.511 20 5 EFBDHN CC(C)(C)[C@@H]1CCN(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000544189215 478815841 /nfs/dbraw/zinc/81/58/41/478815841.db2.gz FYUDKRLZAMKGLP-CQSZACIVSA-N 0 3 331.416 2.852 20 5 EFBDHN Cc1ccccc1[C@@H](CO)NCCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000583308682 478818152 /nfs/dbraw/zinc/81/81/52/478818152.db2.gz TVGXYMPRONZKMI-MRXNPFEDSA-N 0 3 343.383 2.555 20 5 EFBDHN O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2N[C@@H]2c3ccccc3C[C@@H]2O)n1 ZINC000564812393 478819384 /nfs/dbraw/zinc/81/93/84/478819384.db2.gz MMIMHHZOEAZJSV-MUQADHOPSA-N 0 3 342.399 2.523 20 5 EFBDHN C[C@H]1CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC2(CCCC2)O1 ZINC000592193403 478820953 /nfs/dbraw/zinc/82/09/53/478820953.db2.gz MLRWOYKRDLDQRL-AWEZNQCLSA-N 0 3 347.415 2.957 20 5 EFBDHN CC[C@@H]1C[C@@]1(NCCn1cc([N+](=O)[O-])ccc1=O)c1cccc(C)c1 ZINC000502590032 478824140 /nfs/dbraw/zinc/82/41/40/478824140.db2.gz BKNDJSXXBFTTKN-BEFAXECRSA-N 0 3 341.411 2.980 20 5 EFBDHN CC(C)[C@H]1CN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CCN1 ZINC000592247092 478840345 /nfs/dbraw/zinc/84/03/45/478840345.db2.gz RIEZITFHRWCCGK-CYBMUJFWSA-N 0 3 333.413 2.880 20 5 EFBDHN COc1cc(C(=O)Nc2cccc3c2CCNC3)cc([N+](=O)[O-])c1C ZINC000583625858 478899098 /nfs/dbraw/zinc/89/90/98/478899098.db2.gz PYKGVPKGLVKTSN-UHFFFAOYSA-N 0 3 341.367 2.810 20 5 EFBDHN CC(C)[C@@H]1CN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)CCN1 ZINC000598569203 478900483 /nfs/dbraw/zinc/90/04/83/478900483.db2.gz BPTVDCFVABKWEJ-HNNXBMFYSA-N 0 3 333.432 2.962 20 5 EFBDHN COc1cc(CN(C)C)ccc1NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000601620237 478911800 /nfs/dbraw/zinc/91/18/00/478911800.db2.gz IIGOAQABFQHNLG-UHFFFAOYSA-N 0 3 343.383 2.846 20 5 EFBDHN COC[C@H](NCCOc1cccc([N+](=O)[O-])c1)c1cccc(OC)c1 ZINC000595684914 478936409 /nfs/dbraw/zinc/93/64/09/478936409.db2.gz SEERCIPGLOMRFL-SFHVURJKSA-N 0 3 346.383 2.960 20 5 EFBDHN CCOC(=O)c1cc(N[C@H]2C[C@H](C)N(C3CC3)C2)ccc1[N+](=O)[O-] ZINC000583784956 478940208 /nfs/dbraw/zinc/94/02/08/478940208.db2.gz FHDXADKLTPIWFM-AAEUAGOBSA-N 0 3 333.388 2.809 20 5 EFBDHN C[C@@H](C1CCN(C)CC1)N(C)C(=O)/C=C/c1ccc(F)cc1[N+](=O)[O-] ZINC000492344331 478941308 /nfs/dbraw/zinc/94/13/08/478941308.db2.gz XIAFKAUWTRLWEO-IYNGYCSASA-N 0 3 349.406 2.936 20 5 EFBDHN Cc1cccc(OC[C@H](O)CN(C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511135478 478974771 /nfs/dbraw/zinc/97/47/71/478974771.db2.gz GNXQIRYIAXAHBC-QGZVFWFLSA-N 0 3 344.411 2.817 20 5 EFBDHN C[C@H](NC(=O)N1CC[C@]2(C1)CCCN(C)C2)c1cccc([N+](=O)[O-])c1 ZINC000583979099 478984059 /nfs/dbraw/zinc/98/40/59/478984059.db2.gz MFYZDHYWZMKKMR-KBXCAEBGSA-N 0 3 346.431 2.783 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C\CN1CCC[C@H](N2CCOCC2)CC1 ZINC000565373402 478992097 /nfs/dbraw/zinc/99/20/97/478992097.db2.gz VBCZCESZNTWYMC-CJISVDGZSA-N 0 3 345.443 2.795 20 5 EFBDHN O=C(CCN1CCC2(CCCC2=O)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000595809299 479011075 /nfs/dbraw/zinc/01/10/75/479011075.db2.gz ZQBOVTLJCZNLIQ-UHFFFAOYSA-N 0 3 345.399 2.759 20 5 EFBDHN CN1CC[C@]2(CCN(c3ncc([N+](=O)[O-])cc3C(F)(F)F)C2)C1 ZINC000584159657 479034093 /nfs/dbraw/zinc/03/40/93/479034093.db2.gz QAZJGBHNGAFRDE-ZDUSSCGKSA-N 0 3 330.310 2.541 20 5 EFBDHN CCCN(C(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)[C@H]1CCN(C)C1 ZINC000592828034 479063623 /nfs/dbraw/zinc/06/36/23/479063623.db2.gz ADLILAVYQJGXPD-JSGCOSHPSA-N 0 3 337.395 2.780 20 5 EFBDHN CCCN(C(=O)CCOc1cc(C)ccc1[N+](=O)[O-])[C@H]1CCN(C)C1 ZINC000592831472 479065196 /nfs/dbraw/zinc/06/51/96/479065196.db2.gz MVAVEEQHORMHOL-HNNXBMFYSA-N 0 3 349.431 2.615 20 5 EFBDHN O=c1[n-]ccc(NC2CC[NH+](Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000596056416 479111357 /nfs/dbraw/zinc/11/13/57/479111357.db2.gz ZDDQYJDYTLZMTG-UHFFFAOYSA-N 0 3 328.372 2.772 20 5 EFBDHN CN1CCC[C@H](CNC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C1 ZINC000547710550 479119381 /nfs/dbraw/zinc/11/93/81/479119381.db2.gz ABDQMNOTOKPPSU-CQSZACIVSA-N 0 3 349.434 2.753 20 5 EFBDHN CCN1CCN(CCNc2ccc(C(F)(F)F)c([N+](=O)[O-])c2)CC1 ZINC000596074569 479121864 /nfs/dbraw/zinc/12/18/64/479121864.db2.gz VMAOKFIFBWKHIV-UHFFFAOYSA-N 0 3 346.353 2.663 20 5 EFBDHN Cc1cc(NCCCN2CCC(O)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000596086575 479129612 /nfs/dbraw/zinc/12/96/12/479129612.db2.gz RQPOKIZKGZIHBV-UHFFFAOYSA-N 0 3 344.415 2.710 20 5 EFBDHN C[C@@](O)(CNCCc1ccc(Cl)cc1[N+](=O)[O-])C(F)(F)F ZINC000573795900 479144378 /nfs/dbraw/zinc/14/43/78/479144378.db2.gz SWCUPUDCCHWTKD-LLVKDONJSA-N 0 3 326.702 2.694 20 5 EFBDHN CC[C@@H]1CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](CC)CO1 ZINC000593056934 479148173 /nfs/dbraw/zinc/14/81/73/479148173.db2.gz BMGWDODWSQFXEK-GOEBONIOSA-N 0 3 335.404 2.813 20 5 EFBDHN CC[C@@H]1COC(C)(C)CN1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000593057647 479149014 /nfs/dbraw/zinc/14/90/14/479149014.db2.gz VHEAERDKZNLLGP-CQSZACIVSA-N 0 3 335.404 2.813 20 5 EFBDHN C[C@@H](N[C@@H]1CCO[C@H]1c1ccc(=O)[nH]c1)c1ccc([N+](=O)[O-])cc1 ZINC000599073542 479150880 /nfs/dbraw/zinc/15/08/80/479150880.db2.gz JDUGIWJRZGQLQR-JGFGOQIWSA-N 0 3 329.356 2.876 20 5 EFBDHN C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(c2cc[n-]c(=O)c2[N+](=O)[O-])C1 ZINC000596127281 479153133 /nfs/dbraw/zinc/15/31/33/479153133.db2.gz WKVKLVPWQGQYRU-KBPBESRZSA-N 0 3 334.420 2.786 20 5 EFBDHN C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2cc[n-]c(=O)c2[N+](=O)[O-])C1 ZINC000596127281 479153139 /nfs/dbraw/zinc/15/31/39/479153139.db2.gz WKVKLVPWQGQYRU-KBPBESRZSA-N 0 3 334.420 2.786 20 5 EFBDHN CN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cc[n-]c(=O)c1[N+](=O)[O-] ZINC000596144025 479161819 /nfs/dbraw/zinc/16/18/19/479161819.db2.gz ACNLSSSAJWGXIK-OAHLLOKOSA-N 0 3 342.399 2.654 20 5 EFBDHN CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc[n-]c(=O)c1[N+](=O)[O-] ZINC000596144025 479161823 /nfs/dbraw/zinc/16/18/23/479161823.db2.gz ACNLSSSAJWGXIK-OAHLLOKOSA-N 0 3 342.399 2.654 20 5 EFBDHN C[C@@H]1C[C@@H](Nc2cc[n-]c(=O)c2[N+](=O)[O-])C[N@@H+]1Cc1ccccc1 ZINC000596163376 479172250 /nfs/dbraw/zinc/17/22/50/479172250.db2.gz SNMGZPJCDOCIAU-TZMCWYRMSA-N 0 3 328.372 2.770 20 5 EFBDHN C[C@@H]1C[C@@H](Nc2cc[n-]c(=O)c2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000596163376 479172259 /nfs/dbraw/zinc/17/22/59/479172259.db2.gz SNMGZPJCDOCIAU-TZMCWYRMSA-N 0 3 328.372 2.770 20 5 EFBDHN COc1cc(NC2CCN([C@@H]3CCOC3)CC2)c([N+](=O)[O-])cc1C ZINC000596167474 479176122 /nfs/dbraw/zinc/17/61/22/479176122.db2.gz HXISZXUCBMAJSS-CQSZACIVSA-N 0 3 335.404 2.577 20 5 EFBDHN CN(C)[C@H](CC(=O)NCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000574022665 479196099 /nfs/dbraw/zinc/19/60/99/479196099.db2.gz SQSYUIPZPIVLFL-QGZVFWFLSA-N 0 3 327.384 2.904 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN(C)CCOC(C)(C)C ZINC000610859804 479211971 /nfs/dbraw/zinc/21/19/71/479211971.db2.gz MSZQOBBWOANBHK-UHFFFAOYSA-N 0 3 337.420 2.979 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1CN[C@H]1CCOC3(CCC3)C1)OCCO2 ZINC000610860093 479212321 /nfs/dbraw/zinc/21/23/21/479212321.db2.gz KDTZUSMHIPZILI-ZDUSSCGKSA-N 0 3 334.372 2.557 20 5 EFBDHN C[C@H](C(=O)N1C[C@@H](N2CCCC2)C[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000557118336 479257369 /nfs/dbraw/zinc/25/73/69/479257369.db2.gz YHCJSZLGQNHUJH-KEYYUXOJSA-N 0 3 331.416 2.784 20 5 EFBDHN Cc1c(Cn2cc(CNC3CCCCC3)nn2)cccc1[N+](=O)[O-] ZINC000603195308 479297601 /nfs/dbraw/zinc/29/76/01/479297601.db2.gz GDRLFQYENCXULV-UHFFFAOYSA-N 0 3 329.404 2.965 20 5 EFBDHN O=C(NCCc1cccc([N+](=O)[O-])c1)[C@@H]1CCCN1C1CCCC1 ZINC000611162590 479298416 /nfs/dbraw/zinc/29/84/16/479298416.db2.gz ATRNLYATZLOMLK-KRWDZBQOSA-N 0 3 331.416 2.661 20 5 EFBDHN COc1ccc(Cn2cc(CNC3CCCCC3)nn2)cc1[N+](=O)[O-] ZINC000603206278 479304302 /nfs/dbraw/zinc/30/43/02/479304302.db2.gz PFWKQLPSBIBOOT-UHFFFAOYSA-N 0 3 345.403 2.666 20 5 EFBDHN CC[C@@H](N)c1cn(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)nn1 ZINC000603231502 479313279 /nfs/dbraw/zinc/31/32/79/479313279.db2.gz QJTRMVOJFUCHGK-LLVKDONJSA-N 0 3 329.282 2.663 20 5 EFBDHN C[C@@H]1CC[C@H](C)N1CC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000611218322 479315018 /nfs/dbraw/zinc/31/50/18/479315018.db2.gz GIFKSCYCMHYHKI-OKILXGFUSA-N 0 3 331.416 2.959 20 5 EFBDHN CC(C)[C@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CCN1 ZINC000596501367 479318887 /nfs/dbraw/zinc/31/88/87/479318887.db2.gz NRPOXLFBBFEDBM-CYBMUJFWSA-N 0 3 326.784 2.710 20 5 EFBDHN COc1ccc(CN[C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cc1O ZINC000574633131 479320520 /nfs/dbraw/zinc/32/05/20/479320520.db2.gz DAKKRUYMCYVVAU-UONOGXRCSA-N 0 3 346.387 2.779 20 5 EFBDHN Cc1nn(CCN(C)Cc2ccccc2)c2ncc([N+](=O)[O-])cc12 ZINC000603323429 479345602 /nfs/dbraw/zinc/34/56/02/479345602.db2.gz BPWARIJPETYPDK-UHFFFAOYSA-N 0 3 325.372 2.780 20 5 EFBDHN O=[N+]([O-])c1ccsc1NC1CCN([C@@H]2CCCC[C@H]2O)CC1 ZINC000611413620 479371873 /nfs/dbraw/zinc/37/18/73/479371873.db2.gz IILGMQMRIXFYOS-TZMCWYRMSA-N 0 3 325.434 2.836 20 5 EFBDHN CN(C)C(=O)CCCNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602529115 479382944 /nfs/dbraw/zinc/38/29/44/479382944.db2.gz QJRNTNZXLCALPQ-UHFFFAOYSA-N 0 3 333.310 2.572 20 5 EFBDHN CC(C)N(C)CCNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602529094 479383296 /nfs/dbraw/zinc/38/32/96/479383296.db2.gz SVQBMXMHALQYTF-UHFFFAOYSA-N 0 3 336.255 2.849 20 5 EFBDHN Cc1ncc(CNC2CCN(c3ccc([N+](=O)[O-])nc3)CC2)s1 ZINC000602545937 479390827 /nfs/dbraw/zinc/39/08/27/479390827.db2.gz SINJMCHLMUJIOQ-UHFFFAOYSA-N 0 3 333.417 2.513 20 5 EFBDHN C[C@@](O)(CNCc1cc(Br)c([N+](=O)[O-])s1)C1CC1 ZINC000602546983 479391124 /nfs/dbraw/zinc/39/11/24/479391124.db2.gz VTMHHTKWBIUJHH-LLVKDONJSA-N 0 3 335.223 2.669 20 5 EFBDHN O=[N+]([O-])c1ccc(CCCCNCc2cc3c(cn2)OCCO3)cc1 ZINC000602558530 479396983 /nfs/dbraw/zinc/39/69/83/479396983.db2.gz CFUXUWUFJCTIPB-UHFFFAOYSA-N 0 3 343.383 2.874 20 5 EFBDHN C[C@@H](CC[S@](C)=O)NCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602569270 479402510 /nfs/dbraw/zinc/40/25/10/479402510.db2.gz OQKNLSLGCYRIDN-AUADJRAKSA-N 0 3 338.351 2.860 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000575171534 479414024 /nfs/dbraw/zinc/41/40/24/479414024.db2.gz BIHXMPBFXPICCO-CABCVRRESA-N 0 3 331.416 2.910 20 5 EFBDHN CC1(C)CCCN(CCNC(=O)Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000593656248 479414457 /nfs/dbraw/zinc/41/44/57/479414457.db2.gz DZNLNHDSUKCXIN-UHFFFAOYSA-N 0 3 337.395 2.515 20 5 EFBDHN CCN1C[C@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1=O ZINC000593684794 479422894 /nfs/dbraw/zinc/42/28/94/479422894.db2.gz AZUBTZAZEHNQBV-ZDUSSCGKSA-N 0 3 343.383 2.813 20 5 EFBDHN COc1ccc(-c2ccc(CN[C@@H](CO)CCF)o2)c([N+](=O)[O-])c1 ZINC000593690495 479424549 /nfs/dbraw/zinc/42/45/49/479424549.db2.gz ZYTOIAIKDFVJJK-LLVKDONJSA-N 0 3 338.335 2.674 20 5 EFBDHN CO[C@@]1(CNCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCOC1 ZINC000602616495 479425730 /nfs/dbraw/zinc/42/57/30/479425730.db2.gz JSRSAEDNZAKGBA-CYBMUJFWSA-N 0 3 334.294 2.509 20 5 EFBDHN CN(C[C@]1(O)CCN(Cc2ccccc2)C1)c1ccsc1[N+](=O)[O-] ZINC000614533694 479437473 /nfs/dbraw/zinc/43/74/73/479437473.db2.gz DMYRTCYTOXGMIR-QGZVFWFLSA-N 0 3 347.440 2.730 20 5 EFBDHN O=[N+]([O-])c1ccc2oc(CNC[C@H]3CCCCN3C3CC3)nc2c1 ZINC000602635477 479440233 /nfs/dbraw/zinc/44/02/33/479440233.db2.gz ZAGHVRAIUXAPSG-CQSZACIVSA-N 0 3 330.388 2.843 20 5 EFBDHN C[C@H](CCO)CCNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602670968 479463830 /nfs/dbraw/zinc/46/38/30/479463830.db2.gz GHDHUTZDDHZCEO-QMMMGPOBSA-N 0 3 337.239 2.917 20 5 EFBDHN CO[C@@H]1COCC[C@H]1CNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602674871 479469193 /nfs/dbraw/zinc/46/91/93/479469193.db2.gz GXMBPGMRWUUUFN-SMDDNHRTSA-N 0 3 348.321 2.755 20 5 EFBDHN CCCN1CC[C@@H](NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)C1 ZINC000596879489 479469596 /nfs/dbraw/zinc/46/95/96/479469596.db2.gz BJGMLEJHMYDMDM-OAHLLOKOSA-N 0 3 346.431 2.753 20 5 EFBDHN CCn1ccnc1[C@@H](C)NC1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602681675 479471648 /nfs/dbraw/zinc/47/16/48/479471648.db2.gz KKVKHJDAONYIOY-CYBMUJFWSA-N 0 3 344.419 2.526 20 5 EFBDHN Cc1ccc(CNC2CCN(c3ccc([N+](=O)[O-])nc3)CC2)nc1C ZINC000602690659 479477744 /nfs/dbraw/zinc/47/77/44/479477744.db2.gz LQHOOWOWIKRZDN-UHFFFAOYSA-N 0 3 341.415 2.760 20 5 EFBDHN CCN(C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)C1CCN(C)CC1 ZINC000599985303 479486769 /nfs/dbraw/zinc/48/67/69/479486769.db2.gz BVNCYEKAMBFXMX-UHFFFAOYSA-N 0 3 344.415 2.561 20 5 EFBDHN CCN(C(=O)c1ccc(SC)c([N+](=O)[O-])c1)C1CCN(C)CC1 ZINC000599985579 479487280 /nfs/dbraw/zinc/48/72/80/479487280.db2.gz GWVCGMCKQNMWRS-UHFFFAOYSA-N 0 3 337.445 2.873 20 5 EFBDHN CN(Cc1cc(Br)c([N+](=O)[O-])s1)C[C@@H]1CCCN1C ZINC000602701083 479487487 /nfs/dbraw/zinc/48/74/87/479487487.db2.gz ZWHYXYPSTJPZGJ-VIFPVBQESA-N 0 3 348.266 2.945 20 5 EFBDHN CCN(C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12)C1CCN(C)CC1 ZINC000599985818 479488037 /nfs/dbraw/zinc/48/80/37/479488037.db2.gz JYIVGXNGHASHRZ-UHFFFAOYSA-N 0 3 330.388 2.632 20 5 EFBDHN CCN(C(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)C1CCN(C)CC1 ZINC000599986193 479488437 /nfs/dbraw/zinc/48/84/37/479488437.db2.gz QEUGFLGXLSZYBG-LBPRGKRZSA-N 0 3 337.395 2.780 20 5 EFBDHN CCCN(CCN1CCCC1)Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000589187830 479494496 /nfs/dbraw/zinc/49/44/96/479494496.db2.gz YBVNFXZHXPHBQU-UHFFFAOYSA-N 0 3 349.431 2.674 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1CN[C@@H]1[C@@H]3Cc4ccccc4[C@@H]31)OCCO2 ZINC000589199354 479498660 /nfs/dbraw/zinc/49/86/60/479498660.db2.gz FPDHSHURWQXDTR-MDASCCDHSA-N 0 3 338.363 2.794 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1ccc(CC(N)=O)cc1 ZINC000589344851 479516914 /nfs/dbraw/zinc/51/69/14/479516914.db2.gz QUMWLDVCZQSWKX-ZDUSSCGKSA-N 0 3 327.384 2.782 20 5 EFBDHN Cc1c(CN2CCC[C@H]2CN2C[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000604467066 479521447 /nfs/dbraw/zinc/52/14/47/479521447.db2.gz VPQNELZEAKLEOA-DAYGRLMNSA-N 0 3 347.459 2.977 20 5 EFBDHN O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])[nH]1 ZINC000604472210 479522527 /nfs/dbraw/zinc/52/25/27/479522527.db2.gz MNPFTWDSMQAZSK-OAHLLOKOSA-N 0 3 342.399 2.565 20 5 EFBDHN Cn1ccnc1[C@@H]1CCN(CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000593967959 479524780 /nfs/dbraw/zinc/52/47/80/479524780.db2.gz CCVNQTVQQLHVFA-CQSZACIVSA-N 0 3 330.388 2.587 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN[C@H](CN2CCCCC2)c2ccccc2)n1 ZINC000611935379 479525352 /nfs/dbraw/zinc/52/53/52/479525352.db2.gz VNDYZQHVNJUUCD-QGZVFWFLSA-N 0 3 343.431 2.608 20 5 EFBDHN CC(C)(C)N1CCCN(C(=O)NCc2cccc([N+](=O)[O-])c2)CC1 ZINC000604505777 479529493 /nfs/dbraw/zinc/52/94/93/479529493.db2.gz LCKCWXAIMBDZPK-UHFFFAOYSA-N 0 3 334.420 2.611 20 5 EFBDHN Cc1cnc(OC2CCN(CCc3ccc([N+](=O)[O-])cc3)CC2)nc1 ZINC000594021159 479551380 /nfs/dbraw/zinc/55/13/80/479551380.db2.gz OIVNDJOUPLAGBZ-UHFFFAOYSA-N 0 3 342.399 2.779 20 5 EFBDHN CCc1csc(CC2CCN(CCn3cc([N+](=O)[O-])cn3)CC2)n1 ZINC000594020176 479551511 /nfs/dbraw/zinc/55/15/11/479551511.db2.gz WELZQDGEDFSTEJ-UHFFFAOYSA-N 0 3 349.460 2.765 20 5 EFBDHN CCC(C)(C)N1CCN([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000594020677 479551567 /nfs/dbraw/zinc/55/15/67/479551567.db2.gz KWKULJPMLPKUNX-AWEZNQCLSA-N 0 3 348.447 2.728 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2NC[C@H](O)COc1ccccc1 ZINC000576172093 479556677 /nfs/dbraw/zinc/55/66/77/479556677.db2.gz DBBXVXMFZPRJJU-GUYCJALGSA-N 0 3 328.368 2.612 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN1CCC(Nc2cccc(C)c2)CC1 ZINC000602793717 479557500 /nfs/dbraw/zinc/55/75/00/479557500.db2.gz JMLLMUFZJMWXMY-UHFFFAOYSA-N 0 3 343.431 2.985 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN1CCC[C@H](Nc2ccccc2)C1 ZINC000602794757 479558989 /nfs/dbraw/zinc/55/89/89/479558989.db2.gz JODXOSCWWQKQAV-INIZCTEOSA-N 0 3 329.404 2.676 20 5 EFBDHN CC[C@@H](NCCn1c(C)ncc1[N+](=O)[O-])c1ccc(OC)c(OC)c1 ZINC000602827420 479578776 /nfs/dbraw/zinc/57/87/76/479578776.db2.gz CKTGTFCALSBMOJ-CQSZACIVSA-N 0 3 348.403 2.858 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN[C@@H](c1cccs1)C(C)(C)CO ZINC000602828363 479578988 /nfs/dbraw/zinc/57/89/88/479578988.db2.gz GNTWVUJSYFTDMX-AWEZNQCLSA-N 0 3 338.433 2.511 20 5 EFBDHN COc1ccc([C@H](C)NCCn2c(C)ncc2[N+](=O)[O-])c(C)c1OC ZINC000602828216 479579292 /nfs/dbraw/zinc/57/92/92/479579292.db2.gz CWXZSEXTIYRTEW-LBPRGKRZSA-N 0 3 348.403 2.776 20 5 EFBDHN COc1ccc(NC(=O)N[C@H]2CCCN3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000594077862 479581791 /nfs/dbraw/zinc/58/17/91/479581791.db2.gz BAOFLUBHMMFOER-KBPBESRZSA-N 0 3 348.403 2.742 20 5 EFBDHN COC[C@@H](NCCn1c(C)ncc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000602833298 479583554 /nfs/dbraw/zinc/58/35/54/479583554.db2.gz NMJOPOVSIKRUBW-CQSZACIVSA-N 0 3 338.795 2.730 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN[C@H](c1ccccc1)C1(CO)CCC1 ZINC000602841924 479587774 /nfs/dbraw/zinc/58/77/74/479587774.db2.gz UNMOMLWCGQCXSX-QGZVFWFLSA-N 0 3 344.415 2.593 20 5 EFBDHN O=[N+]([O-])c1cccc(F)c1CN1CCCN(c2ccncc2)CC1 ZINC000602846529 479590522 /nfs/dbraw/zinc/59/05/22/479590522.db2.gz RABVMLFIXIULOB-UHFFFAOYSA-N 0 3 330.363 2.841 20 5 EFBDHN CC1=Nc2ccccc2C12CCN(CCn1ccc([N+](=O)[O-])n1)CC2 ZINC000602867563 479601050 /nfs/dbraw/zinc/60/10/50/479601050.db2.gz ZZOXTBYOSSEZOR-UHFFFAOYSA-N 0 3 339.399 2.931 20 5 EFBDHN C[C@@H]1C[C@H](CCNCc2cc3c(cc2[N+](=O)[O-])OCCO3)CCO1 ZINC000612201775 479609828 /nfs/dbraw/zinc/60/98/28/479609828.db2.gz XUSPMJNWHLFQQL-CHWSQXEVSA-N 0 3 336.388 2.661 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CN3CCC(O)(CO)CC3)s2)cc1 ZINC000597204679 479619677 /nfs/dbraw/zinc/61/96/77/479619677.db2.gz CVTDMYDYCBTMNO-UHFFFAOYSA-N 0 3 348.424 2.643 20 5 EFBDHN COC(=O)[C@H]1C[C@@H](NCc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000597217565 479626413 /nfs/dbraw/zinc/62/64/13/479626413.db2.gz GJUNPCPPWPKZOH-TXEJJXNPSA-N 0 3 330.340 2.896 20 5 EFBDHN O=C(CCNc1ccccc1[N+](=O)[O-])N[C@H]1CCCN2CCCC[C@H]12 ZINC000594204034 479631831 /nfs/dbraw/zinc/63/18/31/479631831.db2.gz WMONILSEJXTTID-JKSUJKDBSA-N 0 3 346.431 2.530 20 5 EFBDHN CN(Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1(CO)CCOCC1 ZINC000597252227 479645340 /nfs/dbraw/zinc/64/53/40/479645340.db2.gz PNOULPZKLWXXNF-UHFFFAOYSA-N 0 3 346.383 2.828 20 5 EFBDHN COc1ccc(-c2ccc(CN(C)C3(CO)CC3)o2)c([N+](=O)[O-])c1 ZINC000597254268 479646405 /nfs/dbraw/zinc/64/64/05/479646405.db2.gz HYGHWYLWIQODPI-UHFFFAOYSA-N 0 3 332.356 2.820 20 5 EFBDHN CC1(C)C[C@H](NCCOC[C@H]2CCOC2)c2cc([N+](=O)[O-])ccc21 ZINC000618984304 479659092 /nfs/dbraw/zinc/65/90/92/479659092.db2.gz ZSXUGZNJZQGOHQ-GUYCJALGSA-N 0 3 334.416 2.960 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CNCC1(C(=O)OC)CCCC1 ZINC000612403836 479665674 /nfs/dbraw/zinc/66/56/74/479665674.db2.gz GEQSVFUGNXBSSQ-UHFFFAOYSA-N 0 3 336.388 2.817 20 5 EFBDHN CC(C)(CO)[C@@H](NCCc1ccc([N+](=O)[O-])cc1)c1cccnc1 ZINC000590601154 479667236 /nfs/dbraw/zinc/66/72/36/479667236.db2.gz OURWFJMYTJYVJS-KRWDZBQOSA-N 0 3 329.400 2.882 20 5 EFBDHN CN1CCC2(CCCN2C(=O)Nc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000612616226 479712209 /nfs/dbraw/zinc/71/22/09/479712209.db2.gz KFWDQQNOSLAVGY-UHFFFAOYSA-N 0 3 336.367 2.826 20 5 EFBDHN CN1CCCC(C)(C)[C@H]1CNCc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000619198272 479714673 /nfs/dbraw/zinc/71/46/73/479714673.db2.gz QGHFBHSHMZMXOP-QGZVFWFLSA-N 0 3 349.431 2.576 20 5 EFBDHN CC(C)(NC(=O)[C@@H](C1CC1)N1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000612652836 479723443 /nfs/dbraw/zinc/72/34/43/479723443.db2.gz WINUYIIEKSPSLR-MRXNPFEDSA-N 0 3 331.416 2.821 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCC(F)(F)CC1 ZINC000619516103 479816368 /nfs/dbraw/zinc/81/63/68/479816368.db2.gz MECHJCSGZXPCPW-UHFFFAOYSA-N 0 3 343.330 2.663 20 5 EFBDHN Cc1c(NC(=O)CCN2CCC(F)(F)CC2)cccc1[N+](=O)[O-] ZINC000619515905 479816454 /nfs/dbraw/zinc/81/64/54/479816454.db2.gz VSBXOHJQFMLVBY-UHFFFAOYSA-N 0 3 327.331 2.963 20 5 EFBDHN CN1CCC[C@@H](CNc2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)C1 ZINC000619527188 479818037 /nfs/dbraw/zinc/81/80/37/479818037.db2.gz TVUVXTBTYGPMFC-ZDUSSCGKSA-N 0 3 344.390 2.972 20 5 EFBDHN CC[C@@H]1CN(C)CCCN1C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000619567060 479829612 /nfs/dbraw/zinc/82/96/12/479829612.db2.gz MIKOHKIRDHRGEJ-GFCCVEGCSA-N 0 3 330.388 2.632 20 5 EFBDHN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@@H]1CCN(CC2CC2)C1 ZINC000616121612 479830417 /nfs/dbraw/zinc/83/04/17/479830417.db2.gz PNNIOQAXTWRTOT-CQSZACIVSA-N 0 3 332.404 2.817 20 5 EFBDHN CC[C@@H]1CN(C)CCCN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000619567137 479830755 /nfs/dbraw/zinc/83/07/55/479830755.db2.gz UPFGUTQNVOSLIO-CYBMUJFWSA-N 0 3 330.388 2.632 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCC12CCCN1CCC2 ZINC000619574182 479832010 /nfs/dbraw/zinc/83/20/10/479832010.db2.gz YLMGEXROURLZLC-CYBMUJFWSA-N 0 3 349.456 2.820 20 5 EFBDHN CC[C@@H](CN1CCCC1)NC(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000616254651 479862765 /nfs/dbraw/zinc/86/27/65/479862765.db2.gz FCEZPYMTVXYWDT-HNNXBMFYSA-N 0 3 334.420 2.577 20 5 EFBDHN C[C@](CO)(NCCCOc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000609537125 480170553 /nfs/dbraw/zinc/17/05/53/480170553.db2.gz JDNPVYSOQMZZAF-GOSISDBHSA-N 0 3 330.384 2.861 20 5 EFBDHN O=C1[C@@H](NCCc2ccc([N+](=O)[O-])cc2)CCN1c1ccccc1F ZINC000609571888 480178031 /nfs/dbraw/zinc/17/80/31/480178031.db2.gz KTWGYILYCZVZAT-INIZCTEOSA-N 0 3 343.358 2.672 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCCN(C(C)(C)C)CC1 ZINC000617350396 480178881 /nfs/dbraw/zinc/17/88/81/480178881.db2.gz WVUVYVYAHNLOLN-UHFFFAOYSA-N 0 3 335.404 2.550 20 5 EFBDHN Cc1cc(OC[C@H](O)CN(C)Cc2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000614066798 480179962 /nfs/dbraw/zinc/17/99/62/480179962.db2.gz PRAAEFIGXDDZJY-OAHLLOKOSA-N 0 3 348.374 2.914 20 5 EFBDHN CC[C@H]1CCCCN1CCNC(=O)c1ccc(NC)c([N+](=O)[O-])c1 ZINC000609594387 480184058 /nfs/dbraw/zinc/18/40/58/480184058.db2.gz OCJQLTYZKVRIIV-AWEZNQCLSA-N 0 3 334.420 2.631 20 5 EFBDHN C[C@H](O)CN(CCOc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000610161207 480245868 /nfs/dbraw/zinc/24/58/68/480245868.db2.gz PFROJPSWGMGQIG-HNNXBMFYSA-N 0 3 330.384 2.857 20 5 EFBDHN Cn1cncc1CCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000614284896 480255916 /nfs/dbraw/zinc/25/59/16/480255916.db2.gz CXKBMFSKSDXRMQ-UHFFFAOYSA-N 0 3 343.412 2.784 20 5 EFBDHN CN(Cc1ccc(C(C)(C)C)cc1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000610335362 480282342 /nfs/dbraw/zinc/28/23/42/480282342.db2.gz QNGUFVSLRBGFII-KRWDZBQOSA-N 0 3 346.431 2.582 20 5 EFBDHN CCn1cnnc1CCNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000610658098 480356458 /nfs/dbraw/zinc/35/64/58/480356458.db2.gz BIRKHWGQCFCIPB-UHFFFAOYSA-N 0 3 341.371 2.799 20 5 EFBDHN C[C@@H](CNC(=O)Nc1ccncc1[N+](=O)[O-])N(C)Cc1ccccc1 ZINC000183594261 534000071 /nfs/dbraw/zinc/00/00/71/534000071.db2.gz GPNVGPUMXZBKRV-ZDUSSCGKSA-N 0 3 343.387 2.632 20 5 EFBDHN COc1ccc(NC(=O)CCN[C@H](C)c2cccnc2)c([N+](=O)[O-])c1 ZINC000182883370 534069958 /nfs/dbraw/zinc/06/99/58/534069958.db2.gz XXTXNSSEOIYCSY-GFCCVEGCSA-N 0 3 344.371 2.678 20 5 EFBDHN CC(C)[C@@H]1CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCS1 ZINC000072836408 519804328 /nfs/dbraw/zinc/80/43/28/519804328.db2.gz IPSLVKPBTAYKPF-HNNXBMFYSA-N 0 3 337.445 2.997 20 5 EFBDHN CCN(CCNc1ncc([N+](=O)[O-])c(C)c1Br)C1CC1 ZINC000230581424 521084457 /nfs/dbraw/zinc/08/44/57/521084457.db2.gz GZWXVVZFGLMAMG-UHFFFAOYSA-N 0 3 343.225 2.957 20 5 EFBDHN CC[C@@H](c1ccncc1)N(C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000245689108 523122062 /nfs/dbraw/zinc/12/20/62/523122062.db2.gz LKCUHNIOPXXCAN-AEFFLSMTSA-N 0 3 345.399 2.813 20 5 EFBDHN CC[C@@H]1CCCC[C@@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000120515070 523198725 /nfs/dbraw/zinc/19/87/25/523198725.db2.gz CFZFTMOXEPFPJM-CJNGLKHVSA-N 0 3 340.445 2.927 20 5 EFBDHN Cc1ccc(CN(CCN(C)C)C(=O)Cc2ccccc2[N+](=O)[O-])o1 ZINC000060407586 524406413 /nfs/dbraw/zinc/40/64/13/524406413.db2.gz VMOVCAQYKZAGGT-UHFFFAOYSA-N 0 3 345.399 2.629 20 5 EFBDHN Cc1ccc(CN2CCC[C@@H]2CN2C[C@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000245553195 524449196 /nfs/dbraw/zinc/44/91/96/524449196.db2.gz FCZKDNSMOWYYEC-XYJFISCASA-N 0 3 347.459 2.977 20 5 EFBDHN C[C@@H]1CCN(CCOc2ccc([N+](=O)[O-])cc2)C[C@H]1n1ccnc1 ZINC000245608562 524506530 /nfs/dbraw/zinc/50/65/30/524506530.db2.gz NPUJQBVMCJZASI-RHSMWYFYSA-N 0 3 330.388 2.753 20 5 EFBDHN C[C@H](NC(=O)N1CC[C@@H](N2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000066186117 525036400 /nfs/dbraw/zinc/03/64/00/525036400.db2.gz CVOPWZZWFSIVKD-XJKSGUPXSA-N 0 3 332.404 2.536 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)NCc1cccc(CN(C)C)c1 ZINC000067161930 526073339 /nfs/dbraw/zinc/07/33/39/526073339.db2.gz YNPYLNONVQHURQ-UHFFFAOYSA-N 0 3 327.384 2.895 20 5 EFBDHN O=C(NC[C@H]1CCN(Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000193813481 526613585 /nfs/dbraw/zinc/61/35/85/526613585.db2.gz XOCOOENTTYFUSK-MRXNPFEDSA-N 0 3 339.395 2.847 20 5 EFBDHN Cn1c(CCNCc2cccc([N+](=O)[O-])c2)nc2cc(F)ccc21 ZINC000076894260 527050900 /nfs/dbraw/zinc/05/09/00/527050900.db2.gz YFNOSTNYYPZPGC-UHFFFAOYSA-N 0 3 328.347 2.953 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCCN2CCC[C@@H](c3cc[nH]n3)C2)cc1 ZINC000193624087 527371467 /nfs/dbraw/zinc/37/14/67/527371467.db2.gz YVKMBOUVTBQLCL-CQSZACIVSA-N 0 3 330.388 2.966 20 5 EFBDHN Cn1cccc1[C@@H]1CCCN1C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000193280107 527405884 /nfs/dbraw/zinc/40/58/84/527405884.db2.gz OTZKATLGKXCUDX-YJBOKZPZSA-N 0 3 345.399 2.510 20 5 EFBDHN Cc1nn(C)c(NC[C@H]2CCN(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000192958265 527678804 /nfs/dbraw/zinc/67/88/04/527678804.db2.gz GNJDVHGTSMLYQY-OAHLLOKOSA-N 0 3 329.404 2.571 20 5 EFBDHN CC(C)Oc1cc(C(=O)N(C)C[C@H]2CCCN2C)ccc1[N+](=O)[O-] ZINC000421710300 534941798 /nfs/dbraw/zinc/94/17/98/534941798.db2.gz JVIJWRRGKFJYMD-CQSZACIVSA-N 0 3 335.404 2.548 20 5 EFBDHN CC(C)Oc1cc(C(=O)N[C@@H]2CCCN(C)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000412252836 534950112 /nfs/dbraw/zinc/95/01/12/534950112.db2.gz XDLHPOLAYQSPOP-TZMCWYRMSA-N 0 3 335.404 2.595 20 5 EFBDHN CC(C)Oc1cc(C(=O)N[C@H]2CCCN(C)[C@H]2C)ccc1[N+](=O)[O-] ZINC000412252830 534951637 /nfs/dbraw/zinc/95/16/37/534951637.db2.gz XDLHPOLAYQSPOP-JSGCOSHPSA-N 0 3 335.404 2.595 20 5 EFBDHN CC1(C)[C@H](NCc2cc([N+](=O)[O-])cc3c2OCOC3)[C@H]2CCCO[C@@H]21 ZINC000344680556 535073548 /nfs/dbraw/zinc/07/35/48/535073548.db2.gz NZSPRINOBIOIDN-OIISXLGYSA-N 0 3 348.399 2.755 20 5 EFBDHN CC(C)(NC(=O)c1ccc2c(c1)CNC2)c1ccc([N+](=O)[O-])cc1 ZINC000347645991 535240644 /nfs/dbraw/zinc/24/06/44/535240644.db2.gz FCWSPWYEFCPVMU-UHFFFAOYSA-N 0 3 325.368 2.863 20 5 EFBDHN CC(C)(NC[C@H](O)COc1cccc([N+](=O)[O-])c1)c1ccccc1F ZINC000429234453 535251087 /nfs/dbraw/zinc/25/10/87/535251087.db2.gz HFABQVPXDQSJCU-AWEZNQCLSA-N 0 3 348.374 2.999 20 5 EFBDHN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N(C)CCN(C)C ZINC000344007952 535256923 /nfs/dbraw/zinc/25/69/23/535256923.db2.gz OZRRFRVYRJBEID-UHFFFAOYSA-N 0 3 339.461 2.977 20 5 EFBDHN CCOc1ccc([C@@H](C)NCCn2cc([N+](=O)[O-])cn2)cc1OC ZINC000341436678 535410884 /nfs/dbraw/zinc/41/08/84/535410884.db2.gz VCEICCWYNIXDTN-GFCCVEGCSA-N 0 3 334.376 2.549 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000342919501 535507107 /nfs/dbraw/zinc/50/71/07/535507107.db2.gz HUKOVUWWFMOXTH-LBPRGKRZSA-N 0 3 330.388 2.680 20 5 EFBDHN CN(C)Cc1cccc(C(=O)N(C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000359134633 536021523 /nfs/dbraw/zinc/02/15/23/536021523.db2.gz DYHATQKQICTIGB-UHFFFAOYSA-N 0 3 341.411 2.971 20 5 EFBDHN CO[C@@H](CNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C(C)C ZINC000266599497 536509421 /nfs/dbraw/zinc/50/94/21/536509421.db2.gz CSYYSUZWZFKOSJ-INIZCTEOSA-N 0 3 332.404 2.756 20 5 EFBDHN COc1cc(C(=O)N[C@H](C)CN2CCCCCC2)cc([N+](=O)[O-])c1C ZINC000359766647 536513716 /nfs/dbraw/zinc/51/37/16/536513716.db2.gz KRYKUHGEGVGGEV-CYBMUJFWSA-N 0 3 349.431 2.906 20 5 EFBDHN CO[C@@H]1[C@H](C)[C@H](N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1(C)C ZINC000344487101 536815459 /nfs/dbraw/zinc/81/54/59/536815459.db2.gz UNGBAMPMAYFOCT-FDRIWYBQSA-N 0 3 335.404 2.571 20 5 EFBDHN CCO[C@@H]1CCCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000753917394 575359102 /nfs/dbraw/zinc/35/91/02/575359102.db2.gz MVZYSTOXNJCWOO-CYBMUJFWSA-N 0 3 339.367 2.563 20 5 EFBDHN CCN(CC)C(=O)CN[C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000753940645 575363702 /nfs/dbraw/zinc/36/37/02/575363702.db2.gz UUMKYWJPJVLLFY-ZBFHGGJFSA-N 0 3 333.432 2.764 20 5 EFBDHN O=[N+]([O-])c1ccc([C@@H](O)CNCc2ccc(-n3cccn3)cc2)cc1 ZINC000754251913 575410983 /nfs/dbraw/zinc/41/09/83/575410983.db2.gz YTDHMEYDNOJRRQ-SFHVURJKSA-N 0 3 338.367 2.604 20 5 EFBDHN COC[C@H](N[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)C(C)C ZINC000754383843 575428513 /nfs/dbraw/zinc/42/85/13/575428513.db2.gz JUAMNGLIIYIFCX-YGRLFVJLSA-N 0 3 343.811 2.836 20 5 EFBDHN CC[C@H](NCC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])[C@@H]1CCCO1 ZINC000754520713 575446523 /nfs/dbraw/zinc/44/65/23/575446523.db2.gz WDUUZBFQQGTLCG-FZMZJTMJSA-N 0 3 341.795 2.734 20 5 EFBDHN Cc1nn(CN2CC[C@H](C3CCOCC3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000754782040 575489199 /nfs/dbraw/zinc/48/91/99/575489199.db2.gz HTHJSSWMKZDIIY-HNNXBMFYSA-N 0 3 344.415 2.959 20 5 EFBDHN Cc1nn(CN2CC[C@H]([C@@H]3CCOC3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761293924 576141413 /nfs/dbraw/zinc/14/14/13/576141413.db2.gz TUMPEEUDBRBMGT-UONOGXRCSA-N 0 3 330.388 2.569 20 5 EFBDHN Cc1nn(CN2CC[C@H]([C@H]3CCOC3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761293915 576141478 /nfs/dbraw/zinc/14/14/78/576141478.db2.gz TUMPEEUDBRBMGT-KBPBESRZSA-N 0 3 330.388 2.569 20 5 EFBDHN C[C@@H]1CCCN1CCNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000762720859 576327496 /nfs/dbraw/zinc/32/74/96/576327496.db2.gz DLXCVQXKLLXYSG-GFCCVEGCSA-N 0 3 337.395 2.612 20 5 EFBDHN C[C@@H](CNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12)N1CCCCC1 ZINC000762957946 576350299 /nfs/dbraw/zinc/35/02/99/576350299.db2.gz DDAJIWXAEGAJGW-LBPRGKRZSA-N 0 3 330.388 2.680 20 5 EFBDHN Cc1nn(CN2CCN(C3CCCC3)CC2)c2ccc([N+](=O)[O-])cc12 ZINC000764878045 576516639 /nfs/dbraw/zinc/51/66/39/576516639.db2.gz IFKGBOOUQVEXBF-UHFFFAOYSA-N 0 3 343.431 2.771 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCN(C3CCCCC3)CC2)c2nonc21 ZINC000765576774 577055643 /nfs/dbraw/zinc/05/56/43/577055643.db2.gz RKKTZWDMRZYSRN-UHFFFAOYSA-N 0 3 331.376 2.586 20 5 EFBDHN C[C@H](CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12)N1CCCCC1 ZINC000765648571 577062799 /nfs/dbraw/zinc/06/27/99/577062799.db2.gz JJSBSRCIQDIOSH-CYBMUJFWSA-N 0 3 342.399 2.747 20 5 EFBDHN O=[N+]([O-])c1ccc([C@@H](O)CN[C@@H]2CCOc3ccc(F)cc32)cc1 ZINC000765847991 577082699 /nfs/dbraw/zinc/08/26/99/577082699.db2.gz DIHUZMUYDFTVMP-CVEARBPZSA-N 0 3 332.331 2.881 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H]1C[C@@H](O)c1cnn(C)c1 ZINC000766946880 577189258 /nfs/dbraw/zinc/18/92/58/577189258.db2.gz PQWDHPHWZJNKBU-DDUZABMNSA-N 0 3 344.415 2.977 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H]1C[C@H](O)c1cnn(C)c1 ZINC000766946883 577189273 /nfs/dbraw/zinc/18/92/73/577189273.db2.gz PQWDHPHWZJNKBU-XUWXXGDYSA-N 0 3 344.415 2.977 20 5 EFBDHN O=[N+]([O-])c1ccc([C@@H](O)CN2CCC(O)(c3ccccc3)CC2)cc1 ZINC000767855765 577238698 /nfs/dbraw/zinc/23/86/98/577238698.db2.gz LTXYGROJWJZPHL-SFHVURJKSA-N 0 3 342.395 2.612 20 5 EFBDHN CN1CCC(NC(=S)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)CC1 ZINC000768480950 577277643 /nfs/dbraw/zinc/27/76/43/577277643.db2.gz UTNWICKKWMTFQW-UHFFFAOYSA-N 0 3 348.472 2.528 20 5 EFBDHN COc1cc(CONC(=N)COC(C)(C)C)c([N+](=O)[O-])cc1F ZINC000768929054 577317201 /nfs/dbraw/zinc/31/72/01/577317201.db2.gz JRHDVWAQRMITHX-UHFFFAOYSA-N 0 3 329.328 2.556 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCC(N[C@@H](CCO)c3ccco3)CC2)cc1 ZINC000769409630 577360457 /nfs/dbraw/zinc/36/04/57/577360457.db2.gz ACTPAMPTIFWSCD-KRWDZBQOSA-N 0 3 345.399 2.870 20 5 EFBDHN CCN(CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O)[C@H](C)C(C)C ZINC000726589851 577374332 /nfs/dbraw/zinc/37/43/32/577374332.db2.gz YWBFSUSWWNYHLD-CYBMUJFWSA-N 0 3 348.403 2.687 20 5 EFBDHN C[C@H](CN1CCOCC1)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000726607255 577374833 /nfs/dbraw/zinc/37/48/33/577374833.db2.gz LOEBPDUPLPWAOJ-CQSZACIVSA-N 0 3 345.399 2.665 20 5 EFBDHN CC1(C)CCCN(CCNC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)C1 ZINC000769708291 577379901 /nfs/dbraw/zinc/37/99/01/577379901.db2.gz RYQMCNCECBAHJR-TWGQIWQCSA-N 0 3 331.416 2.846 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(N(C)CCN(C)C2CC2)cc1Cl ZINC000770224150 577407738 /nfs/dbraw/zinc/40/77/38/577407738.db2.gz ZYECEWBZKRDOAC-UHFFFAOYSA-N 0 3 341.795 2.565 20 5 EFBDHN O=[N+]([O-])c1ccc([C@H](O)CN2CC[C@]3(C2)OCc2ccccc23)cc1 ZINC000770689224 581126184 /nfs/dbraw/zinc/12/61/84/581126184.db2.gz PMVDYDYDYOAZIX-RTBURBONSA-N 0 3 340.379 2.760 20 5 EFBDHN CCN(CC)CCOC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000772181354 581292971 /nfs/dbraw/zinc/29/29/71/581292971.db2.gz LPOJCSBSLFYKFY-UHFFFAOYSA-N 0 3 345.193 2.856 20 5 EFBDHN CCN(CC)CCOC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000772318237 581307191 /nfs/dbraw/zinc/30/71/91/581307191.db2.gz CTNPGARJWRSHTQ-UHFFFAOYSA-N 0 3 326.368 2.897 20 5 EFBDHN Cn1c(C(=O)OCC2CCN(Cc3ccco3)CC2)ccc1[N+](=O)[O-] ZINC000772685500 581355753 /nfs/dbraw/zinc/35/57/53/581355753.db2.gz PXFMPCDTSUENAF-UHFFFAOYSA-N 0 3 347.371 2.595 20 5 EFBDHN CN(Cc1cc(C(C)(C)C)[nH]n1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000773926632 581473756 /nfs/dbraw/zinc/47/37/56/581473756.db2.gz PZOVWFTUMVYGDZ-OAHLLOKOSA-N 0 3 332.404 2.781 20 5 EFBDHN COc1ccc([C@@H](O)CN[C@@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000850424826 1250480958 /nfs/dbraw/zinc/48/09/58/1250480958.db2.gz MAZKJXWKIINQGQ-SJCJKPOMSA-N 0 3 346.383 2.996 20 5 EFBDHN CC([C@@H](OC(=O)c1cnc2n1CCC2)c1ccccc1F)[N+](=O)[O-] ZINC000851108873 1250806593 /nfs/dbraw/zinc/80/65/93/1250806593.db2.gz QMGHSQBVBDWZMP-MEBBXXQBSA-N 0 3 333.319 2.532 20 5 EFBDHN CC1(C(=O)N2CCC(CNCc3csc([N+](=O)[O-])c3)CC2)CC1 ZINC000997801627 1258440766 /nfs/dbraw/zinc/44/07/66/1258440766.db2.gz VIDDCNXMOOCSEK-UHFFFAOYSA-N 0 3 337.445 2.785 20 5 EFBDHN CN(C)CCN(C(=O)/C=C\c1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC000733156645 1265103590 /nfs/dbraw/zinc/10/35/90/1265103590.db2.gz HPJMUHGHMXPQNZ-XFXZXTDPSA-N 0 3 331.416 2.941 20 5 EFBDHN COC1CCC(N(C)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000734476058 1266996256 /nfs/dbraw/zinc/99/62/56/1266996256.db2.gz BYXLHYLZOPQCEN-UHFFFAOYSA-N 0 3 345.403 2.700 20 5 EFBDHN C[C@H](CNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)N1CCCCC1 ZINC000736070584 1267491057 /nfs/dbraw/zinc/49/10/57/1267491057.db2.gz XUOQADUINNHJOU-LLVKDONJSA-N 0 3 325.796 2.852 20 5 EFBDHN O=C(NC[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1)c1cccs1 ZINC001086018161 1269540281 /nfs/dbraw/zinc/54/02/81/1269540281.db2.gz GMOPJPZJAAARRD-XBXGTLAGSA-N 0 3 345.424 2.955 20 5 EFBDHN O=[N+]([O-])c1ccc2oc(=S)n(CN3CC[C@@H](N4CC=CC4)C3)c2c1 ZINC000742164053 1269909406 /nfs/dbraw/zinc/90/94/06/1269909406.db2.gz XDHPGJDTGCFCCS-CYBMUJFWSA-N 0 3 346.412 2.776 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCN1CCC[C@H]1C ZINC000742239977 1269949415 /nfs/dbraw/zinc/94/94/15/1269949415.db2.gz PFLXGFJZZVBFOE-OLZOCXBDSA-N 0 3 337.445 2.676 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCN1CCC[C@@H]1C ZINC000742239979 1269951669 /nfs/dbraw/zinc/95/16/69/1269951669.db2.gz PFLXGFJZZVBFOE-STQMWFEESA-N 0 3 337.445 2.676 20 5 EFBDHN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NC[C@H]1N(C)CCCC1(C)C ZINC000843873760 1278608156 /nfs/dbraw/zinc/60/81/56/1278608156.db2.gz SCGJNTRUQFOWLD-CQSZACIVSA-N 0 3 337.395 2.893 20 5 EFBDHN C[C@H](NC[C@@H](O)COc1cccc(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000746049931 1271744458 /nfs/dbraw/zinc/74/44/58/1271744458.db2.gz YHAKMGHNCUFSST-BLLLJJGKSA-N 0 3 334.347 2.824 20 5 EFBDHN C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H](C)N1[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169012902 1272585778 /nfs/dbraw/zinc/58/57/78/1272585778.db2.gz SMQFMRJTCYXZEM-BARDWOONSA-N 0 3 341.452 2.762 20 5 EFBDHN COc1ccc(-c2nc(CN[C@@H]3CC[C@@H](C[N+](=O)[O-])C3)co2)cc1 ZINC001168987925 1272588643 /nfs/dbraw/zinc/58/86/43/1272588643.db2.gz LIMATWMPWIQEMS-TZMCWYRMSA-N 0 3 331.372 2.885 20 5 EFBDHN C[C@H]1CN([C@H]2CC[C@@H](C[N+](=O)[O-])C2)[C@@H](C)CN1C(=O)OC(C)(C)C ZINC001169035135 1272598978 /nfs/dbraw/zinc/59/89/78/1272598978.db2.gz AKSLWYWRZGGDBS-XQLPTFJDSA-N 0 3 341.452 2.762 20 5 EFBDHN CC(C)(C)OC(=O)N1CCN([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1(C)C ZINC001169038364 1272604739 /nfs/dbraw/zinc/60/47/39/1272604739.db2.gz YIBQLMKMLPQPOV-KGLIPLIRSA-N 0 3 341.452 2.763 20 5 EFBDHN O=[N+]([O-])C[C@H]1CC[C@H](N2C[C@@H]3C[C@H](C2)c2cc4nccnc4cc23)C1 ZINC001169040198 1272611186 /nfs/dbraw/zinc/61/11/86/1272611186.db2.gz YPNHLKUTBNONDZ-XQLPTFJDSA-N 0 3 338.411 2.962 20 5 EFBDHN CC(C)N(C)Cc1cnc2n1CCN([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)[C@@H]2C ZINC001169025754 1272622668 /nfs/dbraw/zinc/62/26/68/1272622668.db2.gz UTFUHWNZPNVFMJ-BZUAXINKSA-N 0 3 349.479 2.545 20 5 EFBDHN C[C@H]1CN([C@H]2CC[C@H](C[N+](=O)[O-])C2)C[C@H](C)N1C(=O)OC(C)(C)C ZINC001169047877 1272627282 /nfs/dbraw/zinc/62/72/82/1272627282.db2.gz SEDOFOLAONWQEW-AJNGGQMLSA-N 0 3 341.452 2.762 20 5 EFBDHN C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H](C)N1[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169047913 1272627685 /nfs/dbraw/zinc/62/76/85/1272627685.db2.gz SMQFMRJTCYXZEM-APIJFGDWSA-N 0 3 341.452 2.762 20 5 EFBDHN O=[N+]([O-])C[C@@H]1CC[C@@H](N2CCN(Cc3c(F)cccc3F)CC2)C1 ZINC001169050488 1272628532 /nfs/dbraw/zinc/62/85/32/1272628532.db2.gz ZVHDGZCATHDUCE-ZIAGYGMSSA-N 0 3 339.386 2.528 20 5 EFBDHN C[C@H](c1ccc(F)cc1)N1CCN([C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169056796 1272632003 /nfs/dbraw/zinc/63/20/03/1272632003.db2.gz SOWAWFFDLTUABG-VKJFTORMSA-N 0 3 335.423 2.950 20 5 EFBDHN O=C(NCc1ccc(CNCc2ccc([N+](=O)[O-])cc2)cc1)C1CC1 ZINC001034804993 1273007439 /nfs/dbraw/zinc/00/74/39/1273007439.db2.gz PXCWBMQQHUUKIT-UHFFFAOYSA-N 0 3 339.395 2.911 20 5 EFBDHN CCC(=O)N1CCC2(CCN(Cc3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC001035146357 1273633996 /nfs/dbraw/zinc/63/39/96/1273633996.db2.gz DIFXNMVFQMHOLK-UHFFFAOYSA-N 0 3 331.416 2.819 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(NCCCN(C)C(=O)C2(N(C)C)CCC2)c1 ZINC001109547505 1274407345 /nfs/dbraw/zinc/40/73/45/1274407345.db2.gz CEGIXXVMNXUAAO-UHFFFAOYSA-N 0 3 348.447 2.648 20 5 EFBDHN CCN(C)C(C)(C)C(=O)N(C)CCCNc1ccc([N+](=O)[O-])cc1 ZINC001109547882 1274408351 /nfs/dbraw/zinc/40/83/51/1274408351.db2.gz ZUDASRQVLKYHJL-UHFFFAOYSA-N 0 3 336.436 2.586 20 5 EFBDHN Cc1cc(NC[C@H]2CN3CCC[C@H]3CO2)c(Cl)cc1[N+](=O)[O-] ZINC000785808012 1275193785 /nfs/dbraw/zinc/19/37/85/1275193785.db2.gz WMKCNYUQFCYMQH-RYUDHWBXSA-N 0 3 325.796 2.832 20 5 EFBDHN O=[N+]([O-])c1ccn(C2CCN(Cc3ccc4c(c3)COC4)CC2)n1 ZINC000785857357 1275217699 /nfs/dbraw/zinc/21/76/99/1275217699.db2.gz IFPCZZTYAJWPCU-UHFFFAOYSA-N 0 3 328.372 2.659 20 5 EFBDHN O=C(NCC1(NCc2ccccc2[N+](=O)[O-])CCCCC1)C(F)F ZINC001115376173 1275385465 /nfs/dbraw/zinc/38/54/65/1275385465.db2.gz IKFCUMVAYYPNFO-UHFFFAOYSA-N 0 3 341.358 2.769 20 5 EFBDHN CC(=Cc1cccc([N+](=O)[O-])c1)CN1CCC2(CNC(=O)O2)CC1 ZINC000787418735 1275769592 /nfs/dbraw/zinc/76/95/92/1275769592.db2.gz QNBZYWJLLMLRSS-UKTHLTGXSA-N 0 3 331.372 2.573 20 5 EFBDHN C[C@H](NCc1ccc(-n2cncn2)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788665485 1276264882 /nfs/dbraw/zinc/26/48/82/1276264882.db2.gz OEAIRCIXCIHBOI-LBPRGKRZSA-N 0 3 338.371 2.609 20 5 EFBDHN COc1ccc(C[C@@H](C)N[C@@H]2CCCc3nccnc32)c([N+](=O)[O-])c1 ZINC001170323462 1279015006 /nfs/dbraw/zinc/01/50/06/1279015006.db2.gz KVTOUQDNUOKMIF-MLGOLLRUSA-N 0 3 342.399 2.992 20 5 EFBDHN Cc1cccc(F)c1-n1nc(C(=O)OCC(C)[N+](=O)[O-])c2c1CCC2 ZINC000817739016 1276286022 /nfs/dbraw/zinc/28/60/22/1276286022.db2.gz FSBXXEQQCZQBEO-LLVKDONJSA-N 0 3 347.346 2.631 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2ccc(CNCCO[C@H]3CCOC3)o2)c1 ZINC000922938828 1276364066 /nfs/dbraw/zinc/36/40/66/1276364066.db2.gz IRGZNBTWMQORMZ-INIZCTEOSA-N 0 3 332.356 2.750 20 5 EFBDHN COc1ccc(C[C@@H](C)N2CCc3c(cc[nH]c3=O)C2)c([N+](=O)[O-])c1 ZINC001170354856 1279034374 /nfs/dbraw/zinc/03/43/74/1279034374.db2.gz QNOOLYNDKFBBTE-GFCCVEGCSA-N 0 3 343.383 2.693 20 5 EFBDHN O=[N+]([O-])c1ccc([C@@H](O)CNCc2ccc(OCC3CC3)nc2)cc1 ZINC000818990854 1276565574 /nfs/dbraw/zinc/56/55/74/1276565574.db2.gz QIIJVRGWTKPWQZ-KRWDZBQOSA-N 0 3 343.383 2.602 20 5 EFBDHN COCc1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)ccc1F ZINC000819037335 1276597332 /nfs/dbraw/zinc/59/73/32/1276597332.db2.gz OEVPZEIFSGEAKC-QGZVFWFLSA-N 0 3 334.347 2.704 20 5 EFBDHN CC(C)(C)Oc1ccc(CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000819214302 1276692412 /nfs/dbraw/zinc/69/24/12/1276692412.db2.gz SKVPWBLEAUZMOI-MRXNPFEDSA-N 0 3 345.399 2.990 20 5 EFBDHN CC[C@H](C)N[C@@H](CNC[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000819386562 1276767465 /nfs/dbraw/zinc/76/74/65/1276767465.db2.gz AXEQHCOXNIMTKN-JQFCIGGWSA-N 0 3 347.415 2.940 20 5 EFBDHN CCC(CC)Nc1ccncc1NC(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000820139541 1277042995 /nfs/dbraw/zinc/04/29/95/1277042995.db2.gz GHYOHYLUJBXADP-UHFFFAOYSA-N 0 3 343.387 2.847 20 5 EFBDHN COc1ccc(C[C@H](C)NCc2ccc(Cl)nn2)c([N+](=O)[O-])c1 ZINC001170306594 1279029226 /nfs/dbraw/zinc/02/92/26/1279029226.db2.gz YHQPIQKNWMLDIS-JTQLQIEISA-N 0 3 336.779 2.768 20 5 EFBDHN N=C(COc1ccccc1)NOCc1c(F)cc([N+](=O)[O-])cc1F ZINC000820701015 1277284261 /nfs/dbraw/zinc/28/42/61/1277284261.db2.gz HFUFSJBWRADQTC-UHFFFAOYSA-N 0 3 337.282 2.950 20 5 EFBDHN CSc1cccc(C(=O)N2[C@@H]3CC[C@H]2CN(C)CC3)c1[N+](=O)[O-] ZINC000923272748 1277444592 /nfs/dbraw/zinc/44/45/92/1277444592.db2.gz PTCLUUVNFRZIMX-NEPJUHHUSA-N 0 3 335.429 2.625 20 5 EFBDHN Cc1c(CNCc2ccc(NS(C)(=O)=O)cc2)cccc1[N+](=O)[O-] ZINC000790999117 1277899338 /nfs/dbraw/zinc/89/93/38/1277899338.db2.gz NCVGRXPBPWYPSP-UHFFFAOYSA-N 0 3 349.412 2.565 20 5 EFBDHN Cc1csc(C(=O)NCCCNCc2csc([N+](=O)[O-])c2)c1 ZINC001157565528 1277941990 /nfs/dbraw/zinc/94/19/90/1277941990.db2.gz IDWNCBZIHGQLII-UHFFFAOYSA-N 0 3 339.442 2.936 20 5 EFBDHN Cc1cc(F)cc(C(=O)NC[C@H]2N(C)CCCC2(C)C)c1[N+](=O)[O-] ZINC000791116019 1277951675 /nfs/dbraw/zinc/95/16/75/1277951675.db2.gz DGHWGGYXKNNCPG-CQSZACIVSA-N 0 3 337.395 2.893 20 5 EFBDHN Cc1ccc(CN(C)C)cc1NC(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000791378820 1278053016 /nfs/dbraw/zinc/05/30/16/1278053016.db2.gz CHCTZMRPFUPZOC-UHFFFAOYSA-N 0 3 346.362 2.938 20 5 EFBDHN COc1ccc(C[C@@H](C)N2CCN3CCCC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC001170345044 1279049735 /nfs/dbraw/zinc/04/97/35/1279049735.db2.gz GXHHKOBIRCLOGH-GDBMZVCRSA-N 0 3 333.432 2.705 20 5 EFBDHN COC1CCN(CCNc2cc(Cl)c(F)cc2[N+](=O)[O-])CC1 ZINC000845499984 1279684291 /nfs/dbraw/zinc/68/42/91/1279684291.db2.gz SVXOAMLPTYWSKN-UHFFFAOYSA-N 0 3 331.775 2.910 20 5 EFBDHN Cc1nn(C)c(C)c1CC(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845872268 1279900541 /nfs/dbraw/zinc/90/05/41/1279900541.db2.gz FTEJGSRVFVYDIJ-PXAZEXFGSA-N 0 3 349.362 2.668 20 5 EFBDHN COc1ccc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])cn1 ZINC000845873390 1279900619 /nfs/dbraw/zinc/90/06/19/1279900619.db2.gz SZFPIEGALFTZBZ-BONVTDFDSA-N 0 3 334.303 2.793 20 5 EFBDHN COc1ccc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])cn1 ZINC000845873393 1279900799 /nfs/dbraw/zinc/90/07/99/1279900799.db2.gz SZFPIEGALFTZBZ-MEBBXXQBSA-N 0 3 334.303 2.793 20 5 EFBDHN CCc1nn(C)cc1C(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845874821 1279902537 /nfs/dbraw/zinc/90/25/37/1279902537.db2.gz ITZVZVRNLBPRCH-BONVTDFDSA-N 0 3 335.335 2.685 20 5 EFBDHN CCn1cc(CC(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])cn1 ZINC000845876993 1279903439 /nfs/dbraw/zinc/90/34/39/1279903439.db2.gz CUBXCTDLPUDMCO-BZNIZROVSA-N 0 3 335.335 2.534 20 5 EFBDHN CC([C@H](OC(=O)CCC(C)(C)[N+](=O)[O-])c1ccccc1F)[N+](=O)[O-] ZINC000845882711 1279904461 /nfs/dbraw/zinc/90/44/61/1279904461.db2.gz PYDKYHGMVJDATG-HZMBPMFUSA-N 0 3 342.323 2.911 20 5 EFBDHN CCn1ccc(CC(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])n1 ZINC000845883098 1279905732 /nfs/dbraw/zinc/90/57/32/1279905732.db2.gz YNPBJUVJUQFOEE-BZNIZROVSA-N 0 3 335.335 2.534 20 5 EFBDHN CC([C@H](OC(=O)c1cnn(CCF)c1)c1ccccc1F)[N+](=O)[O-] ZINC000845881942 1279905863 /nfs/dbraw/zinc/90/58/63/1279905863.db2.gz MUMOTRCRIBWLFW-YGRLFVJLSA-N 0 3 339.298 2.555 20 5 EFBDHN CC([C@@H](OC(=O)c1cnn(CCF)c1)c1ccccc1F)[N+](=O)[O-] ZINC000845881934 1279905979 /nfs/dbraw/zinc/90/59/79/1279905979.db2.gz MUMOTRCRIBWLFW-IINYFYTJSA-N 0 3 339.298 2.555 20 5 EFBDHN CC([C@H](OC(=O)[C@@H]1C[C@H]2CC(=O)[C@@H]1C2)c1ccccc1F)[N+](=O)[O-] ZINC000845882268 1279906211 /nfs/dbraw/zinc/90/62/11/1279906211.db2.gz SBWUZVWRTFFYMI-ZLGRWFNRSA-N 0 3 335.331 2.690 20 5 EFBDHN CC([C@@H](OC(=O)c1cnc2n1CCCC2)c1ccccc1F)[N+](=O)[O-] ZINC000845883275 1279906250 /nfs/dbraw/zinc/90/62/50/1279906250.db2.gz RJDQLBYMLRGIMZ-MEDUHNTESA-N 0 3 347.346 2.922 20 5 EFBDHN CC([C@H](OC(=O)[C@H](C)Cc1cnn(C)c1)c1ccccc1F)[N+](=O)[O-] ZINC000845883199 1279906430 /nfs/dbraw/zinc/90/64/30/1279906430.db2.gz ZVDBGCNXMCJQLL-WQGACYEGSA-N 0 3 349.362 2.688 20 5 EFBDHN CC([C@H](OC(=O)[C@H]1C[C@H]2CC(=O)[C@@H]1C2)c1ccccc1F)[N+](=O)[O-] ZINC000845882264 1279906664 /nfs/dbraw/zinc/90/66/64/1279906664.db2.gz SBWUZVWRTFFYMI-HXXLIZDESA-N 0 3 335.331 2.690 20 5 EFBDHN CCCNC(=O)CCN[C@@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872024318 1287403973 /nfs/dbraw/zinc/40/39/73/1287403973.db2.gz QBYHMWOSANYLDS-NSHDSACASA-N 0 3 325.434 2.884 20 5 EFBDHN CCc1nncn1CCN[C@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872040962 1287409464 /nfs/dbraw/zinc/40/94/64/1287409464.db2.gz OPXFVAOXUCZWNG-LLVKDONJSA-N 0 3 335.433 2.821 20 5 EFBDHN O=[N+]([O-])c1ccc(Cl)cc1CN[C@H](C1CC1)[C@@]1(CO)CCCO1 ZINC000815289266 1287413204 /nfs/dbraw/zinc/41/32/04/1287413204.db2.gz XKMMSCMSTUSFGY-CVEARBPZSA-N 0 3 340.807 2.658 20 5 EFBDHN CO[C@@]1(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2SC)CCOC1 ZINC000872062387 1287416722 /nfs/dbraw/zinc/41/67/22/1287416722.db2.gz MKPOGKSWFJNLKL-XHDPSFHLSA-N 0 3 326.418 2.773 20 5 EFBDHN C[C@H](NCCn1ccc(C(F)(F)F)n1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000872108618 1287431389 /nfs/dbraw/zinc/43/13/89/1287431389.db2.gz BFFXARLQKTZGCO-VIFPVBQESA-N 0 3 343.309 2.743 20 5 EFBDHN CN1CCN(C[C@H](O)c2cccc([N+](=O)[O-])c2)CC12CCCCC2 ZINC000846945376 1280647327 /nfs/dbraw/zinc/64/73/27/1280647327.db2.gz ZQDZAICMSKGRFA-KRWDZBQOSA-N 0 3 333.432 2.579 20 5 EFBDHN CCC(C)(C)N1CCN(Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000847034827 1280715492 /nfs/dbraw/zinc/71/54/92/1280715492.db2.gz BPHXKPRUVPTJHG-UHFFFAOYSA-N 0 3 336.392 2.809 20 5 EFBDHN CC(C)c1ncsc1C(=O)NCCNCc1cccc([N+](=O)[O-])c1 ZINC001134983630 1287459806 /nfs/dbraw/zinc/45/98/06/1287459806.db2.gz VMZBYYYKXFGRPA-UHFFFAOYSA-N 0 3 348.428 2.694 20 5 EFBDHN CCn1c(C)cc(C(=O)NCCNCc2cccc([N+](=O)[O-])c2)c1C ZINC001130964147 1281332512 /nfs/dbraw/zinc/33/25/12/1281332512.db2.gz WMXMKWYBLHYEKM-UHFFFAOYSA-N 0 3 344.415 2.553 20 5 EFBDHN CN(C)c1ccccc1CN(C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000808785730 1281899390 /nfs/dbraw/zinc/89/93/90/1281899390.db2.gz RNVSHZDQMOHSTD-GOSISDBHSA-N 0 3 329.400 2.826 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)F)ccc1N1CCN(C[C@@H]2CCOC2)CC1 ZINC000809356016 1282172683 /nfs/dbraw/zinc/17/26/83/1282172683.db2.gz XULBJRKBNIHAHN-LBPRGKRZSA-N 0 3 341.358 2.691 20 5 EFBDHN C[C@H](NCCNC(=O)CC1CCCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815593790 1287621490 /nfs/dbraw/zinc/62/14/90/1287621490.db2.gz XKKIIGZNZOEJHC-ZDUSSCGKSA-N 0 3 348.447 2.914 20 5 EFBDHN O=C(Cc1cccc(Cl)c1)NCCNCc1cccc([N+](=O)[O-])c1 ZINC001133211378 1284997727 /nfs/dbraw/zinc/99/77/27/1284997727.db2.gz KMYMTMPOVFTAAR-UHFFFAOYSA-N 0 3 347.802 2.697 20 5 EFBDHN CC(COC(=O)c1c[nH]nc1-c1cccc(OC(F)F)c1)[N+](=O)[O-] ZINC000813099896 1285650334 /nfs/dbraw/zinc/65/03/34/1285650334.db2.gz GQLOTROLJMWUPI-MRVPVSSYSA-N 0 3 341.270 2.500 20 5 EFBDHN CC(COC(=O)c1cccc(-c2noc(C(F)(F)F)n2)c1)[N+](=O)[O-] ZINC000813104654 1285653483 /nfs/dbraw/zinc/65/34/83/1285653483.db2.gz PNPIBOZCQISIDV-SSDOTTSWSA-N 0 3 345.233 2.577 20 5 EFBDHN CC(COC(=O)c1csc(-c2ccc(F)c(F)c2)n1)[N+](=O)[O-] ZINC000813102354 1285654106 /nfs/dbraw/zinc/65/41/06/1285654106.db2.gz DZHZGZGGVBJSGV-SSDOTTSWSA-N 0 3 328.296 2.910 20 5 EFBDHN Cc1cc(NC(=O)c2ccco2)sc1C(=O)OCC(C)[N+](=O)[O-] ZINC000813102555 1285654353 /nfs/dbraw/zinc/65/43/53/1285654353.db2.gz RUEFHRGAPSKDLI-SECBINFHSA-N 0 3 338.341 2.724 20 5 EFBDHN Cc1nn(-c2ccccc2)c2ncc(C(=O)OCC(C)[N+](=O)[O-])cc12 ZINC000813105703 1285662782 /nfs/dbraw/zinc/66/27/82/1285662782.db2.gz SCXKSECMYVDPEG-NSHDSACASA-N 0 3 340.339 2.551 20 5 EFBDHN Cc1nc(-c2cccs2)c(CC(=O)OCC(C)[N+](=O)[O-])s1 ZINC000813107036 1285677248 /nfs/dbraw/zinc/67/72/48/1285677248.db2.gz KQWXBEJPUBJWRL-QMMMGPOBSA-N 0 3 326.399 2.931 20 5 EFBDHN Cc1nc(NC(=O)OC(C)(C)C)sc1C(=O)OCC(C)[N+](=O)[O-] ZINC000813108851 1285679573 /nfs/dbraw/zinc/67/95/73/1285679573.db2.gz BHMUPRDPOSPIOQ-ZETCQYMHSA-N 0 3 345.377 2.621 20 5 EFBDHN Cc1nc(NC(=O)OC(C)(C)C)sc1C(=O)OCC(C)[N+](=O)[O-] ZINC000813108847 1285679871 /nfs/dbraw/zinc/67/98/71/1285679871.db2.gz BHMUPRDPOSPIOQ-SSDOTTSWSA-N 0 3 345.377 2.621 20 5 EFBDHN CC(COC(=O)c1ccccc1N(C)C(=O)c1cccs1)[N+](=O)[O-] ZINC000813107302 1285680181 /nfs/dbraw/zinc/68/01/81/1285680181.db2.gz OVEOXKXPCWHBMB-NSHDSACASA-N 0 3 348.380 2.847 20 5 EFBDHN CCc1c(C(=O)OCC(C)[N+](=O)[O-])cnn1-c1ccccc1Cl ZINC000813109123 1285681702 /nfs/dbraw/zinc/68/17/02/1285681702.db2.gz FUFMJOYSNCQRAF-JTQLQIEISA-N 0 3 337.763 2.910 20 5 EFBDHN CC(COC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)[N+](=O)[O-] ZINC000813108685 1285681978 /nfs/dbraw/zinc/68/19/78/1285681978.db2.gz KAJRMFDPPPEZBC-MRVPVSSYSA-N 0 3 337.313 2.540 20 5 EFBDHN CC(COC(=O)COc1ccc(C(=O)c2ccccc2)cc1)[N+](=O)[O-] ZINC000813109692 1285682722 /nfs/dbraw/zinc/68/27/22/1285682722.db2.gz NUULUMHZPOCCPT-ZDUSSCGKSA-N 0 3 343.335 2.505 20 5 EFBDHN CC(COC(=O)c1ccc(C(=O)Nc2ccccc2)cc1)[N+](=O)[O-] ZINC000813110715 1285683074 /nfs/dbraw/zinc/68/30/74/1285683074.db2.gz IACZZKLFJNTFAR-GFCCVEGCSA-N 0 3 328.324 2.761 20 5 EFBDHN CC(COC(=O)c1cc(-c2ccco2)nn1-c1ccccc1)[N+](=O)[O-] ZINC000813112097 1285683171 /nfs/dbraw/zinc/68/31/71/1285683171.db2.gz ZOFTYALLGGPFOB-LBPRGKRZSA-N 0 3 341.323 2.954 20 5 EFBDHN CC(COC(=O)COc1ccc2oc3c(c2c1)CCCC3)[N+](=O)[O-] ZINC000813112799 1285684306 /nfs/dbraw/zinc/68/43/06/1285684306.db2.gz LLMXQDZGAXYDPB-NSHDSACASA-N 0 3 333.340 2.899 20 5 EFBDHN CC(COC(=O)c1csc(-c2c(F)cccc2F)n1)[N+](=O)[O-] ZINC000813113479 1285684407 /nfs/dbraw/zinc/68/44/07/1285684407.db2.gz DSXNZFRHUYSDIW-SSDOTTSWSA-N 0 3 328.296 2.910 20 5 EFBDHN O=C(CCc1ccccc1)NCCCNCc1ccccc1[N+](=O)[O-] ZINC001171865027 1285866028 /nfs/dbraw/zinc/86/60/28/1285866028.db2.gz NYQYEGZZOSYBNG-UHFFFAOYSA-N 0 3 341.411 2.824 20 5 EFBDHN C[C@H]1CCN(CCNC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000813468145 1285936571 /nfs/dbraw/zinc/93/65/71/1285936571.db2.gz RXJHMYLUUKDZHG-VIFPVBQESA-N 0 3 346.214 2.973 20 5 EFBDHN O=C(NCCNCc1cccc([N+](=O)[O-])c1)c1cc[nH]c1C1CCC1 ZINC001133827553 1285993992 /nfs/dbraw/zinc/99/39/92/1285993992.db2.gz JLHHCYMRAPEJAB-UHFFFAOYSA-N 0 3 342.399 2.710 20 5 EFBDHN O=C(NCCNCc1ccc([N+](=O)[O-])cc1)c1cc[nH]c1C1CCC1 ZINC001133827350 1285994172 /nfs/dbraw/zinc/99/41/72/1285994172.db2.gz DQEYEWXWDZAHJC-UHFFFAOYSA-N 0 3 342.399 2.710 20 5 EFBDHN O=C(NCCNCc1cccc([N+](=O)[O-])c1)c1cccc2cc[nH]c21 ZINC001134150537 1286379618 /nfs/dbraw/zinc/37/96/18/1286379618.db2.gz IRDZTJXXBYDYSS-UHFFFAOYSA-N 0 3 338.367 2.596 20 5 EFBDHN CN(C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1)C1(C)COC1 ZINC001173014873 1286385155 /nfs/dbraw/zinc/38/51/55/1286385155.db2.gz DAVBMHJSZKKBOB-UHFFFAOYSA-N 0 3 341.358 2.563 20 5 EFBDHN CCN(C1COC1)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173017659 1286385687 /nfs/dbraw/zinc/38/56/87/1286385687.db2.gz IHOTXZBXSPNSIC-UHFFFAOYSA-N 0 3 341.358 2.563 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)NCc2cnc(C)cn2)c1F ZINC001173174913 1286451619 /nfs/dbraw/zinc/45/16/19/1286451619.db2.gz GATOYPXDJLYDTF-JTQLQIEISA-N 0 3 334.351 2.562 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)NCc2cccnc2OC)c1F ZINC001173175532 1286451689 /nfs/dbraw/zinc/45/16/89/1286451689.db2.gz DCWNQQYNVIRAER-NSHDSACASA-N 0 3 349.362 2.867 20 5 EFBDHN COC[C@@H]1CCN([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173178310 1286453717 /nfs/dbraw/zinc/45/37/17/1286453717.db2.gz AOIPCRCVPKIUPP-NWDGAFQWSA-N 0 3 326.368 2.642 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)NCc2cncnc2C)c1F ZINC001173177679 1286454029 /nfs/dbraw/zinc/45/40/29/1286454029.db2.gz CTQWOUXIHICPFR-JTQLQIEISA-N 0 3 334.351 2.562 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CC[C@@]3(CCOC3)C2)c1F ZINC001173180386 1286455143 /nfs/dbraw/zinc/45/51/43/1286455143.db2.gz KFZSBMPHEKVZBI-YVEFUNNKSA-N 0 3 338.379 2.786 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)N(C)[C@@H]2CCCOC2)c1F ZINC001173193812 1286458847 /nfs/dbraw/zinc/45/88/47/1286458847.db2.gz QYBDJBKYDGAPOL-VXGBXAGGSA-N 0 3 326.368 2.784 20 5 EFBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)NCc1ccccc1S(C)(=O)=O ZINC001173220202 1286474013 /nfs/dbraw/zinc/47/40/13/1286474013.db2.gz VSTMRNSQBRSVFL-ZDUSSCGKSA-N 0 3 348.424 2.719 20 5 EFBDHN O=C(CCCC(F)(F)F)NCCNCc1ccc([N+](=O)[O-])cc1 ZINC001134229388 1286475552 /nfs/dbraw/zinc/47/55/52/1286475552.db2.gz IOCNYZSQYFKGFV-UHFFFAOYSA-N 0 3 333.310 2.533 20 5 EFBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CCCN(C(=O)C2CCC2)CC1 ZINC001173225030 1286479592 /nfs/dbraw/zinc/47/95/92/1286479592.db2.gz AWWAQCVTAIIGDP-OAHLLOKOSA-N 0 3 345.443 2.860 20 5 EFBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CCC(Oc2ncccn2)CC1 ZINC001173226409 1286480679 /nfs/dbraw/zinc/48/06/79/1286480679.db2.gz JVOFFLJDZGVRTA-AWEZNQCLSA-N 0 3 342.399 2.859 20 5 EFBDHN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)CCC(C)(C)[N+](=O)[O-])C1 ZINC000822712662 1289089281 /nfs/dbraw/zinc/08/92/81/1289089281.db2.gz ZRUIFRQPXMFDKS-ZBFHGGJFSA-N 0 3 333.432 2.774 20 5 EFBDHN CCCN(C)CC(=O)N1CCC(CNc2ccc([N+](=O)[O-])cc2)CC1 ZINC001095262842 1286811527 /nfs/dbraw/zinc/81/15/27/1286811527.db2.gz OMVSCQJFHFRBFW-UHFFFAOYSA-N 0 3 348.447 2.587 20 5 EFBDHN Cc1cc(C(=O)NCCNCc2cccc([N+](=O)[O-])c2)sc1C ZINC001150361282 1286975959 /nfs/dbraw/zinc/97/59/59/1286975959.db2.gz BGWATORPFCOWKI-UHFFFAOYSA-N 0 3 333.413 2.793 20 5 EFBDHN Cc1ccc(C(=O)NCCCNCc2csc([N+](=O)[O-])c2)c(C)n1 ZINC001176817967 1288134889 /nfs/dbraw/zinc/13/48/89/1288134889.db2.gz XCRMNHGCARTWPZ-UHFFFAOYSA-N 0 3 348.428 2.578 20 5 EFBDHN O=C(NCCCNCc1csc([N+](=O)[O-])c1)[C@H]1[C@H]2[C@@H]1[C@@H]1CC[C@H]2C1 ZINC001177212209 1288314548 /nfs/dbraw/zinc/31/45/48/1288314548.db2.gz SKRLLRFKJKFSFS-XLHUXQDVSA-N 0 3 349.456 2.544 20 5 EFBDHN COC1([C@H](C)NCc2cc(Cl)ccc2[N+](=O)[O-])CCOCC1 ZINC000817297612 1288526547 /nfs/dbraw/zinc/52/65/47/1288526547.db2.gz SZRHYMXZQVYGFL-NSHDSACASA-N 0 3 328.796 2.922 20 5 EFBDHN C[C@H](N[C@@H]1CSC[C@H]1C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000796402225 1299218764 /nfs/dbraw/zinc/21/87/64/1299218764.db2.gz HXLDSYQPEVFHJH-VYUIOLGVSA-N 0 3 343.836 2.916 20 5 EFBDHN CCN1CCN(c2ccc(NC(=O)CCC(C)(C)[N+](=O)[O-])cc2)CC1 ZINC000822225494 1288911434 /nfs/dbraw/zinc/91/14/34/1288911434.db2.gz FEFCWCXFWIBXJZ-UHFFFAOYSA-N 0 3 348.447 2.603 20 5 EFBDHN CCCN(C(=O)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1)[C@@H]1CCN(C)C1 ZINC000823500290 1289322596 /nfs/dbraw/zinc/32/25/96/1289322596.db2.gz WHNMZCNDUDVKBG-BRWVUGGUSA-N 0 3 331.416 2.641 20 5 EFBDHN CCc1ccoc1C(=O)NCCCNCc1csc([N+](=O)[O-])c1 ZINC001165966925 1312711962 /nfs/dbraw/zinc/71/19/62/1312711962.db2.gz MEYVPDDHUNPGFO-UHFFFAOYSA-N 0 3 337.401 2.721 20 5 EFBDHN CCC(C)(C)N1CCN(C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)CC1 ZINC000823921373 1289493450 /nfs/dbraw/zinc/49/34/50/1289493450.db2.gz UKAYLEAFLCZZRS-UHFFFAOYSA-N 0 3 335.408 2.515 20 5 EFBDHN Cc1c(CNC[C@H](O)COc2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000873020888 1289524238 /nfs/dbraw/zinc/52/42/38/1289524238.db2.gz DOSMMRKGXCTQQX-HNNXBMFYSA-N 0 3 334.347 2.572 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1CNC[C@@H](O)COc1ccc(F)cc1 ZINC000873023242 1289526203 /nfs/dbraw/zinc/52/62/03/1289526203.db2.gz WEEZYNKFDPWPFF-OAHLLOKOSA-N 0 3 348.374 2.880 20 5 EFBDHN COc1cc(OC)cc([C@@H](O)CNCc2cccc([N+](=O)[O-])c2C)c1 ZINC000873053828 1289541489 /nfs/dbraw/zinc/54/14/89/1289541489.db2.gz HERPFCRPNWNBCE-SFHVURJKSA-N 0 3 346.383 2.744 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1CNCC1(CS(C)(=O)=O)CCC1 ZINC000873132093 1289586937 /nfs/dbraw/zinc/58/69/37/1289586937.db2.gz HABHWQFGWZFCAF-UHFFFAOYSA-N 0 3 340.445 2.516 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1CNCCC(C)(C)S(C)(=O)=O ZINC000873132606 1289587520 /nfs/dbraw/zinc/58/75/20/1289587520.db2.gz YZDCISYWRCGADE-UHFFFAOYSA-N 0 3 328.434 2.515 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@H]1CCCN2CCCC[C@@H]12 ZINC000824311335 1289601870 /nfs/dbraw/zinc/60/18/70/1289601870.db2.gz CHRKATKGQRWOLM-HOCLYGCPSA-N 0 3 331.416 2.958 20 5 EFBDHN CC(C)(C(=O)NCCCNCc1csc([N+](=O)[O-])c1)C(F)F ZINC001166230692 1312749875 /nfs/dbraw/zinc/74/98/75/1312749875.db2.gz FZXJHZJIPQOFKP-UHFFFAOYSA-N 0 3 335.376 2.544 20 5 EFBDHN O=[N+]([O-])c1cc(CN(CCO)CC2CC2)ccc1Br ZINC000092505929 1290764978 /nfs/dbraw/zinc/76/49/78/1290764978.db2.gz JMFIXHLXVXFCRF-UHFFFAOYSA-N 0 3 329.194 2.562 20 5 EFBDHN O=C(CCCF)NCCC1(CNCc2ccccc2[N+](=O)[O-])CC1 ZINC001166630125 1312807280 /nfs/dbraw/zinc/80/72/80/1312807280.db2.gz GFELQPNSRZXNRE-UHFFFAOYSA-N 0 3 337.395 2.721 20 5 EFBDHN CN1CCC[C@H](C(=O)n2c3ccccc3cc3c(=O)c(N)ccc2-3)C1 ZINC001186363073 1290938316 /nfs/dbraw/zinc/93/83/16/1290938316.db2.gz ZOCPSINVLIKCQH-AWEZNQCLSA-N 0 3 335.407 2.671 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1C[C@@H](N2CCOCC2)C[C@@H]1C ZINC000877517032 1291255434 /nfs/dbraw/zinc/25/54/34/1291255434.db2.gz KVUDAVLBBZRPGB-HOCLYGCPSA-N 0 3 333.432 2.507 20 5 EFBDHN CN(CCc1ccccc1[N+](=O)[O-])C[C@H](O)CC1(O)CCCCC1 ZINC000878598675 1291729424 /nfs/dbraw/zinc/72/94/24/1291729424.db2.gz LSQOYOGNHITYGH-MRXNPFEDSA-N 0 3 336.432 2.515 20 5 EFBDHN Cc1cc(NC[C@H]2C[C@H](NC(=O)CN(C)C(C)C)C2)ccc1[N+](=O)[O-] ZINC001114776139 1291931390 /nfs/dbraw/zinc/93/13/90/1291931390.db2.gz XGSNMELWMAVHPL-KOMQPUFPSA-N 0 3 348.447 2.550 20 5 EFBDHN COc1ccc([C@H]2CN(Cc3ccc([N+](=O)[O-])cc3)CCN2)cc1 ZINC000879519275 1292167403 /nfs/dbraw/zinc/16/74/03/1292167403.db2.gz RPJPJKLQIMVTDV-GOSISDBHSA-N 0 3 327.384 2.750 20 5 EFBDHN CN(CCCNC(=O)Cc1ccsc1)Cc1ccc([N+](=O)[O-])cc1 ZINC001233490355 1312942060 /nfs/dbraw/zinc/94/20/60/1312942060.db2.gz MUCWYJNAZWLOBJ-UHFFFAOYSA-N 0 3 347.440 2.837 20 5 EFBDHN CCN1CCN(Cc2ccc(Br)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000796315144 1292868405 /nfs/dbraw/zinc/86/84/05/1292868405.db2.gz FEOHTKUETDKLSX-NSHDSACASA-N 0 3 342.237 2.883 20 5 EFBDHN CN1CCC(Oc2cc([N+](=O)[O-])cc(F)c2Br)CC1 ZINC001233903092 1313014526 /nfs/dbraw/zinc/01/45/26/1313014526.db2.gz ABWNGDDMXNESNN-UHFFFAOYSA-N 0 3 333.157 2.969 20 5 EFBDHN CC(C)N1CC[C@H](Oc2c([N+](=O)[O-])cc([N+](=O)[O-])c3cccnc32)C1 ZINC001233903019 1313014800 /nfs/dbraw/zinc/01/48/00/1313014800.db2.gz ZQHZYMIXOPJBLR-NSHDSACASA-N 0 3 346.343 2.913 20 5 EFBDHN CN1CCN(CCNc2ncc([N+](=O)[O-])c3ccccc32)CC1(C)C ZINC000884497117 1294159655 /nfs/dbraw/zinc/15/96/55/1294159655.db2.gz PETWRPLWJGZHPK-UHFFFAOYSA-N 0 3 343.431 2.581 20 5 EFBDHN CN(CCCNC(=O)c1ccccc1O)Cc1cccc([N+](=O)[O-])c1 ZINC001234100072 1313057174 /nfs/dbraw/zinc/05/71/74/1313057174.db2.gz WEFGJABPEPKVAY-UHFFFAOYSA-N 0 3 343.383 2.552 20 5 EFBDHN CC(C)N1CCC[C@H](Oc2cc(N3CCOCC3)ccc2[N+](=O)[O-])C1 ZINC001234363425 1313113864 /nfs/dbraw/zinc/11/38/64/1313113864.db2.gz IDEXDBWWKZGQIU-INIZCTEOSA-N 0 3 349.431 2.683 20 5 EFBDHN Cc1ccccc1[C@@H](CO)N(C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000886435868 1294966651 /nfs/dbraw/zinc/96/66/51/1294966651.db2.gz KVEWZCHSTZZWRP-MSOLQXFVSA-N 0 3 330.384 2.602 20 5 EFBDHN Cc1ccsc1C(=O)NCCCNCc1csc([N+](=O)[O-])c1 ZINC001154204180 1295152050 /nfs/dbraw/zinc/15/20/50/1295152050.db2.gz KHHPPNOZNVHIAQ-UHFFFAOYSA-N 0 3 339.442 2.936 20 5 EFBDHN Cc1ncc(C(=O)NCCCN(C)Cc2cccc([N+](=O)[O-])c2)s1 ZINC001235274907 1313279592 /nfs/dbraw/zinc/27/95/92/1313279592.db2.gz AMQLFWALJMMELP-UHFFFAOYSA-N 0 3 348.428 2.612 20 5 EFBDHN Cc1ccccc1OCCN(C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776274382 1297338765 /nfs/dbraw/zinc/33/87/65/1297338765.db2.gz HHSBMYVKMZISMY-KRWDZBQOSA-N 0 3 330.384 2.947 20 5 EFBDHN Cc1nn(C)cc1[C@H]1CCCN1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776586407 1299666078 /nfs/dbraw/zinc/66/60/78/1299666078.db2.gz OBWJYZQFTYGXIF-IAGOWNOFSA-N 0 3 330.388 2.507 20 5 EFBDHN CN(CCOCc1ccccc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776592629 1299693197 /nfs/dbraw/zinc/69/31/97/1299693197.db2.gz REFPKUPMYYEUFZ-GOSISDBHSA-N 0 3 330.384 2.777 20 5 EFBDHN Cc1n[nH]c(C)c1[C@@H]1CCCN1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776601932 1299731850 /nfs/dbraw/zinc/73/18/50/1299731850.db2.gz NNCXOUJNBYZCSK-JKSUJKDBSA-N 0 3 330.388 2.805 20 5 EFBDHN COc1cccc(C2(NC[C@H](O)c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000776606391 1299751795 /nfs/dbraw/zinc/75/17/95/1299751795.db2.gz WMSCTVMOWKWDEL-KRWDZBQOSA-N 0 3 328.368 2.916 20 5 EFBDHN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N[C@@H](C)CN1CCC(C)CC1 ZINC000855900359 1301164617 /nfs/dbraw/zinc/16/46/17/1301164617.db2.gz AMXAKMKHAQGJOQ-LBPRGKRZSA-N 0 3 337.395 2.893 20 5 EFBDHN CN(Cc1ccccc1)C1CN(c2cc(F)c([N+](=O)[O-])cc2CO)C1 ZINC000865800829 1303406736 /nfs/dbraw/zinc/40/67/36/1303406736.db2.gz NKMPJRVTOSSJKB-UHFFFAOYSA-N 0 3 345.374 2.547 20 5 EFBDHN CCN(C)C(C)(C)C(=O)N[C@H]1C[C@@H](Nc2cc(C)ccc2[N+](=O)[O-])C1 ZINC001097231090 1313921737 /nfs/dbraw/zinc/92/17/37/1313921737.db2.gz NJSLHHBOHXVFNP-OKILXGFUSA-N 0 3 348.447 2.693 20 5 EFBDHN C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])NCC(=O)NCc1ccccc1 ZINC000866245885 1303578553 /nfs/dbraw/zinc/57/85/53/1303578553.db2.gz HINRXSPSAQTSOM-ZDUSSCGKSA-N 0 3 345.374 2.571 20 5 EFBDHN CCn1ncc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])c1C ZINC000870453627 1305330152 /nfs/dbraw/zinc/33/01/52/1305330152.db2.gz BLEPUAVZHWUIPF-IAQYHMDHSA-N 0 3 335.335 2.914 20 5 EFBDHN Cc1ccn(C[C@H](C)C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])n1 ZINC000870455377 1305331079 /nfs/dbraw/zinc/33/10/79/1305331079.db2.gz YJSGHEKWZQBBFS-GHJWDPDVSA-N 0 3 349.362 2.916 20 5 EFBDHN C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC000901026726 1309225666 /nfs/dbraw/zinc/22/56/66/1309225666.db2.gz OULWIOJUCNTWIC-UFBFGSQYSA-N 0 3 341.770 2.600 20 5 EFBDHN C[C@H](CN(C)CCc1cccc([N+](=O)[O-])c1)NC(=O)OC(C)(C)C ZINC000801601066 1310582068 /nfs/dbraw/zinc/58/20/68/1310582068.db2.gz AJJUDZFMCFWOEF-CYBMUJFWSA-N 0 3 337.420 2.982 20 5 EFBDHN CCN(C)C(C)(C)C(=O)N(C)CCNc1cc(C)ccc1[N+](=O)[O-] ZINC001101830487 1311264265 /nfs/dbraw/zinc/26/42/65/1311264265.db2.gz VDYOYYPAWJOVMP-UHFFFAOYSA-N 0 3 336.436 2.504 20 5 EFBDHN O=[N+]([O-])c1ccc(CCO[C@H]2CC[C@H](N3CCOCC3)CC2)cc1 ZINC001224332631 1311376842 /nfs/dbraw/zinc/37/68/42/1311376842.db2.gz ZOXZKNNPCBPPIA-SAABIXHNSA-N 0 3 334.416 2.797 20 5 EFBDHN C[C@@H](Nc1ccc2c(ccc(Cl)c2[N+](=O)[O-])n1)[C@@H]1CNCCO1 ZINC001159500997 1311527488 /nfs/dbraw/zinc/52/74/88/1311527488.db2.gz UWJFUATWANOLHL-RNCFNFMXSA-N 0 3 336.779 2.585 20 5 EFBDHN CC(C)(CC(F)F)C(=O)NCCCNCc1ccccc1[N+](=O)[O-] ZINC001159690323 1311565943 /nfs/dbraw/zinc/56/59/43/1311565943.db2.gz CMBHUHHSAXMBMQ-UHFFFAOYSA-N 0 3 343.374 2.872 20 5 EFBDHN Cc1cc(Cl)c([N+](=O)[O-])c(-n2nc(-c3ccncc3)cc2CN)n1 ZINC001160337824 1311692283 /nfs/dbraw/zinc/69/22/83/1311692283.db2.gz MMMVOGVVYSXFQO-UHFFFAOYSA-N 0 3 344.762 2.658 20 5 EFBDHN Cc1cc(C)c(C(=O)NCCCNCc2csc([N+](=O)[O-])c2)[nH]1 ZINC001161060712 1311848716 /nfs/dbraw/zinc/84/87/16/1311848716.db2.gz YKFQCUWXRJCVSD-UHFFFAOYSA-N 0 3 336.417 2.511 20 5 EFBDHN Cc1cc(C)nc(C(=O)NCCCNCc2csc([N+](=O)[O-])c2)c1 ZINC001161575870 1311920522 /nfs/dbraw/zinc/92/05/22/1311920522.db2.gz MRLLLBGDTMYSSK-UHFFFAOYSA-N 0 3 348.428 2.578 20 5 EFBDHN O=[N+]([O-])c1cncnc1O[C@H]1[C@@H]2CC[C@H]1CN(Cc1ccccc1)C2 ZINC001228655258 1311976433 /nfs/dbraw/zinc/97/64/33/1311976433.db2.gz PWCNJOGXINSWJB-QLPKVWCKSA-N 0 3 340.383 2.674 20 5 EFBDHN O=[N+]([O-])c1ccc(O[C@@H]2CN3CCC2CC3)cc1Br ZINC001229086279 1312045972 /nfs/dbraw/zinc/04/59/72/1312045972.db2.gz OMTRKACVYUVVAN-CYBMUJFWSA-N 0 3 327.178 2.830 20 5 EFBDHN O=[N+]([O-])c1cc(Br)cc(O[C@H]2CN3CCC2CC3)c1 ZINC001229146017 1312053643 /nfs/dbraw/zinc/05/36/43/1312053643.db2.gz OHZRISUJTDTLDZ-ZDUSSCGKSA-N 0 3 327.178 2.830 20 5 EFBDHN COCCN1CCC(Oc2cc([N+](=O)[O-])cc3cccnc32)CC1 ZINC001229344176 1312081530 /nfs/dbraw/zinc/08/15/30/1312081530.db2.gz RNENNPHFLSYUPD-UHFFFAOYSA-N 0 3 331.372 2.633 20 5 EFBDHN O=[N+]([O-])c1ncc(Br)cc1OC1CCN(C2CC2)CC1 ZINC001229561346 1312113786 /nfs/dbraw/zinc/11/37/86/1312113786.db2.gz WOSJBDVLTBFRNS-UHFFFAOYSA-N 0 3 342.193 2.758 20 5 EFBDHN Cc1ccc(C(=O)NCCCNCc2ccccc2[N+](=O)[O-])nc1C ZINC001162601563 1312133645 /nfs/dbraw/zinc/13/36/45/1312133645.db2.gz OEWFLCDWLODDFX-UHFFFAOYSA-N 0 3 342.399 2.516 20 5 EFBDHN CCc1cncc(C(=O)NCCCNCc2csc([N+](=O)[O-])c2)c1 ZINC001162622270 1312137929 /nfs/dbraw/zinc/13/79/29/1312137929.db2.gz KKCQJKXIOHCORZ-UHFFFAOYSA-N 0 3 348.428 2.523 20 5 EFBDHN COC(=O)c1ccc([N+](=O)[O-])cc1-n1c2ccccc2nc1[C@H](C)N ZINC001162765739 1312171149 /nfs/dbraw/zinc/17/11/49/1312171149.db2.gz ISZSHXMLVOJWDN-JTQLQIEISA-N 0 3 340.339 2.740 20 5 EFBDHN O=C(NCCC1(CNCc2csc([N+](=O)[O-])c2)CC1)C1CCC1 ZINC001163103796 1312241466 /nfs/dbraw/zinc/24/14/66/1312241466.db2.gz JSFHFYBZZGMGHX-UHFFFAOYSA-N 0 3 337.445 2.833 20 5 EFBDHN CC1(C(=O)N2C[C@H]3CN(Cc4ccc([N+](=O)[O-])cc4)C[C@H]3C2)CCC1 ZINC001048988660 1312328720 /nfs/dbraw/zinc/32/87/20/1312328720.db2.gz LOCJXRYFCBQDKP-IYBDPMFKSA-N 0 3 343.427 2.675 20 5 EFBDHN CN1CCC(Oc2c(Br)cc(F)cc2[N+](=O)[O-])CC1 ZINC001230932709 1312396019 /nfs/dbraw/zinc/39/60/19/1312396019.db2.gz WSNVXOXWEUDBBJ-UHFFFAOYSA-N 0 3 333.157 2.969 20 5 EFBDHN C/C=C(/C)C(=O)NCCC1(CNCc2ccccc2[N+](=O)[O-])CC1 ZINC001163991505 1312421593 /nfs/dbraw/zinc/42/15/93/1312421593.db2.gz AUPSDSYIKJFHQI-BNNQUZSASA-N 0 3 331.416 2.937 20 5 EFBDHN C/C=C(/C)C(=O)NCCC1(CNCc2csc([N+](=O)[O-])c2)CC1 ZINC001163992106 1312422039 /nfs/dbraw/zinc/42/20/39/1312422039.db2.gz KNXFGIQISJSTTN-BASWHVEKSA-N 0 3 337.445 2.999 20 5 EFBDHN Cc1nc(O[C@@H]2CCN(C(C)C)C2)c([N+](=O)[O-])cc1Br ZINC001231120181 1312436274 /nfs/dbraw/zinc/43/62/74/1312436274.db2.gz JQNHOVVNZZINKU-SNVBAGLBSA-N 0 3 344.209 2.922 20 5 EFBDHN Cc1nc(OC2CCN(C)CC2)c([N+](=O)[O-])cc1Br ZINC001231121872 1312437815 /nfs/dbraw/zinc/43/78/15/1312437815.db2.gz OIIONLSMFHUCQI-UHFFFAOYSA-N 0 3 330.182 2.534 20 5 EFBDHN CN(CCCNC(=O)Cc1cccs1)Cc1cccc([N+](=O)[O-])c1 ZINC001231242757 1312461811 /nfs/dbraw/zinc/46/18/11/1312461811.db2.gz GQPHYJDVRGDBPU-UHFFFAOYSA-N 0 3 347.440 2.837 20 5 EFBDHN O=C(NCCCNCc1ccccc1[N+](=O)[O-])C1CC2(CCC2)C1 ZINC001164257983 1312480368 /nfs/dbraw/zinc/48/03/68/1312480368.db2.gz UEDZQTNZSUEHKZ-UHFFFAOYSA-N 0 3 331.416 2.771 20 5 EFBDHN O=[N+]([O-])c1ccc(-n2ncc3c2CCNC3)nc1-c1ccc(F)cc1 ZINC001165222591 1312590350 /nfs/dbraw/zinc/59/03/50/1312590350.db2.gz FIKQMWQHXUPATK-UHFFFAOYSA-N 0 3 339.330 2.627 20 5 EFBDHN O=C1CCN(Cc2ccc3ccc4cccnc4c3n2)C[C@H]2CCCN12 ZINC001232229018 1312653056 /nfs/dbraw/zinc/65/30/56/1312653056.db2.gz XLDWYNNFBYJUFW-GOSISDBHSA-N 0 3 346.434 2.980 20 5 EFBDHN CNC(=O)NC1CCN(Cc2ccc3ccc4cccnc4c3n2)CC1 ZINC001232229052 1312654123 /nfs/dbraw/zinc/65/41/23/1312654123.db2.gz YOFTYCUMOIPFKJ-UHFFFAOYSA-N 0 3 349.438 2.676 20 5 EFBDHN Cc1cc(C(=O)N[C@H]2C[C@H](NCc3ccccc3[N+](=O)[O-])C2)oc1C ZINC001020074029 1314600104 /nfs/dbraw/zinc/60/01/04/1314600104.db2.gz VGCNSLBYYYYOCS-SHTZXODSSA-N 0 3 343.383 2.855 20 5 EFBDHN N[C@@]1(C(F)(F)F)CCN([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001246572997 1314650659 /nfs/dbraw/zinc/65/06/59/1314650659.db2.gz VNWIKKJXXPAHSA-ZFWWWQNUSA-N 0 3 343.349 2.808 20 5 EFBDHN N[C@H]1CN([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCC1(F)F ZINC001246603488 1314655878 /nfs/dbraw/zinc/65/58/78/1314655878.db2.gz YUJZAXMPNCWMAQ-ZFWWWQNUSA-N 0 3 325.359 2.511 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)CC[C@H](N1CCNC[C@H]1C(F)(F)F)CC2 ZINC001246985363 1314723928 /nfs/dbraw/zinc/72/39/28/1314723928.db2.gz BLFVNDQWHOTSAD-HIFRSBDPSA-N 0 3 343.349 2.678 20 5 EFBDHN Cc1c(-c2nc(-c3ccc4c(n3)CCNC4)no2)cccc1[N+](=O)[O-] ZINC001215367876 1314825477 /nfs/dbraw/zinc/82/54/77/1314825477.db2.gz HDNQTRNQSZUKKV-UHFFFAOYSA-N 0 3 337.339 2.661 20 5 EFBDHN N[C@H](Cc1nc(-c2ncc(F)cc2[N+](=O)[O-])no1)c1ccccc1F ZINC001249336068 1315056226 /nfs/dbraw/zinc/05/62/26/1315056226.db2.gz AQTIIUFKIZGJJU-LLVKDONJSA-N 0 3 347.281 2.561 20 5 EFBDHN O=[N+]([O-])c1cc(OC(F)(F)F)ccc1O[C@@H]1CNCCC1(F)F ZINC001218447601 1315196893 /nfs/dbraw/zinc/19/68/93/1315196893.db2.gz KAOZIYSATNSVOZ-SNVBAGLBSA-N 0 3 342.220 2.869 20 5 EFBDHN O=[N+]([O-])c1cccc(O[C@@H]2CNCCC2(F)F)c1Br ZINC001218448480 1315197165 /nfs/dbraw/zinc/19/71/65/1315197165.db2.gz NCPFIMXEWKFFEM-SECBINFHSA-N 0 3 337.120 2.733 20 5 EFBDHN O=[N+]([O-])c1cc(O[C@H]2CNCCC2(F)F)ccc1Br ZINC001218447881 1315197212 /nfs/dbraw/zinc/19/72/12/1315197212.db2.gz KAUBXNVUQLXJCP-JTQLQIEISA-N 0 3 337.120 2.733 20 5 EFBDHN O=[N+]([O-])c1ccc(Br)c(O[C@@H]2CNCCC2(F)F)c1 ZINC001218449893 1315198212 /nfs/dbraw/zinc/19/82/12/1315198212.db2.gz WYCKXPFFSHYVCY-SNVBAGLBSA-N 0 3 337.120 2.733 20 5 EFBDHN COC(=O)c1ccc(C)c([N+](=O)[O-])c1O[C@H]1CNCc2ccccc21 ZINC001218491308 1315204700 /nfs/dbraw/zinc/20/47/00/1315204700.db2.gz WJDMOWPVTPVKQH-HNNXBMFYSA-N 0 3 342.351 2.913 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCC(NCc3ccncc3F)CC2)cc1 ZINC001254465587 1315707215 /nfs/dbraw/zinc/70/72/15/1315707215.db2.gz FRKSMJLVJWEGRH-UHFFFAOYSA-N 0 3 330.363 2.888 20 5 EFBDHN C[C@@H]1CN(C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CCCC1=O ZINC001254476410 1315707375 /nfs/dbraw/zinc/70/73/75/1315707375.db2.gz QUNLWFIXCINANR-CQSZACIVSA-N 0 3 331.416 2.865 20 5 EFBDHN C[C@H]1CN(C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CCCC1=O ZINC001254476409 1315707644 /nfs/dbraw/zinc/70/76/44/1315707644.db2.gz QUNLWFIXCINANR-AWEZNQCLSA-N 0 3 331.416 2.865 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N[C@H]1Cc2ccccc2NC1=O ZINC001254535817 1315721287 /nfs/dbraw/zinc/72/12/87/1315721287.db2.gz LPNPPPKBDWDDCO-WBMJQRKESA-N 0 3 325.368 2.679 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N[C@@H]1Cc2ccccc2NC1=O ZINC001254535814 1315721375 /nfs/dbraw/zinc/72/13/75/1315721375.db2.gz LPNPPPKBDWDDCO-BLLLJJGKSA-N 0 3 325.368 2.679 20 5 EFBDHN CCOC(=O)c1ccnc(CN[C@H](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC001254537713 1315721450 /nfs/dbraw/zinc/72/14/50/1315721450.db2.gz GSFARLFTPXAUMY-CYBMUJFWSA-N 0 3 343.383 2.887 20 5 EFBDHN CC(C)Oc1nccc(CN[C@H](C)Cc2ccccc2[N+](=O)[O-])n1 ZINC001254543192 1315721928 /nfs/dbraw/zinc/72/19/28/1315721928.db2.gz CLRUFAFEWRDENW-CYBMUJFWSA-N 0 3 330.388 2.893 20 5 EFBDHN COc1ccccc1[C@@H](CO)N[C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC001254548817 1315722135 /nfs/dbraw/zinc/72/21/35/1315722135.db2.gz MKYLNNAFPJBRDA-XJKSGUPXSA-N 0 3 330.384 2.858 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])NCc1ccnc(OCC2CC2)n1 ZINC001254547015 1315722272 /nfs/dbraw/zinc/72/22/72/1315722272.db2.gz BTNRLZJXOCUCPR-ZDUSSCGKSA-N 0 3 342.399 2.894 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N1CCC2(CCCC(=O)N2)CC1 ZINC001254556395 1315723710 /nfs/dbraw/zinc/72/37/10/1315723710.db2.gz KUBBTZNQEFZRMW-CQSZACIVSA-N 0 3 331.416 2.661 20 5 EFBDHN CCO[C@@H]1CN([C@H](C)Cc2ccccc2[N+](=O)[O-])[C@@H]2CCCO[C@H]12 ZINC001254561174 1315723998 /nfs/dbraw/zinc/72/39/98/1315723998.db2.gz JQYGTSQPXAEDBQ-PILAGYSTSA-N 0 3 334.416 2.794 20 5 EFBDHN Cc1nccnc1O[C@H]1CCN([C@@H](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC001254568437 1315724646 /nfs/dbraw/zinc/72/46/46/1315724646.db2.gz FZEHAUOHPDYNRX-BBRMVZONSA-N 0 3 342.399 2.778 20 5 EFBDHN Cc1nccnc1O[C@@H]1CCN([C@@H](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC001254568443 1315725302 /nfs/dbraw/zinc/72/53/02/1315725302.db2.gz FZEHAUOHPDYNRX-XJKSGUPXSA-N 0 3 342.399 2.778 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N1CCC[C@@H](Oc2ncccn2)C1 ZINC001254570570 1315725708 /nfs/dbraw/zinc/72/57/08/1315725708.db2.gz NYOAJHQVAWHVLQ-GDBMZVCRSA-N 0 3 342.399 2.859 20 5 EFBDHN CC(C)(F)c1ncncc1CN[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254581128 1315726973 /nfs/dbraw/zinc/72/69/73/1315726973.db2.gz KVKHEQLOYXIGIP-CQSZACIVSA-N 0 3 330.363 2.846 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@@H](N1CCC[C@](O)(C(F)(F)F)CC1)C2 ZINC001254599320 1315729028 /nfs/dbraw/zinc/72/90/28/1315729028.db2.gz NUDBYLPIJJKAKH-LSDHHAIUSA-N 0 3 344.333 2.841 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@H](N1CCC[C@@](O)(C(F)(F)F)CC1)C2 ZINC001254599317 1315729126 /nfs/dbraw/zinc/72/91/26/1315729126.db2.gz NUDBYLPIJJKAKH-CABCVRRESA-N 0 3 344.333 2.841 20 5 EFBDHN CN(CCN(C)[C@H]1Cc2ccc([N+](=O)[O-])cc2C1)C(=O)OC(C)(C)C ZINC001254596424 1315729197 /nfs/dbraw/zinc/72/91/97/1315729197.db2.gz DNXJAKYJXBXIIJ-INIZCTEOSA-N 0 3 349.431 2.861 20 5 EFBDHN Cc1nnc(C2CCN([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)CC2)o1 ZINC001254605473 1315730462 /nfs/dbraw/zinc/73/04/62/1315730462.db2.gz AHFDUMQVOJSAAS-INIZCTEOSA-N 0 3 328.372 2.633 20 5 EFBDHN Cc1cnccc1O[C@@H]1CCN([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254606320 1315730710 /nfs/dbraw/zinc/73/07/10/1315730710.db2.gz GJHMHVARPKWLHX-ZWKOTPCHSA-N 0 3 339.395 2.919 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@H](N1CC[C@H](N3CCCC3)[C@@H](F)C1)C2 ZINC001254610218 1315730887 /nfs/dbraw/zinc/73/08/87/1315730887.db2.gz JGYVKKKZEOPIIC-SQNIBIBYSA-N 0 3 333.407 2.570 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@@H](N1CC[C@@H](N3CCCCC3)[C@@H](F)C1)C2 ZINC001254610561 1315731164 /nfs/dbraw/zinc/73/11/64/1315731164.db2.gz NMNBDFFDQPXVLR-GBESFXJTSA-N 0 3 347.434 2.960 20 5 EFBDHN Cc1cccnc1O[C@H]1CCN([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254612056 1315731787 /nfs/dbraw/zinc/73/17/87/1315731787.db2.gz USWGDGNGRAFCKW-MSOLQXFVSA-N 0 3 339.395 2.919 20 5 EFBDHN COC(=O)[C@@H]1CCC[C@H]1NCc1cc([N+](=O)[O-])ccc1OC(F)F ZINC001255734673 1315862765 /nfs/dbraw/zinc/86/27/65/1315862765.db2.gz VZGCVJJWBMJTCC-VXGBXAGGSA-N 0 3 344.314 2.628 20 5 EFBDHN COc1cc(N2CCC(n3ccnc3[C@H](C)N)CC2)ccc1[N+](=O)[O-] ZINC001256083509 1315903195 /nfs/dbraw/zinc/90/31/95/1315903195.db2.gz QYYYMJUTXXLKQA-LBPRGKRZSA-N 0 3 345.403 2.661 20 5 EFBDHN COc1cc(N2CCC(N3CCOC(C)(C)C3)CC2)ccc1[N+](=O)[O-] ZINC001256093676 1315903688 /nfs/dbraw/zinc/90/36/88/1315903688.db2.gz DXQSCGHMTYAXIN-UHFFFAOYSA-N 0 3 349.431 2.683 20 5 EFBDHN COc1cc(N2CCC(N3C[C@@H](C)[C@@H](F)C3)CC2)ccc1[N+](=O)[O-] ZINC001256094252 1315904145 /nfs/dbraw/zinc/90/41/45/1315904145.db2.gz WIYOGGYQPGUFFL-DOMZBBRYSA-N 0 3 337.395 2.862 20 5 EFBDHN COc1cc(N2CCC(N3CCC[C@H]3C(C)=O)CC2)ccc1[N+](=O)[O-] ZINC001256103592 1315905024 /nfs/dbraw/zinc/90/50/24/1315905024.db2.gz NWBYZVCKUYKFLS-INIZCTEOSA-N 0 3 347.415 2.626 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)c2ncnc(N[C@H]3CN4CCC3CC4)c2c1 ZINC001262712531 1316483297 /nfs/dbraw/zinc/48/32/97/1316483297.db2.gz IBPZRLXVOXCHBI-ZDUSSCGKSA-N 0 3 333.779 2.698 20 5 EFBDHN O=C(c1ccccc1)N1CCC[C@@H](NCc2cccc([N+](=O)[O-])c2)C1 ZINC001321652798 1329401340 /nfs/dbraw/zinc/40/13/40/1329401340.db2.gz DXBZILCZEUXHFL-QGZVFWFLSA-N 0 3 339.395 2.989 20 5 EFBDHN Cc1cncc([N+](=O)[O-])c1NCCCN1CCc2ccccc2C1 ZINC001322470948 1329460967 /nfs/dbraw/zinc/46/09/67/1329460967.db2.gz YBDHYQQAQMBAQI-UHFFFAOYSA-N 0 3 326.400 2.580 20 5 EFBDHN O=[N+]([O-])c1ccc(CNC[C@@H](CO)CC2CCOCC2)c(Cl)c1 ZINC001326560367 1330317879 /nfs/dbraw/zinc/31/78/79/1330317879.db2.gz FDHZELBGGJZUKX-ZDUSSCGKSA-N 0 3 342.823 2.763 20 5 EFBDHN C[C@H]1[C@H](C)N(c2ncnc3c(Cl)cc([N+](=O)[O-])cc32)CCN1C ZINC001328555917 1330602519 /nfs/dbraw/zinc/60/25/19/1330602519.db2.gz FYZGMHPCMHEJLC-UWVGGRQHSA-N 0 3 335.795 2.720 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CCC[C@@](O)(c3ccccc3)C2)c1 ZINC001328882623 1330643174 /nfs/dbraw/zinc/64/31/74/1330643174.db2.gz AYAFGSYUPKUNJN-MOPGFXCFSA-N 0 3 342.395 2.612 20 5 EFBDHN CN1CCN(C(C)(C)CNc2ccc([N+](=O)[O-])cc2C(F)F)CC1 ZINC001329288281 1330690350 /nfs/dbraw/zinc/69/03/50/1330690350.db2.gz WUAGVUFKIARGOS-UHFFFAOYSA-N 0 3 342.390 2.970 20 5 EFBDHN O=C(Nc1nccc2ccc([N+](=O)[O-])cc21)C12CCCN1CCC2 ZINC001332557133 1330984988 /nfs/dbraw/zinc/98/49/88/1330984988.db2.gz JUGIXCZXZLWZSF-UHFFFAOYSA-N 0 3 326.356 2.710 20 5 EFBDHN COc1ccccc1C1(NCCn2c(C)ncc2[N+](=O)[O-])CCC1 ZINC001333022887 1331068176 /nfs/dbraw/zinc/06/81/76/1331068176.db2.gz PJVUSFDGGXUNMT-UHFFFAOYSA-N 0 3 330.388 2.777 20 5 EFBDHN CSc1ccc(OC[C@H](O)CNCc2ccc([N+](=O)[O-])cc2)cc1 ZINC001338408239 1331705254 /nfs/dbraw/zinc/70/52/54/1331705254.db2.gz MZAXVQCEECGPKN-OAHLLOKOSA-N 0 3 348.424 2.846 20 5 EFBDHN CC(C)NC(=O)c1ccc(N[C@@H]2CN(C3CC3)C[C@H]2C)c([N+](=O)[O-])c1 ZINC001339608439 1331911649 /nfs/dbraw/zinc/91/16/49/1331911649.db2.gz BEXKIHNNONVDMX-MLGOLLRUSA-N 0 3 346.431 2.628 20 5 EFBDHN COc1ccc(NC(=O)N(CCN(C)C)CC(C)C)c([N+](=O)[O-])c1 ZINC001344460944 1332455147 /nfs/dbraw/zinc/45/51/47/1332455147.db2.gz SJUVEYIDEXFQAX-UHFFFAOYSA-N 0 3 338.408 2.655 20 5 EFBDHN Cc1cncc([N+](=O)[O-])c1N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC001346094318 1332598436 /nfs/dbraw/zinc/59/84/36/1332598436.db2.gz IFNULRMEDFLYJL-GOEBONIOSA-N 0 3 326.400 2.653 20 5 EFBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CCCCN1C ZINC001346433033 1332639723 /nfs/dbraw/zinc/63/97/23/1332639723.db2.gz DLGYPKYDNDZIFM-KRWDZBQOSA-N 0 3 348.447 2.999 20 5 EFBDHN Cc1ccc(CN2CCCN(c3ncc([N+](=O)[O-])c(C)n3)CC2)cc1 ZINC001347825155 1332776066 /nfs/dbraw/zinc/77/60/66/1332776066.db2.gz IDVSLCRZTLGHIS-UHFFFAOYSA-N 0 3 341.415 2.714 20 5 EFBDHN Cc1cc(F)cc(C(=O)N[C@H]2CCCN3CCCC[C@@H]23)c1[N+](=O)[O-] ZINC000847254949 1333449327 /nfs/dbraw/zinc/44/93/27/1333449327.db2.gz HZTWLDQYMGIMHV-GJZGRUSLSA-N 0 3 335.379 2.789 20 5 EFBDHN O=C(NCCN[C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(F)cc1 ZINC000848527172 1334775492 /nfs/dbraw/zinc/77/54/92/1334775492.db2.gz UDVXUDSZQBOUCA-MRXNPFEDSA-N 0 3 343.358 2.741 20 5 EFBDHN COC(=O)Cc1ccccc1CN[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000848573594 1334802519 /nfs/dbraw/zinc/80/25/19/1334802519.db2.gz WEBWZVUAGVAQBV-LBPRGKRZSA-N 0 3 343.383 2.743 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)NC[C@H]2CCCCN2C)cc1[N+](=O)[O-] ZINC001357291336 1335297182 /nfs/dbraw/zinc/29/71/82/1335297182.db2.gz KRUSNTLQRUKEGT-DZGCQCFKSA-N 0 3 334.420 2.748 20 5 EFBDHN Cc1cc(C(=O)N[C@H]2C[C@@H](NCc3ccccc3[N+](=O)[O-])C2)oc1C ZINC001021968540 714621002 /nfs/dbraw/zinc/62/10/02/714621002.db2.gz VGCNSLBYYYYOCS-GASCZTMLSA-N 0 3 343.383 2.855 20 5 EFBDHN COc1ccc(C[C@@](C)(CO)NCc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000933425795 714773253 /nfs/dbraw/zinc/77/32/53/714773253.db2.gz SCMUWJMLDWJBHF-SFHVURJKSA-N 0 3 348.374 2.826 20 5 EFBDHN COc1ccc(C[C@](C)(CO)NCc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000933425794 714773426 /nfs/dbraw/zinc/77/34/26/714773426.db2.gz SCMUWJMLDWJBHF-GOSISDBHSA-N 0 3 348.374 2.826 20 5 EFBDHN COc1c([O-])ccc(CN2CCC([NH+]3CCCCC3)CC2)c1[N+](=O)[O-] ZINC000891568264 714828650 /nfs/dbraw/zinc/82/86/50/714828650.db2.gz PHOTXHZMTMBSCG-UHFFFAOYSA-N 0 3 349.431 2.759 20 5 EFBDHN O=C(N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1)c1occc1Cl ZINC001022660356 715278906 /nfs/dbraw/zinc/27/89/06/715278906.db2.gz QRUGOJZPVYVAPM-TXEJJXNPSA-N 0 3 349.774 2.892 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1 ZINC000934398095 715449858 /nfs/dbraw/zinc/44/98/58/715449858.db2.gz RLSNIFNJNLDWMQ-GHMZBOCLSA-N 0 3 335.429 2.672 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N(C)[C@H]2CCCN(C)C2)cc1[N+](=O)[O-] ZINC000893453541 715571108 /nfs/dbraw/zinc/57/11/08/715571108.db2.gz PPKDYJAZTZNNIR-ZFWWWQNUSA-N 0 3 334.420 2.700 20 5 EFBDHN COc1c([O-])ccc(C[N@@H+]2CCC[C@@H]2[C@H]2CCCOC2)c1[N+](=O)[O-] ZINC000895081992 723233676 /nfs/dbraw/zinc/23/36/76/723233676.db2.gz LRQYJCGUGLWVBN-UONOGXRCSA-N 0 3 336.388 2.700 20 5 EFBDHN COc1c([O-])ccc(C[N@H+]2CCC[C@@H]2[C@H]2CCCOC2)c1[N+](=O)[O-] ZINC000895081992 723233680 /nfs/dbraw/zinc/23/36/80/723233680.db2.gz LRQYJCGUGLWVBN-UONOGXRCSA-N 0 3 336.388 2.700 20 5 EFBDHN C[C@@H]1CN(Cc2ccc(Br)c([N+](=O)[O-])c2)C[C@H](C)N1C ZINC000141908917 723475512 /nfs/dbraw/zinc/47/55/12/723475512.db2.gz ZQBGJXAPVRODQS-PHIMTYICSA-N 0 3 342.237 2.882 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]C[C@H](C)c2ncc(C)s2)c1[N+](=O)[O-] ZINC000893577491 717638957 /nfs/dbraw/zinc/63/89/57/717638957.db2.gz ZYDQYUALTNZZDN-VIFPVBQESA-N 0 3 337.401 2.967 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCCN3CCCC[C@H]23)c1C ZINC000892596068 718322303 /nfs/dbraw/zinc/32/23/03/718322303.db2.gz MVFXLEWNSCPKQD-HUUCEWRRSA-N 0 3 331.416 2.958 20 5 EFBDHN CC(C)[C@H](C(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl)N(C)C ZINC000106903073 718649938 /nfs/dbraw/zinc/64/99/38/718649938.db2.gz CHHOEYQDPQBLGD-CQSZACIVSA-N 0 3 327.812 2.793 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]C[C@]2(C)CCO[C@H]2C2CC2)c1[N+](=O)[O-] ZINC000893642224 719008893 /nfs/dbraw/zinc/00/88/93/719008893.db2.gz MTQDJCDCOMQEGX-IRXDYDNUSA-N 0 3 336.388 2.604 20 5 EFBDHN CC(C)CN1CCN(c2ccc(-c3ccccc3[N+](=O)[O-])nn2)CC1 ZINC001164657579 719338571 /nfs/dbraw/zinc/33/85/71/719338571.db2.gz SOFCYNVZKZBXNI-UHFFFAOYSA-N 0 3 341.415 2.830 20 5 EFBDHN COc1c(O)ccc(CNCCSCC(F)(F)F)c1[N+](=O)[O-] ZINC000893229877 720132978 /nfs/dbraw/zinc/13/29/78/720132978.db2.gz MEKIYKGSWBBSRR-UHFFFAOYSA-N 0 3 340.323 2.694 20 5 EFBDHN COc1c(O)ccc(CN2CCC[C@]2(CO)CC(C)C)c1[N+](=O)[O-] ZINC000893963771 720176850 /nfs/dbraw/zinc/17/68/50/720176850.db2.gz HLMKZMIYQUVDKH-QGZVFWFLSA-N 0 3 338.404 2.682 20 5 EFBDHN COCCN(Cc1ccc(O)c(OC)c1[N+](=O)[O-])[C@@H]1CC[C@@H](C)C1 ZINC000894002260 720216608 /nfs/dbraw/zinc/21/66/08/720216608.db2.gz VCJSWDMEWJQVBL-TZMCWYRMSA-N 0 3 338.404 2.946 20 5 EFBDHN COCC[N@H+](Cc1ccc([O-])c(OC)c1[N+](=O)[O-])[C@@H]1CC[C@@H](C)C1 ZINC000894002260 720216611 /nfs/dbraw/zinc/21/66/11/720216611.db2.gz VCJSWDMEWJQVBL-TZMCWYRMSA-N 0 3 338.404 2.946 20 5 EFBDHN COCC[N@@H+](Cc1ccc([O-])c(OC)c1[N+](=O)[O-])[C@@H]1CC[C@@H](C)C1 ZINC000894002260 720216614 /nfs/dbraw/zinc/21/66/14/720216614.db2.gz VCJSWDMEWJQVBL-TZMCWYRMSA-N 0 3 338.404 2.946 20 5 EFBDHN COc1c([O-])ccc(C[NH2+][C@@H]2CCO[C@H](CC(C)C)C2)c1[N+](=O)[O-] ZINC000893320728 720608068 /nfs/dbraw/zinc/60/80/68/720608068.db2.gz UIHDWJGMGCTDKV-ZIAGYGMSSA-N 0 3 338.404 2.992 20 5 EFBDHN COc1c([O-])ccc(C[N@@H+]2CCCCC[C@@H]2C[C@H](C)O)c1[N+](=O)[O-] ZINC000894412210 722719520 /nfs/dbraw/zinc/71/95/20/722719520.db2.gz ILFKRBVISLJIME-GXTWGEPZSA-N 0 3 338.404 2.825 20 5 EFBDHN COc1c([O-])ccc(C[N@H+]2CCCCC[C@@H]2C[C@H](C)O)c1[N+](=O)[O-] ZINC000894412210 722719522 /nfs/dbraw/zinc/71/95/22/722719522.db2.gz ILFKRBVISLJIME-GXTWGEPZSA-N 0 3 338.404 2.825 20 5 EFBDHN COc1c([O-])ccc(CN(C)C(C)(C)C[NH+]2CCCC2)c1[N+](=O)[O-] ZINC000894964793 723037576 /nfs/dbraw/zinc/03/75/76/723037576.db2.gz YYMBFVZJFSMKFR-UHFFFAOYSA-N 0 3 337.420 2.615 20 5 EFBDHN O=C(N[C@H]1C[C@H](CNCc2csc([N+](=O)[O-])c2)C1)[C@H]1C[C@H]2C[C@H]2C1 ZINC000984620204 723184793 /nfs/dbraw/zinc/18/47/93/723184793.db2.gz JDININZQHOSBEZ-OABLHMDDSA-N 0 3 349.456 2.687 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000139320253 728830626 /nfs/dbraw/zinc/83/06/26/728830626.db2.gz NZHAAXBRWSNCFJ-GFCCVEGCSA-N 0 3 325.796 2.852 20 5 EFBDHN CC(C)(CNCc1ccc(Cl)cc1[N+](=O)[O-])[C@]1(O)CCCOC1 ZINC000895441715 724135118 /nfs/dbraw/zinc/13/51/18/724135118.db2.gz DXRUQHCEBKZBGV-INIZCTEOSA-N 0 3 342.823 2.906 20 5 EFBDHN C[C@H](CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-])N1CCCCC1 ZINC000918373855 728871896 /nfs/dbraw/zinc/87/18/96/728871896.db2.gz MUSNGPCGUZNWTP-LLVKDONJSA-N 0 3 325.796 2.852 20 5 EFBDHN CC(C)CN(CCN(C)C)C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000152673407 726210905 /nfs/dbraw/zinc/21/09/05/726210905.db2.gz JJGDCTGTPHJZLW-UHFFFAOYSA-N 0 3 327.812 2.908 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(OCCC(=O)OCCN2CCCCC2)c1 ZINC000915442269 726987142 /nfs/dbraw/zinc/98/71/42/726987142.db2.gz HVAHTIUBYWXYPV-UHFFFAOYSA-N 0 3 336.388 2.701 20 5 EFBDHN CC(C)c1[nH]nc(C(=O)N2CCN(C)C3(CCCCC3)C2)c1[N+](=O)[O-] ZINC000908573361 727218488 /nfs/dbraw/zinc/21/84/88/727218488.db2.gz PGAXFQAURWFOFR-UHFFFAOYSA-N 0 3 349.435 2.532 20 5 EFBDHN CCN1CCCN(C(=O)c2cccc(SC)c2[N+](=O)[O-])[C@H](C)C1 ZINC000910280850 727426759 /nfs/dbraw/zinc/42/67/59/727426759.db2.gz SYQZUDUFRCRYOQ-GFCCVEGCSA-N 0 3 337.445 2.873 20 5 EFBDHN CCN1CCCN(C(=O)c2cc(SC)ccc2[N+](=O)[O-])[C@H](C)C1 ZINC000910293288 727430875 /nfs/dbraw/zinc/43/08/75/727430875.db2.gz NJEWPZYQJAQNML-GFCCVEGCSA-N 0 3 337.445 2.873 20 5 EFBDHN CCN1CCCN(C(=O)c2ccc(SC)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000910294879 727431139 /nfs/dbraw/zinc/43/11/39/727431139.db2.gz KNQFBLLWZNSULH-LBPRGKRZSA-N 0 3 337.445 2.873 20 5 EFBDHN CCN1CCCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000910297942 727431502 /nfs/dbraw/zinc/43/15/02/727431502.db2.gz NVOAPBWQYLRRSI-ZDUSSCGKSA-N 0 3 337.445 2.630 20 5 EFBDHN CN(C[C@H]1CCCN1C)C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC000911200764 727509800 /nfs/dbraw/zinc/50/98/00/727509800.db2.gz METPGWQFWYORLW-SNVBAGLBSA-N 0 3 329.759 2.554 20 5 EFBDHN O=[N+]([O-])c1ccc(NC[C@@H](c2ccco2)N2CCCC2)c2nonc21 ZINC000912730331 727738634 /nfs/dbraw/zinc/73/86/34/727738634.db2.gz BJSUTIUAPGXFKZ-ZDUSSCGKSA-N 0 3 343.343 2.973 20 5 EFBDHN Cc1ccc(C(=O)NCCNCc2cccc([N+](=O)[O-])c2C)cc1F ZINC000917136322 727775723 /nfs/dbraw/zinc/77/57/23/727775723.db2.gz XDUMEICPLNSSSV-UHFFFAOYSA-N 0 3 345.374 2.870 20 5 EFBDHN COc1ccccc1C[C@](C)(CO)NCc1ccc(F)cc1[N+](=O)[O-] ZINC000931601437 1126135638 /nfs/dbraw/zinc/13/56/38/1126135638.db2.gz OPKJGGFNWRUNMR-GOSISDBHSA-N 0 3 348.374 2.826 20 5 EFBDHN CC(C)CC[C@H](N)C(=O)Nc1nc(-c2ccc([N+](=O)[O-])cc2)c[nH]1 ZINC001575560358 1088555260 /nfs/dbraw/zinc/55/52/60/1088555260.db2.gz ATOJHJLNPCOKNO-ZDUSSCGKSA-N 0 3 331.376 2.687 20 5 EFBDHN CC(C)CC[C@@H](N)C(=O)Nc1nc(-c2ccc([N+](=O)[O-])cc2)c[nH]1 ZINC001575560355 1088555932 /nfs/dbraw/zinc/55/59/32/1088555932.db2.gz ATOJHJLNPCOKNO-CYBMUJFWSA-N 0 3 331.376 2.687 20 5 EFBDHN C[C@H]1CN[C@@H](C)[C@H](C)N1C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC001576880891 1089505464 /nfs/dbraw/zinc/50/54/64/1089505464.db2.gz SAPLCIZYMUDRLP-GUBZILKMSA-N 0 3 345.321 2.825 20 5 EFBDHN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)c1cc2c(s1)CCNC2 ZINC001578478640 1090382633 /nfs/dbraw/zinc/38/26/33/1090382633.db2.gz NSHHBFCEEWQCNX-UHFFFAOYSA-N 0 3 345.424 2.617 20 5 EFBDHN N[C@@H](CC1CC1)C(=O)N[C@H](c1cccc([N+](=O)[O-])c1F)C(F)(F)F ZINC001580122251 1090780256 /nfs/dbraw/zinc/78/02/56/1090780256.db2.gz QCTNNOGTVLEZCM-JOYOIKCWSA-N 0 3 349.284 2.581 20 5 EFBDHN NC1(C(=O)Nc2nccc3ccc([N+](=O)[O-])cc32)Cc2ccccc2C1 ZINC001580139729 1090787450 /nfs/dbraw/zinc/78/74/50/1090787450.db2.gz CBJVFTCNAYABQO-UHFFFAOYSA-N 0 3 348.362 2.578 20 5 EFBDHN Nc1cccc2c1CCN(CCC(=O)Nc1ccccc1[N+](=O)[O-])C2 ZINC001580459152 1090908120 /nfs/dbraw/zinc/90/81/20/1090908120.db2.gz OSRHBNLJYZZYAN-UHFFFAOYSA-N 0 3 340.383 2.564 20 5 EFBDHN O=C(Nc1cccc2c1CNC2)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC001580780094 1091006936 /nfs/dbraw/zinc/00/69/36/1091006936.db2.gz IFDZVANJIALRSB-UHFFFAOYSA-N 0 3 349.350 2.636 20 5 EFBDHN C[C@H](C[NH2+]Cc1cc(-c2nnn[n-]2)cs1)c1ccccc1[N+](=O)[O-] ZINC001589869949 1093162953 /nfs/dbraw/zinc/16/29/53/1093162953.db2.gz CMDHBPLIMQUYBX-SNVBAGLBSA-N 0 3 344.400 2.730 20 5 EFBDHN C[C@H](C[NH2+]Cc1cc(-c2nn[n-]n2)cs1)c1ccccc1[N+](=O)[O-] ZINC001589869949 1093162956 /nfs/dbraw/zinc/16/29/56/1093162956.db2.gz CMDHBPLIMQUYBX-SNVBAGLBSA-N 0 3 344.400 2.730 20 5 EFBDHN C[C@@H]1C[C@H](C)[C@@H](C)[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590189648 1093299832 /nfs/dbraw/zinc/29/98/32/1093299832.db2.gz WLZKOARPGBBJCT-GRYCIOLGSA-N 0 3 330.392 2.641 20 5 EFBDHN C[C@@H]1C[C@H](C)[C@@H](C)[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590189648 1093299835 /nfs/dbraw/zinc/29/98/35/1093299835.db2.gz WLZKOARPGBBJCT-GRYCIOLGSA-N 0 3 330.392 2.641 20 5 EFBDHN C[C@@H]1C[C@H](C)[C@@H](C)[N@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590189648 1093299840 /nfs/dbraw/zinc/29/98/40/1093299840.db2.gz WLZKOARPGBBJCT-GRYCIOLGSA-N 0 3 330.392 2.641 20 5 EFBDHN C[C@@H]1C[C@H](C)[C@@H](C)[N@@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590189648 1093299852 /nfs/dbraw/zinc/29/98/52/1093299852.db2.gz WLZKOARPGBBJCT-GRYCIOLGSA-N 0 3 330.392 2.641 20 5 EFBDHN C[C@@H]1C[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])[C@H]2CCCC[C@@H]12 ZINC001590307016 1093368042 /nfs/dbraw/zinc/36/80/42/1093368042.db2.gz DAZBMFOTEXHUNL-XUJVJEKNSA-N 0 3 342.403 2.785 20 5 EFBDHN C[C@@H]1C[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])[C@H]2CCCC[C@@H]12 ZINC001590307016 1093368051 /nfs/dbraw/zinc/36/80/51/1093368051.db2.gz DAZBMFOTEXHUNL-XUJVJEKNSA-N 0 3 342.403 2.785 20 5 EFBDHN C[C@@H]1C[N@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])[C@H]2CCCC[C@@H]12 ZINC001590307016 1093368065 /nfs/dbraw/zinc/36/80/65/1093368065.db2.gz DAZBMFOTEXHUNL-XUJVJEKNSA-N 0 3 342.403 2.785 20 5 EFBDHN C[C@@H]1C[N@@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])[C@H]2CCCC[C@@H]12 ZINC001590307016 1093368074 /nfs/dbraw/zinc/36/80/74/1093368074.db2.gz DAZBMFOTEXHUNL-XUJVJEKNSA-N 0 3 342.403 2.785 20 5 EFBDHN CCS[C@H]1CCC[C@H]1[NH2+]Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001590849764 1093596240 /nfs/dbraw/zinc/59/62/40/1093596240.db2.gz BVGCHJVWIZVBNM-OCCSQVGLSA-N 0 3 348.432 2.539 20 5 EFBDHN CCS[C@H]1CCC[C@H]1[NH2+]Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001590849764 1093596246 /nfs/dbraw/zinc/59/62/46/1093596246.db2.gz BVGCHJVWIZVBNM-OCCSQVGLSA-N 0 3 348.432 2.539 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[N@@H+]1CCC2(C1)CCCCC2 ZINC001593466994 1094308045 /nfs/dbraw/zinc/30/80/45/1094308045.db2.gz JFCBKWTVJNULJA-UHFFFAOYSA-N 0 3 342.403 2.931 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[N@H+]1CCC2(C1)CCCCC2 ZINC001593466994 1094308053 /nfs/dbraw/zinc/30/80/53/1094308053.db2.gz JFCBKWTVJNULJA-UHFFFAOYSA-N 0 3 342.403 2.931 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1C[N@@H+]1CCC2(C1)CCCCC2 ZINC001593466994 1094308062 /nfs/dbraw/zinc/30/80/62/1094308062.db2.gz JFCBKWTVJNULJA-UHFFFAOYSA-N 0 3 342.403 2.931 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1C[N@H+]1CCC2(C1)CCCCC2 ZINC001593466994 1094308066 /nfs/dbraw/zinc/30/80/66/1094308066.db2.gz JFCBKWTVJNULJA-UHFFFAOYSA-N 0 3 342.403 2.931 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[N@@H+]1CCC[C@H]2CCC[C@@H]21 ZINC001593467406 1094310753 /nfs/dbraw/zinc/31/07/53/1094310753.db2.gz PVNUIHAVZMCBKJ-RISCZKNCSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[N@H+]1CCC[C@H]2CCC[C@@H]21 ZINC001593467406 1094310759 /nfs/dbraw/zinc/31/07/59/1094310759.db2.gz PVNUIHAVZMCBKJ-RISCZKNCSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1C[N@@H+]1CCC[C@H]2CCC[C@@H]21 ZINC001593467406 1094310768 /nfs/dbraw/zinc/31/07/68/1094310768.db2.gz PVNUIHAVZMCBKJ-RISCZKNCSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1C[N@H+]1CCC[C@H]2CCC[C@@H]21 ZINC001593467406 1094310780 /nfs/dbraw/zinc/31/07/80/1094310780.db2.gz PVNUIHAVZMCBKJ-RISCZKNCSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[N@@H+]1CCC[C@@H]2CCC[C@H]21 ZINC001593467408 1094311081 /nfs/dbraw/zinc/31/10/81/1094311081.db2.gz PVNUIHAVZMCBKJ-SMDDNHRTSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[N@H+]1CCC[C@@H]2CCC[C@H]21 ZINC001593467408 1094311091 /nfs/dbraw/zinc/31/10/91/1094311091.db2.gz PVNUIHAVZMCBKJ-SMDDNHRTSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1C[N@@H+]1CCC[C@@H]2CCC[C@H]21 ZINC001593467408 1094311100 /nfs/dbraw/zinc/31/11/00/1094311100.db2.gz PVNUIHAVZMCBKJ-SMDDNHRTSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1C[N@H+]1CCC[C@@H]2CCC[C@H]21 ZINC001593467408 1094311108 /nfs/dbraw/zinc/31/11/08/1094311108.db2.gz PVNUIHAVZMCBKJ-SMDDNHRTSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[N@@H+]1CCC[C@@H]2CCCC[C@@H]21 ZINC001593482236 1094325916 /nfs/dbraw/zinc/32/59/16/1094325916.db2.gz NOAXDKRPUQZDPH-WFASDCNBSA-N 0 3 342.403 2.930 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[N@H+]1CCC[C@@H]2CCCC[C@@H]21 ZINC001593482236 1094325926 /nfs/dbraw/zinc/32/59/26/1094325926.db2.gz NOAXDKRPUQZDPH-WFASDCNBSA-N 0 3 342.403 2.930 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[N@@H+]1CCC[C@@H]2CCCC[C@@H]21 ZINC001593482236 1094325935 /nfs/dbraw/zinc/32/59/35/1094325935.db2.gz NOAXDKRPUQZDPH-WFASDCNBSA-N 0 3 342.403 2.930 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[N@H+]1CCC[C@@H]2CCCC[C@@H]21 ZINC001593482236 1094325941 /nfs/dbraw/zinc/32/59/41/1094325941.db2.gz NOAXDKRPUQZDPH-WFASDCNBSA-N 0 3 342.403 2.930 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[N@@H+]1CC=CC12CCCCC2 ZINC001593481594 1094327696 /nfs/dbraw/zinc/32/76/96/1094327696.db2.gz HYAKDYUFJQXXDD-UHFFFAOYSA-N 0 3 340.387 2.850 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[N@H+]1CC=CC12CCCCC2 ZINC001593481594 1094327701 /nfs/dbraw/zinc/32/77/01/1094327701.db2.gz HYAKDYUFJQXXDD-UHFFFAOYSA-N 0 3 340.387 2.850 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[N@@H+]1CC=CC12CCCCC2 ZINC001593481594 1094327711 /nfs/dbraw/zinc/32/77/11/1094327711.db2.gz HYAKDYUFJQXXDD-UHFFFAOYSA-N 0 3 340.387 2.850 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[N@H+]1CC=CC12CCCCC2 ZINC001593481594 1094327720 /nfs/dbraw/zinc/32/77/20/1094327720.db2.gz HYAKDYUFJQXXDD-UHFFFAOYSA-N 0 3 340.387 2.850 20 5 EFBDHN COc1c(O)ccc(CN[C@@H]2CCCO[C@@H]2CC(C)C)c1[N+](=O)[O-] ZINC000893684296 1095875608 /nfs/dbraw/zinc/87/56/08/1095875608.db2.gz AJADBTQMSGEJEA-UKRRQHHQSA-N 0 3 338.404 2.992 20 5 EFBDHN C[C@H](C1CC1)[N@H+](Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])C1CC1 ZINC001603435833 1096527565 /nfs/dbraw/zinc/52/75/65/1096527565.db2.gz CKRPZHGEFRXASX-SNVBAGLBSA-N 0 3 328.376 2.538 20 5 EFBDHN C[C@H](C1CC1)[N@@H+](Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])C1CC1 ZINC001603435833 1096527568 /nfs/dbraw/zinc/52/75/68/1096527568.db2.gz CKRPZHGEFRXASX-SNVBAGLBSA-N 0 3 328.376 2.538 20 5 EFBDHN C[C@H](C1CC1)[N@H+](Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])C1CC1 ZINC001603435833 1096527576 /nfs/dbraw/zinc/52/75/76/1096527576.db2.gz CKRPZHGEFRXASX-SNVBAGLBSA-N 0 3 328.376 2.538 20 5 EFBDHN C[C@H](C1CC1)[N@@H+](Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])C1CC1 ZINC001603435833 1096527582 /nfs/dbraw/zinc/52/75/82/1096527582.db2.gz CKRPZHGEFRXASX-SNVBAGLBSA-N 0 3 328.376 2.538 20 5 EFBDHN C[C@@H]1CC[C@@H]([NH2+]Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])[C@@H](C)C1 ZINC001603883166 1096655123 /nfs/dbraw/zinc/65/51/23/1096655123.db2.gz XSCXSOAJGYHWMA-UHIISALHSA-N 0 3 330.392 2.689 20 5 EFBDHN C[C@@H]1CC[C@@H]([NH2+]Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])[C@@H](C)C1 ZINC001603883166 1096655129 /nfs/dbraw/zinc/65/51/29/1096655129.db2.gz XSCXSOAJGYHWMA-UHIISALHSA-N 0 3 330.392 2.689 20 5 EFBDHN C[C@@H]1CC[N@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC1(C)C ZINC001603910607 1096668798 /nfs/dbraw/zinc/66/87/98/1096668798.db2.gz JHKVSOBYEANLAH-LLVKDONJSA-N 0 3 330.392 2.643 20 5 EFBDHN C[C@@H]1CC[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC1(C)C ZINC001603910607 1096668800 /nfs/dbraw/zinc/66/88/00/1096668800.db2.gz JHKVSOBYEANLAH-LLVKDONJSA-N 0 3 330.392 2.643 20 5 EFBDHN C[C@H]1CC[N@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC1(C)C ZINC001603910608 1096668972 /nfs/dbraw/zinc/66/89/72/1096668972.db2.gz JHKVSOBYEANLAH-NSHDSACASA-N 0 3 330.392 2.643 20 5 EFBDHN C[C@H]1CC[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC1(C)C ZINC001603910608 1096668973 /nfs/dbraw/zinc/66/89/73/1096668973.db2.gz JHKVSOBYEANLAH-NSHDSACASA-N 0 3 330.392 2.643 20 5 EFBDHN CC[C@H]1CCC[N@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC1 ZINC001604102307 1096738538 /nfs/dbraw/zinc/73/85/38/1096738538.db2.gz AAHGFLBPDFUQGK-LBPRGKRZSA-N 0 3 330.392 2.787 20 5 EFBDHN CC[C@H]1CCC[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC1 ZINC001604102307 1096738542 /nfs/dbraw/zinc/73/85/42/1096738542.db2.gz AAHGFLBPDFUQGK-LBPRGKRZSA-N 0 3 330.392 2.787 20 5 EFBDHN CC[C@H]1CCC[N@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])CC1 ZINC001604102307 1096738547 /nfs/dbraw/zinc/73/85/47/1096738547.db2.gz AAHGFLBPDFUQGK-LBPRGKRZSA-N 0 3 330.392 2.787 20 5 EFBDHN CC[C@H]1CCC[N@@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])CC1 ZINC001604102307 1096738552 /nfs/dbraw/zinc/73/85/52/1096738552.db2.gz AAHGFLBPDFUQGK-LBPRGKRZSA-N 0 3 330.392 2.787 20 5 EFBDHN C[N@@H+](Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])CC1CCCCC1 ZINC001604794988 1096956983 /nfs/dbraw/zinc/95/69/83/1096956983.db2.gz LJHXVKBEWBUCGH-UHFFFAOYSA-N 0 3 330.392 2.787 20 5 EFBDHN C[N@H+](Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])CC1CCCCC1 ZINC001604794988 1096956987 /nfs/dbraw/zinc/95/69/87/1096956987.db2.gz LJHXVKBEWBUCGH-UHFFFAOYSA-N 0 3 330.392 2.787 20 5 EFBDHN C[N@@H+](Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])CC1CCCCC1 ZINC001604794988 1096956993 /nfs/dbraw/zinc/95/69/93/1096956993.db2.gz LJHXVKBEWBUCGH-UHFFFAOYSA-N 0 3 330.392 2.787 20 5 EFBDHN C[N@H+](Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])CC1CCCCC1 ZINC001604794988 1096956996 /nfs/dbraw/zinc/95/69/96/1096956996.db2.gz LJHXVKBEWBUCGH-UHFFFAOYSA-N 0 3 330.392 2.787 20 5 EFBDHN C[C@H]([NH2+]Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])C1CCCCC1 ZINC001609124522 1098158671 /nfs/dbraw/zinc/15/86/71/1098158671.db2.gz CKHIRRMRTFZALY-NSHDSACASA-N 0 3 330.392 2.833 20 5 EFBDHN C[C@H]([NH2+]Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])C1CCCCC1 ZINC001609124522 1098158673 /nfs/dbraw/zinc/15/86/73/1098158673.db2.gz CKHIRRMRTFZALY-NSHDSACASA-N 0 3 330.392 2.833 20 5 EFBDHN CC1(C)CCCC[C@H]1[NH2+]Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001609145265 1098168428 /nfs/dbraw/zinc/16/84/28/1098168428.db2.gz IAMOXAASVOEOFN-CQSZACIVSA-N 0 3 330.392 2.833 20 5 EFBDHN CC1(C)CCCC[C@H]1[NH2+]Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001609145265 1098168431 /nfs/dbraw/zinc/16/84/31/1098168431.db2.gz IAMOXAASVOEOFN-CQSZACIVSA-N 0 3 330.392 2.833 20 5 EFBDHN C[C@@H]1CCC[C@H]([NH2+]Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])[C@H]1C ZINC001609164019 1098177636 /nfs/dbraw/zinc/17/76/36/1098177636.db2.gz KFUGCUCCENGYCB-SUNKGSAMSA-N 0 3 330.392 2.689 20 5 EFBDHN C[C@@H]1CCC[C@H]([NH2+]Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])[C@H]1C ZINC001609164019 1098177643 /nfs/dbraw/zinc/17/76/43/1098177643.db2.gz KFUGCUCCENGYCB-SUNKGSAMSA-N 0 3 330.392 2.689 20 5 EFBDHN CC[C@@H]1CC[C@H](C)[N@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001609248962 1098222289 /nfs/dbraw/zinc/22/22/89/1098222289.db2.gz GTVMAHWADQEFKS-NWDGAFQWSA-N 0 3 330.392 2.785 20 5 EFBDHN CC[C@@H]1CC[C@H](C)[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001609248962 1098222293 /nfs/dbraw/zinc/22/22/93/1098222293.db2.gz GTVMAHWADQEFKS-NWDGAFQWSA-N 0 3 330.392 2.785 20 5 EFBDHN CC[C@@H]1CC[C@H](C)[N@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001609248962 1098222298 /nfs/dbraw/zinc/22/22/98/1098222298.db2.gz GTVMAHWADQEFKS-NWDGAFQWSA-N 0 3 330.392 2.785 20 5 EFBDHN CC[C@@H]1CC[C@H](C)[N@@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001609248962 1098222301 /nfs/dbraw/zinc/22/23/01/1098222301.db2.gz GTVMAHWADQEFKS-NWDGAFQWSA-N 0 3 330.392 2.785 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[N@H+](C1CC1)C1CCCC1 ZINC001609599857 1098394170 /nfs/dbraw/zinc/39/41/70/1098394170.db2.gz FBTMCJOLTPGGHW-UHFFFAOYSA-N 0 3 328.376 2.682 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[N@@H+](C1CC1)C1CCCC1 ZINC001609599857 1098394177 /nfs/dbraw/zinc/39/41/77/1098394177.db2.gz FBTMCJOLTPGGHW-UHFFFAOYSA-N 0 3 328.376 2.682 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[N@@H+]1CCCC2(CCCC2)C1 ZINC001609603106 1098395934 /nfs/dbraw/zinc/39/59/34/1098395934.db2.gz ZYUZWRKDNZNJCL-UHFFFAOYSA-N 0 3 342.403 2.931 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[N@H+]1CCCC2(CCCC2)C1 ZINC001609603106 1098395939 /nfs/dbraw/zinc/39/59/39/1098395939.db2.gz ZYUZWRKDNZNJCL-UHFFFAOYSA-N 0 3 342.403 2.931 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[N@@H+]1CCCC2(CCCC2)C1 ZINC001609603106 1098395945 /nfs/dbraw/zinc/39/59/45/1098395945.db2.gz ZYUZWRKDNZNJCL-UHFFFAOYSA-N 0 3 342.403 2.931 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[N@H+]1CCCC2(CCCC2)C1 ZINC001609603106 1098395949 /nfs/dbraw/zinc/39/59/49/1098395949.db2.gz ZYUZWRKDNZNJCL-UHFFFAOYSA-N 0 3 342.403 2.931 20 5 EFBDHN CCN1CCN([C@@H](C)CNc2nc3ccc([N+](=O)[O-])cc3s2)CC1 ZINC000729632339 1104632325 /nfs/dbraw/zinc/63/23/25/1104632325.db2.gz IGBAWXPEFQTANU-LBPRGKRZSA-N 0 3 349.460 2.642 20 5 EFBDHN O=[N+]([O-])c1sc(CNCC[C@@H](O)C2CC2)cc1Br ZINC000898198072 1106277598 /nfs/dbraw/zinc/27/75/98/1106277598.db2.gz AWHJUZMQAYRBAX-SNVBAGLBSA-N 0 3 335.223 2.669 20 5 EFBDHN O=C(C1=CCCC1)N1CCC(NCc2csc([N+](=O)[O-])c2)CC1 ZINC000991031812 1107328850 /nfs/dbraw/zinc/32/88/50/1107328850.db2.gz YCUBDYOBHXKGFZ-UHFFFAOYSA-N 0 3 335.429 2.847 20 5 EFBDHN CN(C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1)C1CCN(C)CC1 ZINC000899909556 1109541963 /nfs/dbraw/zinc/54/19/63/1109541963.db2.gz RYRUZTBWBVFFSJ-UHFFFAOYSA-N 0 3 329.759 2.554 20 5 EFBDHN CCN(CCNc1ccccc1[N+](=O)[O-])C(=O)CN1CCC(C)(C)C1 ZINC001106951401 1118680498 /nfs/dbraw/zinc/68/04/98/1118680498.db2.gz IBMUKPOKXVYPLI-UHFFFAOYSA-N 0 3 348.447 2.587 20 5 EFBDHN CN(C)[C@H]1CCCN(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000172496917 282252925 /nfs/dbraw/zinc/25/29/25/282252925.db2.gz HJAXWKGZMRIPSH-KRWDZBQOSA-N 0 3 348.447 2.653 20 5 EFBDHN CN(CCN(C)C1CC1)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000186775489 529903094 /nfs/dbraw/zinc/90/30/94/529903094.db2.gz KEJCUJZABONNQQ-UHFFFAOYSA-N 0 3 330.388 2.776 20 5 EFBDHN CCCC(=O)NC[C@@H]1CCCN(CCOc2ccccc2[N+](=O)[O-])C1 ZINC000101912112 219172611 /nfs/dbraw/zinc/17/26/11/219172611.db2.gz QXYCVMFKLBYDRT-HNNXBMFYSA-N 0 3 349.431 2.602 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN2CCC[C@H](OCCO)C2)o1 ZINC000179574907 233177952 /nfs/dbraw/zinc/17/79/52/233177952.db2.gz GPVUGDUEKGRSBG-AWEZNQCLSA-N 0 3 346.383 2.828 20 5 EFBDHN CCOc1ccccc1[C@@H](CC)NCCn1cc([N+](=O)[O-])ccc1=O ZINC000179733923 233381753 /nfs/dbraw/zinc/38/17/53/233381753.db2.gz JWJZIKHOAYWFGP-MRXNPFEDSA-N 0 3 345.399 2.896 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN[C@@H](C)c1ccccn1 ZINC000181790839 234323874 /nfs/dbraw/zinc/32/38/74/234323874.db2.gz SBBWIKZTQUPAAH-ZDUSSCGKSA-N 0 3 328.372 2.978 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@]2(CO)CCOC2)s1 ZINC000184182802 235325922 /nfs/dbraw/zinc/32/59/22/235325922.db2.gz FRBKCTRCBOWJAL-MRXNPFEDSA-N 0 3 334.397 2.564 20 5 EFBDHN CN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000157246243 283162354 /nfs/dbraw/zinc/16/23/54/283162354.db2.gz VBSNZECEUMWDMB-RISCZKNCSA-N 0 3 337.807 2.805 20 5 EFBDHN CN1CC[C@H]2[C@H](CCCN2C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C1 ZINC000342954404 283162703 /nfs/dbraw/zinc/16/27/03/283162703.db2.gz BSKQZGCOKSBVTR-DOMZBBRYSA-N 0 3 342.399 2.632 20 5 EFBDHN CN1CC[C@H]2[C@H](CCCN2C(=O)c2cccc(Cl)c2[N+](=O)[O-])C1 ZINC000164255639 283163366 /nfs/dbraw/zinc/16/33/66/283163366.db2.gz NAXRQTYSIPUYLE-RISCZKNCSA-N 0 3 337.807 2.805 20 5 EFBDHN Cc1c(NC(=O)[C@@H](C)N(C)CC2(N(C)C)CCC2)cccc1[N+](=O)[O-] ZINC000186940631 236071769 /nfs/dbraw/zinc/07/17/69/236071769.db2.gz SJJHNKVTEFGOKE-CQSZACIVSA-N 0 3 348.447 2.646 20 5 EFBDHN C[C@@H]1CCCC[C@@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000129244371 223036391 /nfs/dbraw/zinc/03/63/91/223036391.db2.gz MWYKRKLPWCODJW-DOMZBBRYSA-N 0 3 326.418 2.537 20 5 EFBDHN CN(C)[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000129281137 223039430 /nfs/dbraw/zinc/03/94/30/223039430.db2.gz UUDQVUURSBHNNH-GFCCVEGCSA-N 0 3 345.321 2.780 20 5 EFBDHN C[C@H](NCCC(=O)Nc1cc([N+](=O)[O-])ccc1F)c1cccnc1 ZINC000129698585 223082319 /nfs/dbraw/zinc/08/23/19/223082319.db2.gz KQVZAZBENMWAJG-NSHDSACASA-N 0 3 332.335 2.808 20 5 EFBDHN C[C@H](CNC(=O)c1ccc(F)cc1[N+](=O)[O-])N(C)Cc1ccccc1 ZINC000129960786 223107157 /nfs/dbraw/zinc/10/71/57/223107157.db2.gz YKUGVIBDVLKDSY-CYBMUJFWSA-N 0 3 345.374 2.984 20 5 EFBDHN C[C@H](N[C@H]1CC(C)(C)OC1(C)C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000132661228 223352046 /nfs/dbraw/zinc/35/20/46/223352046.db2.gz USJKBZWJNDJQDH-FZMZJTMJSA-N 0 3 335.404 2.858 20 5 EFBDHN CC(C)NC(=O)CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000236643496 242303363 /nfs/dbraw/zinc/30/33/63/242303363.db2.gz QRIQNTIZCJUAKZ-UHFFFAOYSA-N 0 3 333.413 2.938 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCN1C[C@@H](O)C[C@@H]1c1ccccc1 ZINC000411919668 243028452 /nfs/dbraw/zinc/02/84/52/243028452.db2.gz BIPLAZXHQOWPJB-DOTOQJQBSA-N 0 3 328.368 2.782 20 5 EFBDHN CO[C@@](C)([C@@H](C)NCc1cc([N+](=O)[O-])cc2c1OCOC2)C1CC1 ZINC000411936502 243032523 /nfs/dbraw/zinc/03/25/23/243032523.db2.gz CHUXLYDCVGGLFB-DIFFPNOSSA-N 0 3 336.388 2.755 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCN2C[C@@H](O)C[C@@H]2c2ccccc2)c1 ZINC000411943019 243038410 /nfs/dbraw/zinc/03/84/10/243038410.db2.gz MLMJDRPXTDTTGO-FUHWJXTLSA-N 0 3 328.368 2.782 20 5 EFBDHN CO[C@](C)([C@H](C)NCC(=O)Nc1c(C)cccc1[N+](=O)[O-])C1CC1 ZINC000411965453 243049015 /nfs/dbraw/zinc/04/90/15/243049015.db2.gz FKCJEIKDEOZQRH-YVEFUNNKSA-N 0 3 335.404 2.635 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC[C@@H](Cn2cncn2)C1 ZINC000245517567 243120939 /nfs/dbraw/zinc/12/09/39/243120939.db2.gz GXPSBBMWUJAUTP-LSDHHAIUSA-N 0 3 329.404 2.968 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N(C)[C@@H]2CCN(C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000246149368 243203011 /nfs/dbraw/zinc/20/30/11/243203011.db2.gz CSZIHUSJHDUTTI-IJEWVQPXSA-N 0 3 348.447 2.946 20 5 EFBDHN CCCN1CCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000412340761 243277491 /nfs/dbraw/zinc/27/74/91/243277491.db2.gz DOYIZCXRUGIPCK-HNNXBMFYSA-N 0 3 349.431 2.986 20 5 EFBDHN C[C@H]1CN(C)CC[C@H]1N(C)C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000247159832 243381696 /nfs/dbraw/zinc/38/16/96/243381696.db2.gz AKJQYBOTMCFGCB-IINYFYTJSA-N 0 3 325.796 2.660 20 5 EFBDHN O=[N+]([O-])c1cnc(NCC2CCN(c3ccncc3)CC2)c(F)c1 ZINC000413230659 243553443 /nfs/dbraw/zinc/55/34/43/243553443.db2.gz SCSYJGWCTHXDAS-UHFFFAOYSA-N 0 3 331.351 2.852 20 5 EFBDHN C[S@](=O)C[C@@H](NCCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000183120796 291453222 /nfs/dbraw/zinc/45/32/22/291453222.db2.gz OVDHFILXVKWQQR-HXOBKFHXSA-N 0 3 332.425 2.847 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1NCCc2ccccc21 ZINC000414654647 244277261 /nfs/dbraw/zinc/27/72/61/244277261.db2.gz GIDYMTUXUDMOHC-KRWDZBQOSA-N 0 3 340.383 2.912 20 5 EFBDHN C[C@@]1(F)CNCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000414765786 244333750 /nfs/dbraw/zinc/33/37/50/244333750.db2.gz GEKVGLMDODSQKK-QGZVFWFLSA-N 0 3 333.363 2.988 20 5 EFBDHN Cc1c(NC(=O)NC[C@H]2NCCc3ccccc32)cccc1[N+](=O)[O-] ZINC000414705972 244300167 /nfs/dbraw/zinc/30/01/67/244300167.db2.gz NXIGGXGIHCMIQK-MRXNPFEDSA-N 0 3 340.383 2.912 20 5 EFBDHN C[C@@H](N[C@@H](C)Cc1ccccc1[N+](=O)[O-])c1nnc2ccccn21 ZINC000449067259 296148409 /nfs/dbraw/zinc/14/84/09/296148409.db2.gz JVHQXJVKMSNPGA-QWHCGFSZSA-N 0 3 325.372 2.919 20 5 EFBDHN CC(C)c1ccc([C@H](N)CNC(=O)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000262493863 245003114 /nfs/dbraw/zinc/00/31/14/245003114.db2.gz BDUXDMLPQZNQQW-MRXNPFEDSA-N 0 3 342.399 2.730 20 5 EFBDHN C[C@H](CNC(=O)Cc1ccccc1[N+](=O)[O-])N(C)Cc1ccccc1 ZINC000110351112 220031572 /nfs/dbraw/zinc/03/15/72/220031572.db2.gz DKROFCFHGMCPAZ-OAHLLOKOSA-N 0 3 341.411 2.774 20 5 EFBDHN O=C(c1cc(NCCN2CCCCC2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000072240594 296183039 /nfs/dbraw/zinc/18/30/39/296183039.db2.gz UXSBEFMOYGYLAH-UHFFFAOYSA-N 0 3 346.431 2.729 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C1CCN(C(=O)c2cc[nH]c2)CC1 ZINC000985446882 724381473 /nfs/dbraw/zinc/38/14/73/724381473.db2.gz FTTYRMWHDUJZQD-UHFFFAOYSA-N 0 3 342.399 2.660 20 5 EFBDHN CN(CC1CCN(C)CC1)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000264135367 246095740 /nfs/dbraw/zinc/09/57/40/246095740.db2.gz ZGDFBDACBBBOBY-UHFFFAOYSA-N 0 3 331.372 2.755 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2cnc(CCN3CCCC[C@H]3CO)o2)c1 ZINC000264162947 246125376 /nfs/dbraw/zinc/12/53/76/246125376.db2.gz GCEFWIBIGSBADO-HNNXBMFYSA-N 0 3 331.372 2.639 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCCCN1C1CC1 ZINC000421893533 246153770 /nfs/dbraw/zinc/15/37/70/246153770.db2.gz MIAJIAAJPBUPHO-HNNXBMFYSA-N 0 3 331.416 2.958 20 5 EFBDHN COCC(C)(C)N1CCN(c2ccc([N+](=O)[O-])c3cccnc32)CC1 ZINC000425274547 247024312 /nfs/dbraw/zinc/02/43/12/247024312.db2.gz DIKQVOAISNBGHR-UHFFFAOYSA-N 0 3 344.415 2.690 20 5 EFBDHN CN(Cc1ccc(Br)cc1[N+](=O)[O-])C[C@H]1CCOC1 ZINC000425415193 247077860 /nfs/dbraw/zinc/07/78/60/247077860.db2.gz FHTOENRNPISBRE-SNVBAGLBSA-N 0 3 329.194 2.826 20 5 EFBDHN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@H]2CN(C)C[C@H]21 ZINC000425684349 247167386 /nfs/dbraw/zinc/16/73/86/247167386.db2.gz NADNEZXQHBHOQW-XJKSGUPXSA-N 0 3 332.404 2.715 20 5 EFBDHN Cc1ccnc(NCc2ccccc2OCCN(C)C)c1[N+](=O)[O-] ZINC000265163219 247260983 /nfs/dbraw/zinc/26/09/83/247260983.db2.gz FJKTYHRLVHFMIG-UHFFFAOYSA-N 0 3 330.388 2.851 20 5 EFBDHN CCc1nc(C)c(CN[C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)o1 ZINC000426321366 247261869 /nfs/dbraw/zinc/26/18/69/247261869.db2.gz CHXAOAVRXOEYEK-QWHCGFSZSA-N 0 3 333.392 2.924 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H]1CCCCN1CC(C)C ZINC000427031149 247309215 /nfs/dbraw/zinc/30/92/15/247309215.db2.gz PPCHKPYLCPTFEW-HNNXBMFYSA-N 0 3 349.431 2.844 20 5 EFBDHN O=C(Cc1cccc([N+](=O)[O-])c1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000265993172 248005864 /nfs/dbraw/zinc/00/58/64/248005864.db2.gz IXYIKEMQDUATDU-KRWDZBQOSA-N 0 3 339.395 2.528 20 5 EFBDHN C[C@@H]1CN2CCC[C@@H]2CN1C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000265993901 248007685 /nfs/dbraw/zinc/00/76/85/248007685.db2.gz MWEQJJMAXNUOIP-CZUORRHYSA-N 0 3 331.416 2.568 20 5 EFBDHN Cc1c(NC(=O)[C@H](C)N[C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)cccc1[N+](=O)[O-] ZINC000266012231 248028350 /nfs/dbraw/zinc/02/83/50/248028350.db2.gz QCHXVEKBGPNILM-RKLWJJNISA-N 0 3 347.415 2.633 20 5 EFBDHN Cc1c(NC(=O)[C@H](C)N[C@@H]2[C@H]3CCO[C@@H]3C2(C)C)cccc1[N+](=O)[O-] ZINC000266012229 248028566 /nfs/dbraw/zinc/02/85/66/248028566.db2.gz QCHXVEKBGPNILM-OJDYBEQGSA-N 0 3 347.415 2.633 20 5 EFBDHN O=[N+]([O-])c1cc2ccccc2nc1NC[C@H]1CCCCN1C1CC1 ZINC000433811943 248092532 /nfs/dbraw/zinc/09/25/32/248092532.db2.gz MHWNUJAJKKUFRU-OAHLLOKOSA-N 0 3 326.400 2.994 20 5 EFBDHN C[C@@H]1C[C@@H](N(C)C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CCN1C ZINC000266098133 248095370 /nfs/dbraw/zinc/09/53/70/248095370.db2.gz RAEXTHWQRRYQKW-YPMHNXCESA-N 0 3 330.388 2.631 20 5 EFBDHN Cn1cc([C@H]2OCCC[C@@H]2NC/C=C\c2ccccc2[N+](=O)[O-])cn1 ZINC000433935336 248105888 /nfs/dbraw/zinc/10/58/88/248105888.db2.gz VCTNYADBVWGFAI-BFVRRIQPSA-N 0 3 342.399 2.851 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CC[C@@H](N3CC=CC3)C2)cc1OC(F)F ZINC000266282260 248221892 /nfs/dbraw/zinc/22/18/92/248221892.db2.gz UMFFAMZBZLVOSG-GFCCVEGCSA-N 0 3 325.315 2.647 20 5 EFBDHN CO[C@@]1(C)C[C@@H](NCc2cc([N+](=O)[O-])cc3c2OCOC3)C1(C)C ZINC000266644042 248395376 /nfs/dbraw/zinc/39/53/76/248395376.db2.gz VOICUWZZKFBYLC-PBHICJAKSA-N 0 3 336.388 2.755 20 5 EFBDHN CO[C@]1(C)C[C@@H](NCc2cc([N+](=O)[O-])cc3c2OCOC3)C1(C)C ZINC000266644046 248395390 /nfs/dbraw/zinc/39/53/90/248395390.db2.gz VOICUWZZKFBYLC-RHSMWYFYSA-N 0 3 336.388 2.755 20 5 EFBDHN Cc1c(C(=O)NCc2ccccc2CN(C)C)cccc1[N+](=O)[O-] ZINC000009917234 211133234 /nfs/dbraw/zinc/13/32/34/211133234.db2.gz AFBSQZCWBKTZJZ-UHFFFAOYSA-N 0 3 327.384 2.895 20 5 EFBDHN C[C@@H](O)C[C@@H]1CCCN1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000093482093 218228721 /nfs/dbraw/zinc/22/87/21/218228721.db2.gz QCVCYSWWUJDLID-DYVFJYSZSA-N 0 3 344.415 2.731 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN[C@@H]3CCCC[C@H]3n3cccn3)nc2c1 ZINC000444685646 250327936 /nfs/dbraw/zinc/32/79/36/250327936.db2.gz OWKJZKDMMMIMNU-GDBMZVCRSA-N 0 3 340.387 2.941 20 5 EFBDHN CC1(C)CCCN(CCNC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C1 ZINC000444619636 250317478 /nfs/dbraw/zinc/31/74/78/250317478.db2.gz YYIDUBFSOUOMCM-UHFFFAOYSA-N 0 3 344.415 2.928 20 5 EFBDHN COC[C@@]1(C(=O)OC)CCN(C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000449458635 251032960 /nfs/dbraw/zinc/03/29/60/251032960.db2.gz WLRNTXNVDTTXPH-MOVXZBDNSA-N 0 3 348.399 2.510 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])o1 ZINC000267413251 251037519 /nfs/dbraw/zinc/03/75/19/251037519.db2.gz KTATXFZBCUAJKS-HIFRSBDPSA-N 0 3 343.383 2.828 20 5 EFBDHN C[C@H](NCc1ccc(NS(C)(=O)=O)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000267417961 251039753 /nfs/dbraw/zinc/03/97/53/251039753.db2.gz JTWCFVQJOFMWSV-LBPRGKRZSA-N 0 3 349.412 2.817 20 5 EFBDHN COc1cc(C[NH2+][C@@H](C(C)C)[C@H](CO)C(C)C)c([N+](=O)[O-])cc1[O-] ZINC000449508386 251047679 /nfs/dbraw/zinc/04/76/79/251047679.db2.gz HDYLYADBYDVHBV-DYVFJYSZSA-N 0 3 340.420 2.688 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@H]([C@H](CO)C1CC1)C1CC1 ZINC000449510829 251047901 /nfs/dbraw/zinc/04/79/01/251047901.db2.gz QQEDSODEQUUZOF-AEFFLSMTSA-N 0 3 334.416 2.880 20 5 EFBDHN Cc1ccncc1CN[C@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000449519715 251050334 /nfs/dbraw/zinc/05/03/34/251050334.db2.gz CKKJSPFVXBCOBB-CYBMUJFWSA-N 0 3 328.372 2.805 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN1CC[C@@H]2C[C@@H](O)CC[C@@H]2C1 ZINC000449559453 251065977 /nfs/dbraw/zinc/06/59/77/251065977.db2.gz YIPVKBDJKVXZGZ-CPUCHLNUSA-N 0 3 334.416 2.976 20 5 EFBDHN C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000267481241 251097108 /nfs/dbraw/zinc/09/71/08/251097108.db2.gz VASBKSBCXZZFRZ-DZGCQCFKSA-N 0 3 342.399 2.563 20 5 EFBDHN CCn1cc([C@H](C)N[C@@H](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2)cn1 ZINC000449676451 251113199 /nfs/dbraw/zinc/11/31/99/251113199.db2.gz HEPQQDMIXGJAJF-STQMWFEESA-N 0 3 345.403 2.879 20 5 EFBDHN CCn1cc([C@@H](C)N[C@@H](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2)cn1 ZINC000449676450 251113467 /nfs/dbraw/zinc/11/34/67/251113467.db2.gz HEPQQDMIXGJAJF-QWHCGFSZSA-N 0 3 345.403 2.879 20 5 EFBDHN COC[C@@]1(CO)CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000449695933 251120112 /nfs/dbraw/zinc/12/01/12/251120112.db2.gz JMWWMEMRCLWHNR-SFHVURJKSA-N 0 3 346.383 2.686 20 5 EFBDHN COC(=O)[C@@H]1CN(Cc2cccc([N+](=O)[O-])c2)C[C@H]1c1ccccc1 ZINC000449754166 251142535 /nfs/dbraw/zinc/14/25/35/251142535.db2.gz KYYCRNQAJXCLDC-ZWKOTPCHSA-N 0 3 340.379 2.983 20 5 EFBDHN Cc1nc(NCC(C)(C)N2CCc3ccccc3C2)ncc1[N+](=O)[O-] ZINC000450246091 251312759 /nfs/dbraw/zinc/31/27/59/251312759.db2.gz JFHUBDOLJBJEQO-UHFFFAOYSA-N 0 3 341.415 2.942 20 5 EFBDHN CC(C)Oc1ccc2nccc(NCCn3cc([N+](=O)[O-])cn3)c2c1 ZINC000450391576 251371286 /nfs/dbraw/zinc/37/12/86/251371286.db2.gz MIDFYWYOQFWFLX-UHFFFAOYSA-N 0 3 341.371 2.661 20 5 EFBDHN CCc1cc(N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)ccn1 ZINC000450351959 251357197 /nfs/dbraw/zinc/35/71/97/251357197.db2.gz UVXCZZYTIUCKHX-UHFFFAOYSA-N 0 3 340.383 2.515 20 5 EFBDHN Cc1nc(N(CCCc2ccccc2)CCN(C)C)ncc1[N+](=O)[O-] ZINC000450371519 251364528 /nfs/dbraw/zinc/36/45/28/251364528.db2.gz IDKHNKOUJNLXHA-UHFFFAOYSA-N 0 3 343.431 2.694 20 5 EFBDHN COc1ccc(OCCN(C)CCc2ccccn2)c([N+](=O)[O-])c1 ZINC000153052012 224051875 /nfs/dbraw/zinc/05/18/75/224051875.db2.gz CFFPQCGURWSCBN-UHFFFAOYSA-N 0 3 331.372 2.552 20 5 EFBDHN C[C@@H](N[C@@H]1COC[C@H]1O)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000453330744 252034304 /nfs/dbraw/zinc/03/43/04/252034304.db2.gz FCQISLUFLYJETD-MPKXVKKWSA-N 0 3 334.397 2.734 20 5 EFBDHN CN(C)CC(C)(C)NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000454520703 252293353 /nfs/dbraw/zinc/29/33/53/252293353.db2.gz PFALOTBFUGNPFP-UHFFFAOYSA-N 0 3 346.334 2.658 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC(C)(C)CN(C)C ZINC000457217815 299576902 /nfs/dbraw/zinc/57/69/02/299576902.db2.gz HOZHGXYTTSSDOI-NSHDSACASA-N 0 3 325.434 2.532 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN[C@H]2CC3(CCC3)Oc3ccccc32)c1 ZINC000090539964 285190364 /nfs/dbraw/zinc/19/03/64/285190364.db2.gz GMEHWGAYUKFHSU-HNNXBMFYSA-N 0 3 328.372 2.827 20 5 EFBDHN CCOc1ccc([C@H](C)NC[C@]2(O)CCSC2)cc1[N+](=O)[O-] ZINC000154118703 224205073 /nfs/dbraw/zinc/20/50/73/224205073.db2.gz GMMVRNHUJXHEHW-XHDPSFHLSA-N 0 3 326.418 2.512 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CNC[C@@H]1CN(CC(C)C)CCO1 ZINC000468650445 256017841 /nfs/dbraw/zinc/01/78/41/256017841.db2.gz HFHHBGKEWBBMSE-VPEZWSJASA-N 0 3 347.459 2.945 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN[C@@H]1CC(=O)N(C(C)(C)C)C1 ZINC000468746276 256018454 /nfs/dbraw/zinc/01/84/54/256018454.db2.gz FZUTVWHCBRWHQD-JEMSNHSXSA-N 0 3 331.416 2.987 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CN2CC[C@@H]3[C@H](CCCN3C3CC3)C2)c1 ZINC000154668904 224288048 /nfs/dbraw/zinc/28/80/48/224288048.db2.gz FIGDBJOYJPJDGG-LZQZEXGQSA-N 0 3 345.443 2.577 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN(C)Cc1cccnc1 ZINC000119040357 221230068 /nfs/dbraw/zinc/23/00/68/221230068.db2.gz KLPOGESJAHCGEI-UHFFFAOYSA-N 0 3 328.372 2.759 20 5 EFBDHN C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N)[C@@H](c1ccccc1)N(C)C ZINC000189825720 533280031 /nfs/dbraw/zinc/28/00/31/533280031.db2.gz MBOAAYTWDSWUPT-PXAZEXFGSA-N 0 3 342.399 2.598 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCN(C2CCOCC2)CC1 ZINC000347363499 533382339 /nfs/dbraw/zinc/38/23/39/533382339.db2.gz QYEKXKCGTOTNQP-SSZFMOIBSA-N 0 3 345.443 2.795 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CNCc1ccc(C(N)=O)cc1 ZINC000344842461 533408602 /nfs/dbraw/zinc/40/86/02/533408602.db2.gz GIUTVCCGLHPOLI-UKTHLTGXSA-N 0 3 325.368 2.887 20 5 EFBDHN C[C@@H](N[C@@H]1CC(C)(C)OC1(C)C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000132407404 533516408 /nfs/dbraw/zinc/51/64/08/533516408.db2.gz CZQAMVXLNLSVBQ-BXUZGUMPSA-N 0 3 335.404 2.858 20 5 EFBDHN CCn1ccnc1[C@@H]1OCC[C@@H]1NCc1ccc(C)c([N+](=O)[O-])c1 ZINC000343392250 141987217 /nfs/dbraw/zinc/98/72/17/141987217.db2.gz TXVYXLJIPMXHJX-GOEBONIOSA-N 0 3 330.388 2.739 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)CCN1C ZINC000343452126 142000461 /nfs/dbraw/zinc/00/04/61/142000461.db2.gz RCLQQNKREGUWGQ-ZFWWWQNUSA-N 0 3 346.431 2.752 20 5 EFBDHN O=C(C1CCC1)N(CCCNCc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000343490557 142006989 /nfs/dbraw/zinc/00/69/89/142006989.db2.gz GAQOZYPKTBJDKX-UHFFFAOYSA-N 0 3 331.416 2.866 20 5 EFBDHN CO[C@@H]1[C@H](C)[C@@H](N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1(C)C ZINC000344473465 142023136 /nfs/dbraw/zinc/02/31/36/142023136.db2.gz LRGZWWACCSLDKE-BAESOJJISA-N 0 3 335.404 2.571 20 5 EFBDHN CN1CCCC(C)(C)[C@H]1CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000344603955 142047169 /nfs/dbraw/zinc/04/71/69/142047169.db2.gz JFIBYNSDOWGVPT-OAHLLOKOSA-N 0 3 344.415 2.926 20 5 EFBDHN CN1CCCC(C)(C)[C@H]1CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000344651234 142055849 /nfs/dbraw/zinc/05/58/49/142055849.db2.gz ZGSQIMCUXQKUHG-MRXNPFEDSA-N 0 3 344.415 2.926 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCN([C@@H]2C[C@H]2C)C[C@@H](C)C1 ZINC000346190455 142164617 /nfs/dbraw/zinc/16/46/17/142164617.db2.gz PAKZUDUFGMJTAG-SUYBPPKGSA-N 0 3 331.416 2.706 20 5 EFBDHN CCc1ccc(C(=O)N2CCN([C@@H]3C[C@H]3C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000346260403 142177935 /nfs/dbraw/zinc/17/79/35/142177935.db2.gz LHGIEJLCNMAVMT-JJRVBVJISA-N 0 3 345.443 2.960 20 5 EFBDHN Cc1cc(C(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000346286917 142183508 /nfs/dbraw/zinc/18/35/08/142183508.db2.gz ZROPILYNSRJDQR-HACGYAERSA-N 0 3 331.416 2.706 20 5 EFBDHN CN(CCn1ccc([N+](=O)[O-])n1)[C@@H]1C[C@@H](Oc2ccccc2)C1(C)C ZINC000347484597 142224312 /nfs/dbraw/zinc/22/43/12/142224312.db2.gz WNXXWZVGWLFOBA-HZPDHXFCSA-N 0 3 344.415 2.969 20 5 EFBDHN CC1(C)CCCN(CCNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC000347492279 142226142 /nfs/dbraw/zinc/22/61/42/142226142.db2.gz UNQSHCPYOWFVJV-UHFFFAOYSA-N 0 3 344.415 2.928 20 5 EFBDHN COc1cc([C@H](C)NCCC(=O)Nc2ccc([N+](=O)[O-])cc2)ccn1 ZINC000347665844 142254011 /nfs/dbraw/zinc/25/40/11/142254011.db2.gz FOKGDBRHHYSMRO-LBPRGKRZSA-N 0 3 344.371 2.678 20 5 EFBDHN COc1ccc(-c2ccc(CNC3(CO)CCC3)o2)c([N+](=O)[O-])c1 ZINC000347673327 142254829 /nfs/dbraw/zinc/25/48/29/142254829.db2.gz DHKQDRZSBPKRIA-UHFFFAOYSA-N 0 3 332.356 2.868 20 5 EFBDHN O=[N+]([O-])c1ccc(S(=O)(=O)CCN[C@@H]2CCC[C@@H]2C2CC2)cc1 ZINC000349661905 142345087 /nfs/dbraw/zinc/34/50/87/142345087.db2.gz GZPVWYARGBJPLN-HZPDHXFCSA-N 0 3 338.429 2.537 20 5 EFBDHN C[C@@H]1C[C@@H](NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)CCN1C ZINC000341166986 145004754 /nfs/dbraw/zinc/00/47/54/145004754.db2.gz OEDYRMUFYHRYBM-ZBFHGGJFSA-N 0 3 348.447 2.699 20 5 EFBDHN COc1ccc([C@@H](C)NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC000341203260 145011956 /nfs/dbraw/zinc/01/19/56/145011956.db2.gz CBJPBHAFMAJVGR-CZUORRHYSA-N 0 3 346.383 2.694 20 5 EFBDHN COC1CCN(C(C)(C)CNC(=O)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000341296376 145028499 /nfs/dbraw/zinc/02/84/99/145028499.db2.gz TWAYZPCWKOIGSQ-UHFFFAOYSA-N 0 3 349.431 2.522 20 5 EFBDHN COC(=O)[C@]12CN(Cc3ccc([N+](=O)[O-])cc3OC)C[C@@H]1CCCC2 ZINC000342185153 145077325 /nfs/dbraw/zinc/07/73/25/145077325.db2.gz ZTKLRPOTGKSBEK-KBXCAEBGSA-N 0 3 348.399 2.769 20 5 EFBDHN CC(C)c1ccc(CNC[C@@H]2CCCS(=O)(=O)C2)cc1[N+](=O)[O-] ZINC000342218422 145082198 /nfs/dbraw/zinc/08/21/98/145082198.db2.gz IMRIVEUAQUYYJO-AWEZNQCLSA-N 0 3 340.445 2.633 20 5 EFBDHN COc1ccc(CNC[C@](C)(CO)c2ccccc2)cc1[N+](=O)[O-] ZINC000342228135 145083864 /nfs/dbraw/zinc/08/38/64/145083864.db2.gz PXBIYUWFEGQMOC-GOSISDBHSA-N 0 3 330.384 2.643 20 5 EFBDHN CCCN(CCN1CCCC1)C(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000342236679 145085660 /nfs/dbraw/zinc/08/56/60/145085660.db2.gz AVGQFQGQDZRANB-UHFFFAOYSA-N 0 3 337.395 2.611 20 5 EFBDHN C[C@@H]1[C@@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CCCN1C ZINC000342361295 145108750 /nfs/dbraw/zinc/10/87/50/145108750.db2.gz SQMICFZXYADXBG-SKDRFNHKSA-N 0 3 326.784 2.852 20 5 EFBDHN C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)CSc1ccccc1[N+](=O)[O-] ZINC000342446523 145127907 /nfs/dbraw/zinc/12/79/07/145127907.db2.gz SCWPRQHWWWAAGI-KGLIPLIRSA-N 0 3 349.456 2.772 20 5 EFBDHN C[C@H]1[C@@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CCCN1C ZINC000342650343 145165972 /nfs/dbraw/zinc/16/59/72/145165972.db2.gz HQUFVXWWYJVUGJ-HZMBPMFUSA-N 0 3 340.811 2.530 20 5 EFBDHN C[C@H](CNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12)N1CCC(C)CC1 ZINC000342899444 145217787 /nfs/dbraw/zinc/21/77/87/145217787.db2.gz HDXCQPWQFFHGNH-CYBMUJFWSA-N 0 3 344.415 2.926 20 5 EFBDHN CCCN1CCC[C@@H]1CNC(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000343563949 145239536 /nfs/dbraw/zinc/23/95/36/145239536.db2.gz ZSLDVSLAVPZCCC-GFCCVEGCSA-N 0 3 337.445 2.921 20 5 EFBDHN CS[C@H]1CN(Cc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1N(C)C ZINC000343567077 145240113 /nfs/dbraw/zinc/24/01/13/145240113.db2.gz VPERCANMMKJSNE-KBPBESRZSA-N 0 3 329.853 2.726 20 5 EFBDHN CC(C)NC(=O)c1ccc(N[C@@H]2CCCN(C)[C@@H]2C)c([N+](=O)[O-])c1 ZINC000343588251 145246218 /nfs/dbraw/zinc/24/62/18/145246218.db2.gz FOSYGWSHBJKNPC-TZMCWYRMSA-N 0 3 334.420 2.628 20 5 EFBDHN Cc1cc(N[C@@H]2CCCN(C)[C@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000343598881 145248415 /nfs/dbraw/zinc/24/84/15/145248415.db2.gz IHSTUYFIEBLRFR-XJKSGUPXSA-N 0 3 341.415 2.677 20 5 EFBDHN C[C@H]1[C@H](Nc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)CCCN1C ZINC000343610185 145251875 /nfs/dbraw/zinc/25/18/75/145251875.db2.gz STSKYMHKJUPXOF-XJKSGUPXSA-N 0 3 346.431 2.725 20 5 EFBDHN C[C@H]1[C@H](NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)CCCN1C ZINC000343764758 145289439 /nfs/dbraw/zinc/28/94/39/145289439.db2.gz WOAWANRJRBVGFW-WMLDXEAASA-N 0 3 348.447 2.699 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1N(C)CCCC1(C)C ZINC000348466380 145953061 /nfs/dbraw/zinc/95/30/61/145953061.db2.gz SQAKWUSNGPWCOU-OAHLLOKOSA-N 0 3 349.431 2.844 20 5 EFBDHN C[C@@H](O)C[C@H]1CCCCCN1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000352892202 146342366 /nfs/dbraw/zinc/34/23/66/146342366.db2.gz ISXBVRJXQHBNCZ-RHSMWYFYSA-N 0 3 349.431 2.573 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CN2CC[C@@H]2Cc2ccccc2)c1 ZINC000353039793 146383101 /nfs/dbraw/zinc/38/31/01/146383101.db2.gz LTMYRDKCSKGHEH-SJLPKXTDSA-N 0 3 342.395 2.652 20 5 EFBDHN CCOc1cc(N2CCN(C[C@@H]3CCCOC3)CC2)ccc1[N+](=O)[O-] ZINC000355516672 146983778 /nfs/dbraw/zinc/98/37/78/146983778.db2.gz QCQWFIUKTIIRHU-HNNXBMFYSA-N 0 3 349.431 2.542 20 5 EFBDHN COC(=O)COc1ccc(CN2C[C@H](C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000355597896 147008430 /nfs/dbraw/zinc/00/84/30/147008430.db2.gz FTHJXZZEYPZFPB-BETUJISGSA-N 0 3 336.388 2.625 20 5 EFBDHN Cn1nc([N+](=O)[O-])cc1C(=O)Nc1cccc(CN2CCCCC2)c1 ZINC000356147977 147159419 /nfs/dbraw/zinc/15/94/19/147159419.db2.gz RKJIVVPFAMKQRU-UHFFFAOYSA-N 0 3 343.387 2.567 20 5 EFBDHN CSc1cccc(C(=O)N2CC[C@]3(C2)CCCN(C)C3)c1[N+](=O)[O-] ZINC000356250396 147189039 /nfs/dbraw/zinc/18/90/39/147189039.db2.gz FOENSQATUKHHRN-QGZVFWFLSA-N 0 3 349.456 2.875 20 5 EFBDHN CN1CCC[C@@]2(CCN(C(=O)CSc3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000356259124 147191807 /nfs/dbraw/zinc/19/18/07/147191807.db2.gz WTJPHPRYGZFLKV-QGZVFWFLSA-N 0 3 349.456 2.631 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(CCN(C)C)C1CC1 ZINC000356307818 147206800 /nfs/dbraw/zinc/20/68/00/147206800.db2.gz ZBQHVIYGPAXDEP-OAHLLOKOSA-N 0 3 333.432 2.716 20 5 EFBDHN CC(C)c1ccc(CNCCN2CCOC(C)(C)C2)cc1[N+](=O)[O-] ZINC000356866751 147357993 /nfs/dbraw/zinc/35/79/93/147357993.db2.gz OCRWWJQBRNAYJB-UHFFFAOYSA-N 0 3 335.448 2.919 20 5 EFBDHN C[C@H](C(=O)N(C)CCc1ccccc1[N+](=O)[O-])N1[C@H](C)CC[C@@H]1C ZINC000359128276 148003706 /nfs/dbraw/zinc/00/37/06/148003706.db2.gz HIXCDBDUUTXIMA-QLFBSQMISA-N 0 3 333.432 2.857 20 5 EFBDHN COC1CCN(C(C)(C)CNC(=O)c2cc(C)ccc2[N+](=O)[O-])CC1 ZINC000359421027 148081002 /nfs/dbraw/zinc/08/10/02/148081002.db2.gz XDMHIMKRKZZJCA-UHFFFAOYSA-N 0 3 349.431 2.522 20 5 EFBDHN CC[C@H](C)N[C@H](CNC(=O)Cc1ccccc1[N+](=O)[O-])c1ccco1 ZINC000359541374 148116344 /nfs/dbraw/zinc/11/63/44/148116344.db2.gz DDPKWUHQHQGOHS-DZGCQCFKSA-N 0 3 345.399 2.976 20 5 EFBDHN Cc1c(CNC(=O)N(C)CC2(N(C)C)CCC2)cccc1[N+](=O)[O-] ZINC000359555261 148121410 /nfs/dbraw/zinc/12/14/10/148121410.db2.gz ZXIWQLFXMRHOPW-UHFFFAOYSA-N 0 3 334.420 2.529 20 5 EFBDHN C[C@H](C(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1)N1[C@H](C)CC[C@H]1C ZINC000359628199 148143981 /nfs/dbraw/zinc/14/39/81/148143981.db2.gz ZHKIGKWWAPPYPY-MGPQQGTHSA-N 0 3 347.415 2.577 20 5 EFBDHN C[C@@H]1[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2)CCN1Cc1ccccc1 ZINC000359832152 148201883 /nfs/dbraw/zinc/20/18/83/148201883.db2.gz LJGJLLKFSJBKIZ-KDOFPFPSSA-N 0 3 339.395 2.988 20 5 EFBDHN CCN(CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)[C@H]1CCOC1 ZINC000361597073 148658642 /nfs/dbraw/zinc/65/86/42/148658642.db2.gz WVEHCMHXCOWCBF-HNNXBMFYSA-N 0 3 331.372 2.903 20 5 EFBDHN CN1CCC(N(Cc2ccccc2)C(=O)c2cc([N+](=O)[O-])c[nH]2)CC1 ZINC000362474509 148827754 /nfs/dbraw/zinc/82/77/54/148827754.db2.gz UBFKOYIFBGBVFU-UHFFFAOYSA-N 0 3 342.399 2.660 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)C2(N)Cc3ccccc3C2)cc1[N+](=O)[O-] ZINC000364867548 149263363 /nfs/dbraw/zinc/26/33/63/149263363.db2.gz PQSAYXPJZSLQCK-CYBMUJFWSA-N 0 3 339.395 2.577 20 5 EFBDHN CN1CCC(N2CC[C@@H](Nc3ccc([N+](=O)[O-])cc3Cl)C2)CC1 ZINC000369265125 150315026 /nfs/dbraw/zinc/31/50/26/150315026.db2.gz DUXHCTXCOPXZBH-GFCCVEGCSA-N 0 3 338.839 2.829 20 5 EFBDHN CN1CCC2(CCN(Cc3cc([N+](=O)[O-])ccc3Cl)CC2)C1=O ZINC000373175203 151127046 /nfs/dbraw/zinc/12/70/46/151127046.db2.gz YRFZOKWMJOZAMY-UHFFFAOYSA-N 0 3 337.807 2.693 20 5 EFBDHN Cc1c(CN2CCC[C@@H](c3nc(N(C)C)no3)C2)cccc1[N+](=O)[O-] ZINC000374551012 151368526 /nfs/dbraw/zinc/36/85/26/151368526.db2.gz KKNAUUZWYRXHON-CQSZACIVSA-N 0 3 345.403 2.732 20 5 EFBDHN C[C@@H](NCCn1ccc([N+](=O)[O-])n1)c1cccc(N2CCCC2)c1 ZINC000181856078 287030611 /nfs/dbraw/zinc/03/06/11/287030611.db2.gz DRPWQJAQYDQMRQ-CQSZACIVSA-N 0 3 329.404 2.742 20 5 EFBDHN C[C@@H](NCCOCCO)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000159089560 225144289 /nfs/dbraw/zinc/14/42/89/225144289.db2.gz ILHWJRLJNDYBKA-GFCCVEGCSA-N 0 3 336.413 2.983 20 5 EFBDHN Cc1ccccc1[C@@H]1C[C@H](C)N(CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000159838126 225286493 /nfs/dbraw/zinc/28/64/93/225286493.db2.gz DGUQUJBETSSHAD-JKSUJKDBSA-N 0 3 341.411 2.943 20 5 EFBDHN C[C@H]1C[C@H](c2ccc(F)cc2)CN1CCn1cc([N+](=O)[O-])ccc1=O ZINC000159837208 225286894 /nfs/dbraw/zinc/28/68/94/225286894.db2.gz BKOBIUHGALEKPX-ZFWWWQNUSA-N 0 3 345.374 2.774 20 5 EFBDHN C[C@H]1C[C@H](N(C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CCN1C ZINC000123357751 222263097 /nfs/dbraw/zinc/26/30/97/222263097.db2.gz HIKPQKZXJDBFKU-GXTWGEPZSA-N 0 3 345.403 2.559 20 5 EFBDHN C[C@@H]1C[C@@H](N(C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CCN1C ZINC000123357961 222264112 /nfs/dbraw/zinc/26/41/12/222264112.db2.gz HIKPQKZXJDBFKU-OCCSQVGLSA-N 0 3 345.403 2.559 20 5 EFBDHN CCN(CC)CCCCNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000189753578 265201298 /nfs/dbraw/zinc/20/12/98/265201298.db2.gz MCSMRMCVRRMMFC-UHFFFAOYSA-N 0 3 343.449 2.532 20 5 EFBDHN CN(C)CCN(Cc1ccccc1)C(=O)c1csc([N+](=O)[O-])c1 ZINC000193466695 265330874 /nfs/dbraw/zinc/33/08/74/265330874.db2.gz NWIIYQVIKSBQKS-UHFFFAOYSA-N 0 3 333.413 2.860 20 5 EFBDHN C[C@H]1CN(C)CC[C@H]1N(C)C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000247372853 265474388 /nfs/dbraw/zinc/47/43/88/265474388.db2.gz KYFPCEHUGADUFJ-GXFFZTMASA-N 0 3 325.796 2.660 20 5 EFBDHN CCc1nn(C)c(N[C@H]2CCN(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000271307672 265942406 /nfs/dbraw/zinc/94/24/06/265942406.db2.gz RYSAPMKDPJTSPS-AWEZNQCLSA-N 0 3 329.404 2.577 20 5 EFBDHN Cc1ccc([C@H](C)N[C@H]2CCC[C@H](S(C)(=O)=O)C2)cc1[N+](=O)[O-] ZINC000271559436 266007759 /nfs/dbraw/zinc/00/77/59/266007759.db2.gz XHVPADQUTLYDKS-QEJZJMRPSA-N 0 3 340.445 2.910 20 5 EFBDHN COc1cccc([C@@H](C)NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000271620683 266022904 /nfs/dbraw/zinc/02/29/04/266022904.db2.gz CYFPERRGEXNYDW-CZUORRHYSA-N 0 3 346.383 2.694 20 5 EFBDHN Cc1c(CC(=O)N(C)[C@@H](C)C2CCN(C)CC2)cccc1[N+](=O)[O-] ZINC000272213953 266191467 /nfs/dbraw/zinc/19/14/67/266191467.db2.gz SCIIWWYCFPTNSJ-AWEZNQCLSA-N 0 3 333.432 2.634 20 5 EFBDHN CN1CC[C@H]2CCN(c3ccc(Br)cc3[N+](=O)[O-])[C@H]2C1 ZINC000272223818 266196005 /nfs/dbraw/zinc/19/60/05/266196005.db2.gz SLXUDYJHAYITEU-HZMBPMFUSA-N 0 3 340.221 2.888 20 5 EFBDHN CN1CC[C@H]2CCN(c3ccc([N+](=O)[O-])c(OC(F)F)c3)[C@H]2C1 ZINC000272258847 266206716 /nfs/dbraw/zinc/20/67/16/266206716.db2.gz ZUYLTJIGWKKGEQ-GWCFXTLKSA-N 0 3 327.331 2.727 20 5 EFBDHN C[C@H](NC(=O)N1CCC[C@@H]2CN(C)CC[C@H]21)c1ccccc1[N+](=O)[O-] ZINC000272593853 266319753 /nfs/dbraw/zinc/31/97/53/266319753.db2.gz OGFPNEWHDJAZFV-SQWLQELKSA-N 0 3 346.431 2.782 20 5 EFBDHN COC(=O)C1=C(C)O[C@H](CN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000272609272 266326536 /nfs/dbraw/zinc/32/65/36/266326536.db2.gz WMHCZTDUADXZCN-FZMZJTMJSA-N 0 3 334.372 2.790 20 5 EFBDHN CC[C@H](NC(=O)N1CC[C@@H]2CCN(C)C[C@@H]21)c1cccc([N+](=O)[O-])c1 ZINC000272633259 266333313 /nfs/dbraw/zinc/33/33/13/266333313.db2.gz XFWVLGAIWPVNDR-JQFCIGGWSA-N 0 3 346.431 2.782 20 5 EFBDHN CC[C@H](NC(=O)N1CC[C@H]2CCN(C)C[C@H]21)c1cccc([N+](=O)[O-])c1 ZINC000272633266 266334071 /nfs/dbraw/zinc/33/40/71/266334071.db2.gz XFWVLGAIWPVNDR-XOKHGSTOSA-N 0 3 346.431 2.782 20 5 EFBDHN C[C@@H](NC(=O)N[C@@H](C)C1=CCN(C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000272724897 266364881 /nfs/dbraw/zinc/36/48/81/266364881.db2.gz JQVSEYZPDWXTLL-QWHCGFSZSA-N 0 3 332.404 2.605 20 5 EFBDHN Cc1cc(NCC2(C(N)=O)CCCC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000272784597 266380509 /nfs/dbraw/zinc/38/05/09/266380509.db2.gz BBUKUFYRKHTSOG-UHFFFAOYSA-N 0 3 328.372 2.909 20 5 EFBDHN C[C@H](NCCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)c1cnn(C)c1 ZINC000273363968 266487944 /nfs/dbraw/zinc/48/79/44/266487944.db2.gz JVNHJPCSLXLDCU-LBPRGKRZSA-N 0 3 341.371 2.877 20 5 EFBDHN CCN1CCC(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000273937410 266582611 /nfs/dbraw/zinc/58/26/11/266582611.db2.gz JJPHQCDFOMPCDX-UHFFFAOYSA-N 0 3 337.395 2.612 20 5 EFBDHN COc1cc(CN2CC[C@@H](N3CCCCC3)C2)c([N+](=O)[O-])cc1F ZINC000274345894 266636977 /nfs/dbraw/zinc/63/69/77/266636977.db2.gz VUAURKHWXBRUJY-CQSZACIVSA-N 0 3 337.395 2.803 20 5 EFBDHN CS[C@@H]1CN(c2ccc([N+](=O)[O-])cc2F)C[C@@H]1N1CCCC1 ZINC000274713173 266695966 /nfs/dbraw/zinc/69/59/66/266695966.db2.gz YSKNJVXDXUQMTQ-LSDHHAIUSA-N 0 3 325.409 2.750 20 5 EFBDHN CN1CCC[C@@H](CNC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C1 ZINC000108334739 273009199 /nfs/dbraw/zinc/00/91/99/273009199.db2.gz RQRALLBCWJTCBI-ZDUSSCGKSA-N 0 3 333.432 2.964 20 5 EFBDHN CS[C@H]1CN(c2nc3ccccc3cc2[N+](=O)[O-])C[C@@H]1N(C)C ZINC000276683660 267035564 /nfs/dbraw/zinc/03/55/64/267035564.db2.gz VGYIYNZFPOJHFC-GJZGRUSLSA-N 0 3 332.429 2.625 20 5 EFBDHN CCO[C@@H]1C[C@@H](NCc2cccc([N+](=O)[O-])c2C)C12CCOCC2 ZINC000276911573 267074625 /nfs/dbraw/zinc/07/46/25/267074625.db2.gz PEKWHGLYKLIPQB-IAGOWNOFSA-N 0 3 334.416 2.967 20 5 EFBDHN COc1cc(C(=O)N[C@H]2CCCN(C(C)C)C2)cc([N+](=O)[O-])c1C ZINC000277038267 267104739 /nfs/dbraw/zinc/10/47/39/267104739.db2.gz LZBNDQPJRJMNLB-AWEZNQCLSA-N 0 3 335.404 2.514 20 5 EFBDHN C[C@@H]1CC(C)(C)C[C@@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000277543177 267193019 /nfs/dbraw/zinc/19/30/19/267193019.db2.gz XIYHSUCUTAZEIU-DOMZBBRYSA-N 0 3 340.445 2.783 20 5 EFBDHN C[C@H]1CC(C)(C)C[C@@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000277543191 267193515 /nfs/dbraw/zinc/19/35/15/267193515.db2.gz XIYHSUCUTAZEIU-WFASDCNBSA-N 0 3 340.445 2.783 20 5 EFBDHN Cc1cc(N2CC[S@](=O)C[C@@H](C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000278255119 267382084 /nfs/dbraw/zinc/38/20/84/267382084.db2.gz VBBMVBZYJIZTAN-RULNZOCKSA-N 0 3 333.413 2.656 20 5 EFBDHN Cc1cc(N2CC[S@](=O)C[C@H](C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000278255112 267382461 /nfs/dbraw/zinc/38/24/61/267382461.db2.gz VBBMVBZYJIZTAN-BGJPBQGDSA-N 0 3 333.413 2.656 20 5 EFBDHN Cc1ccc([C@H]2C[C@@H](C)N(CCn3cc([N+](=O)[O-])ccc3=O)C2)cc1 ZINC000278809518 267566459 /nfs/dbraw/zinc/56/64/59/267566459.db2.gz ZYYVWLJZFINDRD-WBVHZDCISA-N 0 3 341.411 2.943 20 5 EFBDHN Cc1cc(CN(C)C)cc(NC(=O)COc2ccc([N+](=O)[O-])cc2)c1 ZINC000270375707 273093837 /nfs/dbraw/zinc/09/38/37/273093837.db2.gz LKBNKAFNXSJLTC-UHFFFAOYSA-N 0 3 343.383 2.982 20 5 EFBDHN CCOc1ccc([C@@H](C)NCCCOCCOC)cc1[N+](=O)[O-] ZINC000271146089 273101812 /nfs/dbraw/zinc/10/18/12/273101812.db2.gz PMJFXLWMMCGYIN-CYBMUJFWSA-N 0 3 326.393 2.697 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCN(CCCC3CCOCC3)CC2)cc1 ZINC000274239351 273126617 /nfs/dbraw/zinc/12/66/17/273126617.db2.gz VOMQHUMOCRYMLD-UHFFFAOYSA-N 0 3 333.432 2.924 20 5 EFBDHN CCC(=O)N1CC[C@H](N[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000279058421 273171630 /nfs/dbraw/zinc/17/16/30/273171630.db2.gz KPLYRTZNXIFBST-BLLLJJGKSA-N 0 3 331.416 2.918 20 5 EFBDHN C[C@@H](CN1CCOCC1)N[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000279156080 273182898 /nfs/dbraw/zinc/18/28/98/273182898.db2.gz TTYGUQGONQMEJX-GUYCJALGSA-N 0 3 333.432 2.628 20 5 EFBDHN CO[C@@]1(C)CCCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000279271664 273196165 /nfs/dbraw/zinc/19/61/65/273196165.db2.gz JGSDWQCRPGLJDQ-INIZCTEOSA-N 0 3 339.367 2.563 20 5 EFBDHN CC(C)[C@H](C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N(C)C ZINC000279357671 273206410 /nfs/dbraw/zinc/20/64/10/273206410.db2.gz UYOQEXWCIOCYBY-CYBMUJFWSA-N 0 3 347.337 2.816 20 5 EFBDHN C[C@H](CC(=O)N(C)C)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000279580121 273230527 /nfs/dbraw/zinc/23/05/27/273230527.db2.gz UNONDPDWSWPKOT-SECBINFHSA-N 0 3 333.310 2.570 20 5 EFBDHN COc1ccc(OCCN2CCCC[C@H]2C[C@H](C)O)c([N+](=O)[O-])c1 ZINC000279745586 273248851 /nfs/dbraw/zinc/24/88/51/273248851.db2.gz KXTDXXWWRKIKHT-KBPBESRZSA-N 0 3 338.404 2.608 20 5 EFBDHN CC1(C)CCN(C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCS1 ZINC000279805739 273255417 /nfs/dbraw/zinc/25/54/17/273255417.db2.gz XDEICJRAVZYONE-CYBMUJFWSA-N 0 3 340.445 2.552 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21 ZINC000279915387 273268568 /nfs/dbraw/zinc/26/85/68/273268568.db2.gz FDKZXRSKFGDQSZ-KBPBESRZSA-N 0 3 347.415 2.550 20 5 EFBDHN CCN(CCNC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000280426722 273326873 /nfs/dbraw/zinc/32/68/73/273326873.db2.gz IQTDRXUISYBYOI-UHFFFAOYSA-N 0 3 343.786 2.530 20 5 EFBDHN CO[C@@]1(C)CCCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000280519974 273336381 /nfs/dbraw/zinc/33/63/81/273336381.db2.gz HPZXLCFBOWAEPG-SFHVURJKSA-N 0 3 344.415 2.996 20 5 EFBDHN O=[N+]([O-])c1ccc(CCN2CC[C@@H](OCc3ccncc3)C2)cc1 ZINC000281079968 273398562 /nfs/dbraw/zinc/39/85/62/273398562.db2.gz UKWAVZPITDFQHX-GOSISDBHSA-N 0 3 327.384 2.823 20 5 EFBDHN COC[C@H](O)CNCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000282726891 273607284 /nfs/dbraw/zinc/60/72/84/273607284.db2.gz SGBKVHXWYKZXPI-LLVKDONJSA-N 0 3 340.763 2.605 20 5 EFBDHN O=C(Nc1ccccc1)N1CC[C@@H](NCc2ccc([N+](=O)[O-])cc2)C1 ZINC000282936429 273641999 /nfs/dbraw/zinc/64/19/99/273641999.db2.gz IJSZIKFHMWMVEF-MRXNPFEDSA-N 0 3 340.383 2.991 20 5 EFBDHN Cc1cc(F)c(NC(=O)NC2CCN(C3CC3)CC2)cc1[N+](=O)[O-] ZINC000283922376 273775122 /nfs/dbraw/zinc/77/51/22/273775122.db2.gz KFGYCIHNTVVXAE-UHFFFAOYSA-N 0 3 336.367 2.791 20 5 EFBDHN C[C@H](N[C@H](CO)Cc1ccc(F)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000285358836 273985181 /nfs/dbraw/zinc/98/51/81/273985181.db2.gz VONVSMSEMMGKIW-NHYWBVRUSA-N 0 3 333.363 2.570 20 5 EFBDHN COc1cccc([C@@H](CNc2ccc(N)cc2[N+](=O)[O-])N(C)C)c1 ZINC000285567397 274026887 /nfs/dbraw/zinc/02/68/87/274026887.db2.gz JPHDIIZBOYFMTR-QGZVFWFLSA-N 0 3 330.388 2.900 20 5 EFBDHN C[C@H]1COCC[C@H]1CNCc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000285617828 274038761 /nfs/dbraw/zinc/03/87/61/274038761.db2.gz WGUSRGAGMZTARD-QWRGUYRKSA-N 0 3 330.331 2.958 20 5 EFBDHN CO[C@](C)([C@@H](C)NCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000411978506 274086643 /nfs/dbraw/zinc/08/66/43/274086643.db2.gz ZCEIWMZVRANCFS-SJKOYZFVSA-N 0 3 335.404 2.635 20 5 EFBDHN C[C@H]1CCCN(CCNC(=O)N(C)CCc2ccccc2[N+](=O)[O-])C1 ZINC000286671991 274247760 /nfs/dbraw/zinc/24/77/60/274247760.db2.gz PMCUIQXPNBVJLT-HNNXBMFYSA-N 0 3 348.447 2.511 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@@H](C(=O)N2CCCC2)C1 ZINC000286702754 274255065 /nfs/dbraw/zinc/25/50/65/274255065.db2.gz AFDPASFULCMMHI-LSDHHAIUSA-N 0 3 331.416 2.909 20 5 EFBDHN O=[N+]([O-])c1ccc(CCN2CC[C@@H](C(F)(F)F)[C@@H](CO)C2)cc1 ZINC000286765838 274269063 /nfs/dbraw/zinc/26/90/63/274269063.db2.gz ZMMKZDGVOFMKQV-TZMCWYRMSA-N 0 3 332.322 2.630 20 5 EFBDHN C[C@@H](N[C@@H]1CCCN(C(=O)N2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000287495611 274432553 /nfs/dbraw/zinc/43/25/53/274432553.db2.gz NMVBWAQSXBXQJE-GDBMZVCRSA-N 0 3 346.431 2.926 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN[C@@H]2CCO[C@H]2c2ccc(Cl)cc2)c1 ZINC000192043581 275042039 /nfs/dbraw/zinc/04/20/39/275042039.db2.gz OXNJEBQKGQDMGL-CABCVRRESA-N 0 3 336.779 2.565 20 5 EFBDHN CN1CCCC(C)(C)[C@H]1CNC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000347490179 277040947 /nfs/dbraw/zinc/04/09/47/277040947.db2.gz GXIOEYVDDVMBMS-MRXNPFEDSA-N 0 3 348.447 2.557 20 5 EFBDHN COc1cc(CN[C@@H]([C@H](CO)C2CC2)C2CC2)c([N+](=O)[O-])cc1F ZINC000451610346 277378069 /nfs/dbraw/zinc/37/80/69/277378069.db2.gz KFPVIPBJHLWMMM-CXAGYDPISA-N 0 3 338.379 2.629 20 5 EFBDHN COC(=O)[C@H]1CCN(c2cc(C)nc3ccc([N+](=O)[O-])cc32)[C@@H]1C ZINC000344981182 277396676 /nfs/dbraw/zinc/39/66/76/277396676.db2.gz HMMOTPZQXHEYLI-YPMHNXCESA-N 0 3 329.356 2.839 20 5 EFBDHN CO[C@@](C)([C@H](C)NCC(=O)Nc1c(C)cccc1[N+](=O)[O-])C1CC1 ZINC000411965451 277699174 /nfs/dbraw/zinc/69/91/74/277699174.db2.gz FKCJEIKDEOZQRH-SJCJKPOMSA-N 0 3 335.404 2.635 20 5 EFBDHN COc1cccc([C@@H]2CCCN2CCn2cc([N+](=O)[O-])ccc2=O)c1 ZINC000159691884 278019955 /nfs/dbraw/zinc/01/99/55/278019955.db2.gz PTBAJZDGJIBGEM-KRWDZBQOSA-N 0 3 343.383 2.602 20 5 EFBDHN C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000341056042 278257176 /nfs/dbraw/zinc/25/71/76/278257176.db2.gz MFWIZNCMWDLYBK-CABCVRRESA-N 0 3 348.447 2.557 20 5 EFBDHN C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000347295674 278257245 /nfs/dbraw/zinc/25/72/45/278257245.db2.gz YSYFCZQBIYQJHE-NEPJUHHUSA-N 0 3 338.383 2.976 20 5 EFBDHN C[C@H]1CCN(C)CCN1c1ccc(Br)cc1[N+](=O)[O-] ZINC000354083380 278366499 /nfs/dbraw/zinc/36/64/99/278366499.db2.gz BSKDRZAOAPEYJN-JTQLQIEISA-N 0 3 328.210 2.888 20 5 EFBDHN C[C@@H](N[C@@H]1CCCN(c2ccnn2C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000365736737 278369450 /nfs/dbraw/zinc/36/94/50/278369450.db2.gz UPPHLHLHTCAKDV-UKRRQHHQSA-N 0 3 329.404 2.648 20 5 EFBDHN CCN(CCN1CCCCCC1)C(=O)c1cc(OC)ccc1[N+](=O)[O-] ZINC000345476359 279188070 /nfs/dbraw/zinc/18/80/70/279188070.db2.gz RRPYMDBHLKAPER-UHFFFAOYSA-N 0 3 349.431 2.942 20 5 EFBDHN C[C@H](CCS(C)(=O)=O)N[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433288793 279270300 /nfs/dbraw/zinc/27/03/00/279270300.db2.gz OCKFVHDCXJYHDX-IAQYHMDHSA-N 0 3 340.445 2.730 20 5 EFBDHN C[C@H](CN1CCCCC1)Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000170639588 279303884 /nfs/dbraw/zinc/30/38/84/279303884.db2.gz GKGPXUDHXUYYSM-GFCCVEGCSA-N 0 3 332.404 2.766 20 5 EFBDHN C[C@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000133515205 279322464 /nfs/dbraw/zinc/32/24/64/279322464.db2.gz DAJIIBXEGKLXQP-JHJVBQTASA-N 0 3 337.395 2.830 20 5 EFBDHN CC(C)[C@H](NCCn1ccc([N+](=O)[O-])n1)c1ccc2c(c1)OCCO2 ZINC000181974111 280325963 /nfs/dbraw/zinc/32/59/63/280325963.db2.gz AGVCSMUWPGGOEA-KRWDZBQOSA-N 0 3 346.387 2.549 20 5 EFBDHN Cc1cc(NC[C@@H](O)CN2CCC(C)CC2)c(F)cc1[N+](=O)[O-] ZINC000360066030 280626695 /nfs/dbraw/zinc/62/66/95/280626695.db2.gz MSMVDHCEFAAAFW-CYBMUJFWSA-N 0 3 325.384 2.547 20 5 EFBDHN Cc1ccc([C@H](CNCc2ccccc2[N+](=O)[O-])N2CCOCC2)o1 ZINC000073052235 280987260 /nfs/dbraw/zinc/98/72/60/280987260.db2.gz PCZFOIKSIFGHJF-KRWDZBQOSA-N 0 3 345.399 2.659 20 5 EFBDHN CN(C)CCN(C(=O)c1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000058297077 292666930 /nfs/dbraw/zinc/66/69/30/292666930.db2.gz AKRWFZIVYYSEBK-UHFFFAOYSA-N 0 3 331.347 2.942 20 5 EFBDHN C[C@@H]1[C@@H](N2CCCC2)CCN1C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000376486115 288983698 /nfs/dbraw/zinc/98/36/98/288983698.db2.gz GVEWLDUNSYLIMN-RISCZKNCSA-N 0 3 337.807 2.947 20 5 EFBDHN CN(C)CCN(CCCc1ccccc1)c1ncccc1[N+](=O)[O-] ZINC000081018835 292810131 /nfs/dbraw/zinc/81/01/31/292810131.db2.gz WBTBYONSQXTHIM-UHFFFAOYSA-N 0 3 328.416 2.991 20 5 EFBDHN CN1CCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000130237205 293158188 /nfs/dbraw/zinc/15/81/88/293158188.db2.gz RSNFOHVYOVLCDA-JTQLQIEISA-N 0 3 345.321 2.685 20 5 EFBDHN O=[N+]([O-])c1ccc(CN(C[C@@H](O)COCc2ccco2)C2CC2)cc1 ZINC000130897245 293181425 /nfs/dbraw/zinc/18/14/25/293181425.db2.gz RIABZKMAZVXPAE-QGZVFWFLSA-N 0 3 346.383 2.730 20 5 EFBDHN CN(C)CCN(Cc1ccco1)C(=O)/C=C\c1ccccc1[N+](=O)[O-] ZINC000255831077 293885993 /nfs/dbraw/zinc/88/59/93/293885993.db2.gz MDZNXJFOXBDHRT-KTKRTIGZSA-N 0 3 343.383 2.791 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN[C@H]3CCO[C@H](C(F)(F)F)C3)nc2c1 ZINC000289908812 293943967 /nfs/dbraw/zinc/94/39/67/293943967.db2.gz XUUOEEYLUXFZKE-UFBFGSQYSA-N 0 3 344.293 2.671 20 5 EFBDHN C[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])cc2N2CCOC2=O)CN1C1CC1 ZINC000290871180 294207827 /nfs/dbraw/zinc/20/78/27/294207827.db2.gz ZQTRZHYGDSYEQJ-RYUDHWBXSA-N 0 3 346.387 2.589 20 5 EFBDHN C[C@H]1C[C@@H](Nc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CN1C1CC1 ZINC000290871279 294208360 /nfs/dbraw/zinc/20/83/60/294208360.db2.gz ZSTQVZSJAGDHPD-SMDDNHRTSA-N 0 3 344.415 2.524 20 5 EFBDHN COCCN1CC[C@@H](NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000290884778 294211788 /nfs/dbraw/zinc/21/17/88/294211788.db2.gz MINRZBSIVDFJKD-GFCCVEGCSA-N 0 3 348.230 2.712 20 5 EFBDHN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc2c(c1)CNCCO2 ZINC000291036839 294254819 /nfs/dbraw/zinc/25/48/19/294254819.db2.gz HROBNINQTRFGOO-UHFFFAOYSA-N 0 3 341.367 2.648 20 5 EFBDHN CON(C)C(=O)C1CCN([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000291979769 294541210 /nfs/dbraw/zinc/54/12/10/294541210.db2.gz WFLHMVORMKSMMV-ZDUSSCGKSA-N 0 3 335.404 2.696 20 5 EFBDHN COc1c(C(=O)N(CCN(C)C)C2CCCCC2)cccc1[N+](=O)[O-] ZINC000355983674 294883866 /nfs/dbraw/zinc/88/38/66/294883866.db2.gz HOQYZSAXZNRUJZ-UHFFFAOYSA-N 0 3 349.431 2.940 20 5 EFBDHN C[C@@H]1CN(C(=O)c2cc(F)ccc2[N+](=O)[O-])CCN(C2CCC2)C1 ZINC000293654999 295020507 /nfs/dbraw/zinc/02/05/07/295020507.db2.gz IQIAZEPCUQHRLK-LBPRGKRZSA-N 0 3 335.379 2.680 20 5 EFBDHN C[C@@H]1CN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CCN(C2CCC2)C1 ZINC000293819579 295056570 /nfs/dbraw/zinc/05/65/70/295056570.db2.gz ZHOWKWGBHGENED-VSGCLNPGSA-N 0 3 343.427 2.941 20 5 EFBDHN C[C@H]1CN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CCN(C2CCC2)C1 ZINC000293819576 295056623 /nfs/dbraw/zinc/05/66/23/295056623.db2.gz ZHOWKWGBHGENED-JOZWUWCOSA-N 0 3 343.427 2.941 20 5 EFBDHN CN1CCC[C@@]2(CCN(C(=O)c3c[nH]c4cc([N+](=O)[O-])ccc34)C2)C1 ZINC000293900112 295075100 /nfs/dbraw/zinc/07/51/00/295075100.db2.gz HBONWSSJJMXEIC-GOSISDBHSA-N 0 3 342.399 2.634 20 5 EFBDHN CN1CCC[C@]2(CCN(C(=O)c3c(Cl)cccc3[N+](=O)[O-])C2)C1 ZINC000294101605 295111122 /nfs/dbraw/zinc/11/11/22/295111122.db2.gz KSURYMUTSVMDKI-INIZCTEOSA-N 0 3 337.807 2.806 20 5 EFBDHN CCc1ccc(C(=O)N2CC[C@@]3(C2)CCCN(C)C3)cc1[N+](=O)[O-] ZINC000294257513 295136400 /nfs/dbraw/zinc/13/64/00/295136400.db2.gz SWXANUCEXXZAIW-SFHVURJKSA-N 0 3 331.416 2.715 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@]3(C2)CCCN(C)C3)c1 ZINC000294380752 295157554 /nfs/dbraw/zinc/15/75/54/295157554.db2.gz ZYUKYMOXKGBIFX-GOSISDBHSA-N 0 3 347.415 2.551 20 5 EFBDHN CN1CCCN(c2ccc(NC(=O)CCC(C)(C)[N+](=O)[O-])cc2)CC1 ZINC000294388275 295158491 /nfs/dbraw/zinc/15/84/91/295158491.db2.gz INAINQLPAFGVDH-UHFFFAOYSA-N 0 3 348.447 2.603 20 5 EFBDHN C[C@@H](CNC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N(C)C1CC1 ZINC000294513103 295178594 /nfs/dbraw/zinc/17/85/94/295178594.db2.gz HPQJICMCQAGAJB-VIFPVBQESA-N 0 3 345.321 2.826 20 5 EFBDHN COc1cc(CNC[C@@H](Cc2ccccc2)OC)c([N+](=O)[O-])cc1O ZINC000294759470 295222163 /nfs/dbraw/zinc/22/21/63/295222163.db2.gz IZAZUTMQCXHDQG-OAHLLOKOSA-N 0 3 346.383 2.656 20 5 EFBDHN CC[C@@H](C)[C@@H](CNCc1cc(OC)c(OC)cc1[N+](=O)[O-])OC ZINC000294764277 295223112 /nfs/dbraw/zinc/22/31/12/295223112.db2.gz JJFPQOALHFPEPB-BDJLRTHQSA-N 0 3 326.393 2.763 20 5 EFBDHN COc1ccc(CNC[C@@H](Cc2ccccc2)OC)cc1[N+](=O)[O-] ZINC000294889552 295241784 /nfs/dbraw/zinc/24/17/84/295241784.db2.gz WHUZATGVSGTUEC-MRXNPFEDSA-N 0 3 330.384 2.951 20 5 EFBDHN CS[C@H]1CCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000295018126 295258182 /nfs/dbraw/zinc/25/81/82/295258182.db2.gz KFYFYXOMZMUJEH-HNNXBMFYSA-N 0 3 332.429 2.933 20 5 EFBDHN C[C@H]1CCN(C(=O)CCC(C)(C)[N+](=O)[O-])CCN1Cc1ccccc1 ZINC000295260041 295289182 /nfs/dbraw/zinc/28/91/82/295289182.db2.gz KUMFQODXFULJKV-INIZCTEOSA-N 0 3 347.459 2.945 20 5 EFBDHN C[C@H]1CN(C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CCN(C2CC2)C1 ZINC000295330129 295301735 /nfs/dbraw/zinc/30/17/35/295301735.db2.gz LUAQBLSGVSDGQO-GFCCVEGCSA-N 0 3 342.399 2.632 20 5 EFBDHN C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CCN(C2CC2)C1 ZINC000295417757 295316692 /nfs/dbraw/zinc/31/66/92/295316692.db2.gz SUNNQCWTZCEWLY-LLVKDONJSA-N 0 3 337.807 2.805 20 5 EFBDHN C[C@@H]1CN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CCN(C2CC2)C1 ZINC000295513448 295333705 /nfs/dbraw/zinc/33/37/05/295333705.db2.gz HTLGTTVXBMJUSD-MRZGDXHCSA-N 0 3 329.400 2.551 20 5 EFBDHN CO[C@@]1(C)C[C@@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1(C)C ZINC000295821601 295381183 /nfs/dbraw/zinc/38/11/83/295381183.db2.gz BXMCCRJYDLXSQC-PBHICJAKSA-N 0 3 335.404 2.635 20 5 EFBDHN CC[C@@H](C)N1CCN([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000296163987 295434459 /nfs/dbraw/zinc/43/44/59/295434459.db2.gz SXGZWHJKKIEXNX-HIFRSBDPSA-N 0 3 348.447 2.646 20 5 EFBDHN Cc1cccc([C@H]2CCCN2CCn2cc([N+](=O)[O-])ccc2=O)c1 ZINC000159769522 302036420 /nfs/dbraw/zinc/03/64/20/302036420.db2.gz LCSILJADMRUBAX-QGZVFWFLSA-N 0 3 327.384 2.902 20 5 EFBDHN COc1ccc2c(c1)ncc([N+](=O)[O-])c2N1CC[C@@H](N2CC=CC2)C1 ZINC000297094339 310851608 /nfs/dbraw/zinc/85/16/08/310851608.db2.gz KTLLRYXNVZEWAY-CYBMUJFWSA-N 0 3 340.383 2.602 20 5 EFBDHN C[C@H]1CCCN(CCNC(=O)c2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000298760611 311021032 /nfs/dbraw/zinc/02/10/32/311021032.db2.gz RCPNIXQZFQAFOQ-NSHDSACASA-N 0 3 325.796 2.710 20 5 EFBDHN CC(C)N(Cc1ccco1)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000299375121 311078281 /nfs/dbraw/zinc/07/82/81/311078281.db2.gz LUPPOMAZIJOVRV-HNNXBMFYSA-N 0 3 334.372 2.838 20 5 EFBDHN O=C(NCC1CCN(Cc2cccs2)CC1)c1ccc([N+](=O)[O-])[nH]1 ZINC000299424527 311083300 /nfs/dbraw/zinc/08/33/00/311083300.db2.gz JLNPYVGRHLVAHB-UHFFFAOYSA-N 0 3 348.428 2.626 20 5 EFBDHN CN(c1ccc([N+](=O)[O-])cn1)C1CCN(CCc2ccccn2)CC1 ZINC000299481993 311089416 /nfs/dbraw/zinc/08/94/16/311089416.db2.gz AHMLWGDUIUICQF-UHFFFAOYSA-N 0 3 341.415 2.528 20 5 EFBDHN CCN1CCN([C@@H](C)CNc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000301113217 311119666 /nfs/dbraw/zinc/11/96/66/311119666.db2.gz PRSVJJAJDJLOQG-LBPRGKRZSA-N 0 3 326.828 2.686 20 5 EFBDHN CC1CCN(C[C@@H](O)CNc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000301573906 311145376 /nfs/dbraw/zinc/14/53/76/311145376.db2.gz ZCJMTBVKACRBQT-ZDUSSCGKSA-N 0 3 327.812 2.753 20 5 EFBDHN CCN1CCCC[C@H]1CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000301573837 311145387 /nfs/dbraw/zinc/14/53/87/311145387.db2.gz ZBNYJXNDQVFQAY-HNNXBMFYSA-N 0 3 346.431 2.773 20 5 EFBDHN COC1CCN(CCNc2ccc([N+](=O)[O-])c3cnccc23)CC1 ZINC000301574582 311145424 /nfs/dbraw/zinc/14/54/24/311145424.db2.gz ZGGHWCBRXUPTGR-UHFFFAOYSA-N 0 3 330.388 2.666 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(NC[C@@H](O)CN2CCc3ccccc3C2)c1 ZINC000301575013 311145603 /nfs/dbraw/zinc/14/56/03/311145603.db2.gz QCQINDIWTYPHGK-QGZVFWFLSA-N 0 3 341.411 2.734 20 5 EFBDHN CCN1CCC(N(C)c2ncc([N+](=O)[O-])cc2Br)CC1 ZINC000301574553 311145657 /nfs/dbraw/zinc/14/56/57/311145657.db2.gz YHLBCXOZDKXUHE-UHFFFAOYSA-N 0 3 343.225 2.673 20 5 EFBDHN O=[N+]([O-])c1ccccc1N[C@@H]1CN(Cc2ccccc2)CC[C@@H]1CO ZINC000301742464 311155949 /nfs/dbraw/zinc/15/59/49/311155949.db2.gz YSMVNUFAEQSZSD-SJLPKXTDSA-N 0 3 341.411 2.890 20 5 EFBDHN Cc1cc(NCC2CCS(=O)(=O)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302093430 311177459 /nfs/dbraw/zinc/17/74/59/311177459.db2.gz QVRLXMTVWAOVQU-UHFFFAOYSA-N 0 3 349.412 2.688 20 5 EFBDHN CN1CCCN(c2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)CC1 ZINC000302161934 311181635 /nfs/dbraw/zinc/18/16/35/311181635.db2.gz HSQUUDFRFCWXJI-UHFFFAOYSA-N 0 3 342.399 2.711 20 5 EFBDHN Cc1cc(NC[C@H](C)CN2CCOCC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302212658 311185016 /nfs/dbraw/zinc/18/50/16/311185016.db2.gz YXXVFAZOLNNYIU-ZDUSSCGKSA-N 0 3 344.415 2.832 20 5 EFBDHN C[C@@H](c1cc2ccccc2o1)N(C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000304358612 311212145 /nfs/dbraw/zinc/21/21/45/311212145.db2.gz SVPSJYGSDGEEKR-SWLSCSKDSA-N 0 3 344.371 2.591 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CN1CCNC[C@H]1c1ccccc1 ZINC000313369057 311232422 /nfs/dbraw/zinc/23/24/22/311232422.db2.gz RFKNZDNJQIWTKW-KRWDZBQOSA-N 0 3 327.384 2.750 20 5 EFBDHN Cc1cccc(OC[C@@H](O)CNCc2cccc([N+](=O)[O-])c2C)c1 ZINC000326493122 311244251 /nfs/dbraw/zinc/24/42/51/311244251.db2.gz YGXVWQVQEJPQOE-INIZCTEOSA-N 0 3 330.384 2.741 20 5 EFBDHN CCN1C[C@@H](C)N(CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C[C@H]1C ZINC000330578818 311322915 /nfs/dbraw/zinc/32/29/15/311322915.db2.gz PIRULCIGHMDPFV-HUUCEWRRSA-N 0 3 348.447 2.646 20 5 EFBDHN CCOc1ccc(C(=O)N2CC[C@H](N3CCCCC3)C2)cc1[N+](=O)[O-] ZINC000330649022 311327068 /nfs/dbraw/zinc/32/70/68/311327068.db2.gz OCGUGKOZBULEFP-HNNXBMFYSA-N 0 3 347.415 2.694 20 5 EFBDHN CCNc1ccc(C(=O)N(C)[C@H](C)C2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000330820158 311336766 /nfs/dbraw/zinc/33/67/66/311336766.db2.gz DGYDFEHJZGCVIH-CYBMUJFWSA-N 0 3 348.447 2.829 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCN(C)C[C@@H]1C(C)C ZINC000331002077 311348124 /nfs/dbraw/zinc/34/81/24/311348124.db2.gz QVOWLZUMQUQXIG-QGZVFWFLSA-N 0 3 348.447 2.504 20 5 EFBDHN COc1cc(CN2CCN(C)C[C@@H]2C(C)C)c([N+](=O)[O-])cc1F ZINC000331236913 311362524 /nfs/dbraw/zinc/36/25/24/311362524.db2.gz HCULWEUDIGKOTE-OAHLLOKOSA-N 0 3 325.384 2.515 20 5 EFBDHN CS[C@@H]1CN(C(=O)c2cc(C)ccc2[N+](=O)[O-])C[C@@H]1N1CCCC1 ZINC000332070173 311450564 /nfs/dbraw/zinc/45/05/64/311450564.db2.gz BMMODXNMCKQEDI-JKSUJKDBSA-N 0 3 349.456 2.555 20 5 EFBDHN C[C@@H](C(=O)N1CCC[C@H](N2CCCC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000332388302 311497619 /nfs/dbraw/zinc/49/76/19/311497619.db2.gz CHFYQECYEHQJQS-HIFRSBDPSA-N 0 3 349.406 2.924 20 5 EFBDHN C[C@H](C(=O)N1CCC[C@H](N2CCCC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000332388305 311497724 /nfs/dbraw/zinc/49/77/24/311497724.db2.gz CHFYQECYEHQJQS-ZFWWWQNUSA-N 0 3 349.406 2.924 20 5 EFBDHN CN(C)CCOC1CCN(c2ccc([N+](=O)[O-])c3ncccc23)CC1 ZINC000413146223 312046316 /nfs/dbraw/zinc/04/63/16/312046316.db2.gz WRCGUTJOBXRNMV-UHFFFAOYSA-N 0 3 344.415 2.690 20 5 EFBDHN CCC(=O)N1CC[C@H](N[C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417308222 312207083 /nfs/dbraw/zinc/20/70/83/312207083.db2.gz HQRHPKASBJVJDE-WMLDXEAASA-N 0 3 331.416 2.963 20 5 EFBDHN Cc1nc2n(n1)C[C@@H](N[C@H]1CCCCc3ccc([N+](=O)[O-])cc31)CC2 ZINC000417312000 312207438 /nfs/dbraw/zinc/20/74/38/312207438.db2.gz MYJNQDFTEREIOJ-YOEHRIQHSA-N 0 3 341.415 2.867 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](N[C@H]1CCN(CC(F)F)C1)CCC2 ZINC000417394624 312217755 /nfs/dbraw/zinc/21/77/55/312217755.db2.gz VNYWWLKTYLQYJD-SWLSCSKDSA-N 0 3 325.359 2.901 20 5 EFBDHN C[C@H](NC(=O)NCc1ccc2c(c1)CNC2)c1ccccc1[N+](=O)[O-] ZINC000417977143 312303880 /nfs/dbraw/zinc/30/38/80/312303880.db2.gz GVCVUYICESPYRN-LBPRGKRZSA-N 0 3 340.383 2.758 20 5 EFBDHN CN(C)C(=O)c1ccccc1CN(C)CCc1ccccc1[N+](=O)[O-] ZINC000418052806 312317147 /nfs/dbraw/zinc/31/71/47/312317147.db2.gz XQUOHUOEUCEJFY-UHFFFAOYSA-N 0 3 341.411 2.971 20 5 EFBDHN CN(C)[C@]1(CNc2ccnc3c2cccc3[N+](=O)[O-])CCSC1 ZINC000432315507 312555558 /nfs/dbraw/zinc/55/55/58/312555558.db2.gz ZQLMYENSZYRBCA-INIZCTEOSA-N 0 3 332.429 2.992 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nc(CNCCC3CC(O)C3)cs2)c1 ZINC000432351902 312559192 /nfs/dbraw/zinc/55/91/92/312559192.db2.gz SFWBREHWWMKRKK-UHFFFAOYSA-N 0 3 333.413 2.969 20 5 EFBDHN C[C@@H](CN1CCN(C)CC1)N[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433169409 312597320 /nfs/dbraw/zinc/59/73/20/312597320.db2.gz RGUOYJQHLGLRJV-KSSFIOAISA-N 0 3 346.475 2.543 20 5 EFBDHN CN(C)[C@H](CNc1cccc(C(N)=O)c1[N+](=O)[O-])c1ccc(F)cc1 ZINC000439104956 312633724 /nfs/dbraw/zinc/63/37/24/312633724.db2.gz GMPCPACPAHUJJK-OAHLLOKOSA-N 0 3 346.362 2.548 20 5 EFBDHN COc1ccc(CN[C@H](C)Cc2ccccc2[N+](=O)[O-])c(OC)n1 ZINC000449334883 312684284 /nfs/dbraw/zinc/68/42/84/312684284.db2.gz KAOMMWPOCWIFLR-GFCCVEGCSA-N 0 3 331.372 2.728 20 5 EFBDHN COc1ccc(CN[C@@H](C)Cc2ccccc2[N+](=O)[O-])c(OC)n1 ZINC000449334884 312684536 /nfs/dbraw/zinc/68/45/36/312684536.db2.gz KAOMMWPOCWIFLR-LBPRGKRZSA-N 0 3 331.372 2.728 20 5 EFBDHN CS[C@@H]1CN(c2nccc3c2cccc3[N+](=O)[O-])C[C@H]1N(C)C ZINC000450409084 312692693 /nfs/dbraw/zinc/69/26/93/312692693.db2.gz XANVNZWDGGKEEO-HUUCEWRRSA-N 0 3 332.429 2.625 20 5 EFBDHN CCC[C@H](NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C1CCC1 ZINC000453194620 312878320 /nfs/dbraw/zinc/87/83/20/312878320.db2.gz OEKPIHJRZBKEQC-INIZCTEOSA-N 0 3 340.445 2.927 20 5 EFBDHN CNc1nc(C(=O)Nc2cc(C)cc(CN(C)C)c2)ccc1[N+](=O)[O-] ZINC000456003766 313009367 /nfs/dbraw/zinc/00/93/67/313009367.db2.gz PAQRPVMCBCMYRZ-UHFFFAOYSA-N 0 3 343.387 2.654 20 5 EFBDHN CNc1nc(C(=O)Nc2ccc(CN(C)C)c(C)c2)ccc1[N+](=O)[O-] ZINC000458259508 313096792 /nfs/dbraw/zinc/09/67/92/313096792.db2.gz GKPMAXIUKQGMOG-UHFFFAOYSA-N 0 3 343.387 2.654 20 5 EFBDHN CN(CCc1ccccc1[N+](=O)[O-])Cc1cc(=O)[nH]c(C2CC2)n1 ZINC000459464596 313108593 /nfs/dbraw/zinc/10/85/93/313108593.db2.gz NQJULGQBUOCCLY-UHFFFAOYSA-N 0 3 328.372 2.642 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC[C@H](CN2CCOCC2)C1 ZINC000470169857 313129128 /nfs/dbraw/zinc/12/91/28/313129128.db2.gz LAMXVWRFJAZKDO-QIPHDZALSA-N 0 3 345.443 2.652 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCN(CC(C)(C)O)[C@H](C)C1 ZINC000470211302 313130578 /nfs/dbraw/zinc/13/05/78/313130578.db2.gz HJEPYSBFBLLSOU-DDITZMBXSA-N 0 3 347.459 2.775 20 5 EFBDHN COc1c(C(=O)N[C@H]2CCN(CC3CCCC3)C2)cccc1[N+](=O)[O-] ZINC000476201508 313229833 /nfs/dbraw/zinc/22/98/33/313229833.db2.gz VRERUKATTJEMIV-AWEZNQCLSA-N 0 3 347.415 2.598 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2noc(N3CC[C@H](N4CCCCC4)C3)n2)cc1 ZINC000486966760 313353036 /nfs/dbraw/zinc/35/30/36/313353036.db2.gz KKYGDLXGAWDOQC-HNNXBMFYSA-N 0 3 343.387 2.709 20 5 EFBDHN CCOc1cc(NC[C@]2(N(C)C)CCSC2)ccc1[N+](=O)[O-] ZINC000486976946 313354444 /nfs/dbraw/zinc/35/44/44/313354444.db2.gz ZUMDFYCVNNRCKW-OAHLLOKOSA-N 0 3 325.434 2.843 20 5 EFBDHN CC[C@@H]1CN(CCNCc2ccc(C(C)C)c([N+](=O)[O-])c2)CCO1 ZINC000487190902 313374589 /nfs/dbraw/zinc/37/45/89/313374589.db2.gz RLQZKOLGLGLVSV-MRXNPFEDSA-N 0 3 335.448 2.919 20 5 EFBDHN C[C@@H](NC(=O)/C=C/c1ccc(F)cc1[N+](=O)[O-])C1=CCN(C)CC1 ZINC000492486422 314008518 /nfs/dbraw/zinc/00/85/18/314008518.db2.gz GDFXSUKFEFAIKD-FVOPLDGLSA-N 0 3 333.363 2.514 20 5 EFBDHN CCOC(=O)N1CC[C@@H](NC/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000492511589 314019528 /nfs/dbraw/zinc/01/95/28/314019528.db2.gz QQGZVUBKOOXHFI-BMQCOBNYSA-N 0 3 333.388 2.819 20 5 EFBDHN O=C(/C=C\c1ccccc1)NCCCNCc1csc([N+](=O)[O-])c1 ZINC000492852750 314151293 /nfs/dbraw/zinc/15/12/93/314151293.db2.gz MGWGJEUTBFTUFX-FPLPWBNLSA-N 0 3 345.424 2.966 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)N2CCN(C)CC[C@@H]2C)cc1[N+](=O)[O-] ZINC000492964005 314193520 /nfs/dbraw/zinc/19/35/20/314193520.db2.gz UZYVKOLVECRHQU-UONOGXRCSA-N 0 3 334.420 2.700 20 5 EFBDHN C[C@H](NCc1ccccc1[N+](=O)[O-])C1CN(C(=O)OC(C)(C)C)C1 ZINC000495669009 314790328 /nfs/dbraw/zinc/79/03/28/314790328.db2.gz KFEULRPBRNQIBF-LBPRGKRZSA-N 0 3 335.404 2.940 20 5 EFBDHN CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(CNCc2ccc([N+](=O)[O-])cc2)C1 ZINC000495866059 314857181 /nfs/dbraw/zinc/85/71/81/314857181.db2.gz MPVLYRXPTOXOGV-RDTXWAMCSA-N 0 3 347.415 2.941 20 5 EFBDHN CC(COC(=O)Cc1cccc(NC(=O)OC(C)(C)C)c1)[N+](=O)[O-] ZINC000497193618 315344885 /nfs/dbraw/zinc/34/48/85/315344885.db2.gz AFSADIKMAIMFNE-LLVKDONJSA-N 0 3 338.360 2.785 20 5 EFBDHN CC(COC(=O)Cc1cccc(NC(=O)OC(C)(C)C)c1)[N+](=O)[O-] ZINC000497193619 315344993 /nfs/dbraw/zinc/34/49/93/315344993.db2.gz AFSADIKMAIMFNE-NSHDSACASA-N 0 3 338.360 2.785 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C\CN[C@H](CO)Cc1ccc(F)cc1 ZINC000500229147 315418123 /nfs/dbraw/zinc/41/81/23/315418123.db2.gz NFEDVRRTHNVOGB-IVZVJUQRSA-N 0 3 330.359 2.940 20 5 EFBDHN CC(C)[C@H](C(=O)NCCOc1ccc([N+](=O)[O-])cc1)N1CCCCC1 ZINC000520270486 315943732 /nfs/dbraw/zinc/94/37/32/315943732.db2.gz QMENYLIXEJMDJH-QGZVFWFLSA-N 0 3 349.431 2.600 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCN1CC[C@H](C)C1 ZINC000525292099 316206650 /nfs/dbraw/zinc/20/66/50/316206650.db2.gz IBEGCEQFURBUAM-QWHCGFSZSA-N 0 3 337.445 2.533 20 5 EFBDHN CC(C)N1CCN([C@@H]2CCN([C@@H](C)c3ccccc3[N+](=O)[O-])C2)CC1 ZINC000525686486 316226799 /nfs/dbraw/zinc/22/67/99/316226799.db2.gz SGAIVWWXRSCFKW-DLBZAZTESA-N 0 3 346.475 2.756 20 5 EFBDHN CC(C)N1CCN([C@H]2CCN([C@@H](C)c3ccccc3[N+](=O)[O-])C2)CC1 ZINC000525686488 316226905 /nfs/dbraw/zinc/22/69/05/316226905.db2.gz SGAIVWWXRSCFKW-IRXDYDNUSA-N 0 3 346.475 2.756 20 5 EFBDHN C[C@@H](CNC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCCC1 ZINC000525748453 316232666 /nfs/dbraw/zinc/23/26/66/316232666.db2.gz BBHHFRIYTWTHED-JTQLQIEISA-N 0 3 345.321 2.828 20 5 EFBDHN Cc1ccccc1[C@H]([C@H](C)NC(=O)c1cc([N+](=O)[O-])cn1C)N(C)C ZINC000525959165 316263986 /nfs/dbraw/zinc/26/39/86/316263986.db2.gz SRQIPLZVXBMYJW-GUYCJALGSA-N 0 3 344.415 2.663 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CCC(CCc3ccc(O)cc3)CC2)c1 ZINC000530625893 317157041 /nfs/dbraw/zinc/15/70/41/317157041.db2.gz NNTFJAMQFCTMRO-UHFFFAOYSA-N 0 3 344.415 2.842 20 5 EFBDHN CC(C)OC1CCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000533017298 317463596 /nfs/dbraw/zinc/46/35/96/317463596.db2.gz SNUHHJCHIRHGSZ-UHFFFAOYSA-N 0 3 335.404 2.813 20 5 EFBDHN CC[C@H](NCC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)C(C)(C)C ZINC000537291350 317666658 /nfs/dbraw/zinc/66/66/58/317666658.db2.gz OIEGPOOYFQTVPP-AWEZNQCLSA-N 0 3 337.376 2.676 20 5 EFBDHN COC(=O)[C@H]1CCCC[C@@]1(C)NCc1cc([N+](=O)[O-])ccc1OC ZINC000540577919 317747112 /nfs/dbraw/zinc/74/71/12/317747112.db2.gz WNFXLISCTOBIMB-RHSMWYFYSA-N 0 3 336.388 2.815 20 5 EFBDHN C[C@@H](C(=O)NC[C@@H]1CCCCN1C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000555321483 318353100 /nfs/dbraw/zinc/35/31/00/318353100.db2.gz CAAMDXMQTPBQFE-DYVFJYSZSA-N 0 3 331.416 2.831 20 5 EFBDHN C[C@H](C(=O)NC[C@H]1CCCCN1C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000555321485 318353183 /nfs/dbraw/zinc/35/31/83/318353183.db2.gz CAAMDXMQTPBQFE-SUMWQHHRSA-N 0 3 331.416 2.831 20 5 EFBDHN CC(C)(C)c1ncc(CNCCOc2ccc([N+](=O)[O-])cc2)cn1 ZINC000556595512 318394439 /nfs/dbraw/zinc/39/44/39/318394439.db2.gz VUVDVPAUOBUPCT-UHFFFAOYSA-N 0 3 330.388 2.851 20 5 EFBDHN CCc1nncn1CCN[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000562413090 318645500 /nfs/dbraw/zinc/64/55/00/318645500.db2.gz XGNKNUDOSIMSIA-OAHLLOKOSA-N 0 3 329.404 2.761 20 5 EFBDHN CC[C@@H](C)C[C@H](C)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000565593774 318985494 /nfs/dbraw/zinc/98/54/94/318985494.db2.gz DOUMOHHLUCDTNJ-OLZOCXBDSA-N 0 3 328.434 2.783 20 5 EFBDHN CN(CCCN(C)C(=O)c1csc([N+](=O)[O-])c1)Cc1ccncc1 ZINC000565790733 319003329 /nfs/dbraw/zinc/00/33/29/319003329.db2.gz OITWDAUNMYOVPI-UHFFFAOYSA-N 0 3 348.428 2.645 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](NCCn1cnnc1C1CC1)CCC2 ZINC000565885651 319011429 /nfs/dbraw/zinc/01/14/29/319011429.db2.gz IYDLVNRWOYDAHQ-MRXNPFEDSA-N 0 3 327.388 2.731 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@@H]2CCCc3occc32)c1 ZINC000567464493 319174079 /nfs/dbraw/zinc/17/40/79/319174079.db2.gz VRIJEAXNUJEHMH-CZUORRHYSA-N 0 3 332.356 2.595 20 5 EFBDHN CNc1ccc([N+](=O)[O-])cc1NC(=O)C1CN(C2CCCCC2)C1 ZINC000567965319 319231124 /nfs/dbraw/zinc/23/11/24/319231124.db2.gz BCYUBPCPPMRTJG-UHFFFAOYSA-N 0 3 332.404 2.840 20 5 EFBDHN C[C@@H]1CN(CCCN[C@@H]2CCc3c2cccc3[N+](=O)[O-])C[C@H](C)O1 ZINC000568662582 319306910 /nfs/dbraw/zinc/30/69/10/319306910.db2.gz DGHFCSLJURFVMT-JKIFEVAISA-N 0 3 333.432 2.671 20 5 EFBDHN C[C@H]1CCN(CCNC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC000569555799 319391266 /nfs/dbraw/zinc/39/12/66/319391266.db2.gz PFVGSWORGNZOLX-JTQLQIEISA-N 0 3 345.321 2.685 20 5 EFBDHN Cc1cc(C)c(CNCCC(=O)Nc2ccccc2[N+](=O)[O-])cn1 ZINC000572953612 319719853 /nfs/dbraw/zinc/71/98/53/319719853.db2.gz MXJGFPVNVZEUDH-UHFFFAOYSA-N 0 3 328.372 2.725 20 5 EFBDHN C[C@H](CC(N)=O)NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000578036731 320167468 /nfs/dbraw/zinc/16/74/68/320167468.db2.gz CNOOKNTVQHSMFI-LLVKDONJSA-N 0 3 347.346 2.880 20 5 EFBDHN Cn1nccc1N1CCC[C@@H](N[C@H]2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000578247255 320188784 /nfs/dbraw/zinc/18/87/84/320188784.db2.gz PNAPVVIIEQSYJA-CJNGLKHVSA-N 0 3 341.415 2.574 20 5 EFBDHN O=C(CCN1CC[C@@H](c2cccnc2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000578623296 320223428 /nfs/dbraw/zinc/22/34/28/320223428.db2.gz WHRYYVIKGIBMHD-OAHLLOKOSA-N 0 3 340.383 2.808 20 5 EFBDHN CC(C)[C@@H](NCCn1cc([N+](=O)[O-])cn1)c1ccc2c(c1)OCCO2 ZINC000181974034 323257635 /nfs/dbraw/zinc/25/76/35/323257635.db2.gz DARFOOVXTSCBGT-QGZVFWFLSA-N 0 3 346.387 2.549 20 5 EFBDHN COc1ccc([C@@H](CCO)NCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000182378649 323280132 /nfs/dbraw/zinc/28/01/32/323280132.db2.gz QMRIUELFKQXLEJ-GOSISDBHSA-N 0 3 346.383 2.696 20 5 EFBDHN CC[C@@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)c1c(C)noc1C ZINC000182388983 323280264 /nfs/dbraw/zinc/28/02/64/323280264.db2.gz XFZBJPNIIGWTDD-GOEBONIOSA-N 0 3 349.387 2.680 20 5 EFBDHN C[S@](=O)C[C@@H](NCCOc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000183069209 323314651 /nfs/dbraw/zinc/31/46/51/323314651.db2.gz MQPSDGHIDVHZCQ-OSPHWJPCSA-N 0 3 348.424 2.683 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@@H](CCO)C1CCCCC1 ZINC000183713213 323346361 /nfs/dbraw/zinc/34/63/61/323346361.db2.gz GMOKKTXWZUZTGM-INIZCTEOSA-N 0 3 349.431 2.763 20 5 EFBDHN C[C@H](NC(=O)N(C)CC1CCN(C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000296877099 323662974 /nfs/dbraw/zinc/66/29/74/323662974.db2.gz QDFDKYHPRDYENZ-ZDUSSCGKSA-N 0 3 334.420 2.639 20 5 EFBDHN O=C(CCN1CC[C@@H](c2ccncc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000580511547 324174841 /nfs/dbraw/zinc/17/48/41/324174841.db2.gz GJAAKTLOTCIQDX-OAHLLOKOSA-N 0 3 340.383 2.808 20 5 EFBDHN CC(C)C(CNCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C(C)C ZINC000581444170 324380082 /nfs/dbraw/zinc/38/00/82/324380082.db2.gz IXSQUWTZZRMQOW-UHFFFAOYSA-N 0 3 342.461 2.886 20 5 EFBDHN CC[C@@H](NCc1cccc(OCC(N)=O)c1)c1cccc([N+](=O)[O-])c1 ZINC000128903314 472509927 /nfs/dbraw/zinc/50/99/27/472509927.db2.gz ULHQPZJGZCFMRN-QGZVFWFLSA-N 0 3 343.383 2.700 20 5 EFBDHN CCN1CCN([C@@H](C)CNc2ccc3cc([N+](=O)[O-])ccc3n2)CC1 ZINC000095407765 473199241 /nfs/dbraw/zinc/19/92/41/473199241.db2.gz STSBHYDPFIGNBK-AWEZNQCLSA-N 0 3 343.431 2.581 20 5 EFBDHN CCN1CCCC[C@@H]1C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000124093606 473211464 /nfs/dbraw/zinc/21/14/64/473211464.db2.gz DSULFNRDMXAXAY-QGZVFWFLSA-N 0 3 333.432 2.908 20 5 EFBDHN CCOC(CN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)OCC ZINC000124482030 473251317 /nfs/dbraw/zinc/25/13/17/473251317.db2.gz QRBIPXVHIIJBQF-UHFFFAOYSA-N 0 3 338.404 2.837 20 5 EFBDHN Cc1cc(NC[C@@]2(CCO)CCOC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000096008522 473254181 /nfs/dbraw/zinc/25/41/81/473254181.db2.gz LFDDWKCVMDRFGM-QGZVFWFLSA-N 0 3 331.372 2.652 20 5 EFBDHN C[C@H](CN1CCC[C@@H](C)C1)NC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000171167790 473308144 /nfs/dbraw/zinc/30/81/44/473308144.db2.gz KCMDUTJXTQGNBZ-HUUCEWRRSA-N 0 3 348.447 2.557 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1 ZINC000083025977 473311289 /nfs/dbraw/zinc/31/12/89/473311289.db2.gz WMJZGIHLCWJKBY-GASCZTMLSA-N 0 3 349.431 2.522 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)NCCCCN1C[C@H](C)O[C@@H](C)C1 ZINC000083025982 473311429 /nfs/dbraw/zinc/31/14/29/473311429.db2.gz WMJZGIHLCWJKBY-GJZGRUSLSA-N 0 3 349.431 2.522 20 5 EFBDHN Cc1c(C(=O)NCCCCN2C[C@@H](C)O[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000083040700 473316894 /nfs/dbraw/zinc/31/68/94/473316894.db2.gz UNYJSLXWKHKROB-ZIAGYGMSSA-N 0 3 349.431 2.522 20 5 EFBDHN C[C@H](CN1CCC[C@H](C)C1)NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000148403797 473317576 /nfs/dbraw/zinc/31/75/76/473317576.db2.gz MCXJMPQONAQNKZ-QWHCGFSZSA-N 0 3 344.415 2.926 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@H](C)N(C3CC3)C2)c1 ZINC000177159266 473319185 /nfs/dbraw/zinc/31/91/85/473319185.db2.gz AYZYIXVBBIJQOT-WDEREUQCSA-N 0 3 335.429 2.672 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)CN1C1CC1 ZINC000177206263 473332215 /nfs/dbraw/zinc/33/22/15/473332215.db2.gz QQBPUMHFFXVEBA-DZGCQCFKSA-N 0 3 346.431 2.528 20 5 EFBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC(c2nc[nH]n2)CC1 ZINC000083424700 473343042 /nfs/dbraw/zinc/34/30/42/473343042.db2.gz LBCQTHGTSRVBJF-UHFFFAOYSA-N 0 3 345.403 2.880 20 5 EFBDHN COc1ccc(OC)c([C@@H](O)CN[C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000125031896 473344741 /nfs/dbraw/zinc/34/47/41/473344741.db2.gz DIGHBXPMTHQKGR-PXAZEXFGSA-N 0 3 346.383 2.996 20 5 EFBDHN CC[C@@H]1CCCCN1CCNC(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000113198146 473364556 /nfs/dbraw/zinc/36/45/56/473364556.db2.gz AABVJWJSPDMIPF-CQSZACIVSA-N 0 3 335.404 2.598 20 5 EFBDHN O=C(c1ccc(F)cc1[N+](=O)[O-])N1CCCN(C2CCCC2)CC1 ZINC000177365725 473364580 /nfs/dbraw/zinc/36/45/80/473364580.db2.gz ADXOVWKOCHKGSB-UHFFFAOYSA-N 0 3 335.379 2.824 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN[C@@H]3CCCC34CCOCC4)nc2c1 ZINC000619723142 479866549 /nfs/dbraw/zinc/86/65/49/479866549.db2.gz IHRCZJVDFLGQRK-OAHLLOKOSA-N 0 3 330.388 2.910 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)CN1C[C@H](C)C[C@@H](C)C1 ZINC000346954009 475986298 /nfs/dbraw/zinc/98/62/98/475986298.db2.gz MZERYEFBMOZZKK-UMVBOHGHSA-N 0 3 333.432 2.999 20 5 EFBDHN Cc1ccccc1C1(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1 ZINC000592138538 478791968 /nfs/dbraw/zinc/79/19/68/478791968.db2.gz ZITGVUQWJPYVIH-MRXNPFEDSA-N 0 3 342.395 2.922 20 5 EFBDHN O=C(NCc1ccccc1)[C@@H]1CCN(Cc2ccccc2[N+](=O)[O-])C1 ZINC000592154819 478801102 /nfs/dbraw/zinc/80/11/02/478801102.db2.gz XXYNTDTYGPKTTI-QGZVFWFLSA-N 0 3 339.395 2.733 20 5 EFBDHN CC(C)C(=O)NCCCNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602577955 479407240 /nfs/dbraw/zinc/40/72/40/479407240.db2.gz RQIZRLVHZIRAJL-UHFFFAOYSA-N 0 3 347.337 2.866 20 5 EFBDHN CN(C)C1(CNCc2cc(Br)c([N+](=O)[O-])s2)CCC1 ZINC000602630565 479436965 /nfs/dbraw/zinc/43/69/65/479436965.db2.gz WCYDJNRQSPJXNU-UHFFFAOYSA-N 0 3 348.266 2.993 20 5 EFBDHN CC1(C)CCCN(CCNCc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000602639088 479441638 /nfs/dbraw/zinc/44/16/38/479441638.db2.gz ZSXJTRJTKHVGCU-UHFFFAOYSA-N 0 3 332.404 2.948 20 5 EFBDHN CN(CCN1CCCCC1)C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000593882415 479495256 /nfs/dbraw/zinc/49/52/56/479495256.db2.gz GJSZJRGCWYXRAU-UHFFFAOYSA-N 0 3 325.796 2.806 20 5 EFBDHN Cc1cc(C(=O)NCc2ccc(CN(C)C)cc2)ccc1[N+](=O)[O-] ZINC000008430866 471687929 /nfs/dbraw/zinc/68/79/29/471687929.db2.gz PUHOGHGQQMQQML-UHFFFAOYSA-N 0 3 327.384 2.895 20 5 EFBDHN CN(C)Cc1ccc(CNC(=O)/C=C/c2ccccc2[N+](=O)[O-])cc1 ZINC000008430904 471688385 /nfs/dbraw/zinc/68/83/85/471688385.db2.gz ULARHIXOIMMFCR-VAWYXSNFSA-N 0 3 339.395 2.986 20 5 EFBDHN CN(C)Cc1ccc(CNC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cc1 ZINC000015140267 471891140 /nfs/dbraw/zinc/89/11/40/471891140.db2.gz UKAPREZXURQLFX-FMIVXFBMSA-N 0 3 339.395 2.986 20 5 EFBDHN CN(C)Cc1ccc(CNC(=O)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000015140358 471891286 /nfs/dbraw/zinc/89/12/86/471891286.db2.gz WBRRVZQGQJMJSQ-UHFFFAOYSA-N 0 3 327.384 2.515 20 5 EFBDHN O=C(Nc1cccc([N+](=O)[O-])c1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000018180505 471971657 /nfs/dbraw/zinc/97/16/57/471971657.db2.gz YEAINNJVKJQAAP-MRXNPFEDSA-N 0 3 340.383 2.991 20 5 EFBDHN CC(C)CN(C(=O)Cc1ccccc1[N+](=O)[O-])C1CCN(C)CC1 ZINC000053231526 471985397 /nfs/dbraw/zinc/98/53/97/471985397.db2.gz GINNQAQQVYUCBP-UHFFFAOYSA-N 0 3 333.432 2.716 20 5 EFBDHN CC(C)CN(C(=O)c1csc([N+](=O)[O-])c1)C1CCN(C)CC1 ZINC000053232783 471985873 /nfs/dbraw/zinc/98/58/73/471985873.db2.gz JTJQLSQOXLWZPB-UHFFFAOYSA-N 0 3 325.434 2.849 20 5 EFBDHN Cc1ccc(C(=O)NCCN(C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000053349560 471997487 /nfs/dbraw/zinc/99/74/87/471997487.db2.gz FTYLLKFPHPNJGZ-UHFFFAOYSA-N 0 3 327.384 2.765 20 5 EFBDHN CN(C)[C@@H]1Cc2ccccc2N(C(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000067206783 472005194 /nfs/dbraw/zinc/00/51/94/472005194.db2.gz SEVFBMOXWUMSJB-MRXNPFEDSA-N 0 3 325.368 2.728 20 5 EFBDHN C[C@@H](CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CCC(C)CC1 ZINC000067269785 472012844 /nfs/dbraw/zinc/01/28/44/472012844.db2.gz YQJHAYKKFMDKDV-ZDUSSCGKSA-N 0 3 344.415 2.926 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(CN(C)C)cc1 ZINC000023899326 472040374 /nfs/dbraw/zinc/04/03/74/472040374.db2.gz LTOJENZRQXCWAQ-UHFFFAOYSA-N 0 3 329.356 2.917 20 5 EFBDHN CCc1ccc([C@@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]2)N(C)C)cc1 ZINC000054373835 472082533 /nfs/dbraw/zinc/08/25/33/472082533.db2.gz QGNUCHRJFWOUPE-MRXNPFEDSA-N 0 3 330.388 2.518 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)NCc2ccc(CN(C)C)cc2)c1 ZINC000067839527 472096296 /nfs/dbraw/zinc/09/62/96/472096296.db2.gz BJGNLZNPRYEZNS-UHFFFAOYSA-N 0 3 343.383 2.595 20 5 EFBDHN C[C@@H](C1CC1)N(CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C1CC1 ZINC000042123585 472116553 /nfs/dbraw/zinc/11/65/53/472116553.db2.gz DQYDBPBKIXMRJF-LBPRGKRZSA-N 0 3 329.400 2.747 20 5 EFBDHN CC(C)[C@H](CNc1c([N+](=O)[O-])ncn1C)N1CCc2ccccc2C1 ZINC000026727835 472146054 /nfs/dbraw/zinc/14/60/54/472146054.db2.gz KLEYBEJRESQDQM-INIZCTEOSA-N 0 3 343.431 2.823 20 5 EFBDHN Cc1ccc(C(=O)NC[C@H](Cc2ccccc2)N(C)C)cc1[N+](=O)[O-] ZINC000027580622 472184748 /nfs/dbraw/zinc/18/47/48/472184748.db2.gz QAORTKNIFGVBHM-KRWDZBQOSA-N 0 3 341.411 2.806 20 5 EFBDHN CN(C)CCOc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000055446294 472186530 /nfs/dbraw/zinc/18/65/30/472186530.db2.gz RFVHPXOCXKAAMH-UHFFFAOYSA-N 0 3 347.346 2.927 20 5 EFBDHN Cc1ccc([C@@H]2CCCCN2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000075767213 472194764 /nfs/dbraw/zinc/19/47/64/472194764.db2.gz YILLCPAKJSJRLD-ROUUACIJSA-N 0 3 344.415 2.688 20 5 EFBDHN Cc1ccc(CNCc2ccccc2Cn2cncn2)cc1[N+](=O)[O-] ZINC000075772808 472197037 /nfs/dbraw/zinc/19/70/37/472197037.db2.gz ROVQBXDUMIUXNR-UHFFFAOYSA-N 0 3 337.383 2.833 20 5 EFBDHN C[C@@H](CNC(=O)CCNc1ccccc1[N+](=O)[O-])N1CCCC[C@H]1C ZINC000043085573 472197511 /nfs/dbraw/zinc/19/75/11/472197511.db2.gz TZAGZYWOFDKVFN-CABCVRRESA-N 0 3 348.447 2.776 20 5 EFBDHN Cc1c(C(=O)N[C@H](C)CN2C[C@H](C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000055748360 472232560 /nfs/dbraw/zinc/23/25/60/472232560.db2.gz HGDNXQRYDKJWKL-HZSPNIEDSA-N 0 3 333.432 2.999 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)N(CCN(C)C)CC(C)C ZINC000085545128 472255467 /nfs/dbraw/zinc/25/54/67/472255467.db2.gz POAICEAHRCUXJS-UHFFFAOYSA-N 0 3 338.408 2.655 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC1CCN(C2CC2)CC1 ZINC000085634036 472261391 /nfs/dbraw/zinc/26/13/91/472261391.db2.gz PAAFBGUZZWSKPP-UHFFFAOYSA-N 0 3 332.404 2.960 20 5 EFBDHN CN(C)[C@H](CNC(=O)CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000086987114 472295596 /nfs/dbraw/zinc/29/55/96/472295596.db2.gz XIXAPVCRRMLQNI-GOSISDBHSA-N 0 3 341.411 2.947 20 5 EFBDHN CN(C)[C@H](CNC(=O)c1csc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000044868980 472345897 /nfs/dbraw/zinc/34/58/97/472345897.db2.gz COYJMMYGUIZTSC-AWEZNQCLSA-N 0 3 333.413 2.559 20 5 EFBDHN C[C@H](CN1CCC[C@@H](C)C1)NC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000056788694 472351969 /nfs/dbraw/zinc/35/19/69/472351969.db2.gz FTIKXTKHZQZMRQ-ZIAGYGMSSA-N 0 3 334.420 2.514 20 5 EFBDHN CN(C)Cc1cccc(C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000088349633 472357903 /nfs/dbraw/zinc/35/79/03/472357903.db2.gz PRQCWCJHYFUOBB-UHFFFAOYSA-N 0 3 339.395 2.855 20 5 EFBDHN C[C@@H](CN1CCCCC1)NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000031229905 472368701 /nfs/dbraw/zinc/36/87/01/472368701.db2.gz JIFFBMRCNMBEJR-ZDUSSCGKSA-N 0 3 346.431 2.773 20 5 EFBDHN CN(C)Cc1cccc(CNC(=O)NCc2ccc([N+](=O)[O-])cc2)c1 ZINC000057004604 472372628 /nfs/dbraw/zinc/37/26/28/472372628.db2.gz BIVJDWJYBWSKHX-UHFFFAOYSA-N 0 3 342.399 2.656 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CN[C@@H](CO)[C@H](C)c1ccccc1 ZINC000613389612 479984248 /nfs/dbraw/zinc/98/42/48/479984248.db2.gz OXGRVPHSWPWODO-DYVFJYSZSA-N 0 3 330.384 2.858 20 5 EFBDHN CCN(CC)[C@@H](CNc1ncc([N+](=O)[O-])c(N)n1)c1ccsc1 ZINC000076715794 472389711 /nfs/dbraw/zinc/38/97/11/472389711.db2.gz NHZHXZRIFQEPTK-NSHDSACASA-N 0 3 336.421 2.524 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CN[C@@H](CO)[C@@H](C)c1ccccc1 ZINC000613389613 479984566 /nfs/dbraw/zinc/98/45/66/479984566.db2.gz OXGRVPHSWPWODO-GUYCJALGSA-N 0 3 330.384 2.858 20 5 EFBDHN COC(=O)c1ccc(CN(C)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000076912128 472422801 /nfs/dbraw/zinc/42/28/01/472422801.db2.gz VYIFUQDKNQVYJS-UHFFFAOYSA-N 0 3 344.367 2.892 20 5 EFBDHN O=[N+]([O-])c1ccc2nc(NC3CCN([C@@H]4CCOC4)CC3)ccc2c1 ZINC000089602992 472467625 /nfs/dbraw/zinc/46/76/25/472467625.db2.gz KAXHFUIRJLBOGL-MRXNPFEDSA-N 0 3 342.399 2.808 20 5 EFBDHN C[C@@H](CNC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1)N(C)C ZINC000033093095 472495221 /nfs/dbraw/zinc/49/52/21/472495221.db2.gz LLYLOJBBZFIRAC-AWEZNQCLSA-N 0 3 348.447 2.511 20 5 EFBDHN CN(CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)Cc1cccnc1 ZINC000129409456 472541404 /nfs/dbraw/zinc/54/14/04/472541404.db2.gz HPKKBVFWTVOSOP-UHFFFAOYSA-N 0 3 332.335 2.590 20 5 EFBDHN C[C@@H](CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-])N1CCCC[C@@H]1C ZINC000046338424 472544097 /nfs/dbraw/zinc/54/40/97/472544097.db2.gz LXHUOMQVEMSJDS-GJZGRUSLSA-N 0 3 348.447 2.999 20 5 EFBDHN COc1ccc(C(=O)N(CCN(C)C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000077542693 472551398 /nfs/dbraw/zinc/55/13/98/472551398.db2.gz IFLYVWLTFHYZQN-UHFFFAOYSA-N 0 3 349.431 2.940 20 5 EFBDHN C[C@H](CN1CCC[C@@H](C)C1)NC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000101993607 472561165 /nfs/dbraw/zinc/56/11/65/472561165.db2.gz VIKHARKQUPZNOM-ZIAGYGMSSA-N 0 3 334.420 2.514 20 5 EFBDHN C[C@H](CN1CCC[C@H](C)C1)NC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000101993612 472561297 /nfs/dbraw/zinc/56/12/97/472561297.db2.gz VIKHARKQUPZNOM-UONOGXRCSA-N 0 3 334.420 2.514 20 5 EFBDHN CC1(C)C[C@H](N[C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C(C)(C)O1 ZINC000119720289 472577365 /nfs/dbraw/zinc/57/73/65/472577365.db2.gz WKDFMEQZANSQDJ-GJZGRUSLSA-N 0 3 347.415 2.636 20 5 EFBDHN CCOc1ccc([C@H](C)NCCn2cnnc2C2CC2)cc1[N+](=O)[O-] ZINC000090032734 472583424 /nfs/dbraw/zinc/58/34/24/472583424.db2.gz PIIKVGRCDKFFPD-LBPRGKRZSA-N 0 3 345.403 2.813 20 5 EFBDHN CCOc1ccc(C(=O)N2CCC[C@H](N3CCCC3)C2)cc1[N+](=O)[O-] ZINC000058917925 472612927 /nfs/dbraw/zinc/61/29/27/472612927.db2.gz WBJHMJLPGCXVPY-HNNXBMFYSA-N 0 3 347.415 2.694 20 5 EFBDHN CCN1CCN([C@H](C)CNc2ccc([N+](=O)[O-])c3cnccc23)CC1 ZINC000071954167 472625421 /nfs/dbraw/zinc/62/54/21/472625421.db2.gz UPWNDURBLCIWDP-CQSZACIVSA-N 0 3 343.431 2.581 20 5 EFBDHN CCN1CCN([C@@H](C)CNc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000059389292 472625564 /nfs/dbraw/zinc/62/55/64/472625564.db2.gz YQBGKNDZKCSRPI-LBPRGKRZSA-N 0 3 326.828 2.686 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCN1CCSC2(CCCCC2)C1 ZINC000090551970 472635257 /nfs/dbraw/zinc/63/52/57/472635257.db2.gz VPXRPKLXZFNYLO-UHFFFAOYSA-N 0 3 337.445 2.508 20 5 EFBDHN CC[C@H](NC(=O)N[C@H]1C[C@@H](C)N(C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000090610779 472642021 /nfs/dbraw/zinc/64/20/21/472642021.db2.gz KPGWMQQSOZCRFE-IFIJOSMWSA-N 0 3 346.431 2.970 20 5 EFBDHN CCOC(=O)c1ccnc(N[C@@H]2CCN(C3CCCC3)C2)c1[N+](=O)[O-] ZINC000077965164 472645167 /nfs/dbraw/zinc/64/51/67/472645167.db2.gz PGOGUFOQEKZOCD-GFCCVEGCSA-N 0 3 348.403 2.595 20 5 EFBDHN Cc1c(NC(=O)CCN2CC[C@@H](OCC(C)C)C2)cccc1[N+](=O)[O-] ZINC000120196712 472648150 /nfs/dbraw/zinc/64/81/50/472648150.db2.gz ZHVCWWGQQYLIQB-OAHLLOKOSA-N 0 3 349.431 2.979 20 5 EFBDHN CC[C@H](NC(=O)N1CC[C@H]2CC[C@@H](C1)N2C)c1cccc([N+](=O)[O-])c1 ZINC000090689080 472652128 /nfs/dbraw/zinc/65/21/28/472652128.db2.gz XWMKBMUGILLMED-PVAVHDDUSA-N 0 3 346.431 2.924 20 5 EFBDHN Cc1ccc(CN(CCN(C)C)C(=O)c2csc([N+](=O)[O-])c2)o1 ZINC000060407263 472653116 /nfs/dbraw/zinc/65/31/16/472653116.db2.gz SDXWNMKCOZWQSO-UHFFFAOYSA-N 0 3 337.401 2.762 20 5 EFBDHN CCO[C@@H]1CCCN(CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000156024526 472655958 /nfs/dbraw/zinc/65/59/58/472655958.db2.gz BYRQEGVNRRFNNX-CQSZACIVSA-N 0 3 335.404 2.733 20 5 EFBDHN CC1CCN(CCNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC1 ZINC000047120025 472657012 /nfs/dbraw/zinc/65/70/12/472657012.db2.gz INLKALBVUGWKJU-UHFFFAOYSA-N 0 3 346.431 2.631 20 5 EFBDHN C[C@H]1C[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])c3cccnc23)CCN1C ZINC000156036969 472658094 /nfs/dbraw/zinc/65/80/94/472658094.db2.gz SBIOYGJSWGXHGL-STQMWFEESA-N 0 3 342.399 2.698 20 5 EFBDHN CCOc1ccc([C@@H](C)NCCCNC(=O)C(C)C)cc1[N+](=O)[O-] ZINC000090880934 472661369 /nfs/dbraw/zinc/66/13/69/472661369.db2.gz RVQLEAMCAPDOKO-CYBMUJFWSA-N 0 3 337.420 2.806 20 5 EFBDHN Cc1c(CN2CCC(OC[C@@H]3CCOC3)CC2)cccc1[N+](=O)[O-] ZINC000131772767 472691965 /nfs/dbraw/zinc/69/19/65/472691965.db2.gz YTBRPHXTLPDTJQ-OAHLLOKOSA-N 0 3 334.416 2.921 20 5 EFBDHN CC1(C)CCCC[C@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000120518608 472703224 /nfs/dbraw/zinc/70/32/24/472703224.db2.gz DNRPOXVQHIXCKK-OAHLLOKOSA-N 0 3 340.445 2.927 20 5 EFBDHN C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)/C=C/c1ccc(F)cc1[N+](=O)[O-] ZINC000120660148 472726714 /nfs/dbraw/zinc/72/67/14/472726714.db2.gz XHNFGXWGDXDDJF-VQOXYXNASA-N 0 3 335.379 2.546 20 5 EFBDHN CO[C@]1(C)C[C@H](NCc2cc3c(cc2[N+](=O)[O-])OCCO3)C1(C)C ZINC000072926539 472741331 /nfs/dbraw/zinc/74/13/31/472741331.db2.gz PPNIIEZAFCCXQP-DOTOQJQBSA-N 0 3 336.388 2.659 20 5 EFBDHN Cc1cnc(N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)c([N+](=O)[O-])c1 ZINC000078658009 472748147 /nfs/dbraw/zinc/74/81/47/472748147.db2.gz ASTXYODSGSQLQF-HUUCEWRRSA-N 0 3 348.447 2.624 20 5 EFBDHN Cc1cnc(NCC2(N3CCCCC3)CCOCC2)c([N+](=O)[O-])c1 ZINC000078665333 472751285 /nfs/dbraw/zinc/75/12/85/472751285.db2.gz KBUOIILPXPUXMI-UHFFFAOYSA-N 0 3 334.420 2.745 20 5 EFBDHN COc1cc(CNC2CC(C)(C)[NH2+]C(C)(C)C2)c([N+](=O)[O-])cc1[O-] ZINC000120930546 472769342 /nfs/dbraw/zinc/76/93/42/472769342.db2.gz YMQKKFWGOIIYIO-UHFFFAOYSA-N 0 3 337.420 2.708 20 5 EFBDHN CCN(CC)[C@@H](CNc1c([N+](=O)[O-])ncn1C)c1cccc(OC)c1 ZINC000073109526 472773499 /nfs/dbraw/zinc/77/34/99/472773499.db2.gz BRRVJCDWFBYJLF-HNNXBMFYSA-N 0 3 347.419 2.832 20 5 EFBDHN Cc1ccc(CN(CCN(C)C)C(=O)Cc2ccc([N+](=O)[O-])cc2)o1 ZINC000063497855 472782856 /nfs/dbraw/zinc/78/28/56/472782856.db2.gz NBWVPQUPHBQFOH-UHFFFAOYSA-N 0 3 345.399 2.629 20 5 EFBDHN Cc1cc(NC(=O)N2CCC(N3CC=CC3)CC2)ccc1[N+](=O)[O-] ZINC000157279273 472803116 /nfs/dbraw/zinc/80/31/16/472803116.db2.gz SWOXMEUZQBGDMI-UHFFFAOYSA-N 0 3 330.388 2.771 20 5 EFBDHN C[C@@H]1C[C@@H](Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)CN1C1CC1 ZINC000133520621 472813129 /nfs/dbraw/zinc/81/31/29/472813129.db2.gz FMYFHCFLFHOEIJ-ZYHUDNBSSA-N 0 3 330.388 2.517 20 5 EFBDHN C[C@@H](CN1CCCCC1)NC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000079292644 472843890 /nfs/dbraw/zinc/84/38/90/472843890.db2.gz UEPCJKGVDYZSTO-AWEZNQCLSA-N 0 3 334.420 2.611 20 5 EFBDHN O=C(NC[C@H]1CCCN(Cc2cccs2)C1)c1ccc([N+](=O)[O-])o1 ZINC000064522147 472860853 /nfs/dbraw/zinc/86/08/53/472860853.db2.gz CWVUAHWAPRHZNV-GFCCVEGCSA-N 0 3 349.412 2.891 20 5 EFBDHN C[C@@H](NC(=O)N1CC[C@H]2CC[C@@H](C1)N2C)c1cccc([N+](=O)[O-])c1 ZINC000073758322 472870306 /nfs/dbraw/zinc/87/03/06/472870306.db2.gz GLXDBRKXCITMAT-XPKDYRNWSA-N 0 3 332.404 2.534 20 5 EFBDHN CC(C)NC(=O)c1ccc(NCCN2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000079914667 472940700 /nfs/dbraw/zinc/94/07/00/472940700.db2.gz QSHNAURRUMBGRI-AWEZNQCLSA-N 0 3 348.447 2.877 20 5 EFBDHN CCN1CCN(CCCNc2ccc([N+](=O)[O-])c3cccnc23)CC1 ZINC000092607668 472944972 /nfs/dbraw/zinc/94/49/72/472944972.db2.gz XKNZKZXIYWPGFS-UHFFFAOYSA-N 0 3 343.431 2.583 20 5 EFBDHN CN(C)Cc1cccc(CNC(=O)NCc2cccc([N+](=O)[O-])c2)c1 ZINC000065487212 472952916 /nfs/dbraw/zinc/95/29/16/472952916.db2.gz ZGBMYLFOJRIMQO-UHFFFAOYSA-N 0 3 342.399 2.656 20 5 EFBDHN C[C@@H]1CN(C)CC[C@@H]1N(C)c1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000092668137 472959521 /nfs/dbraw/zinc/95/95/21/472959521.db2.gz HHJDWUJCXFIJON-PWSUYJOCSA-N 0 3 329.347 2.973 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CCC[C@H]2C[C@@H](O)c2ccc(F)cc2)n1 ZINC000134788787 472966701 /nfs/dbraw/zinc/96/67/01/472966701.db2.gz VANXIFHJSBPKJM-JKSUJKDBSA-N 0 3 348.378 2.519 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)NCCN2CCC[C@@H](C)C2)c1 ZINC000107594529 472966855 /nfs/dbraw/zinc/96/68/55/472966855.db2.gz VTKXVYRJTHQQDL-GFCCVEGCSA-N 0 3 337.445 2.778 20 5 EFBDHN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCC[C@H](N2CCCC2)C1 ZINC000134875292 472979858 /nfs/dbraw/zinc/97/98/58/472979858.db2.gz GZBRWXXIEXDXJN-AWEZNQCLSA-N 0 3 337.807 2.949 20 5 EFBDHN CNC(=O)CCNCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000074371689 472997264 /nfs/dbraw/zinc/99/72/64/472997264.db2.gz HHLBQGJGHADIPU-UHFFFAOYSA-N 0 3 337.763 2.734 20 5 EFBDHN C[C@H]1C[C@H](Nc2c([N+](=O)[O-])ncn2C)CCN1Cc1ccccc1 ZINC000080230973 472998324 /nfs/dbraw/zinc/99/83/24/472998324.db2.gz BYTALFDAEMGYCB-DZGCQCFKSA-N 0 3 329.404 2.793 20 5 EFBDHN COC[C@@H](Cc1ccccc1)NCc1cc([N+](=O)[O-])ccc1OC ZINC000122424619 473012632 /nfs/dbraw/zinc/01/26/32/473012632.db2.gz NJGCQIQUXUBZEI-MRXNPFEDSA-N 0 3 330.384 2.951 20 5 EFBDHN CCCCNC(=O)[C@@H]1CCCN(CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000051057582 473020964 /nfs/dbraw/zinc/02/09/64/473020964.db2.gz CTXZBQZQPOBEJD-OAHLLOKOSA-N 0 3 349.431 2.602 20 5 EFBDHN CCCCNC(=O)[C@H]1CCCN(CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000051058438 473021765 /nfs/dbraw/zinc/02/17/65/473021765.db2.gz KRQBENMOTFFGNY-INIZCTEOSA-N 0 3 333.432 2.766 20 5 EFBDHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000065940260 473029687 /nfs/dbraw/zinc/02/96/87/473029687.db2.gz OBIMLNSIZYKRRI-UHFFFAOYSA-N 0 3 345.374 2.938 20 5 EFBDHN Cc1nn(C)c(N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000074775149 473062386 /nfs/dbraw/zinc/06/23/86/473062386.db2.gz OAOUJRUCJBMPHN-MRXNPFEDSA-N 0 3 343.431 2.738 20 5 EFBDHN O=C(CCN1CCC[C@H](c2ncc[nH]2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000080961630 473114239 /nfs/dbraw/zinc/11/42/39/473114239.db2.gz YZKRVBPTMXEGNJ-ZDUSSCGKSA-N 0 3 343.387 2.526 20 5 EFBDHN CCC[C@@H](N[C@H]1CCc2nc(C)nn2C1)c1cccc([N+](=O)[O-])c1 ZINC000160453623 473127075 /nfs/dbraw/zinc/12/70/75/473127075.db2.gz JUVAEAVXMQDAMZ-GOEBONIOSA-N 0 3 329.404 2.941 20 5 EFBDHN Cc1c(CC(=O)NCc2cccc(CN(C)C)c2)cccc1[N+](=O)[O-] ZINC000160540542 473139310 /nfs/dbraw/zinc/13/93/10/473139310.db2.gz NZZBLPZFUYDUAS-UHFFFAOYSA-N 0 3 341.411 2.824 20 5 EFBDHN COc1ccccc1[C@@H](CNc1c([N+](=O)[O-])ncn1C)N1CCCC1 ZINC000052722495 473142064 /nfs/dbraw/zinc/14/20/64/473142064.db2.gz GQKNQSJWTLOTGH-CQSZACIVSA-N 0 3 345.403 2.586 20 5 EFBDHN Cn1cc(CN2CC[C@]3(CCOC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000093819956 473150393 /nfs/dbraw/zinc/15/03/93/473150393.db2.gz ATQLDTIOSMGHRX-SFHVURJKSA-N 0 3 342.399 2.608 20 5 EFBDHN C[C@@H](CNC(=O)c1cccc([N+](=O)[O-])c1)N(C)Cc1ccccc1 ZINC000110350848 473152410 /nfs/dbraw/zinc/15/24/10/473152410.db2.gz SPZSTFQFCZIZHH-AWEZNQCLSA-N 0 3 327.384 2.845 20 5 EFBDHN C[C@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1)N(C)Cc1ccccc1 ZINC000110349778 473152842 /nfs/dbraw/zinc/15/28/42/473152842.db2.gz GDFBJHOQXVHNRN-OAHLLOKOSA-N 0 3 341.411 2.774 20 5 EFBDHN Cc1noc([C@@H]2CCCN(CCCOc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000052863679 473157466 /nfs/dbraw/zinc/15/74/66/473157466.db2.gz RVFPSKFKQCGUNL-CQSZACIVSA-N 0 3 346.387 2.935 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC(N2CC=CC2)CC1 ZINC000136695730 473172566 /nfs/dbraw/zinc/17/25/66/473172566.db2.gz QBVSOBDMCFZGOQ-UHFFFAOYSA-N 0 3 330.388 2.771 20 5 EFBDHN COc1cc(C[NH2+][C@@H]2CCOC3(CCCC3)C2)c([N+](=O)[O-])cc1[O-] ZINC000136702461 473172989 /nfs/dbraw/zinc/17/29/89/473172989.db2.gz LEBHJNRPDBQWCB-CYBMUJFWSA-N 0 3 336.388 2.890 20 5 EFBDHN CCOc1ccc(C(=O)N2CCC[C@H]2CN2CCCC2)cc1[N+](=O)[O-] ZINC000066945423 473181100 /nfs/dbraw/zinc/18/11/00/473181100.db2.gz DJVWKSLJRRMIPZ-HNNXBMFYSA-N 0 3 347.415 2.694 20 5 EFBDHN CN(C)CCN(CCCc1ccccc1)C(=O)c1ccc([N+](=O)[O-])o1 ZINC000066946216 473181818 /nfs/dbraw/zinc/18/18/18/473181818.db2.gz QJIFZFBURBPJKP-UHFFFAOYSA-N 0 3 345.399 2.824 20 5 EFBDHN CCc1nn(C)c(NC[C@@H]2CCCN2Cc2ccccc2)c1[N+](=O)[O-] ZINC000094159529 473183500 /nfs/dbraw/zinc/18/35/00/473183500.db2.gz PARVFEZDVXRREE-HNNXBMFYSA-N 0 3 343.431 2.967 20 5 EFBDHN CC(C)(C)CCN1CCN(C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000136984594 473189325 /nfs/dbraw/zinc/18/93/25/473189325.db2.gz WJHUNVKFMWJYQI-KRWDZBQOSA-N 0 3 335.448 2.682 20 5 EFBDHN Cc1ccc(CN(CCN(C)C)C(=O)c2ccccc2[N+](=O)[O-])o1 ZINC000151075949 473405320 /nfs/dbraw/zinc/40/53/20/473405320.db2.gz CHQLAANVNKHKEN-UHFFFAOYSA-N 0 3 331.372 2.700 20 5 EFBDHN COc1cc(C(=O)N[C@@H](C)CN2CCCCCC2)ccc1[N+](=O)[O-] ZINC000185436716 473426698 /nfs/dbraw/zinc/42/66/98/473426698.db2.gz MQEIPUZFHJCJLJ-ZDUSSCGKSA-N 0 3 335.404 2.598 20 5 EFBDHN CC(C)CN(C(=O)c1cc(F)ccc1[N+](=O)[O-])C1CCN(C)CC1 ZINC000114383743 473459492 /nfs/dbraw/zinc/45/94/92/473459492.db2.gz VJQRTQBAWBTHHZ-UHFFFAOYSA-N 0 3 337.395 2.926 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000171838246 473467312 /nfs/dbraw/zinc/46/73/12/473467312.db2.gz KXEQWXUAMMLVAM-XJKSGUPXSA-N 0 3 334.420 2.829 20 5 EFBDHN CN(Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H]1CCc2ccccc2C1 ZINC000114489985 473476322 /nfs/dbraw/zinc/47/63/22/473476322.db2.gz FZTCTWXEFJAXGV-QGZVFWFLSA-N 0 3 339.395 2.683 20 5 EFBDHN Cc1ccc(CN(CCN(C)C)C(=O)c2ccc([N+](=O)[O-])cc2F)o1 ZINC000126051712 473483406 /nfs/dbraw/zinc/48/34/06/473483406.db2.gz MWBSTSRMSHHPNF-UHFFFAOYSA-N 0 3 349.362 2.839 20 5 EFBDHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000114643337 473488973 /nfs/dbraw/zinc/48/89/73/473488973.db2.gz MMERMKXFTKIEGN-INIZCTEOSA-N 0 3 339.395 2.989 20 5 EFBDHN Cc1ccc([C@H](C)NC[C@H]2CN(CC(C)C)CCO2)cc1[N+](=O)[O-] ZINC000178329826 473492677 /nfs/dbraw/zinc/49/26/77/473492677.db2.gz LRDXTICJSQMVLE-RDJZCZTQSA-N 0 3 335.448 2.911 20 5 EFBDHN CC[C@H](N[C@H](C(=O)N1CCOCC1)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000164952441 473502286 /nfs/dbraw/zinc/50/22/86/473502286.db2.gz ZIXOBQGGHGDLAX-IRXDYDNUSA-N 0 3 349.431 2.519 20 5 EFBDHN Cc1c(Br)c(N[C@H]2CCN(C)[C@H](C)C2)ncc1[N+](=O)[O-] ZINC000165794982 473516501 /nfs/dbraw/zinc/51/65/01/473516501.db2.gz UVBDHYDYMXNADP-SCZZXKLOSA-N 0 3 343.225 2.955 20 5 EFBDHN COCC1=CCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000185837628 473527831 /nfs/dbraw/zinc/52/78/31/473527831.db2.gz DZGSAEKDZRRNDS-UHFFFAOYSA-N 0 3 333.388 2.510 20 5 EFBDHN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC1CCN(C2CC2)CC1 ZINC000191329146 473528830 /nfs/dbraw/zinc/52/88/30/473528830.db2.gz VWVHHWKARADYLJ-UHFFFAOYSA-N 0 3 332.404 2.960 20 5 EFBDHN CCC1(CC)[C@H](NCc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@@H](C)[C@@H]1OC ZINC000191395224 473534317 /nfs/dbraw/zinc/53/43/17/473534317.db2.gz RXQLDXFTSITLAM-LYRGGWFBSA-N 0 3 349.431 2.623 20 5 EFBDHN CC1CCC(N2CCN(C(=O)Cc3ccccc3[N+](=O)[O-])CC2)CC1 ZINC000115255240 473548107 /nfs/dbraw/zinc/54/81/07/473548107.db2.gz CGODMFBPEOEORO-UHFFFAOYSA-N 0 3 345.443 2.860 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000191569930 473555260 /nfs/dbraw/zinc/55/52/60/473555260.db2.gz XMVKFXSZHIMSMA-CQSZACIVSA-N 0 3 335.404 2.516 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)CN(CC1CC1)CC1CC1 ZINC000115562656 473581952 /nfs/dbraw/zinc/58/19/52/473581952.db2.gz AAISKFWVYXVOJF-UHFFFAOYSA-N 0 3 333.388 2.664 20 5 EFBDHN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@@H](N2CCCC2)C1 ZINC000170719373 473595420 /nfs/dbraw/zinc/59/54/20/473595420.db2.gz WQSXTCMBIBCMJU-GFCCVEGCSA-N 0 3 338.795 2.950 20 5 EFBDHN CCC[C@@H](N[C@@H](C)CCS(C)(=O)=O)c1cccc([N+](=O)[O-])c1 ZINC000127307368 473598374 /nfs/dbraw/zinc/59/83/74/473598374.db2.gz MRRMGXQUKBYFCS-SWLSCSKDSA-N 0 3 328.434 2.849 20 5 EFBDHN CN(C)[C@@H]1CCCN(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000172496914 473624911 /nfs/dbraw/zinc/62/49/11/473624911.db2.gz HJAXWKGZMRIPSH-QGZVFWFLSA-N 0 3 348.447 2.653 20 5 EFBDHN CCOc1ccc(C(=O)N[C@H](C)CN2CCCCCC2)cc1[N+](=O)[O-] ZINC000186298971 473642330 /nfs/dbraw/zinc/64/23/30/473642330.db2.gz AEKUSDYZEFKNTK-CQSZACIVSA-N 0 3 349.431 2.988 20 5 EFBDHN Cc1cccc(OC[C@@H](O)CN(C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000153798270 473643196 /nfs/dbraw/zinc/64/31/96/473643196.db2.gz YDYWKCRPPQRIBU-INIZCTEOSA-N 0 3 330.384 2.775 20 5 EFBDHN CN(C)CCN(Cc1ccccc1)C(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000172698344 473673579 /nfs/dbraw/zinc/67/35/79/473673579.db2.gz OHOFSRJBEZBIJE-UHFFFAOYSA-N 0 3 341.411 2.728 20 5 EFBDHN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1N)[C@H](c1ccccc1)N(C)C ZINC000186481801 473680321 /nfs/dbraw/zinc/68/03/21/473680321.db2.gz LPDRVFVCANJBLH-YVEFUNNKSA-N 0 3 342.399 2.598 20 5 EFBDHN CN(C)CCN(C(=O)Cc1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000172895203 473698790 /nfs/dbraw/zinc/69/87/90/473698790.db2.gz HQJBXCFIUAWRQD-UHFFFAOYSA-N 0 3 333.432 2.860 20 5 EFBDHN CN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000269120880 473699512 /nfs/dbraw/zinc/69/95/12/473699512.db2.gz SROKVPIQTJFCMU-SWLSCSKDSA-N 0 3 343.383 2.897 20 5 EFBDHN CN(C)CCN(C(=O)Cc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000172907894 473701885 /nfs/dbraw/zinc/70/18/85/473701885.db2.gz QHJAXIHFBDQADC-UHFFFAOYSA-N 0 3 327.384 2.732 20 5 EFBDHN CCc1[nH]nc(C(=O)Nc2cc(CN(C)C)ccc2C)c1[N+](=O)[O-] ZINC000192683386 473704407 /nfs/dbraw/zinc/70/44/07/473704407.db2.gz ZKLPDDAQCISLTM-UHFFFAOYSA-N 0 3 331.376 2.503 20 5 EFBDHN O=C(CCOc1ccccc1[N+](=O)[O-])Nc1ccc2c(c1)CNCC2 ZINC000269185350 473723466 /nfs/dbraw/zinc/72/34/66/473723466.db2.gz FREOEZYNQHVYJD-UHFFFAOYSA-N 0 3 341.367 2.648 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000245873415 473753827 /nfs/dbraw/zinc/75/38/27/473753827.db2.gz HJTHQMNDJRBMPO-UNEWFSDZSA-N 0 3 346.431 2.924 20 5 EFBDHN CN1CCN(CCNc2ccc3cc([N+](=O)[O-])ccc3n2)CC1(C)C ZINC000281540971 473757136 /nfs/dbraw/zinc/75/71/36/473757136.db2.gz BCSHDQCAHSOHBT-UHFFFAOYSA-N 0 3 343.431 2.581 20 5 EFBDHN CSc1cccc(C(=O)N2CCC[C@@H]3CN(C)CC[C@@H]32)c1[N+](=O)[O-] ZINC000186865414 473771491 /nfs/dbraw/zinc/77/14/91/473771491.db2.gz LTJCLVVHMIKODL-OCCSQVGLSA-N 0 3 349.456 2.873 20 5 EFBDHN CC[C@H](NC[C@H]1COC2(CCOCC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000179998485 473773710 /nfs/dbraw/zinc/77/37/10/473773710.db2.gz HLCZKWNSORJGJI-HOTGVXAUSA-N 0 3 336.388 2.558 20 5 EFBDHN CCC[C@H](NC[C@@H]1CC[C@@H](C(=O)N(C)C)O1)c1cccc([N+](=O)[O-])c1 ZINC000246041495 473773742 /nfs/dbraw/zinc/77/37/42/473773742.db2.gz NYIHFTOFASGZJN-ULQDDVLXSA-N 0 3 349.431 2.661 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)CN2C[C@H](C)C[C@H](C)C2)c1 ZINC000173229565 473774663 /nfs/dbraw/zinc/77/46/63/473774663.db2.gz INDFQVPJDAXFED-QLFBSQMISA-N 0 3 333.432 2.999 20 5 EFBDHN Nc1ccc([N+](=O)[O-])c(NCC2(N3CCSCC3)CCCC2)c1 ZINC000193385154 473785117 /nfs/dbraw/zinc/78/51/17/473785117.db2.gz DGEFAYWGBOGZMM-UHFFFAOYSA-N 0 3 336.461 2.951 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)cnc1NCC1(N2CCCC2)CCOCC1 ZINC000269368468 473788581 /nfs/dbraw/zinc/78/85/81/473788581.db2.gz LLGLWLZYKNWQSR-UHFFFAOYSA-N 0 3 340.811 2.700 20 5 EFBDHN NC(=O)C[C@H]1CCCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000180065043 473789356 /nfs/dbraw/zinc/78/93/56/473789356.db2.gz QOYOCSUOMGHWSS-CYBMUJFWSA-N 0 3 343.383 2.942 20 5 EFBDHN C[C@@H](NCCNC(=O)c1ccccc1F)c1cccc([N+](=O)[O-])c1 ZINC000173342524 473809914 /nfs/dbraw/zinc/80/99/14/473809914.db2.gz DBWHOKIRZRLXTE-GFCCVEGCSA-N 0 3 331.347 2.815 20 5 EFBDHN CC(C)N1CCC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000274408761 473811928 /nfs/dbraw/zinc/81/19/28/473811928.db2.gz BRMLGBJYQCADHA-NSHDSACASA-N 0 3 325.796 2.851 20 5 EFBDHN CCCC(=O)NC[C@H]1CCCN(CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000263712086 473815797 /nfs/dbraw/zinc/81/57/97/473815797.db2.gz KJCGGWXKHGARRS-MRXNPFEDSA-N 0 3 333.432 2.766 20 5 EFBDHN C[C@@H](CCN1CCN(C)CC1)Nc1ccc([N+](=O)[O-])c2cnccc12 ZINC000274433204 473821422 /nfs/dbraw/zinc/82/14/22/473821422.db2.gz FHHQPYIJTXEERM-AWEZNQCLSA-N 0 3 343.431 2.581 20 5 EFBDHN Cc1ccoc1C(=O)NCCCN[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000173432612 473836366 /nfs/dbraw/zinc/83/63/66/473836366.db2.gz BSCKLSVNVLIMAJ-ZDUSSCGKSA-N 0 3 331.372 2.967 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@H]1CCCN1C1CCCC1 ZINC000269630571 473848558 /nfs/dbraw/zinc/84/85/58/473848558.db2.gz FKHJILDTPJVJMD-QGZVFWFLSA-N 0 3 331.416 2.960 20 5 EFBDHN CCNC(=O)[C@@H](C)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000263789226 473850385 /nfs/dbraw/zinc/85/03/85/473850385.db2.gz HIAWYNYATYYURB-LLVKDONJSA-N 0 3 333.413 2.938 20 5 EFBDHN CN(CCN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000246399889 473850573 /nfs/dbraw/zinc/85/05/73/473850573.db2.gz TZCFZXKFZZFFSE-OAHLLOKOSA-N 0 3 341.415 2.612 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CCN(CC3CCCCC3)CC2)c1 ZINC000269677251 473857051 /nfs/dbraw/zinc/85/70/51/473857051.db2.gz QAUGLJLXUSPVFL-LJQANCHMSA-N 0 3 347.459 2.826 20 5 EFBDHN CC(C)N1CCC[C@@H](NC(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000274532555 473864271 /nfs/dbraw/zinc/86/42/71/473864271.db2.gz UPGINMCMERVTPE-CYBMUJFWSA-N 0 3 337.445 2.676 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CCC[C@H]2C[C@H](O)c2ccc(F)cc2)c1 ZINC000269704757 473869786 /nfs/dbraw/zinc/86/97/86/473869786.db2.gz ZGLQEJNRDHJYRI-RDJZCZTQSA-N 0 3 348.378 2.519 20 5 EFBDHN CN(CCN(C)C1CC1)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000274546457 473870380 /nfs/dbraw/zinc/87/03/80/473870380.db2.gz VWMXBTQGQFLDSU-UHFFFAOYSA-N 0 3 348.447 2.653 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H]1CCCN1C1CCCC1 ZINC000269722163 473871122 /nfs/dbraw/zinc/87/11/22/473871122.db2.gz SWWXYZQAQOHJRK-MRXNPFEDSA-N 0 3 347.415 2.627 20 5 EFBDHN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCC[C@H]1C[C@H](C)O ZINC000246736678 473946235 /nfs/dbraw/zinc/94/62/35/473946235.db2.gz PCOSQFACMHWONQ-ZOWXZIJZSA-N 0 3 346.387 2.941 20 5 EFBDHN C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000288462657 473948753 /nfs/dbraw/zinc/94/87/53/473948753.db2.gz QBLFDIUCUUYEIF-WCQYABFASA-N 0 3 337.807 2.947 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)N1C[C@@H](N2CCCC2)C[C@@H]1C ZINC000288489756 473956753 /nfs/dbraw/zinc/95/67/53/473956753.db2.gz RLWVWKWAXUDZGZ-KBPBESRZSA-N 0 3 347.415 2.692 20 5 EFBDHN CSc1cccc(C(=O)NC[C@H]2CCN(C3CC3)C2)c1[N+](=O)[O-] ZINC000188049079 473963104 /nfs/dbraw/zinc/96/31/04/473963104.db2.gz SJTZPIXUSNDFHJ-LLVKDONJSA-N 0 3 335.429 2.531 20 5 EFBDHN CSc1cccc(C(=O)NCCN2CCC(C)CC2)c1[N+](=O)[O-] ZINC000188057151 473966170 /nfs/dbraw/zinc/96/61/70/473966170.db2.gz GBKXAXRZTFRHLR-UHFFFAOYSA-N 0 3 337.445 2.778 20 5 EFBDHN Cc1cc(NC[C@H]2CCCN(C(N)=O)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000288630455 474005199 /nfs/dbraw/zinc/00/51/99/474005199.db2.gz WNABQMXDVJACCS-GFCCVEGCSA-N 0 3 343.387 2.654 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N[C@@H]2C[C@@H](C)N(C3CC3)C2)cc1[N+](=O)[O-] ZINC000247038213 474045682 /nfs/dbraw/zinc/04/56/82/474045682.db2.gz ULZUEVFEXWPSMS-VNHYZAJKSA-N 0 3 346.431 2.889 20 5 EFBDHN CS[C@H]1CN(Cc2ccc([N+](=O)[O-])cc2F)C[C@H]1N1CCCC1 ZINC000275055054 474056184 /nfs/dbraw/zinc/05/61/84/474056184.db2.gz IWWMLFOTLUMNAT-CVEARBPZSA-N 0 3 339.436 2.746 20 5 EFBDHN COc1ccc(CNC[C@](C)(O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000270295523 474061852 /nfs/dbraw/zinc/06/18/52/474061852.db2.gz PZOXBDMWHIXKRA-KRWDZBQOSA-N 0 3 334.347 2.740 20 5 EFBDHN CN(CCc1cccc([N+](=O)[O-])c1)C[C@@H](O)COc1ccc(F)cc1 ZINC000282445915 474068642 /nfs/dbraw/zinc/06/86/42/474068642.db2.gz LLCNEUKAUDJPCD-QGZVFWFLSA-N 0 3 348.374 2.648 20 5 EFBDHN COCCN1CC[C@@H](NCc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000264640668 474070640 /nfs/dbraw/zinc/07/06/40/474070640.db2.gz VNYYMLROJMBZGL-CQSZACIVSA-N 0 3 345.399 2.665 20 5 EFBDHN COc1cccc(C(=O)NCC(C)(C)N2CCC[C@H](C)C2)c1[N+](=O)[O-] ZINC000195448497 474076601 /nfs/dbraw/zinc/07/66/01/474076601.db2.gz LZRGBYWTJWBVDN-ZDUSSCGKSA-N 0 3 349.431 2.844 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CN[C@@H](CC(N)=O)C1CCCCC1 ZINC000181997089 474077694 /nfs/dbraw/zinc/07/76/94/474077694.db2.gz KDTZELKLEUEYFQ-HNNXBMFYSA-N 0 3 335.404 2.517 20 5 EFBDHN CC1CCN(CCNC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)CC1 ZINC000282486119 474084283 /nfs/dbraw/zinc/08/42/83/474084283.db2.gz QNBGPXVNBLSZLG-UHFFFAOYSA-N 0 3 348.447 2.511 20 5 EFBDHN CS[C@@H]1CN(C(=O)c2cc(C)cc([N+](=O)[O-])c2)C[C@H]1N1CCCC1 ZINC000275164903 474091490 /nfs/dbraw/zinc/09/14/90/474091490.db2.gz VKRHCKJJMKJKEF-HZPDHXFCSA-N 0 3 349.456 2.555 20 5 EFBDHN O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000198152810 474104917 /nfs/dbraw/zinc/10/49/17/474104917.db2.gz AUQUJOFKIAIORX-QGZVFWFLSA-N 0 3 339.395 2.528 20 5 EFBDHN CC[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2Cl)CCN1C[C@@H](C)O ZINC000182137130 474106490 /nfs/dbraw/zinc/10/64/90/474106490.db2.gz NUXNLHOSOXBIDF-TZMCWYRMSA-N 0 3 341.839 2.525 20 5 EFBDHN CN(C)c1cccc([C@H]2CCCN2CCn2cc([N+](=O)[O-])cn2)c1 ZINC000174867681 474107746 /nfs/dbraw/zinc/10/77/46/474107746.db2.gz NXOKVWKIMGQUDN-QGZVFWFLSA-N 0 3 329.404 2.694 20 5 EFBDHN CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000175004615 474130293 /nfs/dbraw/zinc/13/02/93/474130293.db2.gz LEMLGTMEMBIFQU-UKRRQHHQSA-N 0 3 349.456 2.772 20 5 EFBDHN CN(C)Cc1ccc(CNC(=O)/C=C\c2cccc([N+](=O)[O-])c2)cc1 ZINC000214393705 474137060 /nfs/dbraw/zinc/13/70/60/474137060.db2.gz XHRQRCWIZYXBOQ-KHPPLWFESA-N 0 3 339.395 2.986 20 5 EFBDHN C[C@H](CN1CCCCC1)NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000282675119 474151827 /nfs/dbraw/zinc/15/18/27/474151827.db2.gz HIFLIEBNIOQQDL-OAHLLOKOSA-N 0 3 348.447 2.653 20 5 EFBDHN CN(C(=O)c1ccc([N+](=O)[O-])[nH]1)C1CCN(Cc2ccccc2)CC1 ZINC000264868620 474155368 /nfs/dbraw/zinc/15/53/68/474155368.db2.gz AFEDJMDWKWNKDM-UHFFFAOYSA-N 0 3 342.399 2.660 20 5 EFBDHN O=[N+]([O-])c1cc(CN(CCO)C2CCC2)ccc1Br ZINC000221609341 474162279 /nfs/dbraw/zinc/16/22/79/474162279.db2.gz CXWHEPWQDRQTSM-UHFFFAOYSA-N 0 3 329.194 2.704 20 5 EFBDHN C[C@@H](NC(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21)c1cccc([N+](=O)[O-])c1 ZINC000182406064 474168914 /nfs/dbraw/zinc/16/89/14/474168914.db2.gz NYALQTLXRURIMD-UNEWFSDZSA-N 0 3 346.431 2.782 20 5 EFBDHN Cc1ccc(CN[C@H]2CCCO[C@@H]2c2cnn(C)c2)cc1[N+](=O)[O-] ZINC000275399547 474171900 /nfs/dbraw/zinc/17/19/00/474171900.db2.gz CINUSHHWLJSNIV-DOTOQJQBSA-N 0 3 330.388 2.647 20 5 EFBDHN CS[C@H]1CN(c2cccc(F)c2[N+](=O)[O-])C[C@H]1N1CCCC1 ZINC000275431891 474183965 /nfs/dbraw/zinc/18/39/65/474183965.db2.gz ISGFOKDNZFAGPA-KGLIPLIRSA-N 0 3 325.409 2.750 20 5 EFBDHN C[C@@H]1CN(CC(C)(C)O)CCN1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000275480935 474201801 /nfs/dbraw/zinc/20/18/01/474201801.db2.gz DXDYOZILBAQXCY-GFCCVEGCSA-N 0 3 341.839 2.525 20 5 EFBDHN C[C@@H]1CCN(CCOc2ccccc2[N+](=O)[O-])C[C@H]1n1ccnc1 ZINC000247731640 474204773 /nfs/dbraw/zinc/20/47/73/474204773.db2.gz VFXVHHKCGPYSEX-GDBMZVCRSA-N 0 3 330.388 2.753 20 5 EFBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])N[C@H](C)C(=O)NCCF ZINC000282842236 474215467 /nfs/dbraw/zinc/21/54/67/474215467.db2.gz SUFLKTFUKSQZLN-NEPJUHHUSA-N 0 3 343.424 2.529 20 5 EFBDHN O=[N+]([O-])c1ccc(Cl)cc1CN1CCN(C2CCOCC2)CC1 ZINC000175470091 474228892 /nfs/dbraw/zinc/22/88/92/474228892.db2.gz WPTBMPIJJQSNBA-UHFFFAOYSA-N 0 3 339.823 2.545 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H]3CCCN3C[C@@H]2CC)c1 ZINC000282925513 474243793 /nfs/dbraw/zinc/24/37/93/474243793.db2.gz WUENZQIBYPHQLY-UONOGXRCSA-N 0 3 347.415 2.692 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H]3CCCN3C[C@H]2CC)c1 ZINC000282925511 474243926 /nfs/dbraw/zinc/24/39/26/474243926.db2.gz WUENZQIBYPHQLY-KGLIPLIRSA-N 0 3 347.415 2.692 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCN(C[C@@H]2CCOC2)CC1 ZINC000182829725 474267133 /nfs/dbraw/zinc/26/71/33/474267133.db2.gz TZDOOWGPGFXGSR-HOTGVXAUSA-N 0 3 333.432 2.618 20 5 EFBDHN C[C@@H]1C[C@H](N(C)c2c([N+](=O)[O-])ncn2C)CCN1Cc1ccccc1 ZINC000265624412 474271844 /nfs/dbraw/zinc/27/18/44/474271844.db2.gz YMESTFKSJKOAKB-GDBMZVCRSA-N 0 3 343.431 2.818 20 5 EFBDHN CC[C@@H](NC(=O)NC1CCN(C2CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000175677672 474281648 /nfs/dbraw/zinc/28/16/48/474281648.db2.gz CFHSOYZYRKLXBZ-QGZVFWFLSA-N 0 3 346.431 2.972 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CNCCN2CCCOCC2)o1 ZINC000289477351 474288772 /nfs/dbraw/zinc/28/87/72/474288772.db2.gz QBRXNBREGLCVKW-UHFFFAOYSA-N 0 3 345.399 2.667 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N(C)CCCN1CCN(C)CC1 ZINC000182955587 474296244 /nfs/dbraw/zinc/29/62/44/474296244.db2.gz ZVWYPLCPUPYBCK-MRXNPFEDSA-N 0 3 334.464 2.534 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)NCCN2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000175782080 474307297 /nfs/dbraw/zinc/30/72/97/474307297.db2.gz LFYWCEAAMBALCY-DZGCQCFKSA-N 0 3 348.447 2.995 20 5 EFBDHN C[C@@H]1CN(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)[C@H]2CCCC[C@@H]12 ZINC000248437619 474323183 /nfs/dbraw/zinc/32/31/83/474323183.db2.gz SOVYYXCVYHLGIG-SKDZVZGDSA-N 0 3 343.427 2.994 20 5 EFBDHN O=[N+]([O-])c1ccccc1N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000265753906 474323658 /nfs/dbraw/zinc/32/36/58/474323658.db2.gz DDKOIYGHFDWNQO-IAGOWNOFSA-N 0 3 341.411 2.890 20 5 EFBDHN Cn1cccc1[C@@H]1CCCN1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248457612 474329837 /nfs/dbraw/zinc/32/98/37/474329837.db2.gz MMJBCWIEZYNKSP-ZBFHGGJFSA-N 0 3 345.399 2.510 20 5 EFBDHN CCC[N@H+](CC)C[C@@H](C)NCc1cc(OC)c([O-])cc1[N+](=O)[O-] ZINC000289583051 474333939 /nfs/dbraw/zinc/33/39/39/474333939.db2.gz MNEHTZUTTWTPQJ-GFCCVEGCSA-N 0 3 325.409 2.519 20 5 EFBDHN CCC[N@@H+](CC)C[C@@H](C)NCc1cc(OC)c([O-])cc1[N+](=O)[O-] ZINC000289583051 474333946 /nfs/dbraw/zinc/33/39/46/474333946.db2.gz MNEHTZUTTWTPQJ-GFCCVEGCSA-N 0 3 325.409 2.519 20 5 EFBDHN CN(C)CCc1ccccc1NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000275898850 474354998 /nfs/dbraw/zinc/35/49/98/474354998.db2.gz TVPKCWYVCZYBRG-UHFFFAOYSA-N 0 3 327.384 2.880 20 5 EFBDHN C[C@@H](CN1CCCCC1)NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000265834617 474355454 /nfs/dbraw/zinc/35/54/54/474355454.db2.gz UCDNTJJQVMKQHX-AWEZNQCLSA-N 0 3 333.432 2.863 20 5 EFBDHN CN(C)CCc1ccccc1NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000275906932 474357164 /nfs/dbraw/zinc/35/71/64/474357164.db2.gz UXZYULMNLGIKEE-UHFFFAOYSA-N 0 3 327.384 2.880 20 5 EFBDHN CN1CCN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C(C)(C)C1 ZINC000270998778 474360517 /nfs/dbraw/zinc/36/05/17/474360517.db2.gz FUEOYBWQMXLDEW-UHFFFAOYSA-N 0 3 344.415 2.818 20 5 EFBDHN CCNC(=O)[C@@H](C)N[C@@H](CC)CSc1ccccc1[N+](=O)[O-] ZINC000271025861 474374015 /nfs/dbraw/zinc/37/40/15/474374015.db2.gz BDWHRVVFYUEJTQ-NEPJUHHUSA-N 0 3 325.434 2.580 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)CN2CCC[C@H](C)C2)c1 ZINC000283390091 474389519 /nfs/dbraw/zinc/38/95/19/474389519.db2.gz GJOMEPXRLVZORZ-KBPBESRZSA-N 0 3 349.431 2.844 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)CN2CCC[C@@H](C)C2)c1 ZINC000283390095 474389614 /nfs/dbraw/zinc/38/96/14/474389614.db2.gz GJOMEPXRLVZORZ-KGLIPLIRSA-N 0 3 349.431 2.844 20 5 EFBDHN Cc1c2ccccc2oc1[C@@H](C)NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000183536330 474389749 /nfs/dbraw/zinc/38/97/49/474389749.db2.gz YHBJYQHLBNTRNR-OCCSQVGLSA-N 0 3 344.371 2.558 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)[C@H](CN)c2ccccc2)cc1[N+](=O)[O-] ZINC000237412567 474398587 /nfs/dbraw/zinc/39/85/87/474398587.db2.gz RONSAWACUXLRDT-CZUORRHYSA-N 0 3 327.384 2.823 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)NC[C@@H]2CCCN(C)C2)cc1[N+](=O)[O-] ZINC000176173903 474401500 /nfs/dbraw/zinc/40/15/00/474401500.db2.gz AUSWJYMWTNBFSZ-KGLIPLIRSA-N 0 3 334.420 2.605 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CC[C@@]3(C2)OCc2ccccc23)c1 ZINC000248694759 474405744 /nfs/dbraw/zinc/40/57/44/474405744.db2.gz JJJIGLZSMVOOQR-MOPGFXCFSA-N 0 3 340.379 2.760 20 5 EFBDHN O=C(CCN(Cc1ccccn1)C1CC1)Nc1ccccc1[N+](=O)[O-] ZINC000283454505 474408145 /nfs/dbraw/zinc/40/81/45/474408145.db2.gz IOWHVVQKVGIRSB-UHFFFAOYSA-N 0 3 340.383 2.983 20 5 EFBDHN CCc1nn(C)c(NC[C@@H](c2cccc(OC)c2)N(C)C)c1[N+](=O)[O-] ZINC000271161266 474411088 /nfs/dbraw/zinc/41/10/88/474411088.db2.gz QINQIERKMKAXRT-HNNXBMFYSA-N 0 3 347.419 2.614 20 5 EFBDHN COc1cc(CN(C)CCn2ccc([N+](=O)[O-])n2)ccc1SC ZINC000176220774 474414410 /nfs/dbraw/zinc/41/44/10/474414410.db2.gz UARZQALKSYAVCI-UHFFFAOYSA-N 0 3 336.417 2.654 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])NC[C@@H](O)C(F)(F)F ZINC000271173818 474420181 /nfs/dbraw/zinc/42/01/81/474420181.db2.gz UTQHFZUKEADJRC-BXKDBHETSA-N 0 3 338.351 2.978 20 5 EFBDHN Cc1cccc(NC2CCN(CCn3ccc([N+](=O)[O-])n3)CC2)c1 ZINC000176261695 474423575 /nfs/dbraw/zinc/42/35/75/474423575.db2.gz MTGHAFQAXWRDHE-UHFFFAOYSA-N 0 3 329.404 2.676 20 5 EFBDHN COC[C@@]1(CNCc2ccc([N+](=O)[O-])cc2)OCCc2ccccc21 ZINC000289780429 474423746 /nfs/dbraw/zinc/42/37/46/474423746.db2.gz JNHTUPMFSPIHQY-LJQANCHMSA-N 0 3 342.395 2.799 20 5 EFBDHN CC(C)c1ccc(C(=O)N2CC[C@H]3CCN(C)C[C@H]32)cc1[N+](=O)[O-] ZINC000276166800 474437969 /nfs/dbraw/zinc/43/79/69/474437969.db2.gz RNPZPQKPPVXHOT-CXAGYDPISA-N 0 3 331.416 2.884 20 5 EFBDHN CCN1CCC[C@@H]1CNC(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000176316756 474438340 /nfs/dbraw/zinc/43/83/40/474438340.db2.gz JMDAEEVBHMSQBN-DZGCQCFKSA-N 0 3 334.420 2.748 20 5 EFBDHN COCOc1ccc(OC)cc1CNCCc1ccccc1[N+](=O)[O-] ZINC000271227375 474451895 /nfs/dbraw/zinc/45/18/95/474451895.db2.gz PIQQTSNYNKIWNQ-UHFFFAOYSA-N 0 3 346.383 2.918 20 5 EFBDHN CN(Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C[C@@H]1CCC[C@H]1O ZINC000271233860 474454709 /nfs/dbraw/zinc/45/47/09/474454709.db2.gz CTWKFLUGALDYDI-WMLDXEAASA-N 0 3 344.415 2.588 20 5 EFBDHN COC[C@]1(CNCc2ccccc2[N+](=O)[O-])OCCc2ccccc21 ZINC000289862510 474460416 /nfs/dbraw/zinc/46/04/16/474460416.db2.gz ONPWFVMHCHWIQR-IBGZPJMESA-N 0 3 342.395 2.799 20 5 EFBDHN COCCCN1CCC(Nc2ccc([N+](=O)[O-])cc2C(C)=O)CC1 ZINC000283707636 474475797 /nfs/dbraw/zinc/47/57/97/474475797.db2.gz DIIYONZMTPHCFG-UHFFFAOYSA-N 0 3 335.404 2.710 20 5 EFBDHN C[C@H]1CN(CC2CCN(c3ccc(N)cc3[N+](=O)[O-])CC2)C[C@H](C)O1 ZINC000283738235 474483237 /nfs/dbraw/zinc/48/32/37/474483237.db2.gz ITBZGCJDUCWARJ-KBPBESRZSA-N 0 3 348.447 2.503 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@](C)(CO)C1CCCCC1 ZINC000266871555 474511164 /nfs/dbraw/zinc/51/11/64/474511164.db2.gz QDOJFSFJKMUSPW-GOSISDBHSA-N 0 3 349.431 2.763 20 5 EFBDHN Cc1cccc(C(=O)NCCCCN2C[C@@H](C)O[C@H](C)C2)c1[N+](=O)[O-] ZINC000176694199 474517915 /nfs/dbraw/zinc/51/79/15/474517915.db2.gz ISDHOFIFGRCUQO-HUUCEWRRSA-N 0 3 349.431 2.522 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)N(C)C[C@@H]2CCCN(C)C2)cc1[N+](=O)[O-] ZINC000176720388 474519981 /nfs/dbraw/zinc/51/99/81/474519981.db2.gz YTAUULFGDGJPEX-HUUCEWRRSA-N 0 3 348.447 2.947 20 5 EFBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CN[C@@H]2CCC[C@@H]2CCO)c1 ZINC000189974681 474523851 /nfs/dbraw/zinc/52/38/51/474523851.db2.gz WXWIJBOYIFERQB-ZWNOBZJWSA-N 0 3 330.331 2.837 20 5 EFBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CN[C@@H]2CCC[C@H]2CCO)c1 ZINC000189974718 474524249 /nfs/dbraw/zinc/52/42/49/474524249.db2.gz WXWIJBOYIFERQB-GXFFZTMASA-N 0 3 330.331 2.837 20 5 EFBDHN CCO[C@@H]1C[C@](N)(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1(C)C ZINC000249096326 474525016 /nfs/dbraw/zinc/52/50/16/474525016.db2.gz YAASYDUJKLRPMA-DWQUBVKVSA-N 0 3 349.431 2.613 20 5 EFBDHN O=[N+]([O-])c1cnc(NCc2ccccc2CN2CCC(O)CC2)s1 ZINC000189984104 474527079 /nfs/dbraw/zinc/52/70/79/474527079.db2.gz HZBPJAKISAPLBD-UHFFFAOYSA-N 0 3 348.428 2.620 20 5 EFBDHN O=C(N[C@@H](CN1CCCCC1)c1ccccc1)c1ccc([N+](=O)[O-])[nH]1 ZINC000609018206 480110269 /nfs/dbraw/zinc/11/02/69/480110269.db2.gz SDBYVAOIZTYGGM-INIZCTEOSA-N 0 3 342.399 2.880 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1C(=O)NCc1ccc(CN(C)C)cc1 ZINC000184531836 474538118 /nfs/dbraw/zinc/53/81/18/474538118.db2.gz HFFWRFMNVYDCBE-UHFFFAOYSA-N 0 3 327.384 2.895 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CCCN1CC ZINC000184653964 474575891 /nfs/dbraw/zinc/57/58/91/474575891.db2.gz SLBGTQHAOHJDMF-NVXWUHKLSA-N 0 3 333.432 2.764 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC1CCN(C2CC2)CC1 ZINC000184660343 474576781 /nfs/dbraw/zinc/57/67/81/474576781.db2.gz LLHJAUFGDAECER-OAHLLOKOSA-N 0 3 345.443 2.907 20 5 EFBDHN C[C@@H](CN1CCC[C@H](C)C1)NC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000245393129 474577616 /nfs/dbraw/zinc/57/76/16/474577616.db2.gz VIKHARKQUPZNOM-KBPBESRZSA-N 0 3 334.420 2.514 20 5 EFBDHN C[C@H](NCCn1ccc([N+](=O)[O-])n1)c1ccccc1OC(F)F ZINC000271794918 474592300 /nfs/dbraw/zinc/59/23/00/474592300.db2.gz RDVPLMABKCQDEX-JTQLQIEISA-N 0 3 326.303 2.744 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@@H](N(C)C)C1 ZINC000184727898 474596225 /nfs/dbraw/zinc/59/62/25/474596225.db2.gz AHJAFGKIJNFOAH-NVXWUHKLSA-N 0 3 333.432 2.716 20 5 EFBDHN O=C(N[C@H](CN1CCCCC1)c1ccccc1)c1ccc([N+](=O)[O-])[nH]1 ZINC000609018211 480110343 /nfs/dbraw/zinc/11/03/43/480110343.db2.gz SDBYVAOIZTYGGM-MRXNPFEDSA-N 0 3 342.399 2.880 20 5 EFBDHN C[C@@H](CN1CCC[C@H](C)C1)NC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000249758888 474612218 /nfs/dbraw/zinc/61/22/18/474612218.db2.gz FTIKXTKHZQZMRQ-KBPBESRZSA-N 0 3 334.420 2.514 20 5 EFBDHN C[C@H]1CN(Cc2ccccc2)CC[C@H]1Nc1c([N+](=O)[O-])ncn1C ZINC000267189698 474612758 /nfs/dbraw/zinc/61/27/58/474612758.db2.gz HCFGOLOOOUCEKC-DZGCQCFKSA-N 0 3 329.404 2.651 20 5 EFBDHN C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000249800924 474616827 /nfs/dbraw/zinc/61/68/27/474616827.db2.gz YTLXWRKEWCMIQA-KGLIPLIRSA-N 0 3 334.420 2.514 20 5 EFBDHN CS[C@H]1CN(c2c3c(ccc2[N+](=O)[O-])NCC3)C[C@H]1N1CCCC1 ZINC000278348547 474617284 /nfs/dbraw/zinc/61/72/84/474617284.db2.gz JKYVTZDWPZBIJC-CVEARBPZSA-N 0 3 348.472 2.579 20 5 EFBDHN Cc1cc([N+](=O)[O-])cc(C(=O)N2CCC[C@@H]3CN(C)CC[C@@H]32)c1F ZINC000284365364 474627914 /nfs/dbraw/zinc/62/79/14/474627914.db2.gz ZMAVYCBHSGJRSE-DOMZBBRYSA-N 0 3 335.379 2.599 20 5 EFBDHN CCOc1cc(N2CCN(CC3CCOCC3)CC2)ccc1[N+](=O)[O-] ZINC000267247380 474627869 /nfs/dbraw/zinc/62/78/69/474627869.db2.gz TVFCJABUPCPKRP-UHFFFAOYSA-N 0 3 349.431 2.542 20 5 EFBDHN C[C@@H](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)C1=CCN(C)CC1 ZINC000272858360 474627895 /nfs/dbraw/zinc/62/78/95/474627895.db2.gz HYYDPKDKBHIRLP-GFCCVEGCSA-N 0 3 344.415 2.549 20 5 EFBDHN CN(C)CCN(C(=O)c1cccc([N+](=O)[O-])c1N)C1CCCCC1 ZINC000267279436 474635546 /nfs/dbraw/zinc/63/55/46/474635546.db2.gz VQTVNMKLARUOTO-UHFFFAOYSA-N 0 3 334.420 2.514 20 5 EFBDHN CCCCC[C@@H](C)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000272911472 474639931 /nfs/dbraw/zinc/63/99/31/474639931.db2.gz GQQACBZEYVIFOB-CYBMUJFWSA-N 0 3 328.434 2.927 20 5 EFBDHN C[C@@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])[C@@H](c1ccccc1)N(C)C ZINC000291666408 474645231 /nfs/dbraw/zinc/64/52/31/474645231.db2.gz LHUBZFOXBPYJPB-PXAZEXFGSA-N 0 3 342.399 2.598 20 5 EFBDHN C[C@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])[C@H](c1ccccc1)N(C)C ZINC000291666411 474645507 /nfs/dbraw/zinc/64/55/07/474645507.db2.gz LHUBZFOXBPYJPB-YVEFUNNKSA-N 0 3 342.399 2.598 20 5 EFBDHN C[C@@H](NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)C1=CCN(C)CC1 ZINC000272957006 474650806 /nfs/dbraw/zinc/65/08/06/474650806.db2.gz NDGXUKOWYGBOPG-CHWSQXEVSA-N 0 3 349.456 2.842 20 5 EFBDHN CCC(CC)(CNCc1cc(OC)c(OC)cc1[N+](=O)[O-])OC ZINC000291696785 474651657 /nfs/dbraw/zinc/65/16/57/474651657.db2.gz JRRKTSPSVICTLG-UHFFFAOYSA-N 0 3 326.393 2.907 20 5 EFBDHN C[C@H]1OCC[C@]1(O)CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291702592 474653541 /nfs/dbraw/zinc/65/35/41/474653541.db2.gz ZDSHABRSZYKDAY-OQPBUACISA-N 0 3 335.187 2.531 20 5 EFBDHN Cc1nccnc1CCNCc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000292871968 474687904 /nfs/dbraw/zinc/68/79/04/474687904.db2.gz BMHZOUWSAYOFBC-UHFFFAOYSA-N 0 3 338.314 2.627 20 5 EFBDHN C[C@@H](NC[C@H](O)COc1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000305115039 474694803 /nfs/dbraw/zinc/69/48/03/474694803.db2.gz HOIMEOAHAOFTAR-WBMJQRKESA-N 0 3 334.347 2.824 20 5 EFBDHN Cc1ccc([C@@H](C)N[C@@H]2CCCN(c3ccnn3C)C2)cc1[N+](=O)[O-] ZINC000278549512 474695284 /nfs/dbraw/zinc/69/52/84/474695284.db2.gz VSIKJNSYIPTZLN-GDBMZVCRSA-N 0 3 343.431 2.956 20 5 EFBDHN CO[C@]1(C)C[C@H](N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1(C)C ZINC000340830554 474697684 /nfs/dbraw/zinc/69/76/84/474697684.db2.gz ZKSNUBGOHUIWSK-HYSWKAIVSA-N 0 3 335.404 2.715 20 5 EFBDHN CCN1CCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000292905765 474707662 /nfs/dbraw/zinc/70/76/62/474707662.db2.gz XVZIXSIDKASLOQ-NSHDSACASA-N 0 3 345.321 2.828 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CNC1(c2ccccc2)CC1 ZINC000273094469 474712695 /nfs/dbraw/zinc/71/26/95/474712695.db2.gz CXYNIZBZPZVKMK-OAHLLOKOSA-N 0 3 328.368 2.613 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCCN2CCC(C)CC2)c1 ZINC000344392528 474715398 /nfs/dbraw/zinc/71/53/98/474715398.db2.gz RMKCHKOSZRFPHK-UHFFFAOYSA-N 0 3 349.431 2.520 20 5 EFBDHN C[C@@H]1C[C@@H](NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)CN1C1CC1 ZINC000267976845 474733211 /nfs/dbraw/zinc/73/32/11/474733211.db2.gz NRXQGBHDXNABHZ-TZMCWYRMSA-N 0 3 331.416 2.614 20 5 EFBDHN C[C@@H]1CN(C(=O)Nc2cccc([N+](=O)[O-])c2)CCN(C2CCC2)C1 ZINC000291969976 474779278 /nfs/dbraw/zinc/77/92/78/474779278.db2.gz XONJJUKCRWHVJI-ZDUSSCGKSA-N 0 3 332.404 2.933 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCN2CC[C@](CO)(c3ccccc3)C2)c1 ZINC000291996712 474793723 /nfs/dbraw/zinc/79/37/23/474793723.db2.gz XCQGVRYAIDESFD-IBGZPJMESA-N 0 3 342.395 2.610 20 5 EFBDHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000268129935 474814292 /nfs/dbraw/zinc/81/42/92/474814292.db2.gz PGIAYDKXCLOTKJ-OTYXRUKQSA-N 0 3 338.795 2.852 20 5 EFBDHN Nc1ccc(N[C@H]2CCCN(Cc3ccccc3)C2)nc1[N+](=O)[O-] ZINC000310230436 474825886 /nfs/dbraw/zinc/82/58/86/474825886.db2.gz JIJUVYMCJBXGDT-AWEZNQCLSA-N 0 3 327.388 2.649 20 5 EFBDHN CN1CCN(CCNc2c(Cl)cccc2[N+](=O)[O-])CC1(C)C ZINC000293134051 474833030 /nfs/dbraw/zinc/83/30/30/474833030.db2.gz QTJSYMCVBJTMMB-UHFFFAOYSA-N 0 3 326.828 2.686 20 5 EFBDHN CCOc1cc(CN2CCN(c3ccncc3)CC2)ccc1[N+](=O)[O-] ZINC000617210296 480128860 /nfs/dbraw/zinc/12/88/60/480128860.db2.gz ULSRZOICNRLEMM-UHFFFAOYSA-N 0 3 342.399 2.711 20 5 EFBDHN CCCNC(=O)[C@@H]1CCCN(C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000255336951 474837178 /nfs/dbraw/zinc/83/71/78/474837178.db2.gz UKYABIPMSAQKHH-KQQSKNTNSA-N 0 3 331.416 2.846 20 5 EFBDHN CN(C)CCOc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000337267913 474843044 /nfs/dbraw/zinc/84/30/44/474843044.db2.gz WYBKLDXAIDRCEV-UHFFFAOYSA-N 0 3 329.356 2.788 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@]2(CCN(C)C2)C1 ZINC000292146367 474872484 /nfs/dbraw/zinc/87/24/84/474872484.db2.gz JRJNCJFZWKHJCV-SUMWQHHRSA-N 0 3 349.456 2.630 20 5 EFBDHN C[C@@H](NC[C@H]1COC2(CCCCC2)O1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000285054156 474876959 /nfs/dbraw/zinc/87/69/59/474876959.db2.gz IOICPUPBQJLQJC-OCCSQVGLSA-N 0 3 335.404 2.903 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CN(C2CC2)C[C@@H]1C ZINC000268241756 474883031 /nfs/dbraw/zinc/88/30/31/474883031.db2.gz VELVVWIBTZHOCX-MKBNYLNASA-N 0 3 349.456 2.674 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc([N+](=O)[O-])cc(C)c1F ZINC000278867939 474883379 /nfs/dbraw/zinc/88/33/79/474883379.db2.gz MUSVCZXHROPDCE-OLZOCXBDSA-N 0 3 335.379 2.741 20 5 EFBDHN O=C(NCCN1CCCCCC1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000339059667 474891106 /nfs/dbraw/zinc/89/11/06/474891106.db2.gz HKUTXLBMIVSNHV-UHFFFAOYSA-N 0 3 331.372 2.947 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CN(C3CC3)C[C@H]2C)c1 ZINC000268285176 474906449 /nfs/dbraw/zinc/90/64/49/474906449.db2.gz XYAIOKZBTPYHTO-YGRLFVJLSA-N 0 3 335.429 2.529 20 5 EFBDHN CC1(C)CC[C@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000273471179 474916044 /nfs/dbraw/zinc/91/60/44/474916044.db2.gz RYQWEYZAOHHJOY-LBPRGKRZSA-N 0 3 326.418 2.537 20 5 EFBDHN O=C(CCN1CCOC[C@H](C2CCC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000292239872 474919843 /nfs/dbraw/zinc/91/98/43/474919843.db2.gz WOLWWMXPWRNDFD-OAHLLOKOSA-N 0 3 347.415 2.672 20 5 EFBDHN O=C(CCN1CCOC[C@@H](C2CCC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000292239867 474920472 /nfs/dbraw/zinc/92/04/72/474920472.db2.gz WOLWWMXPWRNDFD-HNNXBMFYSA-N 0 3 347.415 2.672 20 5 EFBDHN C[C@H](NCCc1ccccc1[N+](=O)[O-])c1ccc(N)c([N+](=O)[O-])c1 ZINC000285195338 474924396 /nfs/dbraw/zinc/92/43/96/474924396.db2.gz NXMBNCOPDINVQY-NSHDSACASA-N 0 3 330.344 2.979 20 5 EFBDHN C[C@@H](CN(C)Cc1ccccc1)Nc1cccc(C(N)=O)c1[N+](=O)[O-] ZINC000341076166 474947229 /nfs/dbraw/zinc/94/72/29/474947229.db2.gz WPIWEYIRBWXKGG-ZDUSSCGKSA-N 0 3 342.399 2.626 20 5 EFBDHN C[C@H](NC[C@H](O)CCc1ccccc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000285270461 474953017 /nfs/dbraw/zinc/95/30/17/474953017.db2.gz QTBIUMNAYDGHIU-XJKSGUPXSA-N 0 3 329.400 2.821 20 5 EFBDHN CS[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2C)C[C@@H]1N1CCCC1 ZINC000273549663 474958586 /nfs/dbraw/zinc/95/85/86/474958586.db2.gz VFVDPABRXALRPE-JKSUJKDBSA-N 0 3 349.456 2.555 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc(N)c([N+](=O)[O-])n2)C1 ZINC000323978859 474958984 /nfs/dbraw/zinc/95/89/84/474958984.db2.gz DKCBBUOPGLZSJF-CQSZACIVSA-N 0 3 341.415 2.530 20 5 EFBDHN Cc1nnc([C@H]2CCCN(Cc3nc4cc([N+](=O)[O-])ccc4o3)C2)[nH]1 ZINC000268425001 474970141 /nfs/dbraw/zinc/97/01/41/474970141.db2.gz DPHBIGXIFKTOMX-NSHDSACASA-N 0 3 342.359 2.542 20 5 EFBDHN O=[N+]([O-])c1cnc(Nc2ccc(CCN3CCSCC3)cc2)nc1 ZINC000273611795 474989898 /nfs/dbraw/zinc/98/98/98/474989898.db2.gz MEVPBNFINURJKB-UHFFFAOYSA-N 0 3 345.428 2.720 20 5 EFBDHN C[C@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1OCCc2sccc21 ZINC000292380781 474993882 /nfs/dbraw/zinc/99/38/82/474993882.db2.gz JRSDIJQUJBGNQG-UXEPBGEESA-N 0 3 348.424 2.982 20 5 EFBDHN COc1ccc(NC(=O)CN(C2CCC2)C2CCC2)c([N+](=O)[O-])c1 ZINC000292380590 474994803 /nfs/dbraw/zinc/99/48/03/474994803.db2.gz JOWNIZOFJPFEPI-UHFFFAOYSA-N 0 3 333.388 2.949 20 5 EFBDHN C[C@H]1CN(Cc2ccccc2)CC[C@H]1Nc1ncc([N+](=O)[O-])cn1 ZINC000273665836 475005318 /nfs/dbraw/zinc/00/53/18/475005318.db2.gz WXFNJBZKTBVMRX-XJKSGUPXSA-N 0 3 327.388 2.707 20 5 EFBDHN O=[N+]([O-])c1cnc(NC2CCN(CCc3ccccc3)CC2)nc1 ZINC000273676619 475008056 /nfs/dbraw/zinc/00/80/56/475008056.db2.gz YMIMJKRCIXWYLZ-UHFFFAOYSA-N 0 3 327.388 2.504 20 5 EFBDHN COc1ccc([C@@H](CN2CCCC2)Nc2ncc([N+](=O)[O-])cn2)cc1 ZINC000273716072 475023434 /nfs/dbraw/zinc/02/34/34/475023434.db2.gz FYHPVPIARIFFFZ-MRXNPFEDSA-N 0 3 343.387 2.642 20 5 EFBDHN O=[N+]([O-])c1cc2c(ncnc2NC[C@H]2NCCc3ccccc32)s1 ZINC000261728828 475042048 /nfs/dbraw/zinc/04/20/48/475042048.db2.gz RLJYGTVBRFUCOM-CYBMUJFWSA-N 0 3 341.396 2.898 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCN2CC[C@@H](OCc3ccncc3)C2)c1 ZINC000281108718 475074260 /nfs/dbraw/zinc/07/42/60/475074260.db2.gz WPRRTVBCIWLQQW-GOSISDBHSA-N 0 3 343.383 2.660 20 5 EFBDHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000273886004 475101334 /nfs/dbraw/zinc/10/13/34/475101334.db2.gz UHWBXPLRBOIFFN-BZNIZROVSA-N 0 3 349.406 2.610 20 5 EFBDHN CCc1ccc(C(=O)N2CC[C@@H](N3CCCC3)[C@H]2C)cc1[N+](=O)[O-] ZINC000287356083 475111748 /nfs/dbraw/zinc/11/17/48/475111748.db2.gz WMYDJAPBPNABIR-CZUORRHYSA-N 0 3 331.416 2.856 20 5 EFBDHN C[C@@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)CCN(C2CC2)C1 ZINC000296173784 475215550 /nfs/dbraw/zinc/21/55/50/475215550.db2.gz GBVZJTXFAVVQQG-NSHDSACASA-N 0 3 336.367 2.682 20 5 EFBDHN CCN(C(=O)c1cc([N+](=O)[O-])c[nH]1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000354538655 475231861 /nfs/dbraw/zinc/23/18/61/475231861.db2.gz FMSDRHCTUITREH-HNNXBMFYSA-N 0 3 342.399 2.660 20 5 EFBDHN O=C(N[C@H]1CCN(CC2CC2)C1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000609382862 480154617 /nfs/dbraw/zinc/15/46/17/480154617.db2.gz FWSHGWDSMMFPCH-ZDUSSCGKSA-N 0 3 329.356 2.555 20 5 EFBDHN CC(=O)NC[C@@H]1CCCN(C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000347337145 475242770 /nfs/dbraw/zinc/24/27/70/475242770.db2.gz MCIIRPDZLGTNOS-ZGUWOUCSSA-N 0 3 331.416 2.846 20 5 EFBDHN CCO[C@H]1C[C@@H](N(C)CCn2ccc([N+](=O)[O-])n2)C12CCCCC2 ZINC000357904915 475249513 /nfs/dbraw/zinc/24/95/13/475249513.db2.gz BNQVIFRCBQOIQY-CABCVRRESA-N 0 3 336.436 2.851 20 5 EFBDHN CNc1c(C(=O)N[C@H](C)CN2C[C@H](C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000361180710 475250025 /nfs/dbraw/zinc/25/00/25/475250025.db2.gz UETWBTDCTSYILC-HZSPNIEDSA-N 0 3 348.447 2.733 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(C)CC[C@H]1C ZINC000361197756 475262701 /nfs/dbraw/zinc/26/27/01/475262701.db2.gz AHRLJDBZJRTNTA-ZBFHGGJFSA-N 0 3 333.432 2.716 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC(CCC(N)=O)CC1 ZINC000347360067 475264993 /nfs/dbraw/zinc/26/49/93/475264993.db2.gz NVBZVTHNOMILEK-KAMYIIQDSA-N 0 3 331.416 2.976 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)C[C@@H]1CCCN(C)C1 ZINC000361202554 475266200 /nfs/dbraw/zinc/26/62/00/475266200.db2.gz QKDVYFVQTZPUCC-IAGOWNOFSA-N 0 3 347.459 2.964 20 5 EFBDHN CCO[C@@H]1C[C@H](N[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C12CCC2 ZINC000296504703 475345966 /nfs/dbraw/zinc/34/59/66/475345966.db2.gz ZIEOBKUZROULPS-UHOFOFEASA-N 0 3 347.415 2.859 20 5 EFBDHN C[C@@H]1CN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H](C)N1C ZINC000339625055 475359096 /nfs/dbraw/zinc/35/90/96/475359096.db2.gz WRMGIMZFBGPJLB-ZIAGYGMSSA-N 0 3 344.415 2.817 20 5 EFBDHN CN1CCC(C(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)CC1 ZINC000345693899 475371446 /nfs/dbraw/zinc/37/14/46/475371446.db2.gz YJPJMJUKQYZHSD-INIZCTEOSA-N 0 3 335.429 2.511 20 5 EFBDHN C[C@@H](NC(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1)C1=CCN(C)CC1 ZINC000296610432 475394167 /nfs/dbraw/zinc/39/41/67/475394167.db2.gz KAUBZFQQUXARTP-QWHCGFSZSA-N 0 3 332.404 2.605 20 5 EFBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@H](C(=O)N2CCCC2)C1 ZINC000331732656 475397143 /nfs/dbraw/zinc/39/71/43/475397143.db2.gz QTSYPTGBFPJYQV-HOCLYGCPSA-N 0 3 331.416 2.990 20 5 EFBDHN O=[N+]([O-])c1ccccc1C[C@H](NCc1nnc(C2CC2)[nH]1)C1CC1 ZINC000296628756 475402318 /nfs/dbraw/zinc/40/23/18/475402318.db2.gz XHGBWLDRILOZEH-AWEZNQCLSA-N 0 3 327.388 2.701 20 5 EFBDHN O=[N+]([O-])c1ccccc1C[C@H]([NH2+]Cc1nnc(C2CC2)[n-]1)C1CC1 ZINC000296628756 475402329 /nfs/dbraw/zinc/40/23/29/475402329.db2.gz XHGBWLDRILOZEH-AWEZNQCLSA-N 0 3 327.388 2.701 20 5 EFBDHN CCN(CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1ccncc1 ZINC000348123734 475408135 /nfs/dbraw/zinc/40/81/35/475408135.db2.gz KKUBUTHUAGLXJL-UHFFFAOYSA-N 0 3 328.372 2.841 20 5 EFBDHN C[C@@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCCOC1 ZINC000348140343 475420887 /nfs/dbraw/zinc/42/08/87/475420887.db2.gz BBHVWTOZGYHIIU-MNOVXSKESA-N 0 3 341.795 2.591 20 5 EFBDHN Cc1cc(F)c(NC(=O)N2CC[C@@]3(CCN(C)C3)C2)cc1[N+](=O)[O-] ZINC000296667429 475421253 /nfs/dbraw/zinc/42/12/53/475421253.db2.gz HCNAMLQSXKRIPJ-MRXNPFEDSA-N 0 3 336.367 2.602 20 5 EFBDHN CCOc1ccc([C@H](C)NCCC(=O)NC(C)(C)C)cc1[N+](=O)[O-] ZINC000358132766 475427444 /nfs/dbraw/zinc/42/74/44/475427444.db2.gz OKPZLMQSXWENNU-LBPRGKRZSA-N 0 3 337.420 2.949 20 5 EFBDHN Cc1cc(F)c(NC(=O)N2CC[C@H]3CCN(C)C[C@H]32)cc1[N+](=O)[O-] ZINC000296685696 475429866 /nfs/dbraw/zinc/42/98/66/475429866.db2.gz JACPPDDIISDMGW-IAQYHMDHSA-N 0 3 336.367 2.600 20 5 EFBDHN Cc1cc(F)c(NC(=O)N2CC[C@@H]3CCN(C)C[C@H]32)cc1[N+](=O)[O-] ZINC000296685702 475429982 /nfs/dbraw/zinc/42/99/82/475429982.db2.gz JACPPDDIISDMGW-XHDPSFHLSA-N 0 3 336.367 2.600 20 5 EFBDHN C[C@H](C(=O)N1C[C@H](N2CCCC2)C[C@@H]1C)c1ccc([N+](=O)[O-])cc1F ZINC000331874261 475442132 /nfs/dbraw/zinc/44/21/32/475442132.db2.gz BWPFCIYXUMUBHR-KCQAQPDRSA-N 0 3 349.406 2.923 20 5 EFBDHN C[C@H](C(=O)N1C[C@H](N2CCCC2)C[C@H]1C)c1ccc([N+](=O)[O-])cc1F ZINC000331874264 475442722 /nfs/dbraw/zinc/44/27/22/475442722.db2.gz BWPFCIYXUMUBHR-VNHYZAJKSA-N 0 3 349.406 2.923 20 5 EFBDHN CC(C)[C@@H](NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1(CO)CCC1 ZINC000339727822 475446448 /nfs/dbraw/zinc/44/64/48/475446448.db2.gz NYJGSKGFOOIUOH-MRXNPFEDSA-N 0 3 332.404 2.748 20 5 EFBDHN CN(CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@H]1CCC(C)(C)C1 ZINC000361468131 475472562 /nfs/dbraw/zinc/47/25/62/475472562.db2.gz FSKVGUFVSQVHHR-HNNXBMFYSA-N 0 3 331.416 2.994 20 5 EFBDHN Cn1nccc1[C@@H]1CCCN(CCOc2ccccc2[N+](=O)[O-])C1 ZINC000338026628 475518801 /nfs/dbraw/zinc/51/88/01/475518801.db2.gz DUSLEUPRGORTOD-CQSZACIVSA-N 0 3 330.388 2.587 20 5 EFBDHN Cc1c(CN[C@@H](C)c2ccc(-n3cnnn3)cc2)cccc1[N+](=O)[O-] ZINC000358320086 475588335 /nfs/dbraw/zinc/58/83/35/475588335.db2.gz GIJLQJLVPNFKPX-ZDUSSCGKSA-N 0 3 338.371 2.730 20 5 EFBDHN C[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1F)N1CCCC[C@@H]1C ZINC000358327288 475593906 /nfs/dbraw/zinc/59/39/06/475593906.db2.gz FYGDVLFBXQWHMT-STQMWFEESA-N 0 3 337.395 2.656 20 5 EFBDHN CC(C)c1ccc(CN2CCO[C@@H]3CCN(C)C[C@@H]32)cc1[N+](=O)[O-] ZINC000332320514 475600645 /nfs/dbraw/zinc/60/06/45/475600645.db2.gz RFLFLQZZCZOJGR-ZWKOTPCHSA-N 0 3 333.432 2.623 20 5 EFBDHN Cc1c(CNC(=O)N2CCCN(C(C)C)CC2)cccc1[N+](=O)[O-] ZINC000332366598 475614860 /nfs/dbraw/zinc/61/48/60/475614860.db2.gz XPVQHMDBUAMVME-UHFFFAOYSA-N 0 3 334.420 2.529 20 5 EFBDHN Cc1nc(N2CCCN(Cc3ccccc3)C[C@H]2C)ncc1[N+](=O)[O-] ZINC000297125808 475622734 /nfs/dbraw/zinc/62/27/34/475622734.db2.gz MRVJLUAYLHHFSD-CQSZACIVSA-N 0 3 341.415 2.794 20 5 EFBDHN CN1CC[C@H]2[C@@H](CCCN2C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000332391567 475623581 /nfs/dbraw/zinc/62/35/81/475623581.db2.gz VSBNDZUGFBDNGA-YOEHRIQHSA-N 0 3 345.443 2.815 20 5 EFBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CC[C@H](N2CCN(C)CC2)[C@H](C)C1 ZINC000332394237 475624269 /nfs/dbraw/zinc/62/42/69/475624269.db2.gz NWMSVDZROBHDJZ-GJYPPUQNSA-N 0 3 346.475 2.614 20 5 EFBDHN COc1cc(CNCC(C)(C)OC)c([N+](=O)[O-])cc1OCC(F)F ZINC000352809093 475643619 /nfs/dbraw/zinc/64/36/19/475643619.db2.gz FKOBEIDRCGIOMH-UHFFFAOYSA-N 0 3 348.346 2.762 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@@H]1CC(=O)N(C2CC2)C1 ZINC000358391752 475643735 /nfs/dbraw/zinc/64/37/35/475643735.db2.gz FOEIZXBQAQFSLP-CHWSQXEVSA-N 0 3 349.456 2.818 20 5 EFBDHN O=C(NC1CCN(C2CCC2)CC1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000297202008 475655454 /nfs/dbraw/zinc/65/54/54/475655454.db2.gz PLJXTZFQNYRNCG-UHFFFAOYSA-N 0 3 337.807 2.995 20 5 EFBDHN C[C@@H](CNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12)N1CCC[C@H](C)C1 ZINC000342923724 475656052 /nfs/dbraw/zinc/65/60/52/475656052.db2.gz FYWRPMAKWNTMGR-STQMWFEESA-N 0 3 344.415 2.926 20 5 EFBDHN COc1cc(CN2C[C@H]3CCCCN3C[C@H]2C)c([N+](=O)[O-])cc1F ZINC000332524402 475659252 /nfs/dbraw/zinc/65/92/52/475659252.db2.gz RBMSBONXKLFTSK-TZMCWYRMSA-N 0 3 337.395 2.801 20 5 EFBDHN CCNc1ccc(C(=O)N2C[C@@H]3CCCN3C[C@@H]2CC)cc1[N+](=O)[O-] ZINC000332655469 475704398 /nfs/dbraw/zinc/70/43/98/475704398.db2.gz VKLSFEZZDSUGEK-GJZGRUSLSA-N 0 3 346.431 2.725 20 5 EFBDHN C[C@H](N[C@H]1CCC[C@H]1OC(F)F)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000348521501 475721158 /nfs/dbraw/zinc/72/11/58/475721158.db2.gz QIIXKFLQXCINPG-XHVZSJERSA-N 0 3 343.330 2.672 20 5 EFBDHN CCCN(CCN(C)C)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000343057427 475728808 /nfs/dbraw/zinc/72/88/08/475728808.db2.gz CQUCHHDWLOISDU-UHFFFAOYSA-N 0 3 348.447 2.609 20 5 EFBDHN CCCN(CCN(C)C)C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000343061624 475732721 /nfs/dbraw/zinc/73/27/21/475732721.db2.gz HCZDVDLRMBHYMG-ZDUSSCGKSA-N 0 3 339.461 2.876 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@@H]1CCC[C@H]1OC(F)F ZINC000348535223 475735118 /nfs/dbraw/zinc/73/51/18/475735118.db2.gz QMBIAGUGJAMPAR-DGCLKSJQSA-N 0 3 343.330 2.592 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN[C@H]3CCC[C@@H]3OC(F)F)nc2c1 ZINC000348540236 475740113 /nfs/dbraw/zinc/74/01/13/475740113.db2.gz UYPDZYIIVKNBCV-JQWIXIFHSA-N 0 3 326.303 2.721 20 5 EFBDHN COCCCN(C)CCNc1ccc([N+](=O)[O-])cc1Br ZINC000353172441 475742548 /nfs/dbraw/zinc/74/25/48/475742548.db2.gz LJERLYYGQRJMSA-UHFFFAOYSA-N 0 3 346.225 2.738 20 5 EFBDHN CC(C)N1CCN(C2CCN(c3ccccc3[N+](=O)[O-])CC2)CC1 ZINC000361798229 475763173 /nfs/dbraw/zinc/76/31/73/475763173.db2.gz MJEPQVQCEOZLPS-UHFFFAOYSA-N 0 3 332.448 2.590 20 5 EFBDHN Cc1c(CNC(=O)NC[C@H](C)N2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000358557177 475769323 /nfs/dbraw/zinc/76/93/23/475769323.db2.gz KEBUEKSPXWFUIF-KGLIPLIRSA-N 0 3 348.447 2.823 20 5 EFBDHN C[C@H](NC(=O)N1CCN(C2CC2)C[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000297472578 475771490 /nfs/dbraw/zinc/77/14/90/475771490.db2.gz UVXKMGNOFIOTAK-KGLIPLIRSA-N 0 3 346.431 2.782 20 5 EFBDHN Cc1c(CNC(=O)NC[C@@H](C)N2CCC(C)CC2)cccc1[N+](=O)[O-] ZINC000358586865 475790401 /nfs/dbraw/zinc/79/04/01/475790401.db2.gz HJNKSJAYHYVOTC-CQSZACIVSA-N 0 3 348.447 2.823 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000340167355 475817986 /nfs/dbraw/zinc/81/79/86/475817986.db2.gz WSVSTBWCBNPGCT-CQSZACIVSA-N 0 3 333.432 2.863 20 5 EFBDHN COCC[C@@H](NCC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C(C)(C)C ZINC000338362865 475828048 /nfs/dbraw/zinc/82/80/48/475828048.db2.gz PUSDFYBACXJXOP-MRXNPFEDSA-N 0 3 349.431 2.525 20 5 EFBDHN CCN(Cc1ccc(CN(C)C)cc1)C(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000340177613 475828176 /nfs/dbraw/zinc/82/81/76/475828176.db2.gz AJPKJXGKBOEIDF-UHFFFAOYSA-N 0 3 330.388 2.647 20 5 EFBDHN Cc1nc(N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000297667677 475849767 /nfs/dbraw/zinc/84/97/67/475849767.db2.gz ZQIHCOJZHOACJH-IUODEOHRSA-N 0 3 327.388 2.768 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)[C@H](CN)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000358813941 475960993 /nfs/dbraw/zinc/96/09/93/475960993.db2.gz OFLCNRTYNVPQMA-MLGOLLRUSA-N 0 3 345.374 2.962 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@@H]2CCN(CCCC3CCOCC3)C2)nc1 ZINC000346941279 475977238 /nfs/dbraw/zinc/97/72/38/475977238.db2.gz RMKZJOYXLDSSED-OAHLLOKOSA-N 0 3 334.420 2.683 20 5 EFBDHN Cc1nn(C)c(N[C@H]2CCN([C@@H](C)c3ccccc3)C2)c1[N+](=O)[O-] ZINC000358881198 476009047 /nfs/dbraw/zinc/00/90/47/476009047.db2.gz NJCQUGLZUCGIAV-ZFWWWQNUSA-N 0 3 329.404 2.884 20 5 EFBDHN COc1ccc(CN[C@@H]2CCO[C@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000343399378 476025983 /nfs/dbraw/zinc/02/59/83/476025983.db2.gz VELRRAVSHXZSTF-PBHICJAKSA-N 0 3 329.356 2.618 20 5 EFBDHN CCCCN(C)CCN[C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000353518599 476041210 /nfs/dbraw/zinc/04/12/10/476041210.db2.gz LTRHOJUPUUUGNC-KRWDZBQOSA-N 0 3 345.447 2.739 20 5 EFBDHN CN(C)CCN(Cc1ccc(F)c(F)c1)c1ccc([N+](=O)[O-])cn1 ZINC000347051235 476063684 /nfs/dbraw/zinc/06/36/84/476063684.db2.gz IQRKQKBUFDTASQ-UHFFFAOYSA-N 0 3 336.342 2.836 20 5 EFBDHN Cc1ccc(C(C)(C)NC[C@H](O)COc2ccccc2[N+](=O)[O-])cn1 ZINC000353565297 476084169 /nfs/dbraw/zinc/08/41/69/476084169.db2.gz BDOIFPOERRQHGQ-HNNXBMFYSA-N 0 3 345.399 2.563 20 5 EFBDHN Cc1ccc(C(C)(C)NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cn1 ZINC000353565298 476084269 /nfs/dbraw/zinc/08/42/69/476084269.db2.gz BDOIFPOERRQHGQ-OAHLLOKOSA-N 0 3 345.399 2.563 20 5 EFBDHN C[C@H](CN1CCC[C@H](C)C1)NC(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000334043568 476097104 /nfs/dbraw/zinc/09/71/04/476097104.db2.gz JNLJIXJZEIRUTC-NWDGAFQWSA-N 0 3 338.383 2.976 20 5 EFBDHN COc1c(C(=O)N[C@@H](C)CN2C[C@H](C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000334065087 476103230 /nfs/dbraw/zinc/10/32/30/476103230.db2.gz SOCVJWNJVULUGZ-MJBXVCDLSA-N 0 3 349.431 2.700 20 5 EFBDHN CCc1nn(C)c(N[C@@H](C)CN(C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000336695546 476125367 /nfs/dbraw/zinc/12/53/67/476125367.db2.gz IJBFLVFNLIUQHP-ZDUSSCGKSA-N 0 3 331.420 2.823 20 5 EFBDHN CN(C)c1cccnc1CN[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000353633053 476140651 /nfs/dbraw/zinc/14/06/51/476140651.db2.gz VRXOPMJQQRLXPI-XJKSGUPXSA-N 0 3 344.419 2.526 20 5 EFBDHN Cc1ccc(NC(=O)CCN[C@H](C)c2ccccc2[N+](=O)[O-])nc1 ZINC000343969946 476141572 /nfs/dbraw/zinc/14/15/72/476141572.db2.gz CVROEGGURLEHKE-CYBMUJFWSA-N 0 3 328.372 2.978 20 5 EFBDHN Cc1ccc(CN(CCN(C)C)C(=O)c2cc(F)cc([N+](=O)[O-])c2)o1 ZINC000344261521 476196914 /nfs/dbraw/zinc/19/69/14/476196914.db2.gz MZTBUUSJTQNYON-UHFFFAOYSA-N 0 3 349.362 2.839 20 5 EFBDHN CN1CC=C(CNc2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)CC1 ZINC000362365985 476198190 /nfs/dbraw/zinc/19/81/90/476198190.db2.gz REANJDQZDRHSSP-UHFFFAOYSA-N 0 3 342.374 2.892 20 5 EFBDHN CN(C)CCN(Cc1ccccc1)C(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000344273673 476206666 /nfs/dbraw/zinc/20/66/66/476206666.db2.gz LUDVYGAIKJRKQS-UHFFFAOYSA-N 0 3 345.374 2.938 20 5 EFBDHN C[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)CCN1C ZINC000340697211 476213566 /nfs/dbraw/zinc/21/35/66/476213566.db2.gz QBWREZPIOLSPDC-ZJUUUORDSA-N 0 3 345.321 2.826 20 5 EFBDHN O=[N+]([O-])c1ccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1 ZINC000359482135 476239165 /nfs/dbraw/zinc/23/91/65/476239165.db2.gz OYSFZPPCGOLJAN-SFHVURJKSA-N 0 3 327.384 2.644 20 5 EFBDHN C[C@H](CNC(=O)Nc1cc(F)cc([N+](=O)[O-])c1)N1CCC[C@H](C)C1 ZINC000347297916 476240580 /nfs/dbraw/zinc/24/05/80/476240580.db2.gz IDJCJRIANXJUGB-NWDGAFQWSA-N 0 3 338.383 2.976 20 5 EFBDHN O=[N+]([O-])c1cccc(CN[C@H](Cc2ccccc2)[C@@H](O)C(F)F)c1 ZINC000344316956 476245659 /nfs/dbraw/zinc/24/56/59/476245659.db2.gz KQKBRVMIGVVVEY-HZPDHXFCSA-N 0 3 336.338 2.922 20 5 EFBDHN C[C@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1F)N1CCC[C@H](C)C1 ZINC000357342775 476339143 /nfs/dbraw/zinc/33/91/43/476339143.db2.gz NCIXAJRZPFBZHD-QWHCGFSZSA-N 0 3 337.395 2.513 20 5 EFBDHN CCCCN(C)CCNC(=O)c1cccc(SC)c1[N+](=O)[O-] ZINC000362753851 476388452 /nfs/dbraw/zinc/38/84/52/476388452.db2.gz VKCFLTIYMRUZFC-UHFFFAOYSA-N 0 3 325.434 2.778 20 5 EFBDHN COc1ccc(-c2ccc(CN3CC[C@](C)(O)C3)o2)c([N+](=O)[O-])c1 ZINC000354045077 476388563 /nfs/dbraw/zinc/38/85/63/476388563.db2.gz PMXNQAGQDFBSQB-KRWDZBQOSA-N 0 3 332.356 2.820 20 5 EFBDHN CSc1ccc(C(=O)Nc2cnc3c(c2)CNCC3)cc1[N+](=O)[O-] ZINC000360833413 476416503 /nfs/dbraw/zinc/41/65/03/476416503.db2.gz XZTAQBRWCNCENG-UHFFFAOYSA-N 0 3 344.396 2.610 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CN(C2CC2)C[C@@H]1C ZINC000360944813 476492668 /nfs/dbraw/zinc/49/26/68/476492668.db2.gz PCMNZAKZDNOYCW-JOQOYGCGSA-N 0 3 345.443 2.762 20 5 EFBDHN O=C1O[C@@H](CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)CC12CC2 ZINC000369736086 476500199 /nfs/dbraw/zinc/50/01/99/476500199.db2.gz MHQJOCIKKQRFQI-MRXNPFEDSA-N 0 3 346.383 2.534 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCN(CCCO)Cc2ccccc2)cc1 ZINC000362957343 476502557 /nfs/dbraw/zinc/50/25/57/476502557.db2.gz HWESAXRABOGJDB-UHFFFAOYSA-N 0 3 330.384 2.858 20 5 EFBDHN Cc1noc(C2(C)CCN(CCOc3cccc([N+](=O)[O-])c3)CC2)n1 ZINC000374755823 476516476 /nfs/dbraw/zinc/51/64/76/476516476.db2.gz UKOQNTMCPPCYDF-UHFFFAOYSA-N 0 3 346.387 2.719 20 5 EFBDHN C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000354288001 476562347 /nfs/dbraw/zinc/56/23/47/476562347.db2.gz ASUJCSHGUDHYNU-LSDHHAIUSA-N 0 3 345.443 2.958 20 5 EFBDHN O=[N+]([O-])c1ccc(CNc2cccc(CN3CC[C@H](O)C3)c2)cc1 ZINC000361053936 476569557 /nfs/dbraw/zinc/56/95/57/476569557.db2.gz SIMYOAZZWXIWKH-SFHVURJKSA-N 0 3 327.384 2.774 20 5 EFBDHN O=[N+]([O-])c1ccccc1CN1CCC(CCN2CCOCC2)CC1 ZINC000363141771 476577439 /nfs/dbraw/zinc/57/74/39/476577439.db2.gz BAMUUAONDUBWDF-UHFFFAOYSA-N 0 3 333.432 2.529 20 5 EFBDHN C[C@@H](NCCCn1c2cc([N+](=O)[O-])ccc2oc1=O)c1cccnc1 ZINC000361089937 476594308 /nfs/dbraw/zinc/59/43/08/476594308.db2.gz ZBMQEHPYHNQYEJ-GFCCVEGCSA-N 0 3 342.355 2.639 20 5 EFBDHN CCCN(CC)C[C@H](C)Nc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000357777022 476595884 /nfs/dbraw/zinc/59/58/84/476595884.db2.gz XVNZZOMCNGMQCZ-LBPRGKRZSA-N 0 3 343.449 2.531 20 5 EFBDHN CNc1c(C(=O)NC[C@H](C)N2CCCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000361144940 476633829 /nfs/dbraw/zinc/63/38/29/476633829.db2.gz MJLBFHSCHVJBPX-STQMWFEESA-N 0 3 334.420 2.629 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CCC[C@@H](C[C@@H]3CCOC3)C2)c1 ZINC000375010966 476634776 /nfs/dbraw/zinc/63/47/76/476634776.db2.gz DDMPQMMGRIHSJY-RLFYNMQTSA-N 0 3 334.416 2.767 20 5 EFBDHN Cn1ccnc1[C@@H]1CCCN(CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000365622366 476651707 /nfs/dbraw/zinc/65/17/07/476651707.db2.gz FKGKTHVSOJBASP-OAHLLOKOSA-N 0 3 344.415 2.977 20 5 EFBDHN C[C@H](N[C@H]1CCCN(c2ccnn2C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000365736738 476683081 /nfs/dbraw/zinc/68/30/81/476683081.db2.gz UPPHLHLHTCAKDV-ZFWWWQNUSA-N 0 3 329.404 2.648 20 5 EFBDHN Cc1cc([N+](=O)[O-])cc(C(=O)N2CCCC23CCN(C)CC3)c1F ZINC000375154749 476691537 /nfs/dbraw/zinc/69/15/37/476691537.db2.gz XNZXNIMCINCCTN-UHFFFAOYSA-N 0 3 335.379 2.743 20 5 EFBDHN CC(C)(C(=O)NC1CCN(C2CC2)CC1)c1ccccc1[N+](=O)[O-] ZINC000429830125 476699005 /nfs/dbraw/zinc/69/90/05/476699005.db2.gz WLXJPROFJWXCPV-UHFFFAOYSA-N 0 3 331.416 2.615 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@H](N)c1ccccc1 ZINC000422807775 476786629 /nfs/dbraw/zinc/78/66/29/476786629.db2.gz PMVYLRJZIKEUCZ-HNNXBMFYSA-N 0 3 327.384 2.950 20 5 EFBDHN CCO[C@@H]1CCCC[C@H]1N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000452038806 476787915 /nfs/dbraw/zinc/78/79/15/476787915.db2.gz YLMFXBWKDGKXCI-APHBMKBZSA-N 0 3 335.404 2.859 20 5 EFBDHN CCO[C@@H]1CCCC[C@H]1N[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000452038839 476788565 /nfs/dbraw/zinc/78/85/65/476788565.db2.gz YTTOYTGKFXFFLG-XNRPHZJLSA-N 0 3 335.404 2.859 20 5 EFBDHN Cc1n[nH]cc1C1CCN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000375387586 476809437 /nfs/dbraw/zinc/80/94/37/476809437.db2.gz OHAVOGZZYCNAGB-QGZVFWFLSA-N 0 3 330.388 2.539 20 5 EFBDHN Cc1ccccc1OC[C@@H](O)CNCc1cccc([N+](=O)[O-])c1C ZINC000392540877 476825451 /nfs/dbraw/zinc/82/54/51/476825451.db2.gz TZHXCNKLIPVROD-INIZCTEOSA-N 0 3 330.384 2.741 20 5 EFBDHN CC(C)(CN1CCCC1)NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000457038749 476841850 /nfs/dbraw/zinc/84/18/50/476841850.db2.gz DASKIOGYMGNYPS-UHFFFAOYSA-N 0 3 331.372 2.945 20 5 EFBDHN COc1ccc(C[C@@H](C)NCc2cc([N+](=O)[O-])ccc2OC)cn1 ZINC000414063196 476859498 /nfs/dbraw/zinc/85/94/98/476859498.db2.gz CNBSYONCNVPYOM-GFCCVEGCSA-N 0 3 331.372 2.728 20 5 EFBDHN CC1(C)CCCN1CCNC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000457074034 476860665 /nfs/dbraw/zinc/86/06/65/476860665.db2.gz KRYRRRXUUXAMER-UHFFFAOYSA-N 0 3 325.796 2.852 20 5 EFBDHN CC(C)N1CC[C@H](N(C)C(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000457080900 476863485 /nfs/dbraw/zinc/86/34/85/476863485.db2.gz CPWVNQOJUHNGKJ-NSHDSACASA-N 0 3 325.796 2.803 20 5 EFBDHN COc1ccc(C[C@H](C)NCc2ccc(OC)c([N+](=O)[O-])c2)cn1 ZINC000414079610 476868266 /nfs/dbraw/zinc/86/82/66/476868266.db2.gz SCSVLKVYJXPIJR-LBPRGKRZSA-N 0 3 331.372 2.728 20 5 EFBDHN CC(C)N1CC[C@@H](N(C)C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000457089287 476869361 /nfs/dbraw/zinc/86/93/61/476869361.db2.gz SYHJFAHHJRGNNH-OAHLLOKOSA-N 0 3 346.431 2.724 20 5 EFBDHN CC(C)N1CC[C@H](N(C)C(=O)CSc2ccccc2[N+](=O)[O-])C1 ZINC000457091507 476869726 /nfs/dbraw/zinc/86/97/26/476869726.db2.gz WEWHOPCMDBETLU-ZDUSSCGKSA-N 0 3 337.445 2.628 20 5 EFBDHN CC(C)N1CC[C@@H](N(C)C(=O)CSc2ccccc2[N+](=O)[O-])C1 ZINC000457091505 476869889 /nfs/dbraw/zinc/86/98/89/476869889.db2.gz WEWHOPCMDBETLU-CYBMUJFWSA-N 0 3 337.445 2.628 20 5 EFBDHN CC(C)N1CC[C@H](N(C)C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C1 ZINC000457125266 476889073 /nfs/dbraw/zinc/88/90/73/476889073.db2.gz QJVFFEDHZRHXDJ-ZDUSSCGKSA-N 0 3 330.388 2.631 20 5 EFBDHN CCOc1cc(CN2CC[C@H](Cc3cnn(C)c3)C2)ccc1[N+](=O)[O-] ZINC000370623191 476900772 /nfs/dbraw/zinc/90/07/72/476900772.db2.gz WFBFMCPEDRLBPP-OAHLLOKOSA-N 0 3 344.415 2.792 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@@H]1NCCc2ccccc21 ZINC000414960619 476903591 /nfs/dbraw/zinc/90/35/91/476903591.db2.gz UEPCGHXIDUICNE-SFHVURJKSA-N 0 3 341.411 2.970 20 5 EFBDHN CC(C)(C(=O)NCCc1ccc([N+](=O)[O-])cc1)[C@@H](N)c1ccccc1 ZINC000423059740 476909404 /nfs/dbraw/zinc/90/94/04/476909404.db2.gz MWYIHSZIYMFGEW-KRWDZBQOSA-N 0 3 341.411 2.980 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@H]1NCCc2ccccc21 ZINC000415508731 476933527 /nfs/dbraw/zinc/93/35/27/476933527.db2.gz VOISKZBRHLYUOQ-QGZVFWFLSA-N 0 3 340.383 2.912 20 5 EFBDHN Cc1c(CN2CC[C@@H](N3CCN(C(C)C)CC3)C2)cccc1[N+](=O)[O-] ZINC000375906808 477074412 /nfs/dbraw/zinc/07/44/12/477074412.db2.gz QEKZPYVYMBAIJG-GOSISDBHSA-N 0 3 346.475 2.504 20 5 EFBDHN C[C@@H]1NCCN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])[C@H]1C ZINC000423614955 477087116 /nfs/dbraw/zinc/08/71/16/477087116.db2.gz QRJBSRXIOBWRAZ-UWVGGRQHSA-N 0 3 343.836 2.549 20 5 EFBDHN O=C(C1CN(C2CCCCC2)C1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000457596920 477101943 /nfs/dbraw/zinc/10/19/43/477101943.db2.gz QXYSCPFDBZRSRD-UHFFFAOYSA-N 0 3 329.400 2.748 20 5 EFBDHN O=C(N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)C12CCCN1CCC2 ZINC000452855766 477109414 /nfs/dbraw/zinc/10/94/14/477109414.db2.gz PPOKXJUOVKWUAI-INIZCTEOSA-N 0 3 343.427 2.929 20 5 EFBDHN CN(C)C1(CNC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000416308878 477118816 /nfs/dbraw/zinc/11/88/16/477118816.db2.gz SEQODFWNIIVDRG-UHFFFAOYSA-N 0 3 343.836 2.551 20 5 EFBDHN CN1CCN(CCNc2ccnc3c2cccc3[N+](=O)[O-])CC1(C)C ZINC000432146505 477167838 /nfs/dbraw/zinc/16/78/38/477167838.db2.gz BWNFDBJEYHQULT-UHFFFAOYSA-N 0 3 343.431 2.581 20 5 EFBDHN CC(C)N1CC[C@H](N(C)C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000457843628 477227262 /nfs/dbraw/zinc/22/72/62/477227262.db2.gz BKJRACINQLKBJE-CJNGLKHVSA-N 0 3 334.420 2.780 20 5 EFBDHN CCc1ccccc1[C@H](N)CNC(=O)c1cc(C)ccc1[N+](=O)[O-] ZINC000423986082 477247183 /nfs/dbraw/zinc/24/71/83/477247183.db2.gz VOXXCRNLDNXDGU-MRXNPFEDSA-N 0 3 327.384 2.895 20 5 EFBDHN C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411604457 477290742 /nfs/dbraw/zinc/29/07/42/477290742.db2.gz NWEDQAKBLCGCNU-IDCJVQTKSA-N 0 3 345.443 2.935 20 5 EFBDHN CN(CCNC(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)C1CC1 ZINC000454644149 477308601 /nfs/dbraw/zinc/30/86/01/477308601.db2.gz OBTULCWJHPCKGL-HNNXBMFYSA-N 0 3 346.431 2.578 20 5 EFBDHN C[C@H](CN1CCN(C)CC1)N[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433169410 477314138 /nfs/dbraw/zinc/31/41/38/477314138.db2.gz RGUOYJQHLGLRJV-RDTXWAMCSA-N 0 3 346.475 2.543 20 5 EFBDHN CC1(C)C[C@@H](NC[C@@H]2CN(C3CC3)CCO2)c2cc([N+](=O)[O-])ccc21 ZINC000433228539 477318664 /nfs/dbraw/zinc/31/86/64/477318664.db2.gz BBIIYXMHAZECQQ-CRAIPNDOSA-N 0 3 345.443 2.770 20 5 EFBDHN C[C@H]1[C@@H](N2CCCC2)CCN1C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000376446138 477338714 /nfs/dbraw/zinc/33/87/14/477338714.db2.gz FJBUQZRCDIVYKY-NHYWBVRUSA-N 0 3 337.807 2.947 20 5 EFBDHN CN(Cc1ccccc1)[C@H]1CCN(c2cc(N)ccc2[N+](=O)[O-])C1 ZINC000367174363 477376826 /nfs/dbraw/zinc/37/68/26/477376826.db2.gz UWPOQBREKBHULE-INIZCTEOSA-N 0 3 326.400 2.888 20 5 EFBDHN C[C@H](CNC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12)N(C)C ZINC000436107345 477422153 /nfs/dbraw/zinc/42/21/53/477422153.db2.gz HLPHVQJSCRNJSU-LLVKDONJSA-N 0 3 341.386 2.500 20 5 EFBDHN CC(C)N1CC[C@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000412407992 477422740 /nfs/dbraw/zinc/42/27/40/477422740.db2.gz GMZAZEIMWHHNML-YESZJQIVSA-N 0 3 331.416 2.639 20 5 EFBDHN C[C@@H](CNCc1ccc([N+](=O)[O-])cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000449218345 477493121 /nfs/dbraw/zinc/49/31/21/477493121.db2.gz HNBOWIPXSQIDHR-ZDUSSCGKSA-N 0 3 348.424 2.892 20 5 EFBDHN O=[N+]([O-])c1ccc(S(=O)(=O)CCN[C@@H]2CCCC23CCC3)cc1 ZINC000449236821 477500061 /nfs/dbraw/zinc/50/00/61/477500061.db2.gz LWXJAJLNRIXYQE-OAHLLOKOSA-N 0 3 338.429 2.681 20 5 EFBDHN CN(C[C@@H]1CCCN(C)C1)c1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC000413132618 477536855 /nfs/dbraw/zinc/53/68/55/477536855.db2.gz BVQPSRKMHZGOAC-SNVBAGLBSA-N 0 3 332.326 2.787 20 5 EFBDHN CS[C@H]1CN(c2nccc3ccc([N+](=O)[O-])cc32)C[C@@H]1N(C)C ZINC000413204816 477568535 /nfs/dbraw/zinc/56/85/35/477568535.db2.gz JMSWARIGVRQNKP-GJZGRUSLSA-N 0 3 332.429 2.625 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1CCN(C2CC2)C[C@@H](C)C1 ZINC000450549841 477628850 /nfs/dbraw/zinc/62/88/50/477628850.db2.gz WHHJQCUTMVKLGR-GFCCVEGCSA-N 0 3 347.415 2.610 20 5 EFBDHN CC(C)N1CC[C@H](N(C)C(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000458893652 477644850 /nfs/dbraw/zinc/64/48/50/477644850.db2.gz WRIMQEHROHLZRJ-BBRMVZONSA-N 0 3 334.420 2.780 20 5 EFBDHN NC(=O)C[C@H]1CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000367711087 477650706 /nfs/dbraw/zinc/65/07/06/477650706.db2.gz XNTRYTPNZKHBQN-GFCCVEGCSA-N 0 3 329.356 2.552 20 5 EFBDHN CN1CC[C@H]2[C@@H](CCCN2C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000413621533 477754574 /nfs/dbraw/zinc/75/45/74/477754574.db2.gz CNQWRHZPJLWQAG-OWLYRPNTSA-N 0 3 343.427 2.641 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCN1CCNC[C@@H]1c1ccccc1 ZINC000420422346 477756834 /nfs/dbraw/zinc/75/68/34/477756834.db2.gz ZHGYAJYMPMNWFD-QGZVFWFLSA-N 0 3 327.384 2.620 20 5 EFBDHN CN1CC[C@@H]2[C@@H](CCCN2c2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000428177774 477833965 /nfs/dbraw/zinc/83/39/65/477833965.db2.gz RJMIOQYFTHAKNK-DZGCQCFKSA-N 0 3 343.387 2.565 20 5 EFBDHN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)C[C@@H]1CCCN1C ZINC000421001727 477891226 /nfs/dbraw/zinc/89/12/26/477891226.db2.gz LTMJRXZUTSGXLM-WFASDCNBSA-N 0 3 345.403 2.732 20 5 EFBDHN C/C(=C/c1ccccc1)CN(C)CCn1cc([N+](=O)[O-])ccc1=O ZINC000494291472 477961817 /nfs/dbraw/zinc/96/18/17/477961817.db2.gz WTZPEGFWXONHDV-QINSGFPZSA-N 0 3 327.384 2.792 20 5 EFBDHN C[C@@H]1CC[C@H](C)N1CC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000428730927 477970465 /nfs/dbraw/zinc/97/04/65/477970465.db2.gz QILQJYHIJLGMMH-OKILXGFUSA-N 0 3 331.416 2.959 20 5 EFBDHN CO[C@@H]1C[C@@H](N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1(C)C ZINC000439510608 477994413 /nfs/dbraw/zinc/99/44/13/477994413.db2.gz GZKIURKRTJNTKG-KCPJHIHWSA-N 0 3 335.404 2.633 20 5 EFBDHN C[C@H](N[C@@H]1[C@@H]2CCCO[C@H]2C1(C)C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000439617448 478009295 /nfs/dbraw/zinc/00/92/95/478009295.db2.gz YORLJMPAICDLOE-YXAMBPQSSA-N 0 3 347.415 2.715 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CNC[C@H](O)[C@@H](C)c1ccccc1 ZINC000516921935 478012673 /nfs/dbraw/zinc/01/26/73/478012673.db2.gz XTTWTWPLTGORTC-GUYCJALGSA-N 0 3 330.384 2.858 20 5 EFBDHN NC(=O)CC1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000459619632 478013951 /nfs/dbraw/zinc/01/39/51/478013951.db2.gz GDBCCUFYVXANMM-UHFFFAOYSA-N 0 3 331.397 2.631 20 5 EFBDHN C[C@@H]1CCN(CCNC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000560097537 478018988 /nfs/dbraw/zinc/01/89/88/478018988.db2.gz WCGVJNXFNDAEII-SNVBAGLBSA-N 0 3 345.321 2.685 20 5 EFBDHN CC(C)OC1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000533017146 478023766 /nfs/dbraw/zinc/02/37/66/478023766.db2.gz GVXINOHJOQQTRS-UHFFFAOYSA-N 0 3 335.404 2.813 20 5 EFBDHN O=C(CN[C@H]1CCC12CCCC2)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000451457836 478027729 /nfs/dbraw/zinc/02/77/29/478027729.db2.gz NTOXNBCYALUGEQ-INIZCTEOSA-N 0 3 329.400 2.796 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000487517537 478040945 /nfs/dbraw/zinc/04/09/45/478040945.db2.gz OOEHUBYMGFLYJZ-CZUORRHYSA-N 0 3 342.399 2.563 20 5 EFBDHN CCO[C@@H]1C[C@@H](N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C12CCC2 ZINC000451480794 478041542 /nfs/dbraw/zinc/04/15/42/478041542.db2.gz QBXGOWBIEZCPHQ-DAXOMENPSA-N 0 3 347.415 2.859 20 5 EFBDHN CCO[C@@H]1C[C@H](N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C12CCC2 ZINC000451480795 478041964 /nfs/dbraw/zinc/04/19/64/478041964.db2.gz QBXGOWBIEZCPHQ-UHOFOFEASA-N 0 3 347.415 2.859 20 5 EFBDHN O=C(NCCNc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCN1C1CCCC1 ZINC000439897632 478045280 /nfs/dbraw/zinc/04/52/80/478045280.db2.gz HYKMMYPOHQUHDO-KRWDZBQOSA-N 0 3 346.431 2.530 20 5 EFBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CNC1(CO)CCSCC1 ZINC000459700790 478045941 /nfs/dbraw/zinc/04/59/41/478045941.db2.gz BHKSMGIOASYECN-UHFFFAOYSA-N 0 3 340.445 2.730 20 5 EFBDHN CO[C@@]1(C)C[C@@H](NCC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1(C)C ZINC000451499874 478054338 /nfs/dbraw/zinc/05/43/38/478054338.db2.gz XPGBQGVKGKPOGM-DYVFJYSZSA-N 0 3 335.404 2.635 20 5 EFBDHN COc1ccc([C@H](CO)CNCc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000459749336 478072509 /nfs/dbraw/zinc/07/25/09/478072509.db2.gz MGTUSUGHBFJYIR-INIZCTEOSA-N 0 3 330.384 2.778 20 5 EFBDHN CO[C@@H]1COC[C@@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000459756204 478075346 /nfs/dbraw/zinc/07/53/46/478075346.db2.gz NHQVCHQEXMVGQP-LSDHHAIUSA-N 0 3 334.397 2.827 20 5 EFBDHN CC1CCN(CCNC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])CC1 ZINC000487831760 478077054 /nfs/dbraw/zinc/07/70/54/478077054.db2.gz GZJRXHDMXMPUOS-UHFFFAOYSA-N 0 3 348.447 2.861 20 5 EFBDHN COCCN(CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@@H]1CCC[C@@H]1C ZINC000487959922 478090766 /nfs/dbraw/zinc/09/07/66/478090766.db2.gz SKKAUVDBHZLVDC-WMLDXEAASA-N 0 3 349.431 2.979 20 5 EFBDHN CNc1ccc(C(=O)NC[C@@H]2CCCCN2CC(C)C)cc1[N+](=O)[O-] ZINC000533506525 478090819 /nfs/dbraw/zinc/09/08/19/478090819.db2.gz OYVIKKFEELCJLS-HNNXBMFYSA-N 0 3 348.447 2.877 20 5 EFBDHN COCCN(CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@H]1CCC[C@H]1C ZINC000487959920 478092072 /nfs/dbraw/zinc/09/20/72/478092072.db2.gz SKKAUVDBHZLVDC-PBHICJAKSA-N 0 3 349.431 2.979 20 5 EFBDHN COCCN(CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[C@@H]1C ZINC000488001429 478104306 /nfs/dbraw/zinc/10/43/06/478104306.db2.gz JRNMJACNHQHPHS-WMLDXEAASA-N 0 3 349.431 2.695 20 5 EFBDHN COCCN(CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@H]1CCC[C@@H]1C ZINC000488039854 478110326 /nfs/dbraw/zinc/11/03/26/478110326.db2.gz CZSKESKSKIFBCU-GUYCJALGSA-N 0 3 349.431 2.979 20 5 EFBDHN COC(=O)[C@H]1CCN(Cc2cc([N+](=O)[O-])ccc2OC)[C@H]1C(C)C ZINC000429384509 478125512 /nfs/dbraw/zinc/12/55/12/478125512.db2.gz WDRURYIFLZFTHC-HOCLYGCPSA-N 0 3 336.388 2.623 20 5 EFBDHN CC(C)Oc1nc(N2CCN(C3CCCC3)CC2)ccc1[N+](=O)[O-] ZINC000517962094 478136262 /nfs/dbraw/zinc/13/62/62/478136262.db2.gz QZUWAGLOISMIOG-UHFFFAOYSA-N 0 3 334.420 2.842 20 5 EFBDHN CC(=O)c1ccc([N+](=O)[O-])cc1N1CCN([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000488722698 478175334 /nfs/dbraw/zinc/17/53/34/478175334.db2.gz VOWFNEJGBVSKMJ-GDZNZVCISA-N 0 3 331.416 2.964 20 5 EFBDHN COc1cc(N2CCN([C@@H]3C[C@@H]3C)C[C@H](C)C2)c([N+](=O)[O-])cc1F ZINC000488743370 478177581 /nfs/dbraw/zinc/17/75/81/478177581.db2.gz HUHQMEQVRZVODN-SGMGOOAPSA-N 0 3 337.395 2.909 20 5 EFBDHN CC[C@@H]1CN(CC)CCN1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000451733541 478182991 /nfs/dbraw/zinc/18/29/91/478182991.db2.gz VIGBOMIXBGOEBA-OAHLLOKOSA-N 0 3 348.447 2.648 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])CCN1C ZINC000489401654 478241124 /nfs/dbraw/zinc/24/11/24/478241124.db2.gz LKMPWSBHVQFQPV-QWHCGFSZSA-N 0 3 334.420 2.612 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N[C@H]2CCN(C)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000489624033 478261923 /nfs/dbraw/zinc/26/19/23/478261923.db2.gz HXILKZPLAINFTN-IPYPFGDCSA-N 0 3 334.420 2.746 20 5 EFBDHN COc1cc(CN[C@H]2C[C@H](OC)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000600214154 478290067 /nfs/dbraw/zinc/29/00/67/478290067.db2.gz LOFYPXMYEXOVCA-XYPYZODXSA-N 0 3 346.330 2.514 20 5 EFBDHN COCCN1CCC[C@@H](Nc2nccc3c2cccc3[N+](=O)[O-])C1 ZINC000590689611 478292037 /nfs/dbraw/zinc/29/20/37/478292037.db2.gz AAIAWJZQNGEXPN-CYBMUJFWSA-N 0 3 330.388 2.666 20 5 EFBDHN CC(C)Oc1nc(N2CC[C@]3(C2)CCCN(C)C3)ccc1[N+](=O)[O-] ZINC000579614247 478343441 /nfs/dbraw/zinc/34/34/41/478343441.db2.gz WSBPZVHOOJARLJ-QGZVFWFLSA-N 0 3 334.420 2.699 20 5 EFBDHN O=C(N[C@@H]1CCCN2CCCC[C@H]12)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000594418186 478373929 /nfs/dbraw/zinc/37/39/29/478373929.db2.gz GYTGNPZFPRRPMX-ZIAGYGMSSA-N 0 3 337.807 2.995 20 5 EFBDHN O=C(N[C@H]1CCCN2CCCC[C@H]12)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000594418877 478375433 /nfs/dbraw/zinc/37/54/33/478375433.db2.gz NOIQGYXGYBBVQX-DZGCQCFKSA-N 0 3 342.399 2.823 20 5 EFBDHN CC(C)Oc1ccccc1[C@H](C)NCCn1cc([N+](=O)[O-])ccc1=O ZINC000539225408 478406870 /nfs/dbraw/zinc/40/68/70/478406870.db2.gz LWYARDKZQQIDAZ-AWEZNQCLSA-N 0 3 345.399 2.895 20 5 EFBDHN CCCC1(CNCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000581662497 478413038 /nfs/dbraw/zinc/41/30/38/478413038.db2.gz LTGHIRUCTWQHLA-UHFFFAOYSA-N 0 3 326.418 2.538 20 5 EFBDHN O=C(Nc1ccc([N+](=O)[O-])cc1F)N[C@@H]1CCCN2CCCC[C@H]12 ZINC000594524856 478426272 /nfs/dbraw/zinc/42/62/72/478426272.db2.gz MCWHJAIWOFKHIK-HUUCEWRRSA-N 0 3 336.367 2.872 20 5 EFBDHN O=C1[C@H](NCCc2ccc([N+](=O)[O-])cc2)CCN1C1CCCCC1 ZINC000600591887 478431051 /nfs/dbraw/zinc/43/10/51/478431051.db2.gz PPZUEQJBCIOVDR-QGZVFWFLSA-N 0 3 331.416 2.661 20 5 EFBDHN O=[N+]([O-])c1cccc2ncnc(N[C@@H]3CCCN4CCCC[C@H]34)c21 ZINC000594603323 478461991 /nfs/dbraw/zinc/46/19/91/478461991.db2.gz UCORFUDUILPVLA-TZMCWYRMSA-N 0 3 327.388 2.967 20 5 EFBDHN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCNC2(CCCCC2)C1 ZINC000594628778 478473430 /nfs/dbraw/zinc/47/34/30/478473430.db2.gz KDWCGRARLAEPOX-UHFFFAOYSA-N 0 3 337.807 2.997 20 5 EFBDHN CN(C)CCn1cc(Nc2ncc([N+](=O)[O-])cc2C(F)(F)F)cn1 ZINC000591143026 478473729 /nfs/dbraw/zinc/47/37/29/478473729.db2.gz GRCBBXFHUMCFSC-UHFFFAOYSA-N 0 3 344.297 2.510 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCNC2(CCCCC2)C1 ZINC000594629026 478473971 /nfs/dbraw/zinc/47/39/71/478473971.db2.gz WUMDDQYHOHKNMS-UHFFFAOYSA-N 0 3 331.416 2.960 20 5 EFBDHN O=C(CCNc1ccccc1[N+](=O)[O-])N1CCNC2(CCCCC2)C1 ZINC000594628767 478474197 /nfs/dbraw/zinc/47/41/97/478474197.db2.gz JAWSJVKINIVUFA-UHFFFAOYSA-N 0 3 346.431 2.532 20 5 EFBDHN CN(Cc1ccccc1)[C@@H]1CCN(c2ncc([N+](=O)[O-])cc2F)C1 ZINC000591148851 478475846 /nfs/dbraw/zinc/47/58/46/478475846.db2.gz FLWNRSIAPLIQJU-CQSZACIVSA-N 0 3 330.363 2.840 20 5 EFBDHN Cc1cc(C)cc(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])c1 ZINC000594716002 478508684 /nfs/dbraw/zinc/50/86/84/478508684.db2.gz GATNEXPUSXERAZ-MRXNPFEDSA-N 0 3 330.384 2.741 20 5 EFBDHN CN(CC(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)C1CCC1 ZINC000600827095 478536502 /nfs/dbraw/zinc/53/65/02/478536502.db2.gz SBMLZHUKECEDQN-HNNXBMFYSA-N 0 3 331.416 2.785 20 5 EFBDHN CN1CCC[C@@]2(CCN(c3ncc([N+](=O)[O-])cc3C(F)(F)F)C2)C1 ZINC000571174067 478536605 /nfs/dbraw/zinc/53/66/05/478536605.db2.gz ORDMJXMUCOKPJM-CQSZACIVSA-N 0 3 344.337 2.931 20 5 EFBDHN CC(COC(=O)C[C@H]1CCCC[C@@H]1NC(=O)OC(C)(C)C)[N+](=O)[O-] ZINC000496106636 478540987 /nfs/dbraw/zinc/54/09/87/478540987.db2.gz YFSWTCLKDIUAPQ-UPJWGTAASA-N 0 3 344.408 2.668 20 5 EFBDHN C[C@@H](C(=O)N[C@H]1CCN(C(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1F ZINC000597920375 478574446 /nfs/dbraw/zinc/57/44/46/478574446.db2.gz ASNIATBAQPTNDI-NEPJUHHUSA-N 0 3 337.395 2.826 20 5 EFBDHN C[C@H](C(=O)N[C@@H]1CCN(C(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1F ZINC000597920376 478574498 /nfs/dbraw/zinc/57/44/98/478574498.db2.gz ASNIATBAQPTNDI-NWDGAFQWSA-N 0 3 337.395 2.826 20 5 EFBDHN CC(C)(C)N1CC[C@H](NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000597920864 478575629 /nfs/dbraw/zinc/57/56/29/478575629.db2.gz BXOFDSROKZFMAS-AWEZNQCLSA-N 0 3 344.415 2.539 20 5 EFBDHN CC(C)Oc1cc(C(=O)N[C@H]2CCN(C(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000597920872 478575690 /nfs/dbraw/zinc/57/56/90/478575690.db2.gz CAPVJDFFAVZBKY-AWEZNQCLSA-N 0 3 349.431 2.985 20 5 EFBDHN CC(C)Oc1cc(C(=O)N[C@@H]2CCN(C(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000597920874 478576491 /nfs/dbraw/zinc/57/64/91/478576491.db2.gz CAPVJDFFAVZBKY-CQSZACIVSA-N 0 3 349.431 2.985 20 5 EFBDHN CC(C)(C)N1CC[C@H](NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000597925079 478579690 /nfs/dbraw/zinc/57/96/90/478579690.db2.gz NNWJKBTYVKLBME-AWEZNQCLSA-N 0 3 346.431 2.772 20 5 EFBDHN COc1ccc([C@H](CO)CN[C@H]2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000582370435 478583112 /nfs/dbraw/zinc/58/31/12/478583112.db2.gz PTICUFBMMRJHMA-KSSFIOAISA-N 0 3 342.395 2.956 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1Cn1cc(CNC2CCCCC2)nn1 ZINC000600974215 478591550 /nfs/dbraw/zinc/59/15/50/478591550.db2.gz WYRKKLBUDANYGI-UHFFFAOYSA-N 0 3 345.403 2.666 20 5 EFBDHN Cn1nc(C(F)(F)F)cc1CNCCc1cccc([N+](=O)[O-])c1 ZINC000594937643 478595603 /nfs/dbraw/zinc/59/56/03/478595603.db2.gz PCJHVDIUGPIITP-UHFFFAOYSA-N 0 3 328.294 2.679 20 5 EFBDHN C[C@H](O)[C@@H]1CCCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000541890332 478609102 /nfs/dbraw/zinc/60/91/02/478609102.db2.gz RCZZXPIKCKCHRN-DZGCQCFKSA-N 0 3 344.415 2.588 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CN[C@@H]1CCc2ccc(F)cc21 ZINC000571516011 478614812 /nfs/dbraw/zinc/61/48/12/478614812.db2.gz GVHUGURDMKAXIP-GDBMZVCRSA-N 0 3 346.358 2.751 20 5 EFBDHN C[C@]1(c2ccccc2)C[C@H]1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000591744332 478618588 /nfs/dbraw/zinc/61/85/88/478618588.db2.gz UFMLVEMMLUQWQF-BHIYHBOVSA-N 0 3 342.395 2.654 20 5 EFBDHN CO[C@@H](CNCc1cc2c(cc1[N+](=O)[O-])OCCO2)C1CCCC1 ZINC000594993002 478621290 /nfs/dbraw/zinc/62/12/90/478621290.db2.gz AXZXKBOOXBNPPB-KRWDZBQOSA-N 0 3 336.388 2.661 20 5 EFBDHN CC(C)(CNCc1ccc([N+](=O)[O-])cc1Cl)[C@@]1(O)CCCOC1 ZINC000594997500 478623562 /nfs/dbraw/zinc/62/35/62/478623562.db2.gz XMXYUUCJDMGGLI-MRXNPFEDSA-N 0 3 342.823 2.906 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCCCOC[C@@H]1CCCO1 ZINC000595003151 478625881 /nfs/dbraw/zinc/62/58/81/478625881.db2.gz FHEUHIIZXPMQOM-HIFRSBDPSA-N 0 3 338.404 2.840 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@H]1CCC[C@H](C(=O)N(C)C)C1 ZINC000595007343 478626899 /nfs/dbraw/zinc/62/68/99/478626899.db2.gz HJVOKZCCQRWFON-IHRRRGAJSA-N 0 3 349.431 2.901 20 5 EFBDHN CNC(=O)C1CCC(N[C@H](C)c2ccc([N+](=O)[O-])cc2OC)CC1 ZINC000595017382 478629956 /nfs/dbraw/zinc/62/99/56/478629956.db2.gz UOLBHDMXUQPJGT-PNESKVBLSA-N 0 3 335.404 2.559 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@]1(N(C)C)CCSC1 ZINC000595014272 478629980 /nfs/dbraw/zinc/62/99/80/478629980.db2.gz WAOHSQUNAOXOMQ-MLGOLLRUSA-N 0 3 339.461 2.691 20 5 EFBDHN CN(C(=O)/C=C/c1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CCN(C2CC2)C1 ZINC000491684099 478631582 /nfs/dbraw/zinc/63/15/82/478631582.db2.gz CQXAVMNBQWMIPC-UFZAZABTSA-N 0 3 349.818 2.957 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCCc1cn2c(n1)SCC2 ZINC000595034414 478636479 /nfs/dbraw/zinc/63/64/79/478636479.db2.gz XVMDSRDINHPBOS-LLVKDONJSA-N 0 3 348.428 2.799 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)N[C@H]1CCN(CC(F)F)C1 ZINC000595044146 478639228 /nfs/dbraw/zinc/63/92/28/478639228.db2.gz IXWGBIUHSPKMNQ-MNOVXSKESA-N 0 3 329.347 2.593 20 5 EFBDHN CCCN1C[C@H](CN[C@@H](C)c2ccc([N+](=O)[O-])cc2OC)CC1=O ZINC000595044437 478640545 /nfs/dbraw/zinc/64/05/45/478640545.db2.gz MSMUGMPMAHQNMO-STQMWFEESA-N 0 3 335.404 2.513 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@@H]1CC(=O)N(C(C)(C)C)C1 ZINC000595098585 478659023 /nfs/dbraw/zinc/65/90/23/478659023.db2.gz BZCBWMCCEMFRHZ-OLZOCXBDSA-N 0 3 349.431 2.901 20 5 EFBDHN CS[C@H]1CN(c2ccnc3ccc([N+](=O)[O-])cc32)C[C@H]1N(C)C ZINC000601134401 478678902 /nfs/dbraw/zinc/67/89/02/478678902.db2.gz BPAULNPHAVVQLV-CVEARBPZSA-N 0 3 332.429 2.625 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3COCC[C@H]3O)s2)cc1 ZINC000601159938 478698388 /nfs/dbraw/zinc/69/83/88/478698388.db2.gz QPUBNEOIHIGCSG-HUUCEWRRSA-N 0 3 334.397 2.563 20 5 EFBDHN CC(C)c1n[nH]c(C(=O)N[C@H]2CCN(C3CCCCC3)C2)c1[N+](=O)[O-] ZINC000598220949 478711271 /nfs/dbraw/zinc/71/12/71/478711271.db2.gz SAYZLHGRVUPOSM-LBPRGKRZSA-N 0 3 349.435 2.578 20 5 EFBDHN CC(C)N(CCN1C[C@@H](C)O[C@@H](C)C1)Cc1ccc([N+](=O)[O-])cc1 ZINC000595294975 478720150 /nfs/dbraw/zinc/72/01/50/478720150.db2.gz DRGZVRFFXXXUBK-IYBDPMFKSA-N 0 3 335.448 2.914 20 5 EFBDHN Cc1noc(CN[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000595441074 478784616 /nfs/dbraw/zinc/78/46/16/478784616.db2.gz ULRWTBXJNYRQDS-CZUORRHYSA-N 0 3 344.415 2.891 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CNCc1cc2ccccc2o1 ZINC000564754398 478803941 /nfs/dbraw/zinc/80/39/41/478803941.db2.gz RWKJRALWPZHPON-CQSZACIVSA-N 0 3 342.351 2.871 20 5 EFBDHN CC(=O)c1nc(CCN(C)CCc2cccc([N+](=O)[O-])c2)[nH]c1C ZINC000595473998 478805499 /nfs/dbraw/zinc/80/54/99/478805499.db2.gz CBHNQJMCZHDPCR-UHFFFAOYSA-N 0 3 330.388 2.546 20 5 EFBDHN CC(=O)c1[nH]c(CCN(C)CCc2cccc([N+](=O)[O-])c2)nc1C ZINC000595473998 478805507 /nfs/dbraw/zinc/80/55/07/478805507.db2.gz CBHNQJMCZHDPCR-UHFFFAOYSA-N 0 3 330.388 2.546 20 5 EFBDHN CC(C)N(Cc1ccccn1)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000544071648 478807606 /nfs/dbraw/zinc/80/76/06/478807606.db2.gz JWVFBJBDCRTRBP-MRXNPFEDSA-N 0 3 345.399 2.640 20 5 EFBDHN C[C@@H](C(=O)N1CCN(C2CC2)C[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000572354139 478813881 /nfs/dbraw/zinc/81/38/81/478813881.db2.gz KEDVJDZIJGKDDR-ZIAGYGMSSA-N 0 3 331.416 2.641 20 5 EFBDHN C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC2(C[C@@H]1C)CCOCC2 ZINC000592181486 478814772 /nfs/dbraw/zinc/81/47/72/478814772.db2.gz FNHPTRKTFSSLPR-KBPBESRZSA-N 0 3 347.415 2.813 20 5 EFBDHN C[C@@H]1CC2(CN1Cc1cc([N+](=O)[O-])cc3c1OCOC3)CCOCC2 ZINC000592181812 478815180 /nfs/dbraw/zinc/81/51/80/478815180.db2.gz IAOZACBHENSACZ-CYBMUJFWSA-N 0 3 348.399 2.852 20 5 EFBDHN CC(C)(CO)[C@@H](NCCOc1ccc([N+](=O)[O-])cc1)c1cccnc1 ZINC000595498603 478820935 /nfs/dbraw/zinc/82/09/35/478820935.db2.gz GIJVXNWWSBUSQG-KRWDZBQOSA-N 0 3 345.399 2.718 20 5 EFBDHN C[C@@H](CN1CCC(C)CC1)NC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000595523242 478833518 /nfs/dbraw/zinc/83/35/18/478833518.db2.gz QCBSXKXZNMDACF-HNNXBMFYSA-N 0 3 348.447 2.557 20 5 EFBDHN CCN1CCCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H](C)C1 ZINC000595535943 478839519 /nfs/dbraw/zinc/83/95/19/478839519.db2.gz KEKSLDAHOMCING-ZDUSSCGKSA-N 0 3 345.403 2.561 20 5 EFBDHN CCCN(C(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@@H]1CCN(C)C1 ZINC000592249695 478840945 /nfs/dbraw/zinc/84/09/45/478840945.db2.gz MCELNVFDYUIIOO-CYBMUJFWSA-N 0 3 336.392 2.551 20 5 EFBDHN O=c1oc2ccc([N+](=O)[O-])cc2n1CCCN1C[C@@H]2CCCC[C@@H]21 ZINC000595568333 478860671 /nfs/dbraw/zinc/86/06/71/478860671.db2.gz UHIAZCVCDMCILB-JSGCOSHPSA-N 0 3 331.372 2.767 20 5 EFBDHN COc1ccc(CNCCc2cn3c(cccc3C)n2)cc1[N+](=O)[O-] ZINC000592380194 478876032 /nfs/dbraw/zinc/87/60/32/478876032.db2.gz UXUJKVXIPZRINR-UHFFFAOYSA-N 0 3 340.383 2.892 20 5 EFBDHN COc1ccc(CNCCc2nnc(C(C)C)s2)cc1[N+](=O)[O-] ZINC000492272145 478902987 /nfs/dbraw/zinc/90/29/87/478902987.db2.gz IFHHBNIECWZQIQ-UHFFFAOYSA-N 0 3 336.417 2.911 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1CCN(C(C)(C)C)C1 ZINC000595702034 478946485 /nfs/dbraw/zinc/94/64/85/478946485.db2.gz JEXAYTZPAUESQV-CQSZACIVSA-N 0 3 334.420 2.609 20 5 EFBDHN C[C@H](NC(=O)N1CC[C@@]2(C1)CCCN(C)C2)c1cccc([N+](=O)[O-])c1 ZINC000583979101 478983846 /nfs/dbraw/zinc/98/38/46/478983846.db2.gz MFYZDHYWZMKKMR-KSSFIOAISA-N 0 3 346.431 2.783 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[C@@H](CN2CCCC2=O)C1 ZINC000595828125 479021282 /nfs/dbraw/zinc/02/12/82/479021282.db2.gz HZUQBVWUQHXEGJ-HUUCEWRRSA-N 0 3 331.416 2.909 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[C@H](CN2CCCC2=O)C1 ZINC000595828112 479021425 /nfs/dbraw/zinc/02/14/25/479021425.db2.gz HZUQBVWUQHXEGJ-CABCVRRESA-N 0 3 331.416 2.909 20 5 EFBDHN O=C(Nc1ccc([N+](=O)[O-])cc1)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000598804285 479030770 /nfs/dbraw/zinc/03/07/70/479030770.db2.gz ZMBYXYLTAGOHJG-NEPJUHHUSA-N 0 3 348.277 2.517 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN(C)CC1=CCSC1 ZINC000595890156 479054687 /nfs/dbraw/zinc/05/46/87/479054687.db2.gz YSPBZSLPPNNRQQ-UHFFFAOYSA-N 0 3 335.429 2.837 20 5 EFBDHN CCCN(C(=O)Cc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCN(C)C1 ZINC000592828751 479063157 /nfs/dbraw/zinc/06/31/57/479063157.db2.gz JAABYUDLYUTFQX-AWEZNQCLSA-N 0 3 339.823 2.733 20 5 EFBDHN CCCN(C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12)[C@H]1CCN(C)C1 ZINC000592829260 479063527 /nfs/dbraw/zinc/06/35/27/479063527.db2.gz MGCAZIDDVXRTDZ-LBPRGKRZSA-N 0 3 330.388 2.632 20 5 EFBDHN CCCN(C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)[C@H]1CCN(C)C1 ZINC000592832709 479064267 /nfs/dbraw/zinc/06/42/67/479064267.db2.gz VLBVEZSVMLGFNW-ZDUSSCGKSA-N 0 3 330.388 2.632 20 5 EFBDHN CC1(C)C[C@@]1(NCCn1cc([N+](=O)[O-])ccc1=O)c1ccccc1 ZINC000595909425 479064755 /nfs/dbraw/zinc/06/47/55/479064755.db2.gz NINQILOAWZNHPK-GOSISDBHSA-N 0 3 327.384 2.672 20 5 EFBDHN CC(C)(NC(=O)c1cccc2c1CCNC2)c1ccc([N+](=O)[O-])cc1 ZINC000595958111 479082396 /nfs/dbraw/zinc/08/23/96/479082396.db2.gz JCESOKWPKBHPRM-UHFFFAOYSA-N 0 3 339.395 2.906 20 5 EFBDHN COc1cc(CNC[C@H]2CCC[N@H+](CC3CC3)C2)c([N+](=O)[O-])cc1[O-] ZINC000596058080 479112617 /nfs/dbraw/zinc/11/26/17/479112617.db2.gz CDRLODVMFNUQIA-CQSZACIVSA-N 0 3 349.431 2.521 20 5 EFBDHN COc1cc(CNC[C@H]2CCC[N@@H+](CC3CC3)C2)c([N+](=O)[O-])cc1[O-] ZINC000596058080 479112624 /nfs/dbraw/zinc/11/26/24/479112624.db2.gz CDRLODVMFNUQIA-CQSZACIVSA-N 0 3 349.431 2.521 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@@H]1CCCN1CC(F)F ZINC000598988314 479116038 /nfs/dbraw/zinc/11/60/38/479116038.db2.gz OFHXEEJCJFFBIN-AWEZNQCLSA-N 0 3 343.374 2.813 20 5 EFBDHN CN(C)CCNC(=O)c1ccc(NCc2csc([N+](=O)[O-])c2)cc1 ZINC000598990481 479118267 /nfs/dbraw/zinc/11/82/67/479118267.db2.gz AIVSLOYHVJRPKY-UHFFFAOYSA-N 0 3 348.428 2.560 20 5 EFBDHN CCN(CC)[C@@H](CNc1ccc(N)c([N+](=O)[O-])n1)c1ccsc1 ZINC000596072822 479121426 /nfs/dbraw/zinc/12/14/26/479121426.db2.gz AAKILDAMTYSCRJ-ZDUSSCGKSA-N 0 3 335.433 2.550 20 5 EFBDHN COc1ccc(-c2ccc(CNC[C@H]3C[C@@H](O)C3)o2)c([N+](=O)[O-])c1 ZINC000599006019 479122797 /nfs/dbraw/zinc/12/27/97/479122797.db2.gz BBJVMSZKSHWRTF-TXEJJXNPSA-N 0 3 332.356 2.724 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@@H](OC(C)C)C1 ZINC000573717766 479129487 /nfs/dbraw/zinc/12/94/87/479129487.db2.gz BKVFBHLVWSVJRB-OAHLLOKOSA-N 0 3 335.404 2.731 20 5 EFBDHN Cc1ccc([C@H](CNc2ccc([N+](=O)[O-])c(C(N)=O)c2)N(C)C)cc1 ZINC000596093566 479135557 /nfs/dbraw/zinc/13/55/57/479135557.db2.gz VYRARXPEHRYFSU-KRWDZBQOSA-N 0 3 342.399 2.717 20 5 EFBDHN Cc1ccc(CNCCn2ccc(C(F)(F)F)n2)cc1[N+](=O)[O-] ZINC000602016519 479138166 /nfs/dbraw/zinc/13/81/66/479138166.db2.gz FGRUQOMVUBAFMG-UHFFFAOYSA-N 0 3 328.294 2.908 20 5 EFBDHN CCn1nncc1CN[C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000599061209 479144627 /nfs/dbraw/zinc/14/46/27/479144627.db2.gz LLLZXTOVQHEYHG-CJNGLKHVSA-N 0 3 329.404 2.707 20 5 EFBDHN O=c1[nH]ccc(Nc2cccc(CN3CCSCC3)c2)c1[N+](=O)[O-] ZINC000596111934 479144789 /nfs/dbraw/zinc/14/47/89/479144789.db2.gz DTVIVCVNIABHBF-UHFFFAOYSA-N 0 3 346.412 2.988 20 5 EFBDHN CCn1nncc1CN[C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000599061212 479144841 /nfs/dbraw/zinc/14/48/41/479144841.db2.gz LLLZXTOVQHEYHG-CZUORRHYSA-N 0 3 329.404 2.707 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2NC[C@@H]1CCCN1CC(F)F ZINC000599067240 479145930 /nfs/dbraw/zinc/14/59/30/479145930.db2.gz ZFKJNRAXTVLRFU-SMDDNHRTSA-N 0 3 325.359 2.901 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2NC[C@@H]1CCCN1CC(F)F ZINC000599067238 479146204 /nfs/dbraw/zinc/14/62/04/479146204.db2.gz ZFKJNRAXTVLRFU-FZMZJTMJSA-N 0 3 325.359 2.901 20 5 EFBDHN CC(C)O[C@H]1CCCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000593054882 479147736 /nfs/dbraw/zinc/14/77/36/479147736.db2.gz HLGDEVDWWIVQBS-INIZCTEOSA-N 0 3 335.404 2.813 20 5 EFBDHN Cc1ncccc1CN[C@@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000599073205 479149987 /nfs/dbraw/zinc/14/99/87/479149987.db2.gz MQSUKPRGCPSQPW-LBPRGKRZSA-N 0 3 328.372 2.805 20 5 EFBDHN C[C@H](CNc1ccc([N+](=O)[O-])c(C(N)=O)c1)N(C)Cc1ccccc1 ZINC000596119635 479150065 /nfs/dbraw/zinc/15/00/65/479150065.db2.gz MONKKPBBLSXHEB-CYBMUJFWSA-N 0 3 342.399 2.626 20 5 EFBDHN C[C@@H](CNc1ccc([N+](=O)[O-])c(C(N)=O)c1)N(C)Cc1ccccc1 ZINC000596119636 479150602 /nfs/dbraw/zinc/15/06/02/479150602.db2.gz MONKKPBBLSXHEB-ZDUSSCGKSA-N 0 3 342.399 2.626 20 5 EFBDHN C[C@@H](N[C@@H]1CCO[C@H]1c1ccc(=O)[nH]c1)c1cccc([N+](=O)[O-])c1 ZINC000599075019 479152118 /nfs/dbraw/zinc/15/21/18/479152118.db2.gz ZWMZDIIHUZNNFK-JGFGOQIWSA-N 0 3 329.356 2.876 20 5 EFBDHN C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(c2cc[n-]c(=O)c2[N+](=O)[O-])C1 ZINC000596127287 479153589 /nfs/dbraw/zinc/15/35/89/479153589.db2.gz WKVKLVPWQGQYRU-ZIAGYGMSSA-N 0 3 334.420 2.786 20 5 EFBDHN C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(c2cc[n-]c(=O)c2[N+](=O)[O-])C1 ZINC000596127287 479153595 /nfs/dbraw/zinc/15/35/95/479153595.db2.gz WKVKLVPWQGQYRU-ZIAGYGMSSA-N 0 3 334.420 2.786 20 5 EFBDHN O=c1[n-]ccc(NC[C@@H]2CCC[N@@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000596130127 479155387 /nfs/dbraw/zinc/15/53/87/479155387.db2.gz VIQXHGVHMITTBL-AWEZNQCLSA-N 0 3 328.372 2.772 20 5 EFBDHN O=c1[n-]ccc(NC[C@@H]2CCC[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000596130127 479155399 /nfs/dbraw/zinc/15/53/99/479155399.db2.gz VIQXHGVHMITTBL-AWEZNQCLSA-N 0 3 328.372 2.772 20 5 EFBDHN CN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cc[n-]c(=O)c1[N+](=O)[O-] ZINC000596144024 479161255 /nfs/dbraw/zinc/16/12/55/479161255.db2.gz ACNLSSSAJWGXIK-HNNXBMFYSA-N 0 3 342.399 2.654 20 5 EFBDHN CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc[n-]c(=O)c1[N+](=O)[O-] ZINC000596144024 479161262 /nfs/dbraw/zinc/16/12/62/479161262.db2.gz ACNLSSSAJWGXIK-HNNXBMFYSA-N 0 3 342.399 2.654 20 5 EFBDHN COc1ccc(NC(=O)[C@@H](C)NC2(C3CCC3)CC2)c([N+](=O)[O-])c1 ZINC000593079997 479161923 /nfs/dbraw/zinc/16/19/23/479161923.db2.gz KAVKYISGVBAMHJ-LLVKDONJSA-N 0 3 333.388 2.853 20 5 EFBDHN CN(c1cc[n-]c(=O)c1[N+](=O)[O-])[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000596148160 479164351 /nfs/dbraw/zinc/16/43/51/479164351.db2.gz YUDIVKYDVQMJHP-OAHLLOKOSA-N 0 3 342.399 2.796 20 5 EFBDHN CN(c1cc[n-]c(=O)c1[N+](=O)[O-])[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000596148160 479164355 /nfs/dbraw/zinc/16/43/55/479164355.db2.gz YUDIVKYDVQMJHP-OAHLLOKOSA-N 0 3 342.399 2.796 20 5 EFBDHN O=C(Cc1ccc(F)cc1[N+](=O)[O-])N1CCN(C2CCCCC2)CC1 ZINC000593094609 479171034 /nfs/dbraw/zinc/17/10/34/479171034.db2.gz KREZYYZNMPYJPV-UHFFFAOYSA-N 0 3 349.406 2.753 20 5 EFBDHN Cc1c(NC(=O)[C@@H](C)N(C)CCN2CCCCC2)cccc1[N+](=O)[O-] ZINC000593111591 479180622 /nfs/dbraw/zinc/18/06/22/479180622.db2.gz GXKWQHVCPJVGDV-OAHLLOKOSA-N 0 3 348.447 2.648 20 5 EFBDHN CN(CCN1CCCCC1)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000593113751 479182088 /nfs/dbraw/zinc/18/20/88/479182088.db2.gz UWFZLOCNOPTWEJ-UHFFFAOYSA-N 0 3 345.403 2.563 20 5 EFBDHN CC[C@@H]1CN(c2cc[nH]c(=O)c2[N+](=O)[O-])CCN1Cc1ccccc1 ZINC000596191724 479189987 /nfs/dbraw/zinc/18/99/87/479189987.db2.gz CWVUUIRORCBDMB-OAHLLOKOSA-N 0 3 342.399 2.796 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CNCCSc2ccccc2)c1 ZINC000556750340 479195137 /nfs/dbraw/zinc/19/51/37/479195137.db2.gz IHPPOMIIMIIKPO-OAHLLOKOSA-N 0 3 348.424 2.716 20 5 EFBDHN CN(C(=O)C(C[C@@H]1CCCO1)C(F)(F)F)c1ccc([N+](=O)[O-])nc1 ZINC000593144386 479202669 /nfs/dbraw/zinc/20/26/69/479202669.db2.gz WBNCKYRKKITQIK-WDEREUQCSA-N 0 3 347.293 2.700 20 5 EFBDHN CN(C(=O)C(C[C@H]1CCCO1)C(F)(F)F)c1ccc([N+](=O)[O-])nc1 ZINC000593144382 479202994 /nfs/dbraw/zinc/20/29/94/479202994.db2.gz WBNCKYRKKITQIK-GHMZBOCLSA-N 0 3 347.293 2.700 20 5 EFBDHN C[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1Nc1cc[n-]c(=O)c1[N+](=O)[O-] ZINC000596217297 479205109 /nfs/dbraw/zinc/20/51/09/479205109.db2.gz BWHDDYYDBGLTOV-WFASDCNBSA-N 0 3 328.372 2.628 20 5 EFBDHN C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Nc1cc[n-]c(=O)c1[N+](=O)[O-] ZINC000596217297 479205119 /nfs/dbraw/zinc/20/51/19/479205119.db2.gz BWHDDYYDBGLTOV-WFASDCNBSA-N 0 3 328.372 2.628 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1CN[C@@H]1CCOC3(CCC3)C1)OCCO2 ZINC000610860092 479212590 /nfs/dbraw/zinc/21/25/90/479212590.db2.gz KDTZUSMHIPZILI-CYBMUJFWSA-N 0 3 334.372 2.557 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1CN[C@@H]1CCOC3(CCCC3)C1)OCCO2 ZINC000610860076 479212919 /nfs/dbraw/zinc/21/29/19/479212919.db2.gz DHAMSNSLHSDHLQ-CQSZACIVSA-N 0 3 348.399 2.947 20 5 EFBDHN O=[N+]([O-])c1cc(NC[C@H]2CCCN2CCCO)ccc1C(F)(F)F ZINC000596259747 479228357 /nfs/dbraw/zinc/22/83/57/479228357.db2.gz VZWFLXUGEQHPHG-GFCCVEGCSA-N 0 3 347.337 2.872 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC[C@@H]1[C@@H]1CCCOC1 ZINC000574397581 479279859 /nfs/dbraw/zinc/27/98/59/479279859.db2.gz VISSPDDMSGHNFF-RHSMWYFYSA-N 0 3 347.415 2.733 20 5 EFBDHN CC[C@@H](CN1CCCC1)NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000611151264 479295827 /nfs/dbraw/zinc/29/58/27/479295827.db2.gz WLJJALLJCNYZGP-AWEZNQCLSA-N 0 3 344.415 2.609 20 5 EFBDHN O=[N+]([O-])c1ccc(CCn2cc(CNC3CCCCC3)nn2)cc1 ZINC000603194638 479298287 /nfs/dbraw/zinc/29/82/87/479298287.db2.gz HHZFSJXCHLJAAX-UHFFFAOYSA-N 0 3 329.404 2.851 20 5 EFBDHN CC(C)N1CCN(C2CCN(c3ccsc3[N+](=O)[O-])CC2)CC1 ZINC000611166132 479299954 /nfs/dbraw/zinc/29/99/54/479299954.db2.gz LHBXGJYVJOLCJF-UHFFFAOYSA-N 0 3 338.477 2.651 20 5 EFBDHN O=[N+]([O-])c1ccc(Cn2cc(CCN3CCCCC3)nn2)c(Cl)c1 ZINC000603214533 479306944 /nfs/dbraw/zinc/30/69/44/479306944.db2.gz FEIBTYUQWWFETK-UHFFFAOYSA-N 0 3 349.822 2.916 20 5 EFBDHN O=C(c1c[nH]c2cccc([N+](=O)[O-])c12)N1CC[C@@H](N2CCCCC2)C1 ZINC000611195909 479307942 /nfs/dbraw/zinc/30/79/42/479307942.db2.gz MSFRMSIAUKNNNU-CYBMUJFWSA-N 0 3 342.399 2.777 20 5 EFBDHN CN(Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C1Cc2ccccc2C1 ZINC000611264802 479328238 /nfs/dbraw/zinc/32/82/38/479328238.db2.gz KAWPSWDUKGRAFS-UHFFFAOYSA-N 0 3 340.379 2.965 20 5 EFBDHN C[C@H](CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-])N1CCC[C@H](C)C1 ZINC000593408528 479328840 /nfs/dbraw/zinc/32/88/40/479328840.db2.gz PFDIIZXSFRFTJC-QWHCGFSZSA-N 0 3 337.395 2.513 20 5 EFBDHN O=C(CN[C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)NC1CCCC1 ZINC000611335724 479350308 /nfs/dbraw/zinc/35/03/08/479350308.db2.gz PCSSAHZIPQSOPD-INIZCTEOSA-N 0 3 331.416 2.564 20 5 EFBDHN C[C@@H]1CN(c2c([N+](=O)[O-])ncn2C)[C@H](C)[C@@H](C)N1Cc1ccccc1 ZINC000593483850 479361698 /nfs/dbraw/zinc/36/16/98/479361698.db2.gz JVDGSEMIMIMNQD-RBSFLKMASA-N 0 3 343.431 2.816 20 5 EFBDHN COC(=O)c1cc(-c2ccc(OCCN(C)C)cc2)cc([N+](=O)[O-])c1 ZINC000596635104 479366426 /nfs/dbraw/zinc/36/64/26/479366426.db2.gz DYCWCWMWSMZLGA-UHFFFAOYSA-N 0 3 344.367 2.989 20 5 EFBDHN Cc1ncc(-c2ccccc2CN2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000596639156 479367560 /nfs/dbraw/zinc/36/75/60/479367560.db2.gz JIVGRXAWNCNFAW-UHFFFAOYSA-N 0 3 326.400 2.713 20 5 EFBDHN O=[N+]([O-])c1ccsc1NCCCN1CCN(c2ccncc2)CC1 ZINC000611412181 479371721 /nfs/dbraw/zinc/37/17/21/479371721.db2.gz BBVZWQBYJJXYMU-UHFFFAOYSA-N 0 3 347.444 2.676 20 5 EFBDHN COC(=O)C(C)(C)CNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602505528 479372208 /nfs/dbraw/zinc/37/22/08/479372208.db2.gz LWDOBVHTSBBLJL-UHFFFAOYSA-N 0 3 334.294 2.902 20 5 EFBDHN CN(C)C(=O)c1cccc(CNCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000602508450 479373480 /nfs/dbraw/zinc/37/34/80/479373480.db2.gz CFZXVMZQRDQRSW-UHFFFAOYSA-N 0 3 327.384 2.629 20 5 EFBDHN Cc1cnc(N(C)CCCN(C)Cc2ccncc2)c([N+](=O)[O-])c1 ZINC000603404342 479373987 /nfs/dbraw/zinc/37/39/87/479373987.db2.gz ZGVZLURMWIFQAU-UHFFFAOYSA-N 0 3 329.404 2.652 20 5 EFBDHN CC(C)NC(=O)c1ccc(N(C)CCN2CCCCC2)c([N+](=O)[O-])c1 ZINC000593516105 479374528 /nfs/dbraw/zinc/37/45/28/479374528.db2.gz LZZMKCZKHOUQIG-UHFFFAOYSA-N 0 3 348.447 2.655 20 5 EFBDHN C[C@H](CNCc1nc2cc([N+](=O)[O-])ccc2o1)N1CCC[C@@H](C)C1 ZINC000602513178 479375895 /nfs/dbraw/zinc/37/58/95/479375895.db2.gz AGSBLIIREBCEIC-CHWSQXEVSA-N 0 3 332.404 2.946 20 5 EFBDHN Cc1csc(CNC2CCN(c3ccc([N+](=O)[O-])nc3)CC2)n1 ZINC000602512313 479376288 /nfs/dbraw/zinc/37/62/88/479376288.db2.gz XMFPWPFSHKKXPT-UHFFFAOYSA-N 0 3 333.417 2.513 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(C)cc1N[C@H]1CCN(CC2CC2)C1 ZINC000587973641 479378285 /nfs/dbraw/zinc/37/82/85/479378285.db2.gz BGZGHUNZGDJWSR-ZDUSSCGKSA-N 0 3 333.388 2.586 20 5 EFBDHN COC(=O)[C@@H]1CN(CCc2ccc([N+](=O)[O-])cc2)Cc2ccccc21 ZINC000599668537 479381369 /nfs/dbraw/zinc/38/13/69/479381369.db2.gz LBOSAHPZTQSSCS-GOSISDBHSA-N 0 3 340.379 2.910 20 5 EFBDHN NCc1cccc2c1N(C(=O)Cc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000602538927 479388003 /nfs/dbraw/zinc/38/80/03/479388003.db2.gz FJDMGANJWDZTHV-UHFFFAOYSA-N 0 3 325.368 2.575 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNCCSCCCO ZINC000602540174 479388915 /nfs/dbraw/zinc/38/89/15/479388915.db2.gz WUTWUGBNLZIXEJ-UHFFFAOYSA-N 0 3 338.351 2.819 20 5 EFBDHN COc1cc(C[C@H](C)NCc2cc([N+](=O)[O-])ccc2OC)ccn1 ZINC000602554896 479393700 /nfs/dbraw/zinc/39/37/00/479393700.db2.gz ZUGIMTGGXCYXET-LBPRGKRZSA-N 0 3 331.372 2.728 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN[C@H]1CCc2c[nH]nc2C1 ZINC000602566496 479400705 /nfs/dbraw/zinc/40/07/05/479400705.db2.gz DOQOVDPNSFOQRI-LBPRGKRZSA-N 0 3 340.305 2.984 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNCCCO[C@H]1CCOC1 ZINC000602568362 479401051 /nfs/dbraw/zinc/40/10/51/479401051.db2.gz LZRAUSPPJYODPB-ZDUSSCGKSA-N 0 3 348.321 2.899 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNC[C@]1(O)CCSC1 ZINC000602573559 479403128 /nfs/dbraw/zinc/40/31/28/479403128.db2.gz RYDNERRHKPBPNO-GFCCVEGCSA-N 0 3 336.335 2.571 20 5 EFBDHN C[C@H](CO)CCCNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602576379 479405757 /nfs/dbraw/zinc/40/57/57/479405757.db2.gz BLOZACBBDPCVCK-QMMMGPOBSA-N 0 3 337.239 2.917 20 5 EFBDHN Cc1cccc(C)c1NC(=O)CNCCc1ccc([N+](=O)[O-])cc1 ZINC000602594086 479414973 /nfs/dbraw/zinc/41/49/73/479414973.db2.gz RGEUZXBRKQEVFK-UHFFFAOYSA-N 0 3 327.384 2.982 20 5 EFBDHN CC[C@@H](CN1CCCC1)NC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000588623157 479422699 /nfs/dbraw/zinc/42/26/99/479422699.db2.gz NAZZELYXOBSRNW-INIZCTEOSA-N 0 3 348.447 2.653 20 5 EFBDHN COC(=O)[C@@H]1CN(C/C=C/c2ccccc2[N+](=O)[O-])C[C@H]1C1CC1 ZINC000593698187 479428059 /nfs/dbraw/zinc/42/80/59/479428059.db2.gz ZJIVIEBVLHVKTP-INCBCAAFSA-N 0 3 330.384 2.739 20 5 EFBDHN COC(=O)C1(CNCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602621892 479429141 /nfs/dbraw/zinc/42/91/41/479429141.db2.gz FSYYENJRKJMUAU-UHFFFAOYSA-N 0 3 332.278 2.656 20 5 EFBDHN O=[N+]([O-])c1ccc(NCc2ccccc2CN2CC[C@H](O)C2)s1 ZINC000611617999 479430750 /nfs/dbraw/zinc/43/07/50/479430750.db2.gz XHDUKOFLMSOPSJ-AWEZNQCLSA-N 0 3 333.413 2.835 20 5 EFBDHN CO[C@@H](CNCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@H]1CCOC1 ZINC000602641478 479443248 /nfs/dbraw/zinc/44/32/48/479443248.db2.gz SCFBGFRBQQLJGK-FZMZJTMJSA-N 0 3 348.321 2.755 20 5 EFBDHN CN(C)CCN(Cc1ccco1)c1ncnc2ccc([N+](=O)[O-])cc21 ZINC000611712036 479454326 /nfs/dbraw/zinc/45/43/26/479454326.db2.gz UFWSTNKWFLDZMW-UHFFFAOYSA-N 0 3 341.371 2.699 20 5 EFBDHN CCCC(=O)NC1CCN(CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000604012223 479462201 /nfs/dbraw/zinc/46/22/01/479462201.db2.gz OLNVQSVGXLDLPH-UHFFFAOYSA-N 0 3 349.431 2.744 20 5 EFBDHN CCCN1CC[C@H](NC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])C1 ZINC000596881133 479470403 /nfs/dbraw/zinc/47/04/03/479470403.db2.gz ILCMUYZJGGWWCN-ZDUSSCGKSA-N 0 3 334.420 2.613 20 5 EFBDHN COc1ccc(CN[C@H]2COc3cc(F)ccc3C2)cc1[N+](=O)[O-] ZINC000575816208 479480204 /nfs/dbraw/zinc/48/02/04/479480204.db2.gz LRRNAJHIXLESCS-CQSZACIVSA-N 0 3 332.331 2.836 20 5 EFBDHN CC(C)[C@H](NCCOc1ccccc1[N+](=O)[O-])[C@H](O)C(F)(F)F ZINC000589162095 479487078 /nfs/dbraw/zinc/48/70/78/479487078.db2.gz HAOHHDYADBLJOI-STQMWFEESA-N 0 3 336.310 2.511 20 5 EFBDHN CCN(C(=O)Cc1ccc([N+](=O)[O-])cc1Cl)C1CCN(C)CC1 ZINC000599985796 479488353 /nfs/dbraw/zinc/48/83/53/479488353.db2.gz ITTUVGXEWFOPBI-UHFFFAOYSA-N 0 3 339.823 2.733 20 5 EFBDHN Cn1cc([N+](=O)[O-])cc1C(=O)N1CCCN(CC2CCCCC2)CC1 ZINC000604267007 479493675 /nfs/dbraw/zinc/49/36/75/479493675.db2.gz LQHGUYIXKIEUPI-UHFFFAOYSA-N 0 3 348.447 2.662 20 5 EFBDHN CN(CCN1CCCCC1)C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000593884120 479496541 /nfs/dbraw/zinc/49/65/41/479496541.db2.gz RDNSRUBXUFILPZ-UHFFFAOYSA-N 0 3 333.432 2.817 20 5 EFBDHN COC1CCN(CCN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000618571529 479497078 /nfs/dbraw/zinc/49/70/78/479497078.db2.gz BPZQGHUFAYKAIZ-SFHVURJKSA-N 0 3 333.432 2.673 20 5 EFBDHN Cc1c(CN2CCC[C@@H]2CN2C[C@@H](C)O[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000604467067 479521153 /nfs/dbraw/zinc/52/11/53/479521153.db2.gz VPQNELZEAKLEOA-IIDMSEBBSA-N 0 3 347.459 2.977 20 5 EFBDHN Cc1c(CN2CCC[C@@H]2CN2C[C@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000604467068 479521221 /nfs/dbraw/zinc/52/12/21/479521221.db2.gz VPQNELZEAKLEOA-RLFYNMQTSA-N 0 3 347.459 2.977 20 5 EFBDHN CC[C@@]1(O)CCCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000602740956 479521510 /nfs/dbraw/zinc/52/15/10/479521510.db2.gz SILUWPPRNBYYSS-GOSISDBHSA-N 0 3 344.415 2.732 20 5 EFBDHN O=[N+]([O-])c1ccc(NCCCN2CCN(c3ccncc3)CC2)s1 ZINC000604524835 479534376 /nfs/dbraw/zinc/53/43/76/479534376.db2.gz RZSFICIAUPHWJK-UHFFFAOYSA-N 0 3 347.444 2.676 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN(Cc1ccccc1)C[C@H]1CCCO1 ZINC000602761908 479534554 /nfs/dbraw/zinc/53/45/54/479534554.db2.gz BTJBHTZQVCTQSM-QGZVFWFLSA-N 0 3 344.415 2.781 20 5 EFBDHN CCC(C)(C)N1CCN([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000594020666 479552916 /nfs/dbraw/zinc/55/29/16/479552916.db2.gz KRZMDRPBTMWQKQ-AWEZNQCLSA-N 0 3 348.447 2.728 20 5 EFBDHN CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCC(=O)N(C)C1 ZINC000600179242 479566014 /nfs/dbraw/zinc/56/60/14/479566014.db2.gz WWDHRCKGRGEELR-HNNXBMFYSA-N 0 3 343.383 2.907 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCCN2CCCC[C@H]12 ZINC000594056126 479570901 /nfs/dbraw/zinc/57/09/01/479570901.db2.gz RCBQSDSWSGSVFF-DZGCQCFKSA-N 0 3 348.403 2.742 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN1CCCc2sccc2C1 ZINC000612074498 479572249 /nfs/dbraw/zinc/57/22/49/479572249.db2.gz ZZLMHJSGQSEPFE-AWEZNQCLSA-N 0 3 348.424 2.844 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN1C[C@]2(C[C@@H]3CC[C@H]2C3)OC(C)(C)C1 ZINC000602826987 479578554 /nfs/dbraw/zinc/57/85/54/479578554.db2.gz PAKMIDMVHJKNGH-VKJFTORMSA-N 0 3 348.447 2.769 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@H]1CC[C@](O)(C(F)(F)F)C1 ZINC000589938053 479584029 /nfs/dbraw/zinc/58/40/29/479584029.db2.gz BLWVIPYSCVQWDY-SMDDNHRTSA-N 0 3 348.321 2.929 20 5 EFBDHN O=[N+]([O-])c1ccn(C2CCN(Cc3ccc4[nH]cnc4c3)CC2)n1 ZINC000618821798 479606382 /nfs/dbraw/zinc/60/63/82/479606382.db2.gz GKTSMMKFDFDLPX-UHFFFAOYSA-N 0 3 326.360 2.505 20 5 EFBDHN O=[N+]([O-])c1ccn(C2CCN(Cc3ccc4nc[nH]c4c3)CC2)n1 ZINC000618821798 479606390 /nfs/dbraw/zinc/60/63/90/479606390.db2.gz GKTSMMKFDFDLPX-UHFFFAOYSA-N 0 3 326.360 2.505 20 5 EFBDHN C[C@H]1CN(C2CCOCC2)CCN1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000618826824 479607129 /nfs/dbraw/zinc/60/71/29/479607129.db2.gz CJCSELGIFHVJIX-LEXSJLIMSA-N 0 3 345.443 2.793 20 5 EFBDHN CN(Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)CC1=CCCOC1 ZINC000597206379 479619585 /nfs/dbraw/zinc/61/95/85/479619585.db2.gz PGLARVONEUCZKM-UHFFFAOYSA-N 0 3 342.399 2.774 20 5 EFBDHN O=C(N[C@@H]1CCCN2CCCC[C@@H]12)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000594195692 479626894 /nfs/dbraw/zinc/62/68/94/479626894.db2.gz HIDXNBQNMIITGJ-CABCVRRESA-N 0 3 337.807 2.995 20 5 EFBDHN CCc1ccc(C(=O)N[C@@H]2CCCN3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC000594197844 479628064 /nfs/dbraw/zinc/62/80/64/479628064.db2.gz QPTWHWJLZMPWJC-HZPDHXFCSA-N 0 3 331.416 2.904 20 5 EFBDHN O=C(N[C@@H]1CCCN2CCCC[C@H]12)c1c(Cl)cccc1[N+](=O)[O-] ZINC000594198980 479628903 /nfs/dbraw/zinc/62/89/03/479628903.db2.gz WZMCEDVWSDVWQJ-CHWSQXEVSA-N 0 3 337.807 2.995 20 5 EFBDHN O=C(CCc1cccc([N+](=O)[O-])c1)N[C@H]1CCCN2CCCC[C@H]12 ZINC000594198707 479629267 /nfs/dbraw/zinc/62/92/67/479629267.db2.gz VEJGFQKJQNUVCV-DLBZAZTESA-N 0 3 331.416 2.661 20 5 EFBDHN CCOC(=O)[C@]1(C)CCC[C@@H]1NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000597240069 479638908 /nfs/dbraw/zinc/63/89/08/479638908.db2.gz NRBZUOLZBZGXJO-DOTOQJQBSA-N 0 3 336.388 2.815 20 5 EFBDHN CN1CCC[C@]2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4o3)C2)C1 ZINC000590505888 479654892 /nfs/dbraw/zinc/65/48/92/479654892.db2.gz CNRBVUUZJKCQEV-SFHVURJKSA-N 0 3 343.383 2.899 20 5 EFBDHN CC1(C)C[C@H](NCCOC[C@@H]2CCOC2)c2cc([N+](=O)[O-])ccc21 ZINC000618984303 479659390 /nfs/dbraw/zinc/65/93/90/479659390.db2.gz ZSXUGZNJZQGOHQ-DYVFJYSZSA-N 0 3 334.416 2.960 20 5 EFBDHN CC(C)(CO)[C@H](NCCOc1ccccc1[N+](=O)[O-])c1cccnc1 ZINC000590599691 479666407 /nfs/dbraw/zinc/66/64/07/479666407.db2.gz FVJBQUODSZTQFJ-QGZVFWFLSA-N 0 3 345.399 2.718 20 5 EFBDHN Cc1c(CN2CCC([C@@H]3NC(=O)C3(C)C)CC2)cccc1[N+](=O)[O-] ZINC000590601349 479666610 /nfs/dbraw/zinc/66/66/10/479666610.db2.gz SHXYIUNUGXFIBI-INIZCTEOSA-N 0 3 331.416 2.640 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H](N2CCOCC2)CC1 ZINC000590601422 479666789 /nfs/dbraw/zinc/66/67/89/479666789.db2.gz WJHSMIZCXOXGLU-CVEARBPZSA-N 0 3 333.432 2.843 20 5 EFBDHN CC(C)(CO)[C@@H](NCCOc1ccccc1[N+](=O)[O-])c1cccnc1 ZINC000590599688 479666804 /nfs/dbraw/zinc/66/68/04/479666804.db2.gz FVJBQUODSZTQFJ-KRWDZBQOSA-N 0 3 345.399 2.718 20 5 EFBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H](N2CCOCC2)CC1 ZINC000590601427 479667524 /nfs/dbraw/zinc/66/75/24/479667524.db2.gz WJHSMIZCXOXGLU-JKSUJKDBSA-N 0 3 333.432 2.843 20 5 EFBDHN CN1CCCC(C)(C)[C@@H]1CNCc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000619198268 479714725 /nfs/dbraw/zinc/71/47/25/479714725.db2.gz QGHFBHSHMZMXOP-KRWDZBQOSA-N 0 3 349.431 2.576 20 5 EFBDHN CC(C)(C(=O)N[C@@H]1CCN(CC2CC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000613019653 479841777 /nfs/dbraw/zinc/84/17/77/479841777.db2.gz BEAWHRCBWGFTFJ-CYBMUJFWSA-N 0 3 349.406 2.612 20 5 EFBDHN CC(C)(C(=O)N[C@H]1CCN(CC2CC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000613019655 479841799 /nfs/dbraw/zinc/84/17/99/479841799.db2.gz BEAWHRCBWGFTFJ-ZDUSSCGKSA-N 0 3 349.406 2.612 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCN(c3ccnc4ccccc43)CC2)cn1 ZINC000609495638 480167486 /nfs/dbraw/zinc/16/74/86/480167486.db2.gz GSPDOCVPTLWHAB-UHFFFAOYSA-N 0 3 335.367 2.865 20 5 EFBDHN CC[C@@H](CN1CCCC1)NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000609833867 480210743 /nfs/dbraw/zinc/21/07/43/480210743.db2.gz ZCLTWKWEQOWJEM-ZDUSSCGKSA-N 0 3 330.388 2.680 20 5 EFBDHN CN(C)[C@H](CNc1ncnc2ccc([N+](=O)[O-])cc21)c1cccs1 ZINC000609849296 480213609 /nfs/dbraw/zinc/21/36/09/480213609.db2.gz ILPTXMVWXHDVKI-CQSZACIVSA-N 0 3 343.412 2.736 20 5 EFBDHN Cn1cc(CCCN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cn1 ZINC000610371185 480293348 /nfs/dbraw/zinc/29/33/48/480293348.db2.gz MPGYVPVWTYYVBG-UHFFFAOYSA-N 0 3 344.415 2.804 20 5 EFBDHN COc1cc(C)c(CN(C)CCn2c(C)ncc2[N+](=O)[O-])cc1OC ZINC000610664936 480359352 /nfs/dbraw/zinc/35/93/52/480359352.db2.gz QWRRJKHTGUESMS-UHFFFAOYSA-N 0 3 348.403 2.557 20 5 EFBDHN COc1cc(C[NH2+]CCc2ccc(F)c(F)c2)c([N+](=O)[O-])cc1[O-] ZINC000190297492 533878209 /nfs/dbraw/zinc/87/82/09/533878209.db2.gz TXIUDXHHUYBZNW-UHFFFAOYSA-N 0 3 338.310 2.920 20 5 EFBDHN CCOC(=O)CC1CCN(CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000120045127 520613321 /nfs/dbraw/zinc/61/33/21/520613321.db2.gz FASFEVHTZUGKPN-UHFFFAOYSA-N 0 3 336.388 2.639 20 5 EFBDHN CN(C)Cc1ccc(CNC(=O)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000088280286 521903802 /nfs/dbraw/zinc/90/38/02/521903802.db2.gz NUUNBKJGPWZGJD-UHFFFAOYSA-N 0 3 341.411 2.905 20 5 EFBDHN Cc1cccc(C(=O)NC2CCN(CCOC(C)C)CC2)c1[N+](=O)[O-] ZINC000176675372 534600580 /nfs/dbraw/zinc/60/05/80/534600580.db2.gz ZHWDCZYYUHERNO-UHFFFAOYSA-N 0 3 349.431 2.522 20 5 EFBDHN CCc1nn(C)c(NC[C@@H]2CCN(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000192957980 522670887 /nfs/dbraw/zinc/67/08/87/522670887.db2.gz XAXKMGCZFJORQD-HNNXBMFYSA-N 0 3 343.431 2.825 20 5 EFBDHN CN(CCOc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCc2c1cnn2C ZINC000135645095 522911744 /nfs/dbraw/zinc/91/17/44/522911744.db2.gz MQDFAHVGRKCTCS-MRXNPFEDSA-N 0 3 330.388 2.717 20 5 EFBDHN CN1CCC(N(Cc2ccco2)C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000073573899 523768533 /nfs/dbraw/zinc/76/85/33/523768533.db2.gz YZQCLTOCIIRMRP-UHFFFAOYSA-N 0 3 349.412 2.986 20 5 EFBDHN CN1CC[C@H]2[C@H](CCCN2C(=O)CSc2ccccc2[N+](=O)[O-])C1 ZINC000157156977 523992985 /nfs/dbraw/zinc/99/29/85/523992985.db2.gz VFVCTYQZYAQAFK-KGLIPLIRSA-N 0 3 349.456 2.630 20 5 EFBDHN COc1ccc(CNC[C@H](C)O)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000072714045 524071954 /nfs/dbraw/zinc/07/19/54/524071954.db2.gz RLQIIODIVBLAJA-ZDUSSCGKSA-N 0 3 346.383 2.653 20 5 EFBDHN Cc1cc(C(=O)N[C@H](C)CN2C[C@H](C)C[C@@H](C)C2)cc([N+](=O)[O-])c1 ZINC000195694657 524142179 /nfs/dbraw/zinc/14/21/79/524142179.db2.gz JHBFITYYKBRIAO-RBSFLKMASA-N 0 3 333.432 2.999 20 5 EFBDHN Cc1cc(C(=O)N[C@H](C)CN2C[C@H](C)C[C@H](C)C2)cc([N+](=O)[O-])c1 ZINC000195694655 524142237 /nfs/dbraw/zinc/14/22/37/524142237.db2.gz JHBFITYYKBRIAO-QLFBSQMISA-N 0 3 333.432 2.999 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[C@@H](N2CCCC2)C1 ZINC000119838390 524338032 /nfs/dbraw/zinc/33/80/32/524338032.db2.gz KBWZXXXPBZMRMC-CQSZACIVSA-N 0 3 332.404 2.914 20 5 EFBDHN C[C@H](CNC(=O)NCCc1cccc([N+](=O)[O-])c1)N1CCC(C)CC1 ZINC000120675223 524413827 /nfs/dbraw/zinc/41/38/27/524413827.db2.gz ZSNPHYUOCPHKTB-OAHLLOKOSA-N 0 3 348.447 2.557 20 5 EFBDHN COc1ccc(NC(=O)CN[C@@H]2CC[C@@H](C)C[C@H]2C)c([N+](=O)[O-])c1 ZINC000119384268 524500042 /nfs/dbraw/zinc/50/00/42/524500042.db2.gz NUVMKBMJTXMUBM-YRGRVCCFSA-N 0 3 335.404 2.956 20 5 EFBDHN C[C@@H](CNC(=O)NCCc1cccc([N+](=O)[O-])c1)N1CCC(C)CC1 ZINC000120675089 524679544 /nfs/dbraw/zinc/67/95/44/524679544.db2.gz ZSNPHYUOCPHKTB-HNNXBMFYSA-N 0 3 348.447 2.557 20 5 EFBDHN C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000120916486 524892787 /nfs/dbraw/zinc/89/27/87/524892787.db2.gz UZQMPAZZJYTFGO-YGRLFVJLSA-N 0 3 325.796 2.660 20 5 EFBDHN C[C@H]1NCCN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@@H]1C ZINC000262763006 525011616 /nfs/dbraw/zinc/01/16/16/525011616.db2.gz ISLKRYJPNJJHGG-GHMZBOCLSA-N 0 3 346.412 2.541 20 5 EFBDHN Cc1cc(NC[C@H](O)COCC(C)C)c2cc([N+](=O)[O-])ccc2n1 ZINC000181456760 525274534 /nfs/dbraw/zinc/27/45/34/525274534.db2.gz MKDBTIMBYBNVOC-AWEZNQCLSA-N 0 3 333.388 2.897 20 5 EFBDHN C[C@H](NCCNC(=O)c1c(F)cccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000178655912 525354509 /nfs/dbraw/zinc/35/45/09/525354509.db2.gz FNUUIYUXRAWMHQ-NSHDSACASA-N 0 3 349.337 2.954 20 5 EFBDHN C[C@@H](NCCn1cc([N+](=O)[O-])ccc1=O)c1ccc2c(c1)CCCC2 ZINC000181924625 525470771 /nfs/dbraw/zinc/47/07/71/525470771.db2.gz DOQDQRLDGQEFDF-CQSZACIVSA-N 0 3 341.411 2.986 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)N2CC[C@@H](N3CCCC3)C2)cc1[N+](=O)[O-] ZINC000176746812 525703013 /nfs/dbraw/zinc/70/30/13/525703013.db2.gz XUGKALQVFKTYCR-GDBMZVCRSA-N 0 3 346.431 2.844 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CN3CCC[C@H](OCCO)C3)o2)cc1 ZINC000179573280 534881136 /nfs/dbraw/zinc/88/11/36/534881136.db2.gz CLFSJRWXJIZAHZ-INIZCTEOSA-N 0 3 346.383 2.828 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N2CC[C@H](N3CCCC3)C2)cc1[N+](=O)[O-] ZINC000176746790 525897274 /nfs/dbraw/zinc/89/72/74/525897274.db2.gz XUGKALQVFKTYCR-HOCLYGCPSA-N 0 3 346.431 2.844 20 5 EFBDHN Cc1ccc([C@H](C)NC[C@H](C(C)C)N2CCOCC2)cc1[N+](=O)[O-] ZINC000120078069 525925858 /nfs/dbraw/zinc/92/58/58/525925858.db2.gz LNGGTLOGANQLHV-MAUKXSAKSA-N 0 3 335.448 2.911 20 5 EFBDHN CCCN1CCC[C@H]1CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000343641150 534910293 /nfs/dbraw/zinc/91/02/93/534910293.db2.gz NYRLFXIZYPFBDX-ZDUSSCGKSA-N 0 3 330.388 2.680 20 5 EFBDHN Cc1cc(C(=O)NC2CCN(CCOC(C)C)CC2)ccc1[N+](=O)[O-] ZINC000081995581 526264423 /nfs/dbraw/zinc/26/44/23/526264423.db2.gz OBIXKMXJSLXPHK-UHFFFAOYSA-N 0 3 349.431 2.522 20 5 EFBDHN O=[N+]([O-])c1ccc(CCN2CCC[C@@H](c3nnc4n3CCC4)C2)cc1 ZINC000195521098 527347330 /nfs/dbraw/zinc/34/73/30/527347330.db2.gz VCGXHRRIEIGDIY-OAHLLOKOSA-N 0 3 341.415 2.555 20 5 EFBDHN O=C(NC1CC1)[C@@H](NCCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000066388400 527487480 /nfs/dbraw/zinc/48/74/80/527487480.db2.gz OHWQRUIQMNYMPG-SFHVURJKSA-N 0 3 339.395 2.747 20 5 EFBDHN CCOc1ccc([C@@H](C)NC[C@@]2(O)CCSC2)cc1[N+](=O)[O-] ZINC000154118773 528594792 /nfs/dbraw/zinc/59/47/92/528594792.db2.gz GMMVRNHUJXHEHW-ABAIWWIYSA-N 0 3 326.418 2.512 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000171853260 528996926 /nfs/dbraw/zinc/99/69/26/528996926.db2.gz LEIIVPFBIMYVTD-OAHLLOKOSA-N 0 3 334.420 2.611 20 5 EFBDHN CC(C)Oc1cc(C(=O)N[C@H]2CN(C3CC3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000412182379 534951324 /nfs/dbraw/zinc/95/13/24/534951324.db2.gz JTRSIHYJORCMFI-WFASDCNBSA-N 0 3 347.415 2.595 20 5 EFBDHN CC(C)(C(=O)N1CCC[C@H](N2CCCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000352041907 535019058 /nfs/dbraw/zinc/01/90/58/535019058.db2.gz FRGHPVXZAXSGLL-KRWDZBQOSA-N 0 3 345.443 2.959 20 5 EFBDHN CC(C)(CNCc1ccc([N+](=O)[O-])cc1Cl)C1(O)CCOCC1 ZINC000418122365 535147923 /nfs/dbraw/zinc/14/79/23/535147923.db2.gz FLCSVNLKQYIZCL-UHFFFAOYSA-N 0 3 342.823 2.906 20 5 EFBDHN CCCN1CCC[C@@H]1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000341366484 535362188 /nfs/dbraw/zinc/36/21/88/535362188.db2.gz HPDDGYKMNPOLKH-CQSZACIVSA-N 0 3 325.796 2.739 20 5 EFBDHN CC[C@@H](C(=O)NCc1ccc([N+](=O)[O-])cc1Cl)N(CC)CC ZINC000341341221 535419420 /nfs/dbraw/zinc/41/94/20/535419420.db2.gz FZHCCAMCVDGSDG-AWEZNQCLSA-N 0 3 327.812 2.985 20 5 EFBDHN CCO[C@@H]1C[C@H](NCc2cc([N+](=O)[O-])cc3c2OCOC3)C12CCC2 ZINC000266121938 535506897 /nfs/dbraw/zinc/50/68/97/535506897.db2.gz AFXOHIBYAPQZJR-JKSUJKDBSA-N 0 3 348.399 2.899 20 5 EFBDHN CC[C@@H]1CN(Cc2ccc(Cl)cc2[N+](=O)[O-])CCN1C[C@H](C)O ZINC000246859038 535861445 /nfs/dbraw/zinc/86/14/45/535861445.db2.gz DXBOELMNBGLTHY-SWLSCSKDSA-N 0 3 341.839 2.525 20 5 EFBDHN CN(C)CCOc1cccc(NC(=O)Cc2cccc([N+](=O)[O-])c2)c1 ZINC000358373956 535910781 /nfs/dbraw/zinc/91/07/81/535910781.db2.gz FRQWUEUAWPNCJB-UHFFFAOYSA-N 0 3 343.383 2.716 20 5 EFBDHN CN(C)CCOc1cnccc1CNc1ccc(F)cc1[N+](=O)[O-] ZINC000341022138 535920757 /nfs/dbraw/zinc/92/07/57/535920757.db2.gz AGADAORIVGKKFK-UHFFFAOYSA-N 0 3 334.351 2.681 20 5 EFBDHN CN(C)C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000359794901 535952832 /nfs/dbraw/zinc/95/28/32/535952832.db2.gz OZPHWNHQPPDLTI-INIZCTEOSA-N 0 3 331.347 2.767 20 5 EFBDHN CN(C)C[C@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000359806355 535953190 /nfs/dbraw/zinc/95/31/90/535953190.db2.gz OOCMBJJAJQUIFA-INIZCTEOSA-N 0 3 349.337 2.906 20 5 EFBDHN CCc1cnccc1[C@@H](C)NC[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000343748548 536095770 /nfs/dbraw/zinc/09/57/70/536095770.db2.gz IAWHJKBHZBKLBJ-HIFRSBDPSA-N 0 3 345.399 2.643 20 5 EFBDHN CCc1cnccc1[C@@H](C)NC[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000343748550 536096776 /nfs/dbraw/zinc/09/67/76/536096776.db2.gz IAWHJKBHZBKLBJ-UKRRQHHQSA-N 0 3 345.399 2.643 20 5 EFBDHN CC[C@H]1CN(Cc2ccc(Cl)cc2[N+](=O)[O-])CCN1C[C@H](C)O ZINC000246859053 536154904 /nfs/dbraw/zinc/15/49/04/536154904.db2.gz DXBOELMNBGLTHY-WFASDCNBSA-N 0 3 341.839 2.525 20 5 EFBDHN CN(CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CCc1ccccc1O ZINC000344160677 536307214 /nfs/dbraw/zinc/30/72/14/536307214.db2.gz FSZKGXUYTKXKGT-UHFFFAOYSA-N 0 3 343.383 2.804 20 5 EFBDHN COC1CCC(N(C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000360328492 536731918 /nfs/dbraw/zinc/73/19/18/536731918.db2.gz ZKAYGJUMEZTETP-UHFFFAOYSA-N 0 3 335.404 2.731 20 5 EFBDHN COc1ccc(NC(=O)N(CCN(C)C)CC(C)C)cc1[N+](=O)[O-] ZINC000360392113 536787358 /nfs/dbraw/zinc/78/73/58/536787358.db2.gz WWMIKXJJLLMPPF-UHFFFAOYSA-N 0 3 338.408 2.655 20 5 EFBDHN COc1cc(CN[C@H](CO)C(C)(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000193113184 536812042 /nfs/dbraw/zinc/81/20/42/536812042.db2.gz SQDRZIKUWGNECZ-CYBMUJFWSA-N 0 3 348.346 2.701 20 5 EFBDHN CO[C@@H]1[C@H](C)[C@H](N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1(C)C ZINC000344485850 536816059 /nfs/dbraw/zinc/81/60/59/536816059.db2.gz YEZJINXIYMJGRP-GUYJKWIASA-N 0 3 349.431 2.879 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(C2CCC2)C[C@H](C)C1 ZINC000344725635 536951325 /nfs/dbraw/zinc/95/13/25/536951325.db2.gz GZDKYXVQCUSABT-ZDUSSCGKSA-N 0 3 347.415 2.550 20 5 EFBDHN CCNC(=O)C1(CNCc2ccc([N+](=O)[O-])c(Cl)c2)CCC1 ZINC000754155466 575398835 /nfs/dbraw/zinc/39/88/35/575398835.db2.gz XCAQOPIZWJWCSR-UHFFFAOYSA-N 0 3 325.796 2.644 20 5 EFBDHN C[C@H](NC[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1cccc([N+](=O)[O-])c1 ZINC000754250518 575410744 /nfs/dbraw/zinc/41/07/44/575410744.db2.gz JBXPGHSXVIPXKU-MEDUHNTESA-N 0 3 331.328 2.887 20 5 EFBDHN CC(C)[C@@H](CN(C)C)NC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000754361535 575424965 /nfs/dbraw/zinc/42/49/65/575424965.db2.gz IIARBAJHFDRCQG-IAQYHMDHSA-N 0 3 325.384 2.540 20 5 EFBDHN O=C(CCN[C@@H](CCO)c1cccs1)Nc1ccccc1[N+](=O)[O-] ZINC000754385055 575428844 /nfs/dbraw/zinc/42/88/44/575428844.db2.gz HVFZOSOAGGFBOJ-ZDUSSCGKSA-N 0 3 349.412 2.698 20 5 EFBDHN CC[C@@H](NCC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])[C@H]1CCCO1 ZINC000754520690 575446532 /nfs/dbraw/zinc/44/65/32/575446532.db2.gz WDUUZBFQQGTLCG-BXUZGUMPSA-N 0 3 341.795 2.734 20 5 EFBDHN CC(C)OCC(=N)NOCc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000760351691 576010038 /nfs/dbraw/zinc/01/00/38/576010038.db2.gz RZUGWOLCRJNTJI-UHFFFAOYSA-N 0 3 334.332 2.673 20 5 EFBDHN C[C@H]1CCCN1CCNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000762720860 576327455 /nfs/dbraw/zinc/32/74/55/576327455.db2.gz DLXCVQXKLLXYSG-LBPRGKRZSA-N 0 3 337.395 2.612 20 5 EFBDHN C[C@@H](NC[C@@H](O)COc1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000765289192 577027714 /nfs/dbraw/zinc/02/77/14/577027714.db2.gz MVKIVDOEWIVNJT-MLGOLLRUSA-N 0 3 334.347 2.824 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](CN(C)C)C(C)C ZINC000765517234 577049942 /nfs/dbraw/zinc/04/99/42/577049942.db2.gz WBWXFHDDIGJNHT-WBVHZDCISA-N 0 3 335.448 2.866 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](CN(C)C)C(C)C ZINC000765517228 577050090 /nfs/dbraw/zinc/05/00/90/577050090.db2.gz WBWXFHDDIGJNHT-NVXWUHKLSA-N 0 3 335.448 2.866 20 5 EFBDHN CS[C@@H]1CN(c2nc3ccc([N+](=O)[O-])cc3s2)C[C@H]1N(C)C ZINC000767292985 577202962 /nfs/dbraw/zinc/20/29/62/577202962.db2.gz WHTJVWREZAJDTO-DGCLKSJQSA-N 0 3 338.458 2.686 20 5 EFBDHN CN1CCC2(CCCN2C(=S)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000768287564 577264460 /nfs/dbraw/zinc/26/44/60/577264460.db2.gz RVGJNZTZFSXYGS-UHFFFAOYSA-N 0 3 334.445 2.852 20 5 EFBDHN C[C@H](CN1CCOCC1)NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000726607606 577375444 /nfs/dbraw/zinc/37/54/44/577375444.db2.gz UXDAYABDROZCNO-CQSZACIVSA-N 0 3 345.399 2.665 20 5 EFBDHN CC1(C)CCCN(CCNC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C1 ZINC000769708288 577379888 /nfs/dbraw/zinc/37/98/88/577379888.db2.gz RYQMCNCECBAHJR-RMKNXTFCSA-N 0 3 331.416 2.846 20 5 EFBDHN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NCCN1CCCC(C)(C)C1 ZINC000769706548 577379921 /nfs/dbraw/zinc/37/99/21/577379921.db2.gz XTNKPCKXDACJBB-UHFFFAOYSA-N 0 3 348.447 2.513 20 5 EFBDHN O=[N+]([O-])c1ccc([C@@H](O)CN2CC[C@@]3(C2)OCc2ccccc23)cc1 ZINC000770689220 581126144 /nfs/dbraw/zinc/12/61/44/581126144.db2.gz PMVDYDYDYOAZIX-OALUTQOASA-N 0 3 340.379 2.760 20 5 EFBDHN CCN(CC)CCOC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000772066192 581277793 /nfs/dbraw/zinc/27/77/93/581277793.db2.gz OPDAUNGOCMEMNG-UHFFFAOYSA-N 0 3 339.348 2.618 20 5 EFBDHN O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2NCc2ccccc2[N+](=O)[O-])n1 ZINC000774224027 581487522 /nfs/dbraw/zinc/48/75/22/581487522.db2.gz GRRLFHZLBKYXAR-DZGCQCFKSA-N 0 3 345.359 2.973 20 5 EFBDHN O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2NCc2ccc([N+](=O)[O-])cc2)n1 ZINC000774232464 581487741 /nfs/dbraw/zinc/48/77/41/581487741.db2.gz YTKXSFHCKHWKLA-HUUCEWRRSA-N 0 3 345.359 2.973 20 5 EFBDHN C[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824606212 607983295 /nfs/dbraw/zinc/98/32/95/607983295.db2.gz OTOMYVCFWMTJFA-GFCCVEGCSA-N 0 3 338.371 2.668 20 5 EFBDHN C[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824606212 607983296 /nfs/dbraw/zinc/98/32/96/607983296.db2.gz OTOMYVCFWMTJFA-GFCCVEGCSA-N 0 3 338.371 2.668 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NCCc1nnc2ccccn21 ZINC000850422269 1250477872 /nfs/dbraw/zinc/47/78/72/1250477872.db2.gz KTYCATCBJUHHND-LBPRGKRZSA-N 0 3 341.371 2.539 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NCCCNc1ncccn1 ZINC000850439547 1250485653 /nfs/dbraw/zinc/48/56/53/1250485653.db2.gz LRUBTYYAHFINAE-LBPRGKRZSA-N 0 3 331.376 2.546 20 5 EFBDHN CCCn1nccc1C(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000851108069 1250801954 /nfs/dbraw/zinc/80/19/54/1250801954.db2.gz IZDKCOZHJDXWII-NHYWBVRUSA-N 0 3 335.335 2.996 20 5 EFBDHN CN(CC(=O)NC/C=C/CNc1ccc([N+](=O)[O-])cc1)CC(C)(C)C ZINC001107513698 1256021324 /nfs/dbraw/zinc/02/13/24/1256021324.db2.gz JTRZCCBVDJDURD-AATRIKPKSA-N 0 3 348.447 2.657 20 5 EFBDHN Cc1cocc1C(=O)N1CCC(NCc2csc([N+](=O)[O-])c2)CC1 ZINC000996889543 1256357838 /nfs/dbraw/zinc/35/78/38/1256357838.db2.gz NIVPMLTXPUZQOF-UHFFFAOYSA-N 0 3 349.412 2.952 20 5 EFBDHN Cc1c(F)cccc1C(=O)NCCNCc1ccc([N+](=O)[O-])cc1 ZINC001127823309 1256404277 /nfs/dbraw/zinc/40/42/77/1256404277.db2.gz XGNFLMKVBPAYJC-UHFFFAOYSA-N 0 3 331.347 2.562 20 5 EFBDHN O=C(C1CC2(CC2)C1)N1CCC(NCc2csc([N+](=O)[O-])c2)CC1 ZINC000996988800 1256620514 /nfs/dbraw/zinc/62/05/14/1256620514.db2.gz LSNINPVFPAGOTM-UHFFFAOYSA-N 0 3 349.456 2.927 20 5 EFBDHN Cc1cccc(C(=O)NCCNCc2ccc([N+](=O)[O-])cc2)c1F ZINC001127865732 1256802104 /nfs/dbraw/zinc/80/21/04/1256802104.db2.gz NGQXDIDWZZHTAC-UHFFFAOYSA-N 0 3 331.347 2.562 20 5 EFBDHN CCCC(=O)N1CCC(CNCc2csc([N+](=O)[O-])c2)CC1 ZINC000997473022 1257702894 /nfs/dbraw/zinc/70/28/94/1257702894.db2.gz QLNVJZIWTXMZJX-UHFFFAOYSA-N 0 3 325.434 2.785 20 5 EFBDHN Cc1scc(C(=O)NCCNCc2ccc([N+](=O)[O-])cc2)c1C ZINC001128118570 1261266218 /nfs/dbraw/zinc/26/62/18/1261266218.db2.gz WYTLHVQHJUZICT-UHFFFAOYSA-N 0 3 333.413 2.793 20 5 EFBDHN CSc1ccc(C(=O)N2[C@@H]3CC[C@H]2CN(C)CC3)cc1[N+](=O)[O-] ZINC000923313080 1261445978 /nfs/dbraw/zinc/44/59/78/1261445978.db2.gz STHNKAPPQZCGJJ-OLZOCXBDSA-N 0 3 335.429 2.625 20 5 EFBDHN CC1(C)CCN(CCNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000890082078 1261463950 /nfs/dbraw/zinc/46/39/50/1261463950.db2.gz QINKOTMNKYMRJF-UHFFFAOYSA-N 0 3 325.796 2.710 20 5 EFBDHN CCC(=O)N1CCC2(C1)CCN(Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001040559156 1264544897 /nfs/dbraw/zinc/54/48/97/1264544897.db2.gz KMNCBMNDTIIFTG-UHFFFAOYSA-N 0 3 331.416 2.819 20 5 EFBDHN CCC(=O)N1CCC2(C1)CCN(Cc1ccccc1[N+](=O)[O-])CC2 ZINC001040559160 1264546095 /nfs/dbraw/zinc/54/60/95/1264546095.db2.gz KTIWZBNFIBIAQN-UHFFFAOYSA-N 0 3 331.416 2.819 20 5 EFBDHN Cc1cccc(C)c1CC(=O)NCCNCc1ccc([N+](=O)[O-])cc1 ZINC001128395460 1264583917 /nfs/dbraw/zinc/58/39/17/1264583917.db2.gz KWPCZNLYZHGPLI-UHFFFAOYSA-N 0 3 341.411 2.660 20 5 EFBDHN CCc1cc(CNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000738431430 1268462278 /nfs/dbraw/zinc/46/22/78/1268462278.db2.gz RBWUSDRVAUOATD-UHFFFAOYSA-N 0 3 340.387 2.571 20 5 EFBDHN O=C(C1CC1)N1CCC(NCc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000740003095 1268788042 /nfs/dbraw/zinc/78/80/42/1268788042.db2.gz UUGPEBLMBCNJII-UHFFFAOYSA-N 0 3 337.807 2.739 20 5 EFBDHN Cc1occc1C(=O)NC[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001086024730 1269565358 /nfs/dbraw/zinc/56/53/58/1269565358.db2.gz HIDIJXUZGQPXGG-OTVXOJSOSA-N 0 3 343.383 2.794 20 5 EFBDHN O=C(NC[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1)[C@H]1C[C@H]2C[C@H]2C1 ZINC001086454592 1271562313 /nfs/dbraw/zinc/56/23/13/1271562313.db2.gz WGVWXGWKZWJLEI-FKJNJTITSA-N 0 3 343.427 2.625 20 5 EFBDHN CN(C)Cc1ccc(-c2noc(-c3ccc([N+](=O)[O-])nc3)n2)cc1 ZINC001212581291 1272434730 /nfs/dbraw/zinc/43/47/30/1272434730.db2.gz AHYOOLMXXPGQGP-UHFFFAOYSA-N 0 3 325.328 2.768 20 5 EFBDHN O=[N+]([O-])C[C@H]1CC[C@H](N2CCN(c3ccc(F)c(F)c3)CC2)C1 ZINC001169007428 1272580316 /nfs/dbraw/zinc/58/03/16/1272580316.db2.gz NQPWCQVTRIREFS-STQMWFEESA-N 0 3 325.359 2.532 20 5 EFBDHN O=[N+]([O-])C[C@H]1CC[C@@H](N2CCN(C/C=C/c3ccccc3)CC2)C1 ZINC001169009339 1272583014 /nfs/dbraw/zinc/58/30/14/1272583014.db2.gz VTNXXTQXYUIQEC-BBDZXRDTSA-N 0 3 329.444 2.763 20 5 EFBDHN O=[N+]([O-])C[C@H]1CC[C@H](NCc2cc(O)ccc2Br)C1 ZINC001168988161 1272588500 /nfs/dbraw/zinc/58/85/00/1272588500.db2.gz OOYFHHOMIOIYAG-ONGXEEELSA-N 0 3 329.194 2.690 20 5 EFBDHN COc1ccc(-c2nc(CN[C@H]3CC[C@@H](C[N+](=O)[O-])C3)co2)cc1 ZINC001168987924 1272589261 /nfs/dbraw/zinc/58/92/61/1272589261.db2.gz LIMATWMPWIQEMS-OCCSQVGLSA-N 0 3 331.372 2.885 20 5 EFBDHN O=[N+]([O-])C[C@@H]1CC[C@@H](N2CCN(Cc3ccccc3Cl)CC2)C1 ZINC001169028415 1272591853 /nfs/dbraw/zinc/59/18/53/1272591853.db2.gz RYEJZPHRRUPMCI-GDBMZVCRSA-N 0 3 337.851 2.903 20 5 EFBDHN CC(C)(C)OC(=O)N1CCN([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC12CC2 ZINC001169036452 1272601694 /nfs/dbraw/zinc/60/16/94/1272601694.db2.gz OLWSKCASRLIRTP-KGLIPLIRSA-N 0 3 339.436 2.517 20 5 EFBDHN O=[N+]([O-])C[C@@H]1CC[C@H](N2CCN(Cc3ccc(Cl)cc3)CC2)C1 ZINC001169037559 1272604280 /nfs/dbraw/zinc/60/42/80/1272604280.db2.gz SMIBNSRVQDYCMB-WBVHZDCISA-N 0 3 337.851 2.903 20 5 EFBDHN O=[N+]([O-])C[C@@H]1CC[C@@H](N2CCN(c3nccc4ccccc43)CC2)C1 ZINC001169038001 1272606522 /nfs/dbraw/zinc/60/65/22/1272606522.db2.gz UZQNFJNFJIMXPR-NVXWUHKLSA-N 0 3 340.427 2.802 20 5 EFBDHN O=[N+]([O-])C[C@H]1CC[C@@H](N2C[C@@H]3C[C@H](C2)c2cc4nccnc4cc23)C1 ZINC001169040196 1272609666 /nfs/dbraw/zinc/60/96/66/1272609666.db2.gz YPNHLKUTBNONDZ-BYNSBNAKSA-N 0 3 338.411 2.962 20 5 EFBDHN O=[N+]([O-])C[C@@H]1CC[C@H](N2CCN(c3ccc4ccccc4n3)CC2)C1 ZINC001169040013 1272610384 /nfs/dbraw/zinc/61/03/84/1272610384.db2.gz WXWHXFIPWLOFJV-WBVHZDCISA-N 0 3 340.427 2.802 20 5 EFBDHN CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H]1CN2[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169041599 1272612972 /nfs/dbraw/zinc/61/29/72/1272612972.db2.gz BLEHFJISZGPSGN-AJNGGQMLSA-N 0 3 339.436 2.516 20 5 EFBDHN CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H]1CN2[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169041605 1272613151 /nfs/dbraw/zinc/61/31/51/1272613151.db2.gz BLEHFJISZGPSGN-XGUBFFRZSA-N 0 3 339.436 2.516 20 5 EFBDHN C[C@H](N)c1ccn(-c2ccc(C(=O)OC(C)(C)C)c([N+](=O)[O-])c2)n1 ZINC001169234267 1272748308 /nfs/dbraw/zinc/74/83/08/1272748308.db2.gz WMUOVVXLBVIDSX-JTQLQIEISA-N 0 3 332.360 2.756 20 5 EFBDHN CN(CCCNc1ccc([N+](=O)[O-])cc1)C(=O)CN1CCC(C)(C)C1 ZINC001109623496 1274481219 /nfs/dbraw/zinc/48/12/19/1274481219.db2.gz ZIHKSOPBAZMJNS-UHFFFAOYSA-N 0 3 348.447 2.587 20 5 EFBDHN O=C(CC1(C(F)(F)F)CC1)NCCNCc1ccc([N+](=O)[O-])cc1 ZINC001129231437 1275196630 /nfs/dbraw/zinc/19/66/30/1275196630.db2.gz VQDKIOZDGXNPSI-UHFFFAOYSA-N 0 3 345.321 2.533 20 5 EFBDHN C[C@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc(N2CCNC2=O)cc1 ZINC000786833569 1275537811 /nfs/dbraw/zinc/53/78/11/1275537811.db2.gz LIPHOJISLWGUNR-ZDUSSCGKSA-N 0 3 340.383 2.975 20 5 EFBDHN COc1ccc(C[C@@H](C)NCC(=O)NC2CCCCC2)c([N+](=O)[O-])c1 ZINC001170296609 1278980866 /nfs/dbraw/zinc/98/08/66/1278980866.db2.gz GLJIYQINVOXZJA-CYBMUJFWSA-N 0 3 349.431 2.573 20 5 EFBDHN COc1ccc(C[C@H](C)NCc2ncn3ccccc23)c([N+](=O)[O-])c1 ZINC001170325443 1279015979 /nfs/dbraw/zinc/01/59/79/1279015979.db2.gz VJSRLHWCGRRLBV-ZDUSSCGKSA-N 0 3 340.383 2.972 20 5 EFBDHN COc1ccc(C[C@H](C)NCc2cc3ccccn3n2)c([N+](=O)[O-])c1 ZINC001170326811 1279017688 /nfs/dbraw/zinc/01/76/88/1279017688.db2.gz NQWAUOSTOZKGFD-ZDUSSCGKSA-N 0 3 340.383 2.972 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2ccc(CNCCO[C@@H]3CCOC3)o2)c1 ZINC000922938829 1276364469 /nfs/dbraw/zinc/36/44/69/1276364469.db2.gz IRGZNBTWMQORMZ-MRXNPFEDSA-N 0 3 332.356 2.750 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CNCCO[C@@H]3CCOC3)o2)cc1 ZINC000922939473 1276365010 /nfs/dbraw/zinc/36/50/10/1276365010.db2.gz PHYYEALNEUQUKT-MRXNPFEDSA-N 0 3 332.356 2.750 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CNCCO[C@H]3CCOC3)o2)cc1 ZINC000922939472 1276365564 /nfs/dbraw/zinc/36/55/64/1276365564.db2.gz PHYYEALNEUQUKT-INIZCTEOSA-N 0 3 332.356 2.750 20 5 EFBDHN COc1ccc(C[C@H](C)N2CC(N3CCCCC3)C2)c([N+](=O)[O-])c1 ZINC001170352871 1279031650 /nfs/dbraw/zinc/03/16/50/1279031650.db2.gz SIRDWDGHRGHJAX-AWEZNQCLSA-N 0 3 333.432 2.705 20 5 EFBDHN CC1(C(=O)NCCCNCc2ccccc2[N+](=O)[O-])CC(F)(F)C1 ZINC001170894125 1276500888 /nfs/dbraw/zinc/50/08/88/1276500888.db2.gz LWUPZVDLBCMPKR-UHFFFAOYSA-N 0 3 341.358 2.626 20 5 EFBDHN CC(C)Oc1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cn1 ZINC000818960835 1276560755 /nfs/dbraw/zinc/56/07/55/1276560755.db2.gz JVKVZDLGYILKBN-MRXNPFEDSA-N 0 3 331.372 2.600 20 5 EFBDHN CC[C@H](C)Oc1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)ccn1 ZINC000819216509 1276693223 /nfs/dbraw/zinc/69/32/23/1276693223.db2.gz VFYAOOXOQLPXRU-GUYCJALGSA-N 0 3 345.399 2.990 20 5 EFBDHN COc1ccc2c(c1)[C@@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)CCO2 ZINC000819233900 1276701482 /nfs/dbraw/zinc/70/14/82/1276701482.db2.gz VCBBEFHOZNPKSZ-DLBZAZTESA-N 0 3 344.367 2.750 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CNCc2ccnc(C(F)(F)F)c2)c1 ZINC000819342837 1276735341 /nfs/dbraw/zinc/73/53/41/1276735341.db2.gz WWSJGHAIYZVKGU-CYBMUJFWSA-N 0 3 341.289 2.832 20 5 EFBDHN CC[C@H](C)N[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000819386744 1276766909 /nfs/dbraw/zinc/76/69/09/1276766909.db2.gz CJIHEPWWZZHQCK-JQFCIGGWSA-N 0 3 347.415 2.940 20 5 EFBDHN CC[C@H](C)N[C@H](CNC[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000819386561 1276767601 /nfs/dbraw/zinc/76/76/01/1276767601.db2.gz AXEQHCOXNIMTKN-IAOVAPTHSA-N 0 3 347.415 2.940 20 5 EFBDHN C[C@H]1CCCN1CCNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000746878039 1277242515 /nfs/dbraw/zinc/24/25/15/1277242515.db2.gz QQJZAEVWTSUMJR-JTQLQIEISA-N 0 3 345.321 2.828 20 5 EFBDHN COCCN(Cn1nc(C)c2cc([N+](=O)[O-])cnc21)[C@@H]1CC[C@H](C)C1 ZINC000790476361 1277586043 /nfs/dbraw/zinc/58/60/43/1277586043.db2.gz CITWHNJQANCTHB-GXTWGEPZSA-N 0 3 347.419 2.742 20 5 EFBDHN O=C(Cc1ccc(F)cc1)NCCCNCc1ccccc1[N+](=O)[O-] ZINC001175042221 1287303918 /nfs/dbraw/zinc/30/39/18/1287303918.db2.gz PFRDZCOQBPKZQL-UHFFFAOYSA-N 0 3 345.374 2.573 20 5 EFBDHN Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@@H]2N(C)CCCC2(C)C)c1F ZINC000791045365 1277928291 /nfs/dbraw/zinc/92/82/91/1277928291.db2.gz VNCPPRVQOBGJJO-AWEZNQCLSA-N 0 3 337.395 2.893 20 5 EFBDHN CN1CCCC(C)(C)[C@H]1CNC(=O)c1cc(F)c([N+](=O)[O-])cc1F ZINC000791060772 1277933966 /nfs/dbraw/zinc/93/39/66/1277933966.db2.gz MPGWWVAZMRPRGP-CQSZACIVSA-N 0 3 341.358 2.723 20 5 EFBDHN COc1ccc(C[C@H](C)N2CCN3CCCC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC001170345045 1279050200 /nfs/dbraw/zinc/05/02/00/1279050200.db2.gz GXHHKOBIRCLOGH-GOEBONIOSA-N 0 3 333.432 2.705 20 5 EFBDHN C[C@@H](c1ccccc1)[C@@H](CO)NCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792878744 1279233120 /nfs/dbraw/zinc/23/31/20/1279233120.db2.gz ZULMYCPBPHIGDO-BLLLJJGKSA-N 0 3 345.355 2.757 20 5 EFBDHN C[C@H](c1ccccc1)[C@@H](CO)NCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792878746 1279233134 /nfs/dbraw/zinc/23/31/34/1279233134.db2.gz ZULMYCPBPHIGDO-MLGOLLRUSA-N 0 3 345.355 2.757 20 5 EFBDHN Cc1n[nH]cc1C1CCN(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000792929827 1279282954 /nfs/dbraw/zinc/28/29/54/1279282954.db2.gz ZINLCGATZSJRNG-QGZVFWFLSA-N 0 3 330.388 2.539 20 5 EFBDHN C[C@@H](CN1CCCC1)OC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000845663240 1279774787 /nfs/dbraw/zinc/77/47/87/1279774787.db2.gz OXOUJXMMIBXPMA-ZDUSSCGKSA-N 0 3 334.372 2.585 20 5 EFBDHN Cc1c(CCC(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])cnn1C ZINC000845873013 1279901201 /nfs/dbraw/zinc/90/12/01/1279901201.db2.gz BCZCKVITCZABOH-SJKOYZFVSA-N 0 3 349.362 2.750 20 5 EFBDHN CC([C@@H](OC(=O)C[C@@H](C)n1cccn1)c1ccccc1F)[N+](=O)[O-] ZINC000845875304 1279901723 /nfs/dbraw/zinc/90/17/23/1279901723.db2.gz BBRCGNIBRCORIM-XHBSWPGZSA-N 0 3 335.335 2.923 20 5 EFBDHN CCc1nn(C)cc1C(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845874823 1279901886 /nfs/dbraw/zinc/90/18/86/1279901886.db2.gz ITZVZVRNLBPRCH-MEBBXXQBSA-N 0 3 335.335 2.685 20 5 EFBDHN CC([C@@H](OC(=O)c1cc(C2CC2)[nH]n1)c1ccccc1F)[N+](=O)[O-] ZINC000845874975 1279902256 /nfs/dbraw/zinc/90/22/56/1279902256.db2.gz KLKFGXZQIJVFBH-BJOHPYRUSA-N 0 3 333.319 2.990 20 5 EFBDHN Cc1ccc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])c(=O)[nH]1 ZINC000845873962 1279902366 /nfs/dbraw/zinc/90/23/66/1279902366.db2.gz GEDFPKLAYVZMJW-HZMBPMFUSA-N 0 3 334.303 2.798 20 5 EFBDHN Cc1ncc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])c(C)n1 ZINC000845875953 1279902382 /nfs/dbraw/zinc/90/23/82/1279902382.db2.gz MFVHAXVGVRKYQZ-BONVTDFDSA-N 0 3 333.319 2.796 20 5 EFBDHN Cc1nccc(CCC(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])n1 ZINC000845875330 1279902469 /nfs/dbraw/zinc/90/24/69/1279902469.db2.gz BIBQIBMAJGRUBZ-APPDUMDISA-N 0 3 347.346 2.806 20 5 EFBDHN CC([C@@H](OC(=O)c1cc2n(n1)CCC2)c1ccccc1F)[N+](=O)[O-] ZINC000845875640 1279902561 /nfs/dbraw/zinc/90/25/61/1279902561.db2.gz ASWONGHJFJFHTG-MEBBXXQBSA-N 0 3 333.319 2.532 20 5 EFBDHN Cc1ncc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])c(C)n1 ZINC000845875952 1279902601 /nfs/dbraw/zinc/90/26/01/1279902601.db2.gz MFVHAXVGVRKYQZ-BMIGLBTASA-N 0 3 333.319 2.796 20 5 EFBDHN CC([C@H](OC(=O)c1cc2n(n1)CCC2)c1ccccc1F)[N+](=O)[O-] ZINC000845875639 1279902610 /nfs/dbraw/zinc/90/26/10/1279902610.db2.gz ASWONGHJFJFHTG-BONVTDFDSA-N 0 3 333.319 2.532 20 5 EFBDHN CCn1cc(CC(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])cn1 ZINC000845876994 1279903241 /nfs/dbraw/zinc/90/32/41/1279903241.db2.gz CUBXCTDLPUDMCO-MEDUHNTESA-N 0 3 335.335 2.534 20 5 EFBDHN CC([C@@H](OC(=O)[C@H]1CSCCS1)c1ccccc1F)[N+](=O)[O-] ZINC000845876722 1279903255 /nfs/dbraw/zinc/90/32/55/1279903255.db2.gz OATUOBHVYZNOEW-OASPWFOLSA-N 0 3 345.417 2.924 20 5 EFBDHN CC([C@@H](OC(=O)c1cnn(C)c1Cl)c1ccccc1F)[N+](=O)[O-] ZINC000845877616 1279903462 /nfs/dbraw/zinc/90/34/62/1279903462.db2.gz FPDJOYJSQFBSKC-QPUJVOFHSA-N 0 3 341.726 2.776 20 5 EFBDHN CC([C@@H](OC(=O)[C@@H]1C[C@H]1c1cnn(C)c1)c1ccccc1F)[N+](=O)[O-] ZINC000845877682 1279903517 /nfs/dbraw/zinc/90/35/17/1279903517.db2.gz FZOMMSSPJYOMMM-YZOIGVHSSA-N 0 3 347.346 2.612 20 5 EFBDHN CC([C@@H](OC(=O)c1cc2n(n1)CCCC2)c1ccccc1F)[N+](=O)[O-] ZINC000845882323 1279904133 /nfs/dbraw/zinc/90/41/33/1279904133.db2.gz OMEXSYATBZLXTC-MEDUHNTESA-N 0 3 347.346 2.922 20 5 EFBDHN CC([C@H](OC(=O)C[C@@H](C)n1ccnc1)c1ccccc1F)[N+](=O)[O-] ZINC000845882332 1279904711 /nfs/dbraw/zinc/90/47/11/1279904711.db2.gz SRRJKLISPKCXFS-HSMVNMDESA-N 0 3 335.335 2.923 20 5 EFBDHN CC([C@@H](OC(=O)[C@H](C)Oc1ccccn1)c1ccccc1F)[N+](=O)[O-] ZINC000845882352 1279904911 /nfs/dbraw/zinc/90/49/11/1279904911.db2.gz ONPVPYQDTQEVBE-BFQNTYOBSA-N 0 3 348.330 2.938 20 5 EFBDHN CCn1ccc(CC(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])n1 ZINC000845883097 1279905568 /nfs/dbraw/zinc/90/55/68/1279905568.db2.gz YNPBJUVJUQFOEE-BDJLRTHQSA-N 0 3 335.335 2.534 20 5 EFBDHN CCn1ccc(CC(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])n1 ZINC000845883100 1279905764 /nfs/dbraw/zinc/90/57/64/1279905764.db2.gz YNPBJUVJUQFOEE-ZBEGNZNMSA-N 0 3 335.335 2.534 20 5 EFBDHN CC([C@@H](OC(=O)[C@H](C)Oc1ccccn1)c1ccccc1F)[N+](=O)[O-] ZINC000845882356 1279906120 /nfs/dbraw/zinc/90/61/20/1279906120.db2.gz ONPVPYQDTQEVBE-MQIPJXDCSA-N 0 3 348.330 2.938 20 5 EFBDHN COc1ccnc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])c1 ZINC000845882410 1279906162 /nfs/dbraw/zinc/90/61/62/1279906162.db2.gz UJYOHZWNDROKNX-BMIGLBTASA-N 0 3 334.303 2.793 20 5 EFBDHN CC([C@H](OC(=O)[C@H](C)Oc1ccccn1)c1ccccc1F)[N+](=O)[O-] ZINC000845882354 1279906400 /nfs/dbraw/zinc/90/64/00/1279906400.db2.gz ONPVPYQDTQEVBE-MKBNYLNASA-N 0 3 348.330 2.938 20 5 EFBDHN CC([C@H](OC(=O)c1cc(Cl)n(C)n1)c1ccccc1F)[N+](=O)[O-] ZINC000845882070 1279906506 /nfs/dbraw/zinc/90/65/06/1279906506.db2.gz NVAYYAXDBYGZAJ-OQPBUACISA-N 0 3 341.726 2.776 20 5 EFBDHN CC([C@H](OC(=O)[C@H](C)Cc1cnn(C)c1)c1ccccc1F)[N+](=O)[O-] ZINC000845883198 1279906561 /nfs/dbraw/zinc/90/65/61/1279906561.db2.gz ZVDBGCNXMCJQLL-HSMVNMDESA-N 0 3 349.362 2.688 20 5 EFBDHN CCc1nncn1CCN[C@@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872040964 1287409709 /nfs/dbraw/zinc/40/97/09/1287409709.db2.gz OPXFVAOXUCZWNG-NSHDSACASA-N 0 3 335.433 2.821 20 5 EFBDHN CCN(CC)CC(=O)NC[C@H]1C[C@@H](Nc2cc(C)ccc2[N+](=O)[O-])C1 ZINC001091350288 1280384073 /nfs/dbraw/zinc/38/40/73/1280384073.db2.gz KUYUGOAOFKLGJX-GASCZTMLSA-N 0 3 348.447 2.552 20 5 EFBDHN O=C(NCCCNCc1ccccc1[N+](=O)[O-])c1cc(F)cc(F)c1 ZINC001175415620 1287420855 /nfs/dbraw/zinc/42/08/55/1287420855.db2.gz NOHSDVPMHXZCPH-UHFFFAOYSA-N 0 3 349.337 2.783 20 5 EFBDHN Cc1cc(C(=O)NCCNCc2ccc([N+](=O)[O-])cc2)c(F)cc1F ZINC001130109215 1280471491 /nfs/dbraw/zinc/47/14/91/1280471491.db2.gz DRSMDXVRWVHMSL-UHFFFAOYSA-N 0 3 349.337 2.701 20 5 EFBDHN O=C(NCCNCc1cccc([N+](=O)[O-])c1)C1(C(F)(F)F)CCC1 ZINC001130316078 1280700853 /nfs/dbraw/zinc/70/08/53/1280700853.db2.gz XYWAYZKHGGZECZ-UHFFFAOYSA-N 0 3 345.321 2.533 20 5 EFBDHN CCN(CC)CC(=O)NC[C@H]1C[C@H](Nc2cc(C)ccc2[N+](=O)[O-])C1 ZINC001091458971 1280736866 /nfs/dbraw/zinc/73/68/66/1280736866.db2.gz KUYUGOAOFKLGJX-SHTZXODSSA-N 0 3 348.447 2.552 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(N[C@H]2C[C@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001091462304 1280742931 /nfs/dbraw/zinc/74/29/31/1280742931.db2.gz LEKKCSQOADJGSF-SHTZXODSSA-N 0 3 348.447 2.550 20 5 EFBDHN Cc1cc(N[C@H]2C[C@H](CNC(=O)CN(C)C(C)C)C2)ccc1[N+](=O)[O-] ZINC001091462317 1280743283 /nfs/dbraw/zinc/74/32/83/1280743283.db2.gz LSBNFDMOLIDBQD-KOMQPUFPSA-N 0 3 348.447 2.550 20 5 EFBDHN CC[C@H](C)N[C@@H](CNC(=O)c1ccc(N)c([N+](=O)[O-])c1)c1ccco1 ZINC000807681125 1281388461 /nfs/dbraw/zinc/38/84/61/1281388461.db2.gz ZBQGCJMVGSYAMV-FZMZJTMJSA-N 0 3 346.387 2.629 20 5 EFBDHN CC(C)(C(=O)NCCNCc1cccc([N+](=O)[O-])c1)c1cccs1 ZINC001132331030 1283341661 /nfs/dbraw/zinc/34/16/61/1283341661.db2.gz JAOBCLHNLCGALL-UHFFFAOYSA-N 0 3 347.440 2.840 20 5 EFBDHN C[C@@H](NCc1ccc2cnn(C)c2c1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815628198 1287645281 /nfs/dbraw/zinc/64/52/81/1287645281.db2.gz UHLRWWRLBKWKAX-LLVKDONJSA-N 0 3 325.372 2.915 20 5 EFBDHN O=C(NCCNCc1ccc([N+](=O)[O-])cc1)c1ccc2[nH]ccc2c1 ZINC001133136167 1284852668 /nfs/dbraw/zinc/85/26/68/1284852668.db2.gz JQXXKMXUDFLTJR-UHFFFAOYSA-N 0 3 338.367 2.596 20 5 EFBDHN Cc1ccc(-n2nc(C(=O)OCC(C)[N+](=O)[O-])c3c2CCC3)c(F)c1 ZINC000813104550 1285653585 /nfs/dbraw/zinc/65/35/85/1285653585.db2.gz DRJFCLWNDPWKLM-NSHDSACASA-N 0 3 347.346 2.631 20 5 EFBDHN Cc1ccc(OCc2cccc(C(=O)OCC(C)[N+](=O)[O-])c2)cn1 ZINC000813101526 1285653898 /nfs/dbraw/zinc/65/38/98/1285653898.db2.gz CTJDQWLVOKRZMY-ZDUSSCGKSA-N 0 3 330.340 2.791 20 5 EFBDHN CC(COC(=O)c1ccc(-n2cnc3ccccc32)cc1)[N+](=O)[O-] ZINC000813103244 1285653918 /nfs/dbraw/zinc/65/39/18/1285653918.db2.gz ZHGAELZFIWFVKW-GFCCVEGCSA-N 0 3 325.324 2.848 20 5 EFBDHN CC(COC(=O)c1cc(NC(=O)C(C)(C)C)ccc1F)[N+](=O)[O-] ZINC000813105572 1285653995 /nfs/dbraw/zinc/65/39/95/1285653995.db2.gz PDTGJIHQJRSASB-VIFPVBQESA-N 0 3 326.324 2.632 20 5 EFBDHN Cc1ccc(-n2nc(C(=O)OCC(C)[N+](=O)[O-])c3c2CCCC3)cc1 ZINC000813102369 1285654025 /nfs/dbraw/zinc/65/40/25/1285654025.db2.gz QAOZJJHQSMQSKL-CYBMUJFWSA-N 0 3 343.383 2.882 20 5 EFBDHN CC(C)CC(=O)Nc1ccc(C(=O)OCC(C)[N+](=O)[O-])cc1F ZINC000813104151 1285655195 /nfs/dbraw/zinc/65/51/95/1285655195.db2.gz XAFHCNSASVSHHC-JTQLQIEISA-N 0 3 326.324 2.632 20 5 EFBDHN CC(COC(=O)c1cc2sc(N3CCCC3)nc2s1)[N+](=O)[O-] ZINC000813105946 1285656651 /nfs/dbraw/zinc/65/66/51/1285656651.db2.gz VZJCYSWLARWFRM-QMMMGPOBSA-N 0 3 341.414 2.780 20 5 EFBDHN Cc1nc(COc2ccccc2C(=O)OCC(C)[N+](=O)[O-])cs1 ZINC000813106621 1285678868 /nfs/dbraw/zinc/67/88/68/1285678868.db2.gz FIMQTLPWXNHRDD-JTQLQIEISA-N 0 3 336.369 2.853 20 5 EFBDHN CC(COC(=O)c1cccc(CNC(=O)OC(C)(C)C)c1)[N+](=O)[O-] ZINC000813107293 1285679653 /nfs/dbraw/zinc/67/96/53/1285679653.db2.gz LVTJQDBFHIQLHY-NSHDSACASA-N 0 3 338.360 2.533 20 5 EFBDHN CC(COC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)[N+](=O)[O-] ZINC000813108686 1285680645 /nfs/dbraw/zinc/68/06/45/1285680645.db2.gz KAJRMFDPPPEZBC-QMMMGPOBSA-N 0 3 337.313 2.540 20 5 EFBDHN CC(COC(=O)c1ccccc1NC(=O)c1ccsc1)[N+](=O)[O-] ZINC000813109412 1285682440 /nfs/dbraw/zinc/68/24/40/1285682440.db2.gz RZEAATGTUPKRBV-JTQLQIEISA-N 0 3 334.353 2.822 20 5 EFBDHN CC(COC(=O)COc1ccc(C(=O)c2ccccc2)cc1)[N+](=O)[O-] ZINC000813109691 1285682950 /nfs/dbraw/zinc/68/29/50/1285682950.db2.gz NUULUMHZPOCCPT-CYBMUJFWSA-N 0 3 343.335 2.505 20 5 EFBDHN COC(=O)c1ccccc1-c1ccccc1C(=O)OCC(C)[N+](=O)[O-] ZINC000813113154 1285684003 /nfs/dbraw/zinc/68/40/03/1285684003.db2.gz BMCIBUWLMAASCU-LBPRGKRZSA-N 0 3 343.335 2.962 20 5 EFBDHN COc1cccc(C(=O)c2ccc(C(=O)OCC(C)[N+](=O)[O-])cc2)c1 ZINC000813114905 1285685175 /nfs/dbraw/zinc/68/51/75/1285685175.db2.gz XMWZUZNSVQMOMA-GFCCVEGCSA-N 0 3 343.335 2.748 20 5 EFBDHN CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)OCC(C)[N+](=O)[O-])O[C@H](C)C2 ZINC000813115694 1285686048 /nfs/dbraw/zinc/68/60/48/1285686048.db2.gz YBFIHVNHJNJYRL-WJNVRWDZSA-N 0 3 349.383 2.721 20 5 EFBDHN O=C(NCCN1CCCC1)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000813378968 1285871062 /nfs/dbraw/zinc/87/10/62/1285871062.db2.gz UOEFMLXNZNRZQO-UHFFFAOYSA-N 0 3 332.187 2.727 20 5 EFBDHN CN(C)C[C@@H](NC(=O)c1cc(F)ccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000813619308 1286026414 /nfs/dbraw/zinc/02/64/14/1286026414.db2.gz RXWVKBMJJOWABT-OAHLLOKOSA-N 0 3 349.337 2.906 20 5 EFBDHN NC(=O)[C@H](N[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccccc1 ZINC001172908830 1286311264 /nfs/dbraw/zinc/31/12/64/1286311264.db2.gz ZPIPPRYIFRMTCR-SJLPKXTDSA-N 0 3 339.395 2.658 20 5 EFBDHN Cc1nc2c(n1[C@@H]1CCc3ccc([N+](=O)[O-])cc3CC1)CNCC2 ZINC001172921004 1286328902 /nfs/dbraw/zinc/32/89/02/1286328902.db2.gz NTNYUOLRCHPGSY-OAHLLOKOSA-N 0 3 326.400 2.866 20 5 EFBDHN O=C(CN[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1cccnc1 ZINC001172912745 1286352866 /nfs/dbraw/zinc/35/28/66/1286352866.db2.gz OZAKSJJNMQUYHY-MRXNPFEDSA-N 0 3 325.368 2.710 20 5 EFBDHN COc1ccc(CN[C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])nc1 ZINC001173190849 1286457751 /nfs/dbraw/zinc/45/77/51/1286457751.db2.gz HYWWEWWQGGQYEZ-NSHDSACASA-N 0 3 349.362 2.867 20 5 EFBDHN CC(C)Oc1cc(CN[C@H](C)Cc2ccc([N+](=O)[O-])cc2)ncn1 ZINC001173225608 1286480693 /nfs/dbraw/zinc/48/06/93/1286480693.db2.gz STMWAFATPVJYNB-CYBMUJFWSA-N 0 3 330.388 2.893 20 5 EFBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[C@@H](Oc2ncc(F)cn2)C1 ZINC001173238320 1286495673 /nfs/dbraw/zinc/49/56/73/1286495673.db2.gz PHWBACCWTURABT-MLGOLLRUSA-N 0 3 346.362 2.608 20 5 EFBDHN Cc1cnc(O[C@H]2CCN([C@H](C)Cc3ccc([N+](=O)[O-])cc3)C2)nc1 ZINC001173238584 1286495729 /nfs/dbraw/zinc/49/57/29/1286495729.db2.gz VVGLUOOQBSEUDY-PBHICJAKSA-N 0 3 342.399 2.778 20 5 EFBDHN CCN(C)C(C)(C)C(=O)N1CCC(Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC001095241556 1286732129 /nfs/dbraw/zinc/73/21/29/1286732129.db2.gz KAQCMABOJXXECE-UHFFFAOYSA-N 0 3 348.447 2.728 20 5 EFBDHN CCc1ccc(CC(=O)NCCNCc2ccc([N+](=O)[O-])cc2)cc1 ZINC001134491563 1286809928 /nfs/dbraw/zinc/80/99/28/1286809928.db2.gz WRGHGRIWHFDDAP-UHFFFAOYSA-N 0 3 341.411 2.606 20 5 EFBDHN CC(C)c1nc(C(=O)NCCNCc2cccc([N+](=O)[O-])c2)cs1 ZINC001135368411 1287977989 /nfs/dbraw/zinc/97/79/89/1287977989.db2.gz BRDCKJQPXATCIW-UHFFFAOYSA-N 0 3 348.428 2.694 20 5 EFBDHN Cc1ccc(C(=O)NCCCNCc2ccccc2[N+](=O)[O-])c(C)n1 ZINC001176817367 1288135183 /nfs/dbraw/zinc/13/51/83/1288135183.db2.gz FAUPOGOKXMJTBP-UHFFFAOYSA-N 0 3 342.399 2.516 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@@H](C2CC2)[C@]2(CO)CCCO2)cc1Cl ZINC000816667567 1288236299 /nfs/dbraw/zinc/23/62/99/1288236299.db2.gz PXVRRKWSJVOCIU-JKSUJKDBSA-N 0 3 340.807 2.658 20 5 EFBDHN Cc1cc([N+](=O)[O-])c(C(=O)N(C)C[C@@H]2CCCN2C)cc1Cl ZINC000817496784 1288636896 /nfs/dbraw/zinc/63/68/96/1288636896.db2.gz VOUILPCTINULMC-NSHDSACASA-N 0 3 325.796 2.723 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@H]1CCN(C(C)C)C1 ZINC000822161539 1288895502 /nfs/dbraw/zinc/89/55/02/1288895502.db2.gz ZUVPTDBTHLGPJR-ZDUSSCGKSA-N 0 3 337.445 2.871 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@@H]1CCN(C(C)C)C1 ZINC000822161538 1288895733 /nfs/dbraw/zinc/89/57/33/1288895733.db2.gz ZUVPTDBTHLGPJR-CYBMUJFWSA-N 0 3 337.445 2.871 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NC[C@@H]1CCCCN1C1CC1 ZINC000822458205 1288996804 /nfs/dbraw/zinc/99/68/04/1288996804.db2.gz GIWLFQLCHNHIAQ-HNNXBMFYSA-N 0 3 331.416 2.958 20 5 EFBDHN CCc1ccoc1C(=O)NCCCNCc1ccccc1[N+](=O)[O-] ZINC001165967304 1312712571 /nfs/dbraw/zinc/71/25/71/1312712571.db2.gz XUTTXRMGKCZTAK-UHFFFAOYSA-N 0 3 331.372 2.660 20 5 EFBDHN Cc1c(CN[C@@H]2CCCN(C(=O)N3CCCC3)C2)cccc1[N+](=O)[O-] ZINC000873125231 1289581263 /nfs/dbraw/zinc/58/12/63/1289581263.db2.gz LCKJYMWABGASQO-MRXNPFEDSA-N 0 3 346.431 2.673 20 5 EFBDHN Cc1c(CNCCn2ccc(C(F)(F)F)n2)cccc1[N+](=O)[O-] ZINC000873157567 1289607224 /nfs/dbraw/zinc/60/72/24/1289607224.db2.gz BUYLWQOSEAAVEM-UHFFFAOYSA-N 0 3 328.294 2.908 20 5 EFBDHN COc1ccc(OC)c([C@H](O)[C@@H](C)NCc2ccc([N+](=O)[O-])cc2)c1 ZINC000873195546 1289633526 /nfs/dbraw/zinc/63/35/26/1289633526.db2.gz NSKYTZOTCUHSCA-KZULUSFZSA-N 0 3 346.383 2.824 20 5 EFBDHN O=C(CCCF)NCCC1(CNCc2csc([N+](=O)[O-])c2)CC1 ZINC001166631664 1312807848 /nfs/dbraw/zinc/80/78/48/1312807848.db2.gz XAUVRRRFXKGTIA-UHFFFAOYSA-N 0 3 343.424 2.782 20 5 EFBDHN CN(C)Cc1ccccc1CNC(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000126098754 1290977138 /nfs/dbraw/zinc/97/71/38/1290977138.db2.gz LVQFSJFNSUBCQU-UHFFFAOYSA-N 0 3 331.347 2.726 20 5 EFBDHN C[C@@H](C[C@H]1CCCC(=O)N1)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000877087783 1291131473 /nfs/dbraw/zinc/13/14/73/1291131473.db2.gz RRAVJUKTSLBHMN-CMPLNLGQSA-N 0 3 325.796 2.785 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1C[C@H](N2CCOCC2)C[C@H]1C ZINC000877517030 1291255957 /nfs/dbraw/zinc/25/59/57/1291255957.db2.gz KVUDAVLBBZRPGB-GDBMZVCRSA-N 0 3 333.432 2.507 20 5 EFBDHN Cn1cc(NC[C@@H](c2ccccc2)N2CCCC2)cc([N+](=O)[O-])c1=O ZINC001166902490 1312863843 /nfs/dbraw/zinc/86/38/43/1312863843.db2.gz YHQKUXGWCZUPIW-KRWDZBQOSA-N 0 3 342.399 2.543 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@@H]([C@@H]2CCCO2)C2(CO)CCC2)cc1F ZINC000878870353 1291836249 /nfs/dbraw/zinc/83/62/49/1291836249.db2.gz ZHFAGRILLLOMKS-HOTGVXAUSA-N 0 3 338.379 2.534 20 5 EFBDHN C[C@@H](CN(C)CCc1ccccc1[N+](=O)[O-])NC(=O)OC(C)(C)C ZINC000796114437 1291984627 /nfs/dbraw/zinc/98/46/27/1291984627.db2.gz RSKIYBUZVFCPHO-ZDUSSCGKSA-N 0 3 337.420 2.982 20 5 EFBDHN CN(CCCNC(=O)Cc1ccsc1)Cc1cccc([N+](=O)[O-])c1 ZINC001233489094 1312941735 /nfs/dbraw/zinc/94/17/35/1312941735.db2.gz HMNKZVHXKRLSPP-UHFFFAOYSA-N 0 3 347.440 2.837 20 5 EFBDHN COc1cc(CN[C@H](C)C[C@@H](O)c2ccco2)c([N+](=O)[O-])cc1O ZINC000130636723 1293412342 /nfs/dbraw/zinc/41/23/42/1293412342.db2.gz BGGSSKSJMYBLMG-ZWNOBZJWSA-N 0 3 336.344 2.504 20 5 EFBDHN Cc1ccoc1C(=O)NCCCN(C)Cc1ccc([N+](=O)[O-])cc1 ZINC001233947143 1313023603 /nfs/dbraw/zinc/02/36/03/1313023603.db2.gz LDBUUYCJLINDJP-UHFFFAOYSA-N 0 3 331.372 2.748 20 5 EFBDHN COCC(C)(C)N1CCN(c2ncc([N+](=O)[O-])c3ccccc32)CC1 ZINC000884537302 1294171819 /nfs/dbraw/zinc/17/18/19/1294171819.db2.gz WQEVZMFGYBPBMK-UHFFFAOYSA-N 0 3 344.415 2.690 20 5 EFBDHN CC(C)SCC(=O)NCCCN(C)Cc1ccc([N+](=O)[O-])cc1 ZINC001234146768 1313068386 /nfs/dbraw/zinc/06/83/86/1313068386.db2.gz PJFGFCASJDDGDC-UHFFFAOYSA-N 0 3 339.461 2.675 20 5 EFBDHN O=[N+]([O-])c1ncccc1CN1CCCN(Cc2ccccc2)CC1 ZINC000885943203 1294577591 /nfs/dbraw/zinc/57/75/91/1294577591.db2.gz ZISPKHPWPZKNNA-UHFFFAOYSA-N 0 3 326.400 2.698 20 5 EFBDHN CC(C)N1CCC[C@@H](Oc2cc(N3CCOCC3)ccc2[N+](=O)[O-])C1 ZINC001234363426 1313114203 /nfs/dbraw/zinc/11/42/03/1313114203.db2.gz IDEXDBWWKZGQIU-MRXNPFEDSA-N 0 3 349.431 2.683 20 5 EFBDHN CCSCCC(=O)NCCCN(C)Cc1ccc([N+](=O)[O-])cc1 ZINC001234441844 1313129135 /nfs/dbraw/zinc/12/91/35/1313129135.db2.gz MBEATRPUERLHRH-UHFFFAOYSA-N 0 3 339.461 2.676 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1C(=O)NCCN1CCC(C)(C)C1 ZINC000890064986 1295890821 /nfs/dbraw/zinc/89/08/21/1295890821.db2.gz VHMYXCXKXHDVED-UHFFFAOYSA-N 0 3 337.445 2.778 20 5 EFBDHN CC(C)(C)OC(=O)NCC1CC(NCc2ccccc2[N+](=O)[O-])C1 ZINC000925312135 1296828036 /nfs/dbraw/zinc/82/80/36/1296828036.db2.gz XDXWFCZBUFUYHR-UHFFFAOYSA-N 0 3 335.404 2.988 20 5 EFBDHN O=[N+]([O-])c1ccc([C@H](O)CN2CCC[C@@H]2C[C@H](O)c2ccco2)cc1 ZINC000776585992 1299650711 /nfs/dbraw/zinc/65/07/11/1299650711.db2.gz GMUOICBOLGMQMR-IXDOHACOSA-N 0 3 346.383 2.809 20 5 EFBDHN CN(C)[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1F)Cc1ccccc1 ZINC000854303210 1300505821 /nfs/dbraw/zinc/50/58/21/1300505821.db2.gz UGKZJWZSBPZEEM-HNNXBMFYSA-N 0 3 345.374 2.637 20 5 EFBDHN Nc1ccc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000854496332 1300592666 /nfs/dbraw/zinc/59/26/66/1300592666.db2.gz JTYYQEIMEYQDGD-VHSXEESVSA-N 0 3 347.293 2.863 20 5 EFBDHN C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])N[C@@H]1Cc2ccccc2NC1=O ZINC000866397979 1303623269 /nfs/dbraw/zinc/62/32/69/1303623269.db2.gz LDLGURWTHHFTNW-MEDUHNTESA-N 0 3 343.358 2.818 20 5 EFBDHN CC(COC(=O)[C@H]1[C@@H]2c3cc(Br)ccc3C[C@H]12)[N+](=O)[O-] ZINC000870378003 1305291549 /nfs/dbraw/zinc/29/15/49/1305291549.db2.gz TZVSOLZLDQXSLF-SZOBPAOMSA-N 0 3 340.173 2.543 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCC(F)(F)CC1 ZINC000796540846 1306178221 /nfs/dbraw/zinc/17/82/21/1306178221.db2.gz XGWQGJCKPQVKRA-UHFFFAOYSA-N 0 3 327.331 2.963 20 5 EFBDHN O=[N+]([O-])c1cc(Br)cc(O[C@@H]2CNCCC2(F)F)c1 ZINC001218448670 1315196941 /nfs/dbraw/zinc/19/69/41/1315196941.db2.gz OMYBISMXNHJRMU-SNVBAGLBSA-N 0 3 337.120 2.733 20 5 EFBDHN CC(C)N1CCCN(C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)CC1 ZINC000900540638 1308282445 /nfs/dbraw/zinc/28/24/45/1308282445.db2.gz QPAMOUYTXIYYLN-UHFFFAOYSA-N 0 3 343.786 2.944 20 5 EFBDHN C[C@@H]1C[C@@H](NC(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)CN1C1CC1 ZINC000900998270 1309145281 /nfs/dbraw/zinc/14/52/81/1309145281.db2.gz YKITZAWDPMBBCF-PSASIEDQSA-N 0 3 341.770 2.742 20 5 EFBDHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC000901026723 1309225503 /nfs/dbraw/zinc/22/55/03/1309225503.db2.gz OULWIOJUCNTWIC-PELKAZGASA-N 0 3 341.770 2.600 20 5 EFBDHN CCC[C@@H]1CN(Cc2ccc([N+](=O)[O-])c(F)c2)CCN1CCOC ZINC000801526478 1310466254 /nfs/dbraw/zinc/46/62/54/1310466254.db2.gz QXOOSUXEMRDHRT-OAHLLOKOSA-N 0 3 339.411 2.667 20 5 EFBDHN Cc1nccc([C@@H]2CCCN(C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)n1 ZINC000749687424 1311037579 /nfs/dbraw/zinc/03/75/79/1311037579.db2.gz JQSOTFGHYSYLIY-QAPCUYQASA-N 0 3 342.399 2.606 20 5 EFBDHN CCOc1cc(COC(=O)C2CCN(C3CC3)CC2)ccc1[N+](=O)[O-] ZINC000801872310 1311039679 /nfs/dbraw/zinc/03/96/79/1311039679.db2.gz OPQXZNJVUAGXJN-UHFFFAOYSA-N 0 3 348.399 2.911 20 5 EFBDHN Cc1cc(C(=O)NCCCNCc2ccccc2[N+](=O)[O-])cc(C)n1 ZINC001158927356 1311417914 /nfs/dbraw/zinc/41/79/14/1311417914.db2.gz IPXAGBWTAFDPQP-UHFFFAOYSA-N 0 3 342.399 2.516 20 5 EFBDHN C[C@H](Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)[C@H]1CNCCO1 ZINC001159499515 1311528061 /nfs/dbraw/zinc/52/80/61/1311528061.db2.gz ANLMGNIVUKBSFX-XHDPSFHLSA-N 0 3 346.362 2.585 20 5 EFBDHN C[C@@H](Nc1cc(Cl)nc2ccc([N+](=O)[O-])cc21)[C@H]1CNCCO1 ZINC001159503766 1311528299 /nfs/dbraw/zinc/52/82/99/1311528299.db2.gz ZDTWDJNOZGBQNG-YMTOWFKASA-N 0 3 336.779 2.585 20 5 EFBDHN C[C@H](Nc1ccc2c(ccc(Cl)c2[N+](=O)[O-])n1)[C@@H]1CNCCO1 ZINC001159500999 1311528609 /nfs/dbraw/zinc/52/86/09/1311528609.db2.gz UWJFUATWANOLHL-ZANVPECISA-N 0 3 336.779 2.585 20 5 EFBDHN O=C(NCCCNCc1ccccc1[N+](=O)[O-])c1[nH]ccc1C1CC1 ZINC001159615008 1311552866 /nfs/dbraw/zinc/55/28/66/1311552866.db2.gz WFOPWPOQXRSKCK-UHFFFAOYSA-N 0 3 342.399 2.710 20 5 EFBDHN COCCCN1CCC(Oc2ccc(C(C)=O)cc2[N+](=O)[O-])CC1 ZINC001226295642 1311643750 /nfs/dbraw/zinc/64/37/50/1311643750.db2.gz ZYOBDIVEDJDPTD-UHFFFAOYSA-N 0 3 336.388 2.677 20 5 EFBDHN Cc1cc(Cl)nc(-n2nc(-c3ccncc3)cc2CN)c1[N+](=O)[O-] ZINC001160337587 1311692718 /nfs/dbraw/zinc/69/27/18/1311692718.db2.gz FWWWCWOTYSHWRO-UHFFFAOYSA-N 0 3 344.762 2.658 20 5 EFBDHN NCc1cc(-c2ccncc2)nn1-c1nc2ccccc2cc1[N+](=O)[O-] ZINC001160338951 1311693211 /nfs/dbraw/zinc/69/32/11/1311693211.db2.gz PMOXBPNQUITHDZ-UHFFFAOYSA-N 0 3 346.350 2.849 20 5 EFBDHN O=[N+]([O-])c1cnc(O[C@H]2[C@@H]3CC[C@H]2CN(Cc2ccccc2)C3)nc1 ZINC001226733656 1311715135 /nfs/dbraw/zinc/71/51/35/1311715135.db2.gz RKYLOLZFDQHEHK-QLPKVWCKSA-N 0 3 340.383 2.674 20 5 EFBDHN CN(C)Cc1ccc(-c2noc(-c3cccc([N+](=O)[O-])n3)n2)cc1 ZINC001213026814 1311787131 /nfs/dbraw/zinc/78/71/31/1311787131.db2.gz URFHYNOVDZJJJY-UHFFFAOYSA-N 0 3 325.328 2.768 20 5 EFBDHN C[NH+](C)CC[C@@H](Oc1ncc([N+](=O)[O-])c2nc[n-]c21)c1ccccc1 ZINC001227691146 1311840135 /nfs/dbraw/zinc/84/01/35/1311840135.db2.gz MVNZVHMBMVBZOC-CQSZACIVSA-N 0 3 341.371 2.938 20 5 EFBDHN O=[N+]([O-])c1ccc2nc(OC3CCN(c4cc[nH+]cc4)CC3)[n-]c2c1 ZINC001227747270 1311849936 /nfs/dbraw/zinc/84/99/36/1311849936.db2.gz ZJRQHIZXXVOPSV-UHFFFAOYSA-N 0 3 339.355 2.914 20 5 EFBDHN O=[N+]([O-])c1ccc2[n-]c(OC3CCN(c4cc[nH+]cc4)CC3)nc2c1 ZINC001227747270 1311849941 /nfs/dbraw/zinc/84/99/41/1311849941.db2.gz ZJRQHIZXXVOPSV-UHFFFAOYSA-N 0 3 339.355 2.914 20 5 EFBDHN CC(C)C[C@H]1CN(C)CCN1Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000902541610 1311853544 /nfs/dbraw/zinc/85/35/44/1311853544.db2.gz IGZJDVAHNJNKKB-INIZCTEOSA-N 0 3 331.420 2.564 20 5 EFBDHN Cc1nn(CN2CCN(C)C[C@H]2CC(C)C)c2ccc([N+](=O)[O-])cc12 ZINC000902542582 1311854505 /nfs/dbraw/zinc/85/45/05/1311854505.db2.gz NUCSUOUJOJFSPP-MRXNPFEDSA-N 0 3 345.447 2.873 20 5 EFBDHN CC(C)C[C@H]1CN(C)CCN1Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000902543328 1311855085 /nfs/dbraw/zinc/85/50/85/1311855085.db2.gz QRJNAFUAIRLHSJ-INIZCTEOSA-N 0 3 331.420 2.564 20 5 EFBDHN O=[N+]([O-])c1ccnc(NC2CCN(Cc3ccc(O)cc3)CC2)c1 ZINC001161129349 1311865778 /nfs/dbraw/zinc/86/57/78/1311865778.db2.gz FBQJHCAWZJZYLT-UHFFFAOYSA-N 0 3 328.372 2.772 20 5 EFBDHN CN1CCN(CCCNc2ccc([N+](=O)[O-])c3ccccc23)CC1 ZINC001161710417 1311957495 /nfs/dbraw/zinc/95/74/95/1311957495.db2.gz PMGSRXGDNZSVLW-UHFFFAOYSA-N 0 3 328.416 2.797 20 5 EFBDHN CN1CCN(CCCNc2cc(Cl)ccc2/C=C/[N+](=O)[O-])CC1 ZINC001161711219 1311957810 /nfs/dbraw/zinc/95/78/10/1311957810.db2.gz XUWZOEDWSRBTHL-VMPITWQZSA-N 0 3 338.839 2.637 20 5 EFBDHN CN1CCN(CCCNc2cc3ccccc3c([N+](=O)[O-])c2)CC1 ZINC001161712095 1311957934 /nfs/dbraw/zinc/95/79/34/1311957934.db2.gz YTPWFQVULUKKOO-UHFFFAOYSA-N 0 3 328.416 2.797 20 5 EFBDHN Cc1nc(OC2CCN(C)CC2)c(Br)cc1[N+](=O)[O-] ZINC001228621773 1311971423 /nfs/dbraw/zinc/97/14/23/1311971423.db2.gz UMNRZRDTKACWDC-UHFFFAOYSA-N 0 3 330.182 2.534 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1Oc1ncncc1[N+](=O)[O-] ZINC001228655073 1311976290 /nfs/dbraw/zinc/97/62/90/1311976290.db2.gz PGZVDJRBNJQXTP-CJNGLKHVSA-N 0 3 328.372 2.674 20 5 EFBDHN O=C(C1CCCC1)N1C[C@H]2CN(Cc3ccccc3[N+](=O)[O-])C[C@H]2C1 ZINC001048641265 1311996113 /nfs/dbraw/zinc/99/61/13/1311996113.db2.gz XMWYEXMUMCMMRK-CALCHBBNSA-N 0 3 343.427 2.675 20 5 EFBDHN COC(=O)c1cc(Cl)cc([N+](=O)[O-])c1O[C@H]1CCN(C(C)C)C1 ZINC001228967527 1312028441 /nfs/dbraw/zinc/02/84/41/1312028441.db2.gz RPUQJADWPFERPC-NSHDSACASA-N 0 3 342.779 2.896 20 5 EFBDHN O=[N+]([O-])/C=C/c1ccc(O[C@H]2CC[C@H](N3CCOCC3)CC2)cc1 ZINC001229116117 1312050419 /nfs/dbraw/zinc/05/04/19/1312050419.db2.gz UAWMMTUYHMZTSM-LRUQOWEJSA-N 0 3 332.400 2.956 20 5 EFBDHN CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3cc(C)c([N+](=O)[O-])c(C)c3)C[C@H]1N2C ZINC001229469435 1312101632 /nfs/dbraw/zinc/10/16/32/1312101632.db2.gz HLSDTAAMRWCQCF-LLLHUVSDSA-N 0 3 348.399 2.757 20 5 EFBDHN COC(=O)c1ccc(C)c([N+](=O)[O-])c1O[C@@H]1CCCN(C(C)C)C1 ZINC001229901147 1312157023 /nfs/dbraw/zinc/15/70/23/1312157023.db2.gz XNRSUBKAFORLLL-CYBMUJFWSA-N 0 3 336.388 2.941 20 5 EFBDHN CCOc1cnc(-n2c3ccccc3nc2[C@@H](C)N)c([N+](=O)[O-])c1 ZINC001162759687 1312169399 /nfs/dbraw/zinc/16/93/99/1312169399.db2.gz SRIFNCPFMKNUMW-SNVBAGLBSA-N 0 3 327.344 2.747 20 5 EFBDHN CC(=O)Nc1ccc(-n2c3ccccc3nc2[C@H](C)N)cc1[N+](=O)[O-] ZINC001162777801 1312174040 /nfs/dbraw/zinc/17/40/40/1312174040.db2.gz VJGCZZFGTGUHDT-JTQLQIEISA-N 0 3 339.355 2.912 20 5 EFBDHN COC(=O)c1cc(N[C@H]2CNCc3ccsc32)cc([N+](=O)[O-])c1 ZINC001163230296 1312270711 /nfs/dbraw/zinc/27/07/11/1312270711.db2.gz OBSWNZKKQOSVMJ-ZDUSSCGKSA-N 0 3 333.369 2.699 20 5 EFBDHN CN1Cc2cc(N[C@H]3CNCc4ccsc43)cc([N+](=O)[O-])c2N1 ZINC001163239854 1312272482 /nfs/dbraw/zinc/27/24/82/1312272482.db2.gz SLEMQKRAKUWOJJ-LBPRGKRZSA-N 0 3 331.401 2.685 20 5 EFBDHN O=C(NCCCNCc1csc([N+](=O)[O-])c1)C1(C2CC2)CCC1 ZINC001163404733 1312305947 /nfs/dbraw/zinc/30/59/47/1312305947.db2.gz NVDVLEOXVFNAKU-UHFFFAOYSA-N 0 3 337.445 2.833 20 5 EFBDHN CC(C)[C@H](N[C@H](C)Cc1ccc(F)cc1[N+](=O)[O-])c1nncn1C ZINC000903065647 1312320949 /nfs/dbraw/zinc/32/09/49/1312320949.db2.gz RSFUKYVLFMTHKH-ABAIWWIYSA-N 0 3 335.383 2.780 20 5 EFBDHN O=[N+]([O-])c1c(N[C@H]2CCCC[C@@]23CNCCO3)ccc2cnccc21 ZINC001163650212 1312354450 /nfs/dbraw/zinc/35/44/50/1312354450.db2.gz MJFVAYSTEGJUMJ-FUHWJXTLSA-N 0 3 342.399 2.856 20 5 EFBDHN O=[N+]([O-])c1ccc(Cl)c(N[C@H]2CCCC[C@@]23CNCCO3)c1 ZINC001163650801 1312354961 /nfs/dbraw/zinc/35/49/61/1312354961.db2.gz TVYUBDFCGIVYRB-LSDHHAIUSA-N 0 3 325.796 2.961 20 5 EFBDHN COc1csc(C(=O)NCCCNCc2ccccc2[N+](=O)[O-])c1 ZINC001163788957 1312385282 /nfs/dbraw/zinc/38/52/82/1312385282.db2.gz SQAPASQWJYJBHF-UHFFFAOYSA-N 0 3 349.412 2.575 20 5 EFBDHN CCN1CCC(Oc2nc(C)c(Br)cc2[N+](=O)[O-])CC1 ZINC001231120978 1312436918 /nfs/dbraw/zinc/43/69/18/1312436918.db2.gz BOXXDRSXMPDPOE-UHFFFAOYSA-N 0 3 344.209 2.924 20 5 EFBDHN CN(CCCNC(=O)/C=C\c1ccco1)Cc1ccc([N+](=O)[O-])cc1 ZINC001231294808 1312473300 /nfs/dbraw/zinc/47/33/00/1312473300.db2.gz GGGWKISRCPYMCU-KTKRTIGZSA-N 0 3 343.383 2.839 20 5 EFBDHN CN(CCCNC(=O)c1cccc(F)c1)Cc1ccc([N+](=O)[O-])cc1 ZINC001231395591 1312485750 /nfs/dbraw/zinc/48/57/50/1312485750.db2.gz XDIASZOJXOGWOJ-UHFFFAOYSA-N 0 3 345.374 2.986 20 5 EFBDHN CN(CCCNC(=O)c1cccs1)Cc1cccc([N+](=O)[O-])c1 ZINC001231397914 1312487016 /nfs/dbraw/zinc/48/70/16/1312487016.db2.gz NKRUYCMAMSIBBW-UHFFFAOYSA-N 0 3 333.413 2.908 20 5 EFBDHN O=C(NCCCNCc1ccccc1[N+](=O)[O-])c1cccc(F)c1F ZINC001165347373 1312613095 /nfs/dbraw/zinc/61/30/95/1312613095.db2.gz OXPSFFZTYNGJGK-UHFFFAOYSA-N 0 3 349.337 2.783 20 5 EFBDHN CN(C)C[C@H]1CN(Cc2ccc3ccc4cccnc4c3n2)CCO1 ZINC001232218670 1312651219 /nfs/dbraw/zinc/65/12/19/1312651219.db2.gz JSAGAFBUUDLEMK-SFHVURJKSA-N 0 3 336.439 2.545 20 5 EFBDHN O=C1CCN(Cc2ccc3ccc4cccnc4c3n2)C[C@@H]2CCCN12 ZINC001232229019 1312652966 /nfs/dbraw/zinc/65/29/66/1312652966.db2.gz XLDWYNNFBYJUFW-SFHVURJKSA-N 0 3 346.434 2.980 20 5 EFBDHN O=C(Cc1cccs1)N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001019942842 1314544800 /nfs/dbraw/zinc/54/48/00/1314544800.db2.gz JDGWIFDPEBSGIM-HDJSIYSDSA-N 0 3 345.424 2.636 20 5 EFBDHN O=C(N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1)c1ccccc1F ZINC001019945850 1314546527 /nfs/dbraw/zinc/54/65/27/1314546527.db2.gz YKFOGYLTZZMBLM-HDJSIYSDSA-N 0 3 343.358 2.785 20 5 EFBDHN O=C(N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1)c1ccsc1 ZINC001019975350 1314553683 /nfs/dbraw/zinc/55/36/83/1314553683.db2.gz ZFBLUBNIYYTMTQ-HDJSIYSDSA-N 0 3 331.397 2.707 20 5 EFBDHN O=C(N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1)c1ccc(Cl)o1 ZINC001019990160 1314559923 /nfs/dbraw/zinc/55/99/23/1314559923.db2.gz BMRBHMBCESRDHV-HAQNSBGRSA-N 0 3 349.774 2.892 20 5 EFBDHN CCc1occc1C(=O)N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001020116826 1314617967 /nfs/dbraw/zinc/61/79/67/1314617967.db2.gz WXNPGKOAXIAOSF-HDJSIYSDSA-N 0 3 343.383 2.801 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)CC[C@H](N1CCNC[C@@H]1C(F)(F)F)CC2 ZINC001246985364 1314723679 /nfs/dbraw/zinc/72/36/79/1314723679.db2.gz BLFVNDQWHOTSAD-UKRRQHHQSA-N 0 3 343.349 2.678 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)CC[C@@H](N1CCNC[C@@H]1C(F)(F)F)CC2 ZINC001246985361 1314724016 /nfs/dbraw/zinc/72/40/16/1314724016.db2.gz BLFVNDQWHOTSAD-DZGCQCFKSA-N 0 3 343.349 2.678 20 5 EFBDHN Cc1ncc([N+](=O)[O-])cc1Nc1cccc(CN2CCN(C)CC2)c1 ZINC001249546462 1315094315 /nfs/dbraw/zinc/09/43/15/1315094315.db2.gz YDSMECLBHAVJDC-UHFFFAOYSA-N 0 3 341.415 2.789 20 5 EFBDHN CC1(C)N[C@@H](CO[C@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)CO1 ZINC001217917368 1315120654 /nfs/dbraw/zinc/12/06/54/1315120654.db2.gz WKPJFUFOJVYMJI-CMPLNLGQSA-N 0 3 334.294 2.939 20 5 EFBDHN CC1(C)N[C@H](CO[C@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)CO1 ZINC001217917371 1315120697 /nfs/dbraw/zinc/12/06/97/1315120697.db2.gz WKPJFUFOJVYMJI-ZYHUDNBSSA-N 0 3 334.294 2.939 20 5 EFBDHN O=[N+]([O-])c1cc(O[C@H]2CNCCC2(F)F)ccc1C(F)(F)F ZINC001218446824 1315197016 /nfs/dbraw/zinc/19/70/16/1315197016.db2.gz DBNOANVCHMILFO-JTQLQIEISA-N 0 3 326.221 2.990 20 5 EFBDHN O=[N+]([O-])c1ccc(O[C@H]2CNCCC2(F)F)c(Br)c1 ZINC001218446919 1315197509 /nfs/dbraw/zinc/19/75/09/1315197509.db2.gz FICMGQNRTOQZQI-JTQLQIEISA-N 0 3 337.120 2.733 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1O[C@@H]1CNCCC1(F)F ZINC001218449276 1315197838 /nfs/dbraw/zinc/19/78/38/1315197838.db2.gz SPRMWDPPYVYKMZ-SNVBAGLBSA-N 0 3 326.221 2.990 20 5 EFBDHN CCOC(=O)c1ccc(O[C@H]2CNCc3ccccc32)cc1[N+](=O)[O-] ZINC001218486717 1315203551 /nfs/dbraw/zinc/20/35/51/1315203551.db2.gz CUUDTJJGOULIJR-KRWDZBQOSA-N 0 3 342.351 2.995 20 5 EFBDHN COC(=O)c1ccc([N+](=O)[O-])cc1O[C@H]1CNCc2ccccc21 ZINC001218484175 1315204038 /nfs/dbraw/zinc/20/40/38/1315204038.db2.gz JCUDEAYQKAPUOG-INIZCTEOSA-N 0 3 328.324 2.605 20 5 EFBDHN Cc1nc2c(n1C1CCN(c3ccc([N+](=O)[O-])cc3)CC1)CNCC2 ZINC001254481573 1315709027 /nfs/dbraw/zinc/70/90/27/1315709027.db2.gz XJKKYPCOKUMRHY-UHFFFAOYSA-N 0 3 341.415 2.587 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])NCC(=O)N1CCc2ccccc21 ZINC001254537296 1315721254 /nfs/dbraw/zinc/72/12/54/1315721254.db2.gz ZFVOUMBMTVPKOI-CQSZACIVSA-N 0 3 339.395 2.705 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N1C[C@H](CO)[C@@H](C(F)(F)F)C1 ZINC001254552979 1315722947 /nfs/dbraw/zinc/72/29/47/1315722947.db2.gz QAENRACGICSUPK-UHTWSYAYSA-N 0 3 332.322 2.628 20 5 EFBDHN Cc1cncnc1O[C@@H]1CCN([C@@H](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC001254571292 1315725341 /nfs/dbraw/zinc/72/53/41/1315725341.db2.gz RUGFDMLFAMEMQP-GOEBONIOSA-N 0 3 342.399 2.778 20 5 EFBDHN Cc1ccnc(O[C@H]2CCN([C@@H](C)Cc3ccccc3[N+](=O)[O-])C2)n1 ZINC001254571523 1315725560 /nfs/dbraw/zinc/72/55/60/1315725560.db2.gz XCNRQFAYVHOPCB-HOCLYGCPSA-N 0 3 342.399 2.778 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@@H](NCc1cc(F)cc3c1OCOC3)C2 ZINC001254575327 1315726324 /nfs/dbraw/zinc/72/63/24/1315726324.db2.gz PSGVANNZZYAQHR-INIZCTEOSA-N 0 3 344.342 2.857 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@@H](N[C@@H](CO)c1cc(F)cc(F)c1)C2 ZINC001254588511 1315727799 /nfs/dbraw/zinc/72/77/99/1315727799.db2.gz ZXMWPXFSJPAPPH-RDJZCZTQSA-N 0 3 334.322 2.663 20 5 EFBDHN Cc1ccc(O[C@H]2CCN([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)nc1 ZINC001254605298 1315730279 /nfs/dbraw/zinc/73/02/79/1315730279.db2.gz BDEAFWZYXSWOQW-ROUUACIJSA-N 0 3 339.395 2.919 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@H](N1CCN3CCc4ccccc4[C@H]3C1)C2 ZINC001254607981 1315730362 /nfs/dbraw/zinc/73/03/62/1315730362.db2.gz OAKDVANVMFYJJG-TZIWHRDSSA-N 0 3 349.434 2.977 20 5 EFBDHN Cc1cnccc1O[C@@H]1CCN([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254606318 1315730404 /nfs/dbraw/zinc/73/04/04/1315730404.db2.gz GJHMHVARPKWLHX-QZTJIDSGSA-N 0 3 339.395 2.919 20 5 EFBDHN COc1cc(N2CCC(N(C)Cc3ccno3)CC2)ccc1[N+](=O)[O-] ZINC001256101229 1315905095 /nfs/dbraw/zinc/90/50/95/1315905095.db2.gz CYLCBAVUHONJJG-UHFFFAOYSA-N 0 3 346.387 2.692 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)c2ncnc(N3CCN(CC4CC4)CC3)c2c1 ZINC001261156322 1316393952 /nfs/dbraw/zinc/39/39/52/1316393952.db2.gz IZWAGQAPFADQLV-UHFFFAOYSA-N 0 3 347.806 2.723 20 5 EFBDHN O=[N+]([O-])c1ccc(Cl)cc1CNC[C@H](CO)CC1CCOCC1 ZINC001322130560 1329431245 /nfs/dbraw/zinc/43/12/45/1329431245.db2.gz VGAMLDFRGYTANH-CYBMUJFWSA-N 0 3 342.823 2.763 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CCC[C@@H](c3nc4ccccc4[nH]3)C2)n1 ZINC001319604906 1328927269 /nfs/dbraw/zinc/92/72/69/1328927269.db2.gz YMYONXBJFDMKPR-CYBMUJFWSA-N 0 3 340.387 2.547 20 5 EFBDHN COc1cc(CN2CCN(C(C)(C)C)CC2)c([N+](=O)[O-])cc1F ZINC001321199296 1329355529 /nfs/dbraw/zinc/35/55/29/1329355529.db2.gz NKPXDWFJZCMRPH-UHFFFAOYSA-N 0 3 325.384 2.659 20 5 EFBDHN Cc1cncc([N+](=O)[O-])c1N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC001322535497 1329465821 /nfs/dbraw/zinc/46/58/21/1329465821.db2.gz RWPUAGASXBOVFR-GOEBONIOSA-N 0 3 326.400 2.795 20 5 EFBDHN CN(C)[C@@H]1CCCC[C@@H]1Nc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC001323107008 1329512558 /nfs/dbraw/zinc/51/25/58/1329512558.db2.gz GWDBZYGHCJNARM-UONOGXRCSA-N 0 3 331.376 2.528 20 5 EFBDHN CN(C)[C@@H]1CCCC[C@@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC001324400792 1329624067 /nfs/dbraw/zinc/62/40/67/1329624067.db2.gz VZKBZIRIPQXQCV-JKSUJKDBSA-N 0 3 347.415 2.547 20 5 EFBDHN CN(C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccc(C(N)=O)cc1 ZINC001325714397 1329708151 /nfs/dbraw/zinc/70/81/51/1329708151.db2.gz VFWILJNPNBDBGR-GQCTYLIASA-N 0 3 325.368 2.839 20 5 EFBDHN C[C@@H]1CN(c2ncnc3c(Cl)cc([N+](=O)[O-])cc32)[C@H](C)CN1C ZINC001327662888 1330505969 /nfs/dbraw/zinc/50/59/69/1330505969.db2.gz RNNZSMGPYIRZMS-NXEZZACHSA-N 0 3 335.795 2.720 20 5 EFBDHN C[C@H]1CN(c2ncnc3c(Cl)cc([N+](=O)[O-])cc32)[C@@H](C)CN1C ZINC001327662889 1330506129 /nfs/dbraw/zinc/50/61/29/1330506129.db2.gz RNNZSMGPYIRZMS-UWVGGRQHSA-N 0 3 335.795 2.720 20 5 EFBDHN O=C(OCc1cccnc1[N+](=O)[O-])c1cccc(CN2CCCC2)c1 ZINC001331159905 1330800352 /nfs/dbraw/zinc/80/03/52/1330800352.db2.gz DGFBHTYDHHMUBA-UHFFFAOYSA-N 0 3 341.367 2.943 20 5 EFBDHN COCCN1CCC[C@@H](Nc2ncc([N+](=O)[O-])c3ccccc32)C1 ZINC001331555598 1330852489 /nfs/dbraw/zinc/85/24/89/1330852489.db2.gz BTGFDYGANLCIBJ-CYBMUJFWSA-N 0 3 330.388 2.666 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1CNCCC(=O)N1CCC[C@@H](C)C1 ZINC001332313959 1330957004 /nfs/dbraw/zinc/95/70/04/1330957004.db2.gz SSEDKENOLCONTG-CYBMUJFWSA-N 0 3 333.432 2.950 20 5 EFBDHN CC1CCN(CCNC(=O)[C@@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)CC1 ZINC001332747127 1331015552 /nfs/dbraw/zinc/01/55/52/1331015552.db2.gz XMPGQRUCKAUVAI-IAGOWNOFSA-N 0 3 331.416 2.546 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]C[C@H]2CCCO[C@H]2C(C)C)c1[N+](=O)[O-] ZINC001334185228 1331263047 /nfs/dbraw/zinc/26/30/47/1331263047.db2.gz AWMODTRXLLRPIL-CJNGLKHVSA-N 0 3 338.404 2.850 20 5 EFBDHN C[C@H](NCc1c(Br)cccc1[N+](=O)[O-])[C@@H]1CCOC1 ZINC001335780564 1331402100 /nfs/dbraw/zinc/40/21/00/1331402100.db2.gz KUBKNKPMEGHEBC-VHSXEESVSA-N 0 3 329.194 2.872 20 5 EFBDHN CCN1CCN(Cc2ccc([N+](=O)[O-])cc2Br)C[C@H]1C ZINC001338318538 1331690689 /nfs/dbraw/zinc/69/06/89/1331690689.db2.gz GXJRCKUVXSRFCY-LLVKDONJSA-N 0 3 342.237 2.883 20 5 EFBDHN CC(C)NC(=O)c1ccc(N[C@H]2CN(C3CC3)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC001339608438 1331911666 /nfs/dbraw/zinc/91/16/66/1331911666.db2.gz BEXKIHNNONVDMX-LRDDRELGSA-N 0 3 346.431 2.628 20 5 EFBDHN Cc1nn(C)cc1CCC(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC001343829409 1332384290 /nfs/dbraw/zinc/38/42/90/1332384290.db2.gz HLHZOXDSFVBAQN-SJCJKPOMSA-N 0 3 349.362 2.750 20 5 EFBDHN CO[C@@H]1CCC[C@@H]1C(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC001345207366 1332521786 /nfs/dbraw/zinc/52/17/86/1332521786.db2.gz KLRYWEIGVAVEPW-DZGBDDFRSA-N 0 3 325.336 2.890 20 5 EFBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CCCCN1C ZINC001346433034 1332639638 /nfs/dbraw/zinc/63/96/38/1332639638.db2.gz DLGYPKYDNDZIFM-QGZVFWFLSA-N 0 3 348.447 2.999 20 5 EFBDHN O=C(N[C@H]1CCCN2CCCC[C@@H]12)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000847254007 1333447415 /nfs/dbraw/zinc/44/74/15/1333447415.db2.gz CHTWNNCEYVIEMF-KBPBESRZSA-N 0 3 339.342 2.620 20 5 EFBDHN O=C(N[C@@H]1CCCN2CCCC[C@H]12)c1cc([N+](=O)[O-])ccc1Cl ZINC000847253552 1333448368 /nfs/dbraw/zinc/44/83/68/1333448368.db2.gz HJCBEMUXSRDOSH-HUUCEWRRSA-N 0 3 337.807 2.995 20 5 EFBDHN Cc1cc([N+](=O)[O-])cc(C(=O)N[C@@H]2CCCN3CCCC[C@H]23)c1F ZINC000847257731 1333453249 /nfs/dbraw/zinc/45/32/49/1333453249.db2.gz YVWMGCCSGGBNGH-HUUCEWRRSA-N 0 3 335.379 2.789 20 5 EFBDHN CN(C)C[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC001353274485 1334059604 /nfs/dbraw/zinc/05/96/04/1334059604.db2.gz UCHQKZALFUBIOR-ROUUACIJSA-N 0 3 347.390 2.660 20 5 EFBDHN CCN(C[C@@H]1CCOC1)Cn1cc(-c2ccccc2[N+](=O)[O-])cn1 ZINC000848478262 1334735785 /nfs/dbraw/zinc/73/57/85/1334735785.db2.gz DZZKJKBONQRXNN-AWEZNQCLSA-N 0 3 330.388 2.774 20 5 EFBDHN CCN(C[C@H]1CCOC1)Cn1cc(-c2ccccc2[N+](=O)[O-])cn1 ZINC000848478264 1334736180 /nfs/dbraw/zinc/73/61/80/1334736180.db2.gz DZZKJKBONQRXNN-CQSZACIVSA-N 0 3 330.388 2.774 20 5 EFBDHN C[C@@H](O)C[C@H]1CCCN1Cn1cc(-c2ccccc2[N+](=O)[O-])cn1 ZINC000848483115 1334739608 /nfs/dbraw/zinc/73/96/08/1334739608.db2.gz YRQCAVSNCZNPSY-UKRRQHHQSA-N 0 3 330.388 2.651 20 5 EFBDHN O=C(NCCN[C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(F)cc1 ZINC000848527171 1334775267 /nfs/dbraw/zinc/77/52/67/1334775267.db2.gz UDVXUDSZQBOUCA-INIZCTEOSA-N 0 3 343.358 2.741 20 5 EFBDHN CCC(C)(C)N1CCN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)CC1 ZINC000848761914 1334881883 /nfs/dbraw/zinc/88/18/83/1334881883.db2.gz AWUGQQFYDDARFX-UHFFFAOYSA-N 0 3 346.431 2.790 20 5 EFBDHN Cc1ccc(CN(C)C)cc1NC(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000177315970 713717700 /nfs/dbraw/zinc/71/77/00/713717700.db2.gz WQWFVIOFAPDIID-UHFFFAOYSA-N 0 3 328.372 2.799 20 5 EFBDHN CC(C)CN(CCN(C)C)C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000126149728 714451657 /nfs/dbraw/zinc/45/16/57/714451657.db2.gz NWKRBHWCJGIYIL-UHFFFAOYSA-N 0 3 327.812 2.908 20 5 EFBDHN O=C(N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1)c1ccccc1F ZINC001021787597 714476864 /nfs/dbraw/zinc/47/68/64/714476864.db2.gz YKFOGYLTZZMBLM-OKILXGFUSA-N 0 3 343.358 2.785 20 5 EFBDHN COc1ccc([C@H](CNc2c([N+](=O)[O-])cnn2C)N2CCCC2)cc1 ZINC000891475552 714775729 /nfs/dbraw/zinc/77/57/29/714775729.db2.gz HXNNDYBOAMEWKK-HNNXBMFYSA-N 0 3 345.403 2.586 20 5 EFBDHN COc1c([O-])ccc(CN2CCC[N@@H+](C(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000891841441 715056756 /nfs/dbraw/zinc/05/67/56/715056756.db2.gz AWTKVMAKJOTUSH-UHFFFAOYSA-N 0 3 337.420 2.615 20 5 EFBDHN COc1c([O-])ccc(CN2CCC[N@H+](C(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000891841441 715056758 /nfs/dbraw/zinc/05/67/58/715056758.db2.gz AWTKVMAKJOTUSH-UHFFFAOYSA-N 0 3 337.420 2.615 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN1CCC[C@H]1COc1ccc(F)cc1 ZINC000933927247 715115059 /nfs/dbraw/zinc/11/50/59/715115059.db2.gz MUKPITGWJQUWIV-HNNXBMFYSA-N 0 3 348.378 2.782 20 5 EFBDHN CN(CC1CCOCC1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000124645204 715448720 /nfs/dbraw/zinc/44/87/20/715448720.db2.gz OZUHCGOLLLKMGA-UHFFFAOYSA-N 0 3 330.388 2.774 20 5 EFBDHN Cc1cc(C(=O)N[C@H]2C[C@@H](NCc3ccccc3[N+](=O)[O-])C2)c(C)[nH]1 ZINC001022779373 715646382 /nfs/dbraw/zinc/64/63/82/715646382.db2.gz JIOJVTIXCHRQKA-GASCZTMLSA-N 0 3 342.399 2.590 20 5 EFBDHN CC(C)C1CCC(N2CCN(Cn3nccc3[N+](=O)[O-])CC2)CC1 ZINC000176988576 717338232 /nfs/dbraw/zinc/33/82/32/717338232.db2.gz ZXIZIJFDKLKXIX-UHFFFAOYSA-N 0 3 335.452 2.581 20 5 EFBDHN CCN(CC)C(=O)CCCNCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000892583077 718309947 /nfs/dbraw/zinc/30/99/47/718309947.db2.gz SEKKGLCGZQLVNK-UHFFFAOYSA-N 0 3 327.812 2.986 20 5 EFBDHN COc1c([O-])ccc(C[NH2+][C@H](C)CCc2cccn2C)c1[N+](=O)[O-] ZINC000892954493 719333045 /nfs/dbraw/zinc/33/30/45/719333045.db2.gz ZZVHEKQZZDYTFO-GFCCVEGCSA-N 0 3 333.388 2.758 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)ccc1CNCCCOC[C@H]1CCOC1 ZINC000893037018 719516036 /nfs/dbraw/zinc/51/60/36/719516036.db2.gz HUZSTAQWIOBHNT-GFCCVEGCSA-N 0 3 328.796 2.781 20 5 EFBDHN COc1c([O-])ccc(C[NH2+][C@@H]2[C@@H]3CCCO[C@H]3C2(C)C)c1[N+](=O)[O-] ZINC000893092694 719625034 /nfs/dbraw/zinc/62/50/34/719625034.db2.gz MVRJQMHWTIENOH-IUIKQTSFSA-N 0 3 336.388 2.602 20 5 EFBDHN O=[N+]([O-])c1cnn(CCNCc2ccccc2N2CCCCC2)c1 ZINC000893135206 719719734 /nfs/dbraw/zinc/71/97/34/719719734.db2.gz NJZKWOGHYBMHCR-UHFFFAOYSA-N 0 3 329.404 2.571 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1C(=O)N(CCN(C)C)CC(C)C ZINC000932031334 719824256 /nfs/dbraw/zinc/82/42/56/719824256.db2.gz MAAKJNQBPZFMHN-UHFFFAOYSA-N 0 3 339.461 2.977 20 5 EFBDHN COCCOC[C@@H](C)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000894082492 720263978 /nfs/dbraw/zinc/26/39/78/720263978.db2.gz ZGAPGTDEFRTWJE-SNVBAGLBSA-N 0 3 336.310 2.755 20 5 EFBDHN COc1c(O)ccc(CN[C@@H]2CCc3ccccc3OC2)c1[N+](=O)[O-] ZINC000894266039 721793337 /nfs/dbraw/zinc/79/33/37/721793337.db2.gz ZBKMQFRNJSJYBL-CQSZACIVSA-N 0 3 344.367 2.792 20 5 EFBDHN COc1c([O-])ccc(C[NH2+][C@@H]2CCc3ccccc3OC2)c1[N+](=O)[O-] ZINC000894266039 721793338 /nfs/dbraw/zinc/79/33/38/721793338.db2.gz ZBKMQFRNJSJYBL-CQSZACIVSA-N 0 3 344.367 2.792 20 5 EFBDHN O=C(CC1CCC1)N[C@H]1C[C@H](CNCc2csc([N+](=O)[O-])c2)C1 ZINC000983396762 722130741 /nfs/dbraw/zinc/13/07/41/722130741.db2.gz FMWXQEDLWUBGPW-MQMHXKEQSA-N 0 3 337.445 2.831 20 5 EFBDHN COc1c(O)ccc(CNC[C@H](Cc2ccccc2)OC)c1[N+](=O)[O-] ZINC000894677900 722813609 /nfs/dbraw/zinc/81/36/09/722813609.db2.gz XKZAWYSUZUYMBL-HNNXBMFYSA-N 0 3 346.383 2.656 20 5 EFBDHN COc1c(O)ccc(CNC[C@@](C)(OC)c2ccccc2)c1[N+](=O)[O-] ZINC000894714246 722824339 /nfs/dbraw/zinc/82/43/39/722824339.db2.gz HQMJZQHDCATMRX-GOSISDBHSA-N 0 3 346.383 2.960 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN1CC[C@H](C2OCCO2)C1 ZINC000896378134 723275667 /nfs/dbraw/zinc/27/56/67/723275667.db2.gz OBKRWMPTMJYJFX-NSHDSACASA-N 0 3 346.305 2.808 20 5 EFBDHN COC(=O)COc1ccc(CN[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000896512337 723323299 /nfs/dbraw/zinc/32/32/99/723323299.db2.gz OABMDCOAGBGTSB-CYBMUJFWSA-N 0 3 344.367 2.997 20 5 EFBDHN COc1c([O-])ccc(C[N@@H+]2CC3(C[C@H]2C)CCOCC3)c1[N+](=O)[O-] ZINC000895120466 723343882 /nfs/dbraw/zinc/34/38/82/723343882.db2.gz DMYNQQBKJXTITQ-GFCCVEGCSA-N 0 3 336.388 2.700 20 5 EFBDHN COc1c([O-])ccc(C[N@H+]2CC3(C[C@H]2C)CCOCC3)c1[N+](=O)[O-] ZINC000895120466 723343886 /nfs/dbraw/zinc/34/38/86/723343886.db2.gz DMYNQQBKJXTITQ-GFCCVEGCSA-N 0 3 336.388 2.700 20 5 EFBDHN CC(C)=CC(=O)N1CCC(N(C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000985231198 724003787 /nfs/dbraw/zinc/00/37/87/724003787.db2.gz MIWKHEYGGJUETP-UHFFFAOYSA-N 0 3 331.416 2.984 20 5 EFBDHN COc1c(O)ccc(CNC[C@@H](OC)C2CCCCC2)c1[N+](=O)[O-] ZINC000895454556 724145219 /nfs/dbraw/zinc/14/52/19/724145219.db2.gz DZMJSGPLKMOGBV-OAHLLOKOSA-N 0 3 338.404 2.994 20 5 EFBDHN CC1(C(=O)N[C@H]2C[C@H](CNCc3csc([N+](=O)[O-])c3)C2)CCC1 ZINC000984555792 724356006 /nfs/dbraw/zinc/35/60/06/724356006.db2.gz ZFBIYOOTGKBDIU-AULYBMBSSA-N 0 3 337.445 2.831 20 5 EFBDHN CC1CCN(CCNC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000152699335 726220426 /nfs/dbraw/zinc/22/04/26/726220426.db2.gz YCJHDXWBQKYELL-UHFFFAOYSA-N 0 3 325.796 2.710 20 5 EFBDHN CC[C@H]1CN(C)CCCN1C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC000907924685 727055198 /nfs/dbraw/zinc/05/51/98/727055198.db2.gz KHDRZCYFPVFPSY-NSHDSACASA-N 0 3 343.786 2.944 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCCN(CC)C[C@H]1C ZINC000910278964 727426679 /nfs/dbraw/zinc/42/66/79/727426679.db2.gz HSTOGKMVMQKVOZ-CYBMUJFWSA-N 0 3 335.404 2.550 20 5 EFBDHN CCN1CCCN(C(=O)c2c(Cl)cccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000910284217 727427254 /nfs/dbraw/zinc/42/72/54/727427254.db2.gz OKPKEXFWTYLJPW-NSHDSACASA-N 0 3 325.796 2.805 20 5 EFBDHN CCN1CCCN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)[C@H](C)C1 ZINC000910289272 727428109 /nfs/dbraw/zinc/42/81/09/727428109.db2.gz OYSCEHCMTFNWEQ-GFCCVEGCSA-N 0 3 330.388 2.632 20 5 EFBDHN CCN1CCCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)[C@@H](C)C1 ZINC000910290236 727428209 /nfs/dbraw/zinc/42/82/09/727428209.db2.gz ZAGYMMGWWQTARS-LBPRGKRZSA-N 0 3 331.372 2.897 20 5 EFBDHN CC[C@H](C)C[C@H](N)C(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000912149985 727664543 /nfs/dbraw/zinc/66/45/43/727664543.db2.gz HMMBTQULXSWQTG-HZMBPMFUSA-N 0 3 327.812 2.970 20 5 EFBDHN COc1ccc(C[C@](C)(CO)NCc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000873191044 1126118567 /nfs/dbraw/zinc/11/85/67/1126118567.db2.gz ONUNMNPQGRSQQS-GOSISDBHSA-N 0 3 348.374 2.826 20 5 EFBDHN COc1ccccc1C[C@@](C)(CO)NCc1ccc([N+](=O)[O-])c(F)c1 ZINC000931604231 1126136841 /nfs/dbraw/zinc/13/68/41/1126136841.db2.gz VVAUCJFVPZOUDF-SFHVURJKSA-N 0 3 348.374 2.826 20 5 EFBDHN C[C@@H]1OC(C)(C)N[C@H]1CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC001576910752 1089523546 /nfs/dbraw/zinc/52/35/46/1089523546.db2.gz WACKGEITHBZFDS-CABZTGNLSA-N 0 3 349.412 2.652 20 5 EFBDHN Cc1cc(NC(=O)NC[C@H]2NCCc3ccccc32)cc([N+](=O)[O-])c1 ZINC001579631267 1090646943 /nfs/dbraw/zinc/64/69/43/1090646943.db2.gz LEMTXEZZBKXYBY-QGZVFWFLSA-N 0 3 340.383 2.912 20 5 EFBDHN Cc1cc([N+](=O)[O-])c(C(=O)Nc2cnc3c(c2)CNCC3)cc1Cl ZINC001579642374 1090648719 /nfs/dbraw/zinc/64/87/19/1090648719.db2.gz CLOPEDQYDCNYND-UHFFFAOYSA-N 0 3 346.774 2.850 20 5 EFBDHN C[C@H]([NH2+]Cc1ccc(-c2nnn[n-]2)s1)c1ccc([N+](=O)[O-])cc1 ZINC001580440931 1090900542 /nfs/dbraw/zinc/90/05/42/1090900542.db2.gz AFMVLSKPCLRHCR-VIFPVBQESA-N 0 3 330.373 2.687 20 5 EFBDHN O=[N+]([O-])c1cnc2ccc(Cl)cc2c1N[C@H]1CNCCC1(F)F ZINC001580875148 1091030757 /nfs/dbraw/zinc/03/07/57/1091030757.db2.gz BAVBQGKCBKGTCU-LBPRGKRZSA-N 0 3 342.733 2.627 20 5 EFBDHN CC(C)C[C@@H]1CC[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001589573742 1093110545 /nfs/dbraw/zinc/11/05/45/1093110545.db2.gz ZSSHLUHWMRJCSK-LBPRGKRZSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)C[C@@H]1CC[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001589573742 1093110549 /nfs/dbraw/zinc/11/05/49/1093110549.db2.gz ZSSHLUHWMRJCSK-LBPRGKRZSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)C[C@@H]1CC[N@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001589573742 1093110552 /nfs/dbraw/zinc/11/05/52/1093110552.db2.gz ZSSHLUHWMRJCSK-LBPRGKRZSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)C[C@@H]1CC[N@@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001589573742 1093110556 /nfs/dbraw/zinc/11/05/56/1093110556.db2.gz ZSSHLUHWMRJCSK-LBPRGKRZSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)[N@@H+](Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])CC1CCC1 ZINC001589701726 1093127862 /nfs/dbraw/zinc/12/78/62/1093127862.db2.gz WSHUZFQFXVUIST-UHFFFAOYSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)[N@H+](Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])CC1CCC1 ZINC001589701726 1093127867 /nfs/dbraw/zinc/12/78/67/1093127867.db2.gz WSHUZFQFXVUIST-UHFFFAOYSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)[N@@H+](Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])CC1CCC1 ZINC001589701726 1093127868 /nfs/dbraw/zinc/12/78/68/1093127868.db2.gz WSHUZFQFXVUIST-UHFFFAOYSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)[N@H+](Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])CC1CCC1 ZINC001589701726 1093127871 /nfs/dbraw/zinc/12/78/71/1093127871.db2.gz WSHUZFQFXVUIST-UHFFFAOYSA-N 0 3 330.392 2.785 20 5 EFBDHN C/C=C/C[C@H]1CCC[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590352614 1093388316 /nfs/dbraw/zinc/38/83/16/1093388316.db2.gz CGTKBQHKYAHABI-IBUXWKBASA-N 0 3 342.403 2.953 20 5 EFBDHN C/C=C/C[C@H]1CCC[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590352614 1093388323 /nfs/dbraw/zinc/38/83/23/1093388323.db2.gz CGTKBQHKYAHABI-IBUXWKBASA-N 0 3 342.403 2.953 20 5 EFBDHN C/C=C/C[C@H]1CCC[N@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590352614 1093388328 /nfs/dbraw/zinc/38/83/28/1093388328.db2.gz CGTKBQHKYAHABI-IBUXWKBASA-N 0 3 342.403 2.953 20 5 EFBDHN C/C=C/C[C@H]1CCC[N@@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590352614 1093388334 /nfs/dbraw/zinc/38/83/34/1093388334.db2.gz CGTKBQHKYAHABI-IBUXWKBASA-N 0 3 342.403 2.953 20 5 EFBDHN CC[C@]1(C)CCC[N@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001590489202 1093450413 /nfs/dbraw/zinc/45/04/13/1093450413.db2.gz BHNUIGNOPGBOGQ-MRXNPFEDSA-N 0 3 330.392 2.787 20 5 EFBDHN CC[C@]1(C)CCC[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001590489202 1093450418 /nfs/dbraw/zinc/45/04/18/1093450418.db2.gz BHNUIGNOPGBOGQ-MRXNPFEDSA-N 0 3 330.392 2.787 20 5 EFBDHN CC[C@H]1CCCC[C@H]1[NH2+]Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001590510188 1093464823 /nfs/dbraw/zinc/46/48/23/1093464823.db2.gz FNNRTRHLHASGDR-SMDDNHRTSA-N 0 3 330.392 2.833 20 5 EFBDHN CC[C@H]1CCCC[C@H]1[NH2+]Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001590510188 1093464825 /nfs/dbraw/zinc/46/48/25/1093464825.db2.gz FNNRTRHLHASGDR-SMDDNHRTSA-N 0 3 330.392 2.833 20 5 EFBDHN C[C@@H]1C[C@H](C)CC[N@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001591735588 1093849576 /nfs/dbraw/zinc/84/95/76/1093849576.db2.gz XSJPLCMZCOHHQG-VXGBXAGGSA-N 0 3 330.392 2.643 20 5 EFBDHN C[C@@H]1C[C@H](C)CC[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001591735588 1093849584 /nfs/dbraw/zinc/84/95/84/1093849584.db2.gz XSJPLCMZCOHHQG-VXGBXAGGSA-N 0 3 330.392 2.643 20 5 EFBDHN C[C@@H]1C[C@H](C)CC[N@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001591735588 1093849590 /nfs/dbraw/zinc/84/95/90/1093849590.db2.gz XSJPLCMZCOHHQG-VXGBXAGGSA-N 0 3 330.392 2.643 20 5 EFBDHN C[C@@H]1C[C@H](C)CC[N@@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001591735588 1093849597 /nfs/dbraw/zinc/84/95/97/1093849597.db2.gz XSJPLCMZCOHHQG-VXGBXAGGSA-N 0 3 330.392 2.643 20 5 EFBDHN NCc1nn(-c2nccc(Br)c2[N+](=O)[O-])c2ccccc12 ZINC001167699807 1096009103 /nfs/dbraw/zinc/00/91/03/1096009103.db2.gz AYECFHYHNNQSSS-UHFFFAOYSA-N 0 3 348.160 2.550 20 5 EFBDHN C[C@@H]1C[N@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC(C)(C)C1 ZINC001603936557 1096674035 /nfs/dbraw/zinc/67/40/35/1096674035.db2.gz SSAVQBVEZWHUTJ-NSHDSACASA-N 0 3 330.392 2.643 20 5 EFBDHN C[C@@H]1C[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC(C)(C)C1 ZINC001603936557 1096674037 /nfs/dbraw/zinc/67/40/37/1096674037.db2.gz SSAVQBVEZWHUTJ-NSHDSACASA-N 0 3 330.392 2.643 20 5 EFBDHN CCC(CC)[C@@H](CNc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)[NH+](C)C ZINC001604023465 1096703108 /nfs/dbraw/zinc/70/31/08/1096703108.db2.gz RFRVTCQWNSECKK-OAHLLOKOSA-N 0 3 347.423 2.553 20 5 EFBDHN CCC(CC)[C@@H](CNc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1)[NH+](C)C ZINC001604023465 1096703111 /nfs/dbraw/zinc/70/31/11/1096703111.db2.gz RFRVTCQWNSECKK-OAHLLOKOSA-N 0 3 347.423 2.553 20 5 EFBDHN C[N@@H+](Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])C[C@H]1CC=CCC1 ZINC001604806888 1096961178 /nfs/dbraw/zinc/96/11/78/1096961178.db2.gz AUIZIRCFTKACAV-LBPRGKRZSA-N 0 3 328.376 2.563 20 5 EFBDHN C[N@H+](Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])C[C@H]1CC=CCC1 ZINC001604806888 1096961184 /nfs/dbraw/zinc/96/11/84/1096961184.db2.gz AUIZIRCFTKACAV-LBPRGKRZSA-N 0 3 328.376 2.563 20 5 EFBDHN Cc1cc(CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)ccc1-c1nn[nH]n1 ZINC001605660993 1097181648 /nfs/dbraw/zinc/18/16/48/1097181648.db2.gz KCYSYYDHQLOXNY-LBPRGKRZSA-N 0 3 338.371 2.934 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[NH2+]C1(C2CCCCC2)CC1 ZINC001607078702 1097507180 /nfs/dbraw/zinc/50/71/80/1097507180.db2.gz CMERVGSLPZFBHM-UHFFFAOYSA-N 0 3 342.403 2.977 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1C[NH2+]C1(C2CCCCC2)CC1 ZINC001607078702 1097507187 /nfs/dbraw/zinc/50/71/87/1097507187.db2.gz CMERVGSLPZFBHM-UHFFFAOYSA-N 0 3 342.403 2.977 20 5 EFBDHN CS(=O)(=O)CC1(CNCc2ccc([N+](=O)[O-])c(Cl)c2)CCC1 ZINC000840974689 1102639672 /nfs/dbraw/zinc/63/96/72/1102639672.db2.gz FFKHQHURSXBIDA-UHFFFAOYSA-N 0 3 346.836 2.553 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCN(C3CC3)C[C@@H](C)C2)c1C ZINC000897866347 1106122941 /nfs/dbraw/zinc/12/29/41/1106122941.db2.gz XBSWCUWVHBDBFL-GFCCVEGCSA-N 0 3 331.416 2.768 20 5 EFBDHN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N1CC[C@@H](N2CCCCC2)C1 ZINC000843791888 1106211104 /nfs/dbraw/zinc/21/11/04/1106211104.db2.gz PLOUXYKREXATOW-CYBMUJFWSA-N 0 3 335.379 2.743 20 5 EFBDHN O=[N+]([O-])c1cncc(Br)c1N[C@H]1CCN2CCCC[C@H]12 ZINC000300185730 1111869208 /nfs/dbraw/zinc/86/92/08/1111869208.db2.gz QNCSRJDWYMNZSW-WDEREUQCSA-N 0 3 341.209 2.791 20 5 EFBDHN CCN(CCNc1ccc(C)cc1[N+](=O)[O-])C(=O)CN(C)C1CCC1 ZINC001106979511 1118976998 /nfs/dbraw/zinc/97/69/98/1118976998.db2.gz RYKJFWFKGXYDNH-UHFFFAOYSA-N 0 3 348.447 2.648 20 5 EFBDHN O=C1COc2ccccc2N1CCCNCc1cccc([N+](=O)[O-])c1 ZINC000174522070 231229804 /nfs/dbraw/zinc/22/98/04/231229804.db2.gz JXQAQDQCSXKLPR-UHFFFAOYSA-N 0 3 341.367 2.500 20 5 EFBDHN CN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)c1ccc([N+](=O)[O-])o1 ZINC000174943279 529954982 /nfs/dbraw/zinc/95/49/82/529954982.db2.gz RAPSURVINJLAHG-HNNXBMFYSA-N 0 3 343.383 2.782 20 5 EFBDHN CN(Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)[C@H]1CCSC1 ZINC000130488086 530014404 /nfs/dbraw/zinc/01/44/04/530014404.db2.gz WNSIWBXMILYRNF-HNNXBMFYSA-N 0 3 332.429 2.933 20 5 EFBDHN Cc1ccc([C@H](CNC(=O)c2cccc([N+](=O)[O-])c2N)N(C)C)cc1 ZINC000178180327 232101740 /nfs/dbraw/zinc/10/17/40/232101740.db2.gz ODCKGSADDHECAC-INIZCTEOSA-N 0 3 342.399 2.518 20 5 EFBDHN COc1cc(C(=O)NCC(C)(C)N2CCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000101653499 219152248 /nfs/dbraw/zinc/15/22/48/219152248.db2.gz HKLGLFHSILZLSM-CYBMUJFWSA-N 0 3 349.431 2.844 20 5 EFBDHN C[C@@H]1CCCN(C(C)(C)CNC(=O)c2cc(F)ccc2[N+](=O)[O-])C1 ZINC000102637284 219216655 /nfs/dbraw/zinc/21/66/55/219216655.db2.gz RVESVMFIFDHDSD-GFCCVEGCSA-N 0 3 337.395 2.974 20 5 EFBDHN O=[N+]([O-])c1ccc(CN2CCC[C@@H](c3nnc(C4CC4)[nH]3)C2)cc1 ZINC000179499205 233106386 /nfs/dbraw/zinc/10/63/86/233106386.db2.gz HXFOMAGBRPPDFU-CQSZACIVSA-N 0 3 327.388 2.970 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C/CN1CCN(CC2CCOCC2)CC1 ZINC000179624658 233246690 /nfs/dbraw/zinc/24/66/90/233246690.db2.gz FNVMIOVVFMCTTB-HWKANZROSA-N 0 3 345.443 2.652 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN[C@H](CCCO)c2ccccc2)c1 ZINC000179743059 233392326 /nfs/dbraw/zinc/39/23/26/233392326.db2.gz YRGIIGBAKRKLAM-QZTJIDSGSA-N 0 3 330.384 2.732 20 5 EFBDHN Cc1cc(C(=O)NC[C@@H](c2ccccc2)N(C)C)c(N)c([N+](=O)[O-])c1 ZINC000068509956 215314377 /nfs/dbraw/zinc/31/43/77/215314377.db2.gz WAJAREQMSDLHTN-INIZCTEOSA-N 0 3 342.399 2.518 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN[C@H](C)c1ccccn1 ZINC000181790854 234323844 /nfs/dbraw/zinc/32/38/44/234323844.db2.gz SBBWIKZTQUPAAH-CYBMUJFWSA-N 0 3 328.372 2.978 20 5 EFBDHN Cc1c([C@@H](C)NCCC(=O)Nc2cc([N+](=O)[O-])ccc2C)cnn1C ZINC000183391215 235044688 /nfs/dbraw/zinc/04/46/88/235044688.db2.gz BJXPFPOILPHMRH-GFCCVEGCSA-N 0 3 345.403 2.625 20 5 EFBDHN CN1CC[C@@H]2[C@@H](CCCN2C(=O)C(C)(C)c2ccccc2[N+](=O)[O-])C1 ZINC000410592848 283090617 /nfs/dbraw/zinc/09/06/17/283090617.db2.gz QEPUWUUMYRREPY-GOEBONIOSA-N 0 3 345.443 2.815 20 5 EFBDHN CN(C)C1(CN(C)C(=O)c2c(Cl)cccc2[N+](=O)[O-])CCC1 ZINC000186988385 236088527 /nfs/dbraw/zinc/08/85/27/236088527.db2.gz DANHIGOYUDJOET-UHFFFAOYSA-N 0 3 325.796 2.805 20 5 EFBDHN CN(C)C1(CN(C)C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CCC1 ZINC000187888680 236326862 /nfs/dbraw/zinc/32/68/62/236326862.db2.gz LHLCRZCKRBIDHO-UHFFFAOYSA-N 0 3 325.796 2.805 20 5 EFBDHN CN(C)C1(CN(C)C(=O)CSc2ccc([N+](=O)[O-])cc2)CCC1 ZINC000188027270 236390302 /nfs/dbraw/zinc/39/03/02/236390302.db2.gz XJKGCFQVDHLXFX-UHFFFAOYSA-N 0 3 337.445 2.630 20 5 EFBDHN CN(C)[C@H](CNc1nc2ccccn2c1[N+](=O)[O-])Cc1ccccc1 ZINC000032806316 212846878 /nfs/dbraw/zinc/84/68/78/212846878.db2.gz XKCWJWPQWFMWDZ-HNNXBMFYSA-N 0 3 339.399 2.827 20 5 EFBDHN C[C@H]1CN(Cc2ccc([N+](=O)[O-])cc2Cl)CCN1CC(C)(C)O ZINC000189903715 237384033 /nfs/dbraw/zinc/38/40/33/237384033.db2.gz RTXOJGDZWBDCET-LBPRGKRZSA-N 0 3 341.839 2.525 20 5 EFBDHN C[C@H]1CCN(CCOc2ccc([N+](=O)[O-])cc2)C[C@@H]1n1ccnc1 ZINC000129640821 223076372 /nfs/dbraw/zinc/07/63/72/223076372.db2.gz NPUJQBVMCJZASI-YOEHRIQHSA-N 0 3 330.388 2.753 20 5 EFBDHN CN1[C@@H]2CC[C@H]1CCN(C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C2 ZINC000072499833 216264296 /nfs/dbraw/zinc/26/42/96/216264296.db2.gz AYMPBEPZOQIODT-NWDGAFQWSA-N 0 3 338.795 2.949 20 5 EFBDHN COc1cc(CNCCCO)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000072713137 216296889 /nfs/dbraw/zinc/29/68/89/216296889.db2.gz UJFHOGRPIYMBCF-UHFFFAOYSA-N 0 3 346.383 2.654 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNCCO)cc1 ZINC000072785917 216304758 /nfs/dbraw/zinc/30/47/58/216304758.db2.gz XYCGIBVVACATDM-UHFFFAOYSA-N 0 3 338.367 2.529 20 5 EFBDHN Cc1ccc([C@H](CNCc2ccc([N+](=O)[O-])cc2)N2CCOCC2)o1 ZINC000073052229 216344638 /nfs/dbraw/zinc/34/46/38/216344638.db2.gz MSBOPLRPGFAZEA-KRWDZBQOSA-N 0 3 345.399 2.659 20 5 EFBDHN C[C@H]1C[C@H](c2ccccc2)CN1CCn1cc([N+](=O)[O-])ccc1=O ZINC000132069723 223296696 /nfs/dbraw/zinc/29/66/96/223296696.db2.gz VVVWNQZUEFBRMX-HOCLYGCPSA-N 0 3 327.384 2.635 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CC[C@@H](OCCCc3ccccc3)C2)n1 ZINC000175959367 239294598 /nfs/dbraw/zinc/29/45/98/239294598.db2.gz TZBZOZVIUOCZSX-QGZVFWFLSA-N 0 3 344.415 2.515 20 5 EFBDHN CN(C)CCN(Cc1ccc(F)cc1F)c1ncc([N+](=O)[O-])s1 ZINC000192488751 239747082 /nfs/dbraw/zinc/74/70/82/239747082.db2.gz SOXGEBLMSXPSGC-UHFFFAOYSA-N 0 3 342.371 2.898 20 5 EFBDHN C[C@H]1CCNC(=O)[C@@H]1NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000193679797 240262592 /nfs/dbraw/zinc/26/25/92/240262592.db2.gz BMXOWXKZCGHBOI-MEDUHNTESA-N 0 3 345.424 2.938 20 5 EFBDHN COC(=O)[C@H]1CCN(Cc2cc(=O)oc3ccc4ccccc4c23)C1 ZINC000298774479 241157691 /nfs/dbraw/zinc/15/76/91/241157691.db2.gz BVOFFSNKNINTJQ-AWEZNQCLSA-N 0 3 337.375 2.941 20 5 EFBDHN C[C@H](CNc1ncc(Br)cc1[N+](=O)[O-])N(C)C1CC1 ZINC000230214856 242252479 /nfs/dbraw/zinc/25/24/79/242252479.db2.gz DYBCBGIYMJWPFW-MRVPVSSYSA-N 0 3 329.198 2.647 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1CNC1(CO)C2CC3CC(C2)CC1C3 ZINC000412003642 243065571 /nfs/dbraw/zinc/06/55/71/243065571.db2.gz QOMBJCNKBXTPFW-UHFFFAOYSA-N 0 3 346.427 2.880 20 5 EFBDHN CO[C@H]1c2ccccc2C[C@H]1NCCOc1cccc([N+](=O)[O-])c1 ZINC000411895019 243019624 /nfs/dbraw/zinc/01/96/24/243019624.db2.gz UKPDEUMVGKDHOZ-MSOLQXFVSA-N 0 3 328.368 2.876 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCN1C[C@H](O)C[C@@H]1c1ccccc1 ZINC000411919670 243026860 /nfs/dbraw/zinc/02/68/60/243026860.db2.gz BIPLAZXHQOWPJB-NVXWUHKLSA-N 0 3 328.368 2.782 20 5 EFBDHN CC(C)N1CCCN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CC1 ZINC000411972705 243051545 /nfs/dbraw/zinc/05/15/45/243051545.db2.gz NVEOXBANXXOUOP-DLBZAZTESA-N 0 3 331.416 2.641 20 5 EFBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CN2CCN3CCCC[C@H]3C2)c1 ZINC000245560223 243131870 /nfs/dbraw/zinc/13/18/70/243131870.db2.gz MQZTULBICIIESJ-AWEZNQCLSA-N 0 3 341.358 2.866 20 5 EFBDHN COc1c(C(=O)N2CCCN(CC3CCC3)CC2)cccc1[N+](=O)[O-] ZINC000412320289 243267368 /nfs/dbraw/zinc/26/73/68/243267368.db2.gz VPWNANDKEOQFMR-UHFFFAOYSA-N 0 3 347.415 2.551 20 5 EFBDHN O=C(NC[C@H]1CCCCN1C1CC1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412290963 243248836 /nfs/dbraw/zinc/24/88/36/243248836.db2.gz JWVJLDPKGIOKBQ-FGTMMUONSA-N 0 3 343.427 2.831 20 5 EFBDHN CCN1CCN([C@H](C)CNc2ccc([N+](=O)[O-])c3ncccc23)CC1 ZINC000413053683 243440079 /nfs/dbraw/zinc/44/00/79/243440079.db2.gz KOSGKRLBGCAKMZ-CQSZACIVSA-N 0 3 343.431 2.581 20 5 EFBDHN Cc1ccc(C(=O)NCCNCc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000076714439 216809163 /nfs/dbraw/zinc/80/91/63/216809163.db2.gz KCDLGMNIUNGIGS-UHFFFAOYSA-N 0 3 327.384 2.731 20 5 EFBDHN Cc1c([C@@H](C)NCCC(C)(C)S(C)(=O)=O)cccc1[N+](=O)[O-] ZINC000414244100 244058037 /nfs/dbraw/zinc/05/80/37/244058037.db2.gz ALFRMIKCNGRDHV-GFCCVEGCSA-N 0 3 328.434 2.767 20 5 EFBDHN O=C(N[C@@H]1CNCCC1(F)F)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000449661243 284125446 /nfs/dbraw/zinc/12/54/46/284125446.db2.gz ZOXYOUIMQVMGDE-GFCCVEGCSA-N 0 3 341.339 2.537 20 5 EFBDHN CN(C)C(=O)[C@H]1CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000414497231 244194927 /nfs/dbraw/zinc/19/49/27/244194927.db2.gz JWVOKOJPLINHHB-AWEZNQCLSA-N 0 3 343.383 2.765 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H](CO)[C@@H]3CCCOC3)o2)cc1 ZINC000414569723 244238896 /nfs/dbraw/zinc/23/88/96/244238896.db2.gz ZSEWNHLCMCTGHN-PBHICJAKSA-N 0 3 346.383 2.732 20 5 EFBDHN Cc1ccc(NC(=O)NC[C@H]2NCCc3ccccc32)cc1[N+](=O)[O-] ZINC000414668763 244287173 /nfs/dbraw/zinc/28/71/73/244287173.db2.gz ZHPFLYNRBFKRBO-MRXNPFEDSA-N 0 3 340.383 2.912 20 5 EFBDHN C[C@H](C(=O)N1CCc2c1cccc2[N+](=O)[O-])[C@@H](N)c1ccccc1 ZINC000262653465 245097753 /nfs/dbraw/zinc/09/77/53/245097753.db2.gz WHXCVYSXLQXWTQ-YVEFUNNKSA-N 0 3 325.368 2.820 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCc1ccc2c(c1)CNC2 ZINC000418547376 245189564 /nfs/dbraw/zinc/18/95/64/245189564.db2.gz BCBRIPOAKDRCGV-UHFFFAOYSA-N 0 3 340.383 2.540 20 5 EFBDHN C[C@H](CNC(=O)c1ccc([N+](=O)[O-])s1)N(C)Cc1ccccc1 ZINC000110356900 220032248 /nfs/dbraw/zinc/03/22/48/220032248.db2.gz NZAVYZSFSFVZQJ-GFCCVEGCSA-N 0 3 333.413 2.907 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)C[C@H]1CCCN1C ZINC000421704575 246067265 /nfs/dbraw/zinc/06/72/65/246067265.db2.gz PGZCSAPYUNENHU-GXTWGEPZSA-N 0 3 337.445 2.628 20 5 EFBDHN COc1ccc(CNC(=O)[C@H](C(C)C)N2CCCCC2)cc1[N+](=O)[O-] ZINC000264109669 246073913 /nfs/dbraw/zinc/07/39/13/246073913.db2.gz BEMVKMBQVTYQNX-KRWDZBQOSA-N 0 3 349.431 2.730 20 5 EFBDHN CN(C[C@@H]1CCCN1C)C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000421710384 246076512 /nfs/dbraw/zinc/07/65/12/246076512.db2.gz KHWZFJAZJVROMT-ZDUSSCGKSA-N 0 3 337.395 2.564 20 5 EFBDHN CC(C)N1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000264918784 247045752 /nfs/dbraw/zinc/04/57/52/247045752.db2.gz LLPBKLCOQNEPTP-UHFFFAOYSA-N 0 3 325.796 2.805 20 5 EFBDHN CN(C)c1ncc(CN2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)n1C ZINC000425367107 247059639 /nfs/dbraw/zinc/05/96/39/247059639.db2.gz HCYNCSSINIZSER-OAHLLOKOSA-N 0 3 343.431 2.774 20 5 EFBDHN COCC(C)(C)N1CCN(c2ccnc3c2cccc3[N+](=O)[O-])CC1 ZINC000425273034 247024721 /nfs/dbraw/zinc/02/47/21/247024721.db2.gz ABGIAYLKYIFDLZ-UHFFFAOYSA-N 0 3 344.415 2.690 20 5 EFBDHN CC[C@@H]1CCCCN1CCNc1ccc(C(=O)NC)cc1[N+](=O)[O-] ZINC000264995356 247119575 /nfs/dbraw/zinc/11/95/75/247119575.db2.gz UMBSUIXNXTUIFM-CQSZACIVSA-N 0 3 334.420 2.631 20 5 EFBDHN CC[C@@H]1CCCCN1CCNC(=O)c1cc(OC)ccc1[N+](=O)[O-] ZINC000265003616 247127470 /nfs/dbraw/zinc/12/74/70/247127470.db2.gz TUGUTYXFHQLXEI-CYBMUJFWSA-N 0 3 335.404 2.598 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)NCc1ccc(CN(C)C)cc1 ZINC000427751328 247389895 /nfs/dbraw/zinc/38/98/95/247389895.db2.gz CDUZIYPYNOREKL-UHFFFAOYSA-N 0 3 343.383 2.595 20 5 EFBDHN CC(=O)Nc1ccc(CNC/C=C/c2ccccc2[N+](=O)[O-])cn1 ZINC000433192715 248025784 /nfs/dbraw/zinc/02/57/84/248025784.db2.gz MMTUPNHNZJIEIL-GQCTYLIASA-N 0 3 326.356 2.751 20 5 EFBDHN COCCN(CCOc1ccccc1[N+](=O)[O-])[C@H]1CCCSC1 ZINC000433201526 248027619 /nfs/dbraw/zinc/02/76/19/248027619.db2.gz WVJRZXUUHBYNEA-AWEZNQCLSA-N 0 3 340.445 2.818 20 5 EFBDHN CCOc1cc(CN(CCO)[C@@H]2CCCSC2)ccc1[N+](=O)[O-] ZINC000433211232 248029341 /nfs/dbraw/zinc/02/93/41/248029341.db2.gz XEUPXBZJQVHJAS-CQSZACIVSA-N 0 3 340.445 2.683 20 5 EFBDHN COc1ccc(CNC[C@@](C)(O)c2cc(C)oc2C)cc1[N+](=O)[O-] ZINC000266163958 248142839 /nfs/dbraw/zinc/14/28/39/248142839.db2.gz OMRIPOFLRYVZLK-QGZVFWFLSA-N 0 3 334.372 2.811 20 5 EFBDHN O=C(CCNc1ccccc1[N+](=O)[O-])NC[C@@H]1CCCCN1C1CC1 ZINC000434423327 248153007 /nfs/dbraw/zinc/15/30/07/248153007.db2.gz DWKQMTLXDOWADE-HNNXBMFYSA-N 0 3 346.431 2.530 20 5 EFBDHN CN(C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CCN(C)CC1 ZINC000266211582 248176143 /nfs/dbraw/zinc/17/61/43/248176143.db2.gz FWDAYFHRLRYTMP-UHFFFAOYSA-N 0 3 345.321 2.780 20 5 EFBDHN O=C1OCCN1c1cc([N+](=O)[O-])ccc1NC1CCN(C2CC2)CC1 ZINC000266142376 248127178 /nfs/dbraw/zinc/12/71/78/248127178.db2.gz HQUZRKYLUNWRJE-UHFFFAOYSA-N 0 3 346.387 2.590 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CC[C@H](N3CC=CC3)C2)cc1OC(F)F ZINC000266282262 248221564 /nfs/dbraw/zinc/22/15/64/248221564.db2.gz UMFFAMZBZLVOSG-LBPRGKRZSA-N 0 3 325.315 2.647 20 5 EFBDHN C[C@@H](N[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCOC1 ZINC000266299893 248233944 /nfs/dbraw/zinc/23/39/44/248233944.db2.gz MEIJUMYVBIZKQH-MDZLAQPJSA-N 0 3 332.360 2.720 20 5 EFBDHN COc1cccc(C(=O)NC[C@@H](C)N2CCCC[C@@H]2C)c1[N+](=O)[O-] ZINC000435541286 248247813 /nfs/dbraw/zinc/24/78/13/248247813.db2.gz HGRHZTIHJBZOBI-QWHCGFSZSA-N 0 3 335.404 2.596 20 5 EFBDHN C[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CCN1Cc1ccccc1 ZINC000266343396 248256143 /nfs/dbraw/zinc/25/61/43/248256143.db2.gz MVQZNTOCUWSORA-AWEZNQCLSA-N 0 3 342.399 2.660 20 5 EFBDHN CCO[C@@H]1C[C@@H](O)C12CCN([C@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000266505849 248335443 /nfs/dbraw/zinc/33/54/43/248335443.db2.gz BWSBXMGKQMMSJL-KBRIMQKVSA-N 0 3 334.416 2.908 20 5 EFBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCN(CC2CCOCC2)CC1 ZINC000266541410 248351687 /nfs/dbraw/zinc/35/16/87/248351687.db2.gz QBLORVRHASJIJW-HNNXBMFYSA-N 0 3 333.432 2.700 20 5 EFBDHN CN(Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C[C@@H]1CCCCO1 ZINC000092427326 218140041 /nfs/dbraw/zinc/14/00/41/218140041.db2.gz IWVCEQANUFMKDV-KRWDZBQOSA-N 0 3 344.415 2.996 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@H]1C[C@H](C)N(C2CC2)C1 ZINC000092429307 218141461 /nfs/dbraw/zinc/14/14/61/218141461.db2.gz MHQGYWPXCLXAHE-JSGCOSHPSA-N 0 3 331.416 2.875 20 5 EFBDHN CCOCCN(CC)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000092537565 218148643 /nfs/dbraw/zinc/14/86/43/218148643.db2.gz UNNDPSHAXPNBMO-UHFFFAOYSA-N 0 3 332.404 2.854 20 5 EFBDHN COCC1CCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000093103443 218193863 /nfs/dbraw/zinc/19/38/63/218193863.db2.gz PAYNVDJEAMQSAK-UHFFFAOYSA-N 0 3 344.415 2.854 20 5 EFBDHN CCN1CCC(Nc2ncc([N+](=O)[O-])cc2Br)CC1 ZINC000093433923 218226655 /nfs/dbraw/zinc/22/66/55/218226655.db2.gz LRRJFUZEECMCEM-UHFFFAOYSA-N 0 3 329.198 2.649 20 5 EFBDHN C[C@H](O)C[C@@H]1CCCN1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000093482092 218228657 /nfs/dbraw/zinc/22/86/57/218228657.db2.gz QCVCYSWWUJDLID-GUYCJALGSA-N 0 3 344.415 2.731 20 5 EFBDHN C[C@@H](O)C[C@H]1CCCN1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000093482095 218229141 /nfs/dbraw/zinc/22/91/41/218229141.db2.gz QCVCYSWWUJDLID-CXAGYDPISA-N 0 3 344.415 2.731 20 5 EFBDHN C[C@@H]1C[C@H](C)CCN(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000443642991 250215236 /nfs/dbraw/zinc/21/52/36/250215236.db2.gz QDGLIIKNVDUWBI-ZIAGYGMSSA-N 0 3 331.416 2.852 20 5 EFBDHN COc1cccc(C(=O)NC[C@@H]2CCCCN2CC(C)C)c1[N+](=O)[O-] ZINC000444336198 250289401 /nfs/dbraw/zinc/28/94/01/250289401.db2.gz CHSIJHGCIZWNSX-AWEZNQCLSA-N 0 3 349.431 2.844 20 5 EFBDHN COC(=O)[C@H]1CCCC[C@@]1(C)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444668823 250325558 /nfs/dbraw/zinc/32/55/58/250325558.db2.gz ZREFKJHSYWDKFP-SJKOYZFVSA-N 0 3 346.387 2.683 20 5 EFBDHN COc1cc(CN[C@@H](CO)C(C)(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000444703377 250333604 /nfs/dbraw/zinc/33/36/04/250333604.db2.gz SQDRZIKUWGNECZ-ZDUSSCGKSA-N 0 3 348.346 2.701 20 5 EFBDHN CNC(=O)C[C@H](N[C@H](C)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000449303318 250989550 /nfs/dbraw/zinc/98/95/50/250989550.db2.gz XVJXLWJGYUJGMA-PBHICJAKSA-N 0 3 341.411 2.993 20 5 EFBDHN CO[C@@H]1COCC[C@H]1CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000449453185 251031210 /nfs/dbraw/zinc/03/12/10/251031210.db2.gz HMIHXJNTLJSUFS-SCLBCKFNSA-N 0 3 346.383 2.996 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@H]([C@@H](CO)C1CC1)C1CC1 ZINC000449510832 251047565 /nfs/dbraw/zinc/04/75/65/251047565.db2.gz QQEDSODEQUUZOF-WMZOPIPTSA-N 0 3 334.416 2.880 20 5 EFBDHN Cc1ccncc1CN[C@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000449526512 251052822 /nfs/dbraw/zinc/05/28/22/251052822.db2.gz WDSYNHDTIAXQLN-CYBMUJFWSA-N 0 3 328.372 2.805 20 5 EFBDHN CO[C@@H]1CCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000449503768 251045425 /nfs/dbraw/zinc/04/54/25/251045425.db2.gz PWYSGEURZSYZCN-SUMWQHHRSA-N 0 3 344.415 2.852 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nc(CNCCC3(CO)CC3)cs2)c1 ZINC000449581051 251072836 /nfs/dbraw/zinc/07/28/36/251072836.db2.gz WQRMSDLJOXVIIT-UHFFFAOYSA-N 0 3 333.413 2.971 20 5 EFBDHN CNC(=O)C[C@@H](C)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000449605915 251080208 /nfs/dbraw/zinc/08/02/08/251080208.db2.gz XHUYGUMCCPIGKM-LLVKDONJSA-N 0 3 333.413 2.938 20 5 EFBDHN CNC(=O)C[C@H](C)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000449605916 251080580 /nfs/dbraw/zinc/08/05/80/251080580.db2.gz XHUYGUMCCPIGKM-NSHDSACASA-N 0 3 333.413 2.938 20 5 EFBDHN COC(=O)[C@H]1CN(Cc2ccc([N+](=O)[O-])cc2)C[C@@H]1c1ccccc1 ZINC000449757314 251142847 /nfs/dbraw/zinc/14/28/47/251142847.db2.gz SDNSXOFQOUDOPV-MSOLQXFVSA-N 0 3 340.379 2.983 20 5 EFBDHN NC(=O)[C@@H]1CC[C@H](NCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000449744798 251137819 /nfs/dbraw/zinc/13/78/19/251137819.db2.gz JUUYYEXCZLHUII-OLZOCXBDSA-N 0 3 329.356 2.598 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@@H]3CN(C)CC[C@@H]32)c1 ZINC000164270167 533008233 /nfs/dbraw/zinc/00/82/33/533008233.db2.gz KNUZYVPYNTZQRQ-DOMZBBRYSA-N 0 3 349.456 2.873 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@H](Cc2ccccc2)[C@H](O)C(F)F)cc1 ZINC000344349212 285115732 /nfs/dbraw/zinc/11/57/32/285115732.db2.gz VODZLJRQTOOGLG-CVEARBPZSA-N 0 3 336.338 2.922 20 5 EFBDHN O=[N+]([O-])c1ccc(N2C[C@@H]3CCN(Cc4ccccc4)C[C@H]3C2)nc1 ZINC000311234513 285133176 /nfs/dbraw/zinc/13/31/76/285133176.db2.gz SLBCGGJUCLRICT-IRXDYDNUSA-N 0 3 338.411 2.948 20 5 EFBDHN C[C@@H](NC(=O)Cc1ccccc1[N+](=O)[O-])[C@H](c1ccccc1)N(C)C ZINC000187180905 533097040 /nfs/dbraw/zinc/09/70/40/533097040.db2.gz JXBGKTMZCLWULU-AUUYWEPGSA-N 0 3 341.411 2.945 20 5 EFBDHN C[C@@H](NC(=O)Cc1cccc([N+](=O)[O-])c1)[C@@H](c1ccccc1)N(C)C ZINC000187165289 533096044 /nfs/dbraw/zinc/09/60/44/533096044.db2.gz FZWCPSKPYLOVEG-KUHUBIRLSA-N 0 3 341.411 2.945 20 5 EFBDHN COc1ccc([C@@H](CO)N(C)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000112995837 220437625 /nfs/dbraw/zinc/43/76/25/220437625.db2.gz YFJHDEPZPRLTMX-QGZVFWFLSA-N 0 3 346.383 2.648 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN[C@@H]2CCO[C@H]2c2ccc(Cl)cc2)n1 ZINC000192029290 285168497 /nfs/dbraw/zinc/16/84/97/285168497.db2.gz RVXYLZGHKQEOHL-HIFRSBDPSA-N 0 3 336.779 2.565 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)CCN[C@@H](C)c1ccccn1 ZINC000181777916 533138136 /nfs/dbraw/zinc/13/81/36/533138136.db2.gz YJWAEGGXEMLSGW-LBPRGKRZSA-N 0 3 344.371 2.678 20 5 EFBDHN O=[N+]([O-])c1cc(CN[C@@H](CO)Cc2c[nH]c3ccccc23)cs1 ZINC000116350669 220955149 /nfs/dbraw/zinc/95/51/49/220955149.db2.gz VBXFONHOCJCJOE-CYBMUJFWSA-N 0 3 331.397 2.831 20 5 EFBDHN CO[C@H]1C[C@H](NCc2cc([N+](=O)[O-])cc3c2OCOC3)C12CCC2 ZINC000459793197 255934630 /nfs/dbraw/zinc/93/46/30/255934630.db2.gz TUVZOWWLCZFIAF-GJZGRUSLSA-N 0 3 334.372 2.509 20 5 EFBDHN CCOC(=O)c1cc(NCCN2CCC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000467745896 256011946 /nfs/dbraw/zinc/01/19/46/256011946.db2.gz GYSOZBBUQPTLMC-ZDUSSCGKSA-N 0 3 335.404 2.915 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN[C@H]1CC(=O)N(C(C)(C)C)C1 ZINC000468746278 256018109 /nfs/dbraw/zinc/01/81/09/256018109.db2.gz FZUTVWHCBRWHQD-ODDCISTRSA-N 0 3 331.416 2.987 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000117799375 221091016 /nfs/dbraw/zinc/09/10/16/221091016.db2.gz WYZVYRDSLXJUJZ-AWEZNQCLSA-N 0 3 339.823 2.781 20 5 EFBDHN CN(C[C@H]1CCCN(C)C1)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000117806922 221091098 /nfs/dbraw/zinc/09/10/98/221091098.db2.gz ZHYARKJXOYYIKR-LBPRGKRZSA-N 0 3 339.823 2.591 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000117799374 221091295 /nfs/dbraw/zinc/09/12/95/221091295.db2.gz WYZVYRDSLXJUJZ-CQSZACIVSA-N 0 3 339.823 2.781 20 5 EFBDHN O=C(Cc1ccccc1[N+](=O)[O-])N1CCN(C2CCCCC2)CC1 ZINC000154891265 224322441 /nfs/dbraw/zinc/32/24/41/224322441.db2.gz PLHIBPYAEDCASR-UHFFFAOYSA-N 0 3 331.416 2.614 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN(C)Cc1cccnc1 ZINC000119070772 221236876 /nfs/dbraw/zinc/23/68/76/221236876.db2.gz UUIHMMXJIMVJHK-UHFFFAOYSA-N 0 3 328.372 2.759 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@@H]1CC[C@@H](C)C[C@H]1C ZINC000119277586 221282759 /nfs/dbraw/zinc/28/27/59/221282759.db2.gz YPSNCKTVCOQUQR-YRGRVCCFSA-N 0 3 335.404 2.956 20 5 EFBDHN CCCC(O)(CCC)C[NH2+]Cc1cc(OC)c([O-])cc1[N+](=O)[O-] ZINC000119706177 221381660 /nfs/dbraw/zinc/38/16/60/221381660.db2.gz UZPNRYATOXGEMB-UHFFFAOYSA-N 0 3 326.393 2.730 20 5 EFBDHN C[C@@H](N[C@H]1CC(C)(C)OC1(C)C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000132661427 533539190 /nfs/dbraw/zinc/53/91/90/533539190.db2.gz USJKBZWJNDJQDH-RISCZKNCSA-N 0 3 335.404 2.858 20 5 EFBDHN COc1cc(C(=O)NC[C@@H]2N(C)CCCC2(C)C)cc([N+](=O)[O-])c1C ZINC000344612919 142049610 /nfs/dbraw/zinc/04/96/10/142049610.db2.gz KELQFEKDFYCTNK-INIZCTEOSA-N 0 3 349.431 2.762 20 5 EFBDHN Cc1c(CC(=O)NC[C@H]2N(C)CCCC2(C)C)cccc1[N+](=O)[O-] ZINC000344678392 142060037 /nfs/dbraw/zinc/06/00/37/142060037.db2.gz XCLGITBXSJQWJR-MRXNPFEDSA-N 0 3 333.432 2.682 20 5 EFBDHN CNc1c(C(=O)N2CCN(C3CCC3)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000344717464 142066458 /nfs/dbraw/zinc/06/64/58/142066458.db2.gz AKLLTYNSDROWNY-CYBMUJFWSA-N 0 3 346.431 2.583 20 5 EFBDHN COc1c(C(=O)N2CCN(C3CCC3)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000344720830 142067439 /nfs/dbraw/zinc/06/74/39/142067439.db2.gz GZSYEJCIKNWAGV-ZDUSSCGKSA-N 0 3 347.415 2.550 20 5 EFBDHN Cc1c(C(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000346136837 142153082 /nfs/dbraw/zinc/15/30/82/142153082.db2.gz LRTYMUBYZNJCBH-IIYDPXPESA-N 0 3 331.416 2.706 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CCN(C)C2)C1 ZINC000346303001 142186652 /nfs/dbraw/zinc/18/66/52/142186652.db2.gz WGWIJAMNLPTRME-KRWDZBQOSA-N 0 3 349.456 2.875 20 5 EFBDHN CCN(CCN1CCCCCC1)C(=O)COc1cccc([N+](=O)[O-])c1 ZINC000346307471 142187292 /nfs/dbraw/zinc/18/72/92/142187292.db2.gz YBBUCSOKVOITGD-UHFFFAOYSA-N 0 3 349.431 2.698 20 5 EFBDHN O=[N+]([O-])c1cc(CN2CCC[C@H]2C2CCOCC2)c2c(c1)COCO2 ZINC000347632175 142248091 /nfs/dbraw/zinc/24/80/91/142248091.db2.gz QTNHZTWJHRBMKC-KRWDZBQOSA-N 0 3 348.399 2.852 20 5 EFBDHN C[C@@H](NC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)C1=CCN(C)CC1 ZINC000347987127 142304547 /nfs/dbraw/zinc/30/45/47/142304547.db2.gz BAHUSWIZYDIZKE-NWDGAFQWSA-N 0 3 335.379 2.604 20 5 EFBDHN CCO[C@@H]1C[C@@H](N(C)CCn2cc([N+](=O)[O-])cn2)C12CCCCC2 ZINC000350039516 142393488 /nfs/dbraw/zinc/39/34/88/142393488.db2.gz IDMSNYCSDGSMHP-HZPDHXFCSA-N 0 3 336.436 2.851 20 5 EFBDHN C[C@@H]1C[C@@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CCN1C ZINC000341194628 145010261 /nfs/dbraw/zinc/01/02/61/145010261.db2.gz HULKDMDYXIXDRB-ZJUUUORDSA-N 0 3 326.784 2.852 20 5 EFBDHN COC1CCN(C(C)(C)CNCc2csc([N+](=O)[O-])c2)CC1 ZINC000341238169 145018656 /nfs/dbraw/zinc/01/86/56/145018656.db2.gz UKSYEYDVFXIWGO-UHFFFAOYSA-N 0 3 327.450 2.635 20 5 EFBDHN COc1ccc(-c2ccc(CN[C@H](C)CN(C)C)o2)c([N+](=O)[O-])c1 ZINC000342204281 145079987 /nfs/dbraw/zinc/07/99/87/145079987.db2.gz PAURDXPOSYNBIX-GFCCVEGCSA-N 0 3 333.388 2.903 20 5 EFBDHN COc1cc(CNC[C@@H]2CCC[C@@H](CO)C2)c([N+](=O)[O-])cc1OC ZINC000342243286 145086598 /nfs/dbraw/zinc/08/65/98/145086598.db2.gz ITKWAUNCTDJRJS-CHWSQXEVSA-N 0 3 338.404 2.500 20 5 EFBDHN C[C@@H]1CCCC[C@@H]1CNCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000342350436 145106738 /nfs/dbraw/zinc/10/67/38/145106738.db2.gz YGTAXCXHLQLMBE-ZIAGYGMSSA-N 0 3 340.445 2.784 20 5 EFBDHN C[C@H]1[C@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CCCN1C ZINC000342361294 145108769 /nfs/dbraw/zinc/10/87/69/145108769.db2.gz SQMICFZXYADXBG-JOYOIKCWSA-N 0 3 326.784 2.852 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])CN1C1CC1 ZINC000342592929 145155392 /nfs/dbraw/zinc/15/53/92/145155392.db2.gz JMBXWHOKXQPQKH-QWHCGFSZSA-N 0 3 331.416 2.614 20 5 EFBDHN COc1ccc([C@H](CN(C)C)NC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000342610262 145158890 /nfs/dbraw/zinc/15/88/90/145158890.db2.gz AIQFVNNBRLEGHY-KRWDZBQOSA-N 0 3 343.383 2.636 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CCN1C ZINC000342655658 145167104 /nfs/dbraw/zinc/16/71/04/145167104.db2.gz NCZFBUODTBJLRJ-JQWIXIFHSA-N 0 3 340.811 2.530 20 5 EFBDHN CCCN(CCN1CCCCC1)C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000342776045 145189644 /nfs/dbraw/zinc/18/96/44/145189644.db2.gz GLPNAQVVOAKAES-UHFFFAOYSA-N 0 3 349.431 2.698 20 5 EFBDHN C[C@H]1[C@H](Nc2ncc(Br)cc2[N+](=O)[O-])CCCN1C ZINC000343614391 145252904 /nfs/dbraw/zinc/25/29/04/145252904.db2.gz YFEDLUSPTMIOFQ-WCBMZHEXSA-N 0 3 329.198 2.647 20 5 EFBDHN CN(CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)Cc1ccoc1 ZINC000343944314 145329960 /nfs/dbraw/zinc/32/99/60/145329960.db2.gz XNXWMWPWFJMARP-UHFFFAOYSA-N 0 3 331.328 2.618 20 5 EFBDHN Cc1ccc(CN(CCN(C)C)Cc2ccccn2)cc1[N+](=O)[O-] ZINC000349303898 146077323 /nfs/dbraw/zinc/07/73/23/146077323.db2.gz ZKGGTMHEBZBAGK-UHFFFAOYSA-N 0 3 328.416 2.862 20 5 EFBDHN C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000351744749 146192886 /nfs/dbraw/zinc/19/28/86/146192886.db2.gz XCIHQYYXDXASGC-IAQYHMDHSA-N 0 3 336.367 2.824 20 5 EFBDHN C[C@H]1CN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H](C)CN1C ZINC000351944906 146243473 /nfs/dbraw/zinc/24/34/73/146243473.db2.gz NOKQTOHTZNTSCZ-KBPBESRZSA-N 0 3 344.415 2.817 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CN2CC[C@H]2Cc2ccccc2)c1 ZINC000353039794 146382802 /nfs/dbraw/zinc/38/28/02/146382802.db2.gz LTMYRDKCSKGHEH-WMZOPIPTSA-N 0 3 342.395 2.652 20 5 EFBDHN CC[C@@H]1CCCCN1Cc1ccc(OCC(=O)OC)c([N+](=O)[O-])c1 ZINC000355584866 147004181 /nfs/dbraw/zinc/00/41/81/147004181.db2.gz PUENTVFHZORQPA-CQSZACIVSA-N 0 3 336.388 2.911 20 5 EFBDHN COC(=O)COc1ccc(CN2CCC[C@@H]3CCC[C@H]32)cc1[N+](=O)[O-] ZINC000355599739 147008130 /nfs/dbraw/zinc/00/81/30/147008130.db2.gz NZZZSZLBTYDHOM-LSDHHAIUSA-N 0 3 348.399 2.911 20 5 EFBDHN CC[C@@H]1CCCN(Cc2ccc(OCC(=O)OC)c([N+](=O)[O-])c2)C1 ZINC000355607204 147011293 /nfs/dbraw/zinc/01/12/93/147011293.db2.gz MRUAJSVLLHYUEI-CYBMUJFWSA-N 0 3 336.388 2.769 20 5 EFBDHN COC(=O)COc1ccc(CN2CC[C@@H](C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000355779260 147060832 /nfs/dbraw/zinc/06/08/32/147060832.db2.gz ZHEQXECWSDHUHY-OLZOCXBDSA-N 0 3 336.388 2.625 20 5 EFBDHN CSc1ccc(C(=O)N2CC[C@@]3(C2)CCCN(C)C3)cc1[N+](=O)[O-] ZINC000356289231 147202781 /nfs/dbraw/zinc/20/27/81/147202781.db2.gz VQOXBRPIKWBRSW-KRWDZBQOSA-N 0 3 349.456 2.875 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(CCN(C)C)C1CC1 ZINC000356307815 147206740 /nfs/dbraw/zinc/20/67/40/147206740.db2.gz ZBQHVIYGPAXDEP-HNNXBMFYSA-N 0 3 333.432 2.716 20 5 EFBDHN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCN(C)C1 ZINC000356348869 147219997 /nfs/dbraw/zinc/21/99/97/147219997.db2.gz UABUBKUVOSHQNP-LBPRGKRZSA-N 0 3 337.445 2.778 20 5 EFBDHN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC1CCN(C)CC1 ZINC000356363748 147224558 /nfs/dbraw/zinc/22/45/58/147224558.db2.gz OXRGLQGBKPHBJO-UHFFFAOYSA-N 0 3 337.445 2.921 20 5 EFBDHN CN(C)[C@]1(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)CCSC1 ZINC000359681717 148162191 /nfs/dbraw/zinc/16/21/91/148162191.db2.gz USPMSEPQVREFSW-INIZCTEOSA-N 0 3 349.412 2.508 20 5 EFBDHN C[C@@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])s1)C(=O)N(C)C ZINC000359811237 148195464 /nfs/dbraw/zinc/19/54/64/148195464.db2.gz DFMJLGOYGBGGCL-LLVKDONJSA-N 0 3 333.413 2.890 20 5 EFBDHN CC(C)(C(=O)N1CC[C@@H](N2CCCC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000364026453 149050933 /nfs/dbraw/zinc/05/09/33/149050933.db2.gz HAGIYJYZXQSSOQ-CQSZACIVSA-N 0 3 349.406 2.708 20 5 EFBDHN CC(=O)Nc1ccc(CN2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc1 ZINC000365118077 149321529 /nfs/dbraw/zinc/32/15/29/149321529.db2.gz SRDLDOMUIAGSPU-UHFFFAOYSA-N 0 3 343.387 2.587 20 5 EFBDHN Cn1cc(CN2CCC(n3ccc([N+](=O)[O-])n3)CC2)c(C(C)(C)C)n1 ZINC000365118098 149321743 /nfs/dbraw/zinc/32/17/43/149321743.db2.gz SYNRCQUPMNIIKE-UHFFFAOYSA-N 0 3 346.435 2.659 20 5 EFBDHN NC(=O)c1ccc(CN2CC[C@@H](c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000368490391 150131707 /nfs/dbraw/zinc/13/17/07/150131707.db2.gz ALURRKUHVONURR-OAHLLOKOSA-N 0 3 325.368 2.683 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCOCC2(CCC2)C1 ZINC000368705876 150186672 /nfs/dbraw/zinc/18/66/72/150186672.db2.gz AGJOIJFRKQNPQG-UHFFFAOYSA-N 0 3 347.415 2.734 20 5 EFBDHN Cc1ncc2c(n1)CC[C@@H](NCc1cc([N+](=O)[O-])ccc1Cl)C2 ZINC000368823756 150214347 /nfs/dbraw/zinc/21/43/47/150214347.db2.gz QBPDQGIUMQULFT-CYBMUJFWSA-N 0 3 332.791 2.994 20 5 EFBDHN Cc1nn(C)cc1[C@@H]1CCCN1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000372729627 151052453 /nfs/dbraw/zinc/05/24/53/151052453.db2.gz VYOVMONDLHDHSQ-IRXDYDNUSA-N 0 3 330.388 2.507 20 5 EFBDHN Cc1ccc([C@@H](C)N[C@H]2CCN(c3cnn(C)c3)C2)cc1[N+](=O)[O-] ZINC000372785899 151062342 /nfs/dbraw/zinc/06/23/42/151062342.db2.gz VYAQLYNHSYYISK-HIFRSBDPSA-N 0 3 329.404 2.566 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@@H]2CC(=O)N3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC000374514825 151360760 /nfs/dbraw/zinc/36/07/60/151360760.db2.gz PYPHPFOGMWOFKY-NWANDNLSSA-N 0 3 347.415 2.798 20 5 EFBDHN Cc1c([C@@H](C)N[C@@H]2CCN(c3cnn(C)c3)C2)cccc1[N+](=O)[O-] ZINC000374574557 151373171 /nfs/dbraw/zinc/37/31/71/151373171.db2.gz IIZNSTZCLONDCJ-ZIAGYGMSSA-N 0 3 329.404 2.566 20 5 EFBDHN Cc1cccc(C(=O)N[C@H](C)CN2C[C@@H](C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000055757876 292427130 /nfs/dbraw/zinc/42/71/30/292427130.db2.gz AZBUBJQNVDVZBR-KCQAQPDRSA-N 0 3 333.432 2.999 20 5 EFBDHN C[C@H](NCCOCCO)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000159089431 225144479 /nfs/dbraw/zinc/14/44/79/225144479.db2.gz ILHWJRLJNDYBKA-LBPRGKRZSA-N 0 3 336.413 2.983 20 5 EFBDHN NC(=O)CC1CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000159792927 225277884 /nfs/dbraw/zinc/27/78/84/225277884.db2.gz PNINNZFHCJXURB-UHFFFAOYSA-N 0 3 343.383 2.942 20 5 EFBDHN Cc1ccccc1[C@@H]1C[C@@H](C)N(CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000159838424 225286931 /nfs/dbraw/zinc/28/69/31/225286931.db2.gz DGUQUJBETSSHAD-HZPDHXFCSA-N 0 3 341.411 2.943 20 5 EFBDHN Cc1ccccc1[C@H]1C[C@@H](C)N(CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000159838547 225287062 /nfs/dbraw/zinc/28/70/62/225287062.db2.gz DGUQUJBETSSHAD-CVEARBPZSA-N 0 3 341.411 2.943 20 5 EFBDHN C[C@@H](CN1CCCCC1)NC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000123117003 222218199 /nfs/dbraw/zinc/21/81/99/222218199.db2.gz OXWDHUHZUOLDIS-ZDUSSCGKSA-N 0 3 342.399 2.747 20 5 EFBDHN Cc1cc(C(=O)NCCCCN2C[C@@H](C)O[C@@H](C)C2)cc([N+](=O)[O-])c1 ZINC000123735712 222325045 /nfs/dbraw/zinc/32/50/45/222325045.db2.gz VLPZJHAMTXQFEF-GASCZTMLSA-N 0 3 349.431 2.522 20 5 EFBDHN CCOc1ccc(C(=O)N[C@@H](C)CN2CCCCC2)cc1[N+](=O)[O-] ZINC000027748494 272963362 /nfs/dbraw/zinc/96/33/62/272963362.db2.gz JHIAOFHUKWDOKG-ZDUSSCGKSA-N 0 3 335.404 2.598 20 5 EFBDHN CCN1CCC[C@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000184738865 265025274 /nfs/dbraw/zinc/02/52/74/265025274.db2.gz VSIVFNUBOCSQTQ-LBPRGKRZSA-N 0 3 340.811 2.532 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@@H]1CCN(C)C[C@@H]1C ZINC000185406928 265041419 /nfs/dbraw/zinc/04/14/19/265041419.db2.gz VQRHKMFNJYJUNG-YXJHDRRASA-N 0 3 347.459 2.962 20 5 EFBDHN COc1ccc(CN[C@H](CO)Cc2ccccc2C)cc1[N+](=O)[O-] ZINC000188941267 265165648 /nfs/dbraw/zinc/16/56/48/265165648.db2.gz WGORAFJRKSJTQD-INIZCTEOSA-N 0 3 330.384 2.605 20 5 EFBDHN COc1cccc([C@H](C)NC[C@H](O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000271620679 266023060 /nfs/dbraw/zinc/02/30/60/266023060.db2.gz CYFPERRGEXNYDW-BBRMVZONSA-N 0 3 346.383 2.694 20 5 EFBDHN C[C@H](CN(C)Cc1ccccc1)Nc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000271769292 266057053 /nfs/dbraw/zinc/05/70/53/266057053.db2.gz GATILJJJTOVLCG-CYBMUJFWSA-N 0 3 342.399 2.626 20 5 EFBDHN Cc1c(CC(=O)N(C)[C@H](C)C2CCN(C)CC2)cccc1[N+](=O)[O-] ZINC000272213957 266190864 /nfs/dbraw/zinc/19/08/64/266190864.db2.gz SCIIWWYCFPTNSJ-CQSZACIVSA-N 0 3 333.432 2.634 20 5 EFBDHN C[C@H](NC(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21)c1ccccc1[N+](=O)[O-] ZINC000272593851 266319559 /nfs/dbraw/zinc/31/95/59/266319559.db2.gz OGFPNEWHDJAZFV-LZWOXQAQSA-N 0 3 346.431 2.782 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000272649969 266338973 /nfs/dbraw/zinc/33/89/73/266338973.db2.gz DWQAZMQVZXXUOV-ZDUSSCGKSA-N 0 3 332.404 2.984 20 5 EFBDHN COCC[C@@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccc(C)o1 ZINC000273295420 266479008 /nfs/dbraw/zinc/47/90/08/266479008.db2.gz NEHNKMPLGSDIGM-HZPDHXFCSA-N 0 3 334.372 2.897 20 5 EFBDHN O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@H]1CN1CCCCC1 ZINC000105199324 273003897 /nfs/dbraw/zinc/00/38/97/273003897.db2.gz VYYZFJARZZMTQY-KRWDZBQOSA-N 0 3 346.431 2.755 20 5 EFBDHN C[C@H]1C[C@H](Nc2ncc([N+](=O)[O-])cn2)CCN1Cc1ccccc1 ZINC000273959007 266587014 /nfs/dbraw/zinc/58/70/14/266587014.db2.gz NSSGUWISJHITMS-DZGCQCFKSA-N 0 3 327.388 2.850 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@H](C)C(=O)N(C)CC ZINC000276578802 267017266 /nfs/dbraw/zinc/01/72/66/267017266.db2.gz HVRDOHMLBKRGPR-CHWSQXEVSA-N 0 3 339.461 2.922 20 5 EFBDHN CCN1CCN(CCCNc2nc3ccccc3cc2[N+](=O)[O-])CC1 ZINC000276668966 267032030 /nfs/dbraw/zinc/03/20/30/267032030.db2.gz SSXDGZMILQDQBY-UHFFFAOYSA-N 0 3 343.431 2.583 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)NCc1ccccc1CN(C)C ZINC000277043096 267103901 /nfs/dbraw/zinc/10/39/01/267103901.db2.gz HPULNJRWPSQYSF-UHFFFAOYSA-N 0 3 343.383 2.595 20 5 EFBDHN CCNC(=O)C1(CN[C@H](C)c2ccc(OCC)c([N+](=O)[O-])c2)CCC1 ZINC000277116257 267117097 /nfs/dbraw/zinc/11/70/97/267117097.db2.gz IJERKXKQODEKMB-CYBMUJFWSA-N 0 3 349.431 2.951 20 5 EFBDHN COCc1cc([N+](=O)[O-])ccc1NCCCN1CCCO[C@H](C)C1 ZINC000277458348 267183408 /nfs/dbraw/zinc/18/34/08/267183408.db2.gz KISAAYIXGBIWCQ-CQSZACIVSA-N 0 3 337.420 2.654 20 5 EFBDHN C[C@H]1CC(C)(C)C[C@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000277543188 267193569 /nfs/dbraw/zinc/19/35/69/267193569.db2.gz XIYHSUCUTAZEIU-SWLSCSKDSA-N 0 3 340.445 2.783 20 5 EFBDHN O=C1CCc2cc([N+](=O)[O-])c(NC[C@H]3CCCCN3C3CC3)cc2N1 ZINC000277567346 267200124 /nfs/dbraw/zinc/20/01/24/267200124.db2.gz ZKPFLBHUXRDNBK-CQSZACIVSA-N 0 3 344.415 2.908 20 5 EFBDHN O=C(NC[C@H]1CCCCN1C1CC1)c1cc([N+](=O)[O-])ccc1Cl ZINC000277582981 267204238 /nfs/dbraw/zinc/20/42/38/267204238.db2.gz UVGRQHVIJYOCCL-CYBMUJFWSA-N 0 3 337.807 2.995 20 5 EFBDHN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NC[C@@H]1CCCCN1C1CC1 ZINC000277632135 267217733 /nfs/dbraw/zinc/21/77/33/267217733.db2.gz XGANYNLFNBHGDP-CEUCYRDJSA-N 0 3 329.400 2.741 20 5 EFBDHN O=[N+]([O-])c1ccc(CCN2CCC[C@H]([C@@H](O)C(F)(F)F)C2)cc1 ZINC000277856233 267280563 /nfs/dbraw/zinc/28/05/63/267280563.db2.gz TVUSMWFVWVMRDN-GXTWGEPZSA-N 0 3 332.322 2.773 20 5 EFBDHN O=[N+]([O-])c1ccc(CN2CC[C@@H](N3CCCCC3)C2)c([N+](=O)[O-])c1 ZINC000278240797 267376932 /nfs/dbraw/zinc/37/69/32/267376932.db2.gz NUOWZKQRQGWJAJ-OAHLLOKOSA-N 0 3 334.376 2.563 20 5 EFBDHN CN(C)[C@H]1CCCN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000273807852 273120263 /nfs/dbraw/zinc/12/02/63/273120263.db2.gz ABKUVPVOQRUPOI-ZDUSSCGKSA-N 0 3 337.395 2.564 20 5 EFBDHN C[C@@H]1CC[C@@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000274304995 273131270 /nfs/dbraw/zinc/13/12/70/273131270.db2.gz OTPKGHPEFNRMKB-MGPQQGTHSA-N 0 3 340.445 2.783 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(N2C[C@@H](SC)[C@@H](N3CCCC3)C2)c1 ZINC000275517859 273137298 /nfs/dbraw/zinc/13/72/98/273137298.db2.gz VUIHYPOVNWYZFA-JKSUJKDBSA-N 0 3 337.445 2.619 20 5 EFBDHN O=C(NC[C@@H]1CCCCN1C1CC1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000277427196 273154354 /nfs/dbraw/zinc/15/43/54/273154354.db2.gz DJRZUSUZPLKFOW-AWEZNQCLSA-N 0 3 342.399 2.823 20 5 EFBDHN Cc1cc(NCC2(N3CCOCC3)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000277528409 273160203 /nfs/dbraw/zinc/16/02/03/273160203.db2.gz VUGFTTRKLIRGHM-UHFFFAOYSA-N 0 3 342.399 2.728 20 5 EFBDHN C[C@@H](CN1CCOCC1)N[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000279156086 273182811 /nfs/dbraw/zinc/18/28/11/273182811.db2.gz TTYGUQGONQMEJX-SUMWQHHRSA-N 0 3 333.432 2.628 20 5 EFBDHN CC1(C)C[C@H](NC[C@H](O)C2CCOCC2)c2cc([N+](=O)[O-])ccc21 ZINC000279212915 273189161 /nfs/dbraw/zinc/18/91/61/273189161.db2.gz YJVIOEBPJRVYAJ-IRXDYDNUSA-N 0 3 334.416 2.694 20 5 EFBDHN COc1ccc(OCCN2CCCC[C@@H]2C[C@@H](C)O)c([N+](=O)[O-])c1 ZINC000279745591 273248844 /nfs/dbraw/zinc/24/88/44/273248844.db2.gz KXTDXXWWRKIKHT-ZIAGYGMSSA-N 0 3 338.404 2.608 20 5 EFBDHN CC1(C)CCN(C[C@H](O)COc2ccccc2[N+](=O)[O-])CCS1 ZINC000279805744 273255433 /nfs/dbraw/zinc/25/54/33/273255433.db2.gz XDEICJRAVZYONE-ZDUSSCGKSA-N 0 3 340.445 2.552 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CNC[C@H](CO)[C@H]2CCOC2)o1 ZINC000280150548 273296313 /nfs/dbraw/zinc/29/63/13/273296313.db2.gz AHEQVTRBULHHNX-UONOGXRCSA-N 0 3 346.383 2.589 20 5 EFBDHN CN(C)C1(CNC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])CCC1 ZINC000280440627 273328236 /nfs/dbraw/zinc/32/82/36/273328236.db2.gz KJQRQXDXLYCYHM-UHFFFAOYSA-N 0 3 343.786 2.530 20 5 EFBDHN Cc1cc(OCC(=O)Nc2ccc(CN(C)C)cc2)ccc1[N+](=O)[O-] ZINC000280473517 273331842 /nfs/dbraw/zinc/33/18/42/273331842.db2.gz GSVQEAFDJGMONT-UHFFFAOYSA-N 0 3 343.383 2.982 20 5 EFBDHN COc1ccc(OCCN2CCC[C@@](C)(OC)CC2)c([N+](=O)[O-])c1 ZINC000280529582 273337481 /nfs/dbraw/zinc/33/74/81/273337481.db2.gz OVTDLTIAHFEPBX-QGZVFWFLSA-N 0 3 338.404 2.873 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCC(C)=C(C)C1 ZINC000280789005 273366951 /nfs/dbraw/zinc/36/69/51/273366951.db2.gz QVWPHLBEQYKZMQ-UHFFFAOYSA-N 0 3 333.388 2.974 20 5 EFBDHN CCOc1ccc([C@H](C)NCC2([S@@](C)=O)CCC2)cc1[N+](=O)[O-] ZINC000280884538 273377561 /nfs/dbraw/zinc/37/75/61/273377561.db2.gz BDHTVOAEHOVVKL-DAOPMYJZSA-N 0 3 340.445 2.945 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)NCCN1CCCC[C@@H]1CC ZINC000281034145 273393839 /nfs/dbraw/zinc/39/38/39/273393839.db2.gz VSUPJAYCAHEHDH-AWEZNQCLSA-N 0 3 349.431 2.988 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)C1CCN(C2CC2)CC1 ZINC000281124778 273403039 /nfs/dbraw/zinc/40/30/39/273403039.db2.gz BOEUMOGJKRIXHW-UHFFFAOYSA-N 0 3 333.388 2.806 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC1(CN(C)C)CCC1 ZINC000281898641 273484137 /nfs/dbraw/zinc/48/41/37/273484137.db2.gz HYEZBKBIWITIRA-UHFFFAOYSA-N 0 3 336.392 2.599 20 5 EFBDHN C[C@H](N[C@@H]1CCCC12CCOCC2)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000282146502 273520340 /nfs/dbraw/zinc/52/03/40/273520340.db2.gz SHIKMFFGTSXLSZ-XJKSGUPXSA-N 0 3 347.415 2.861 20 5 EFBDHN CCOc1ccc([C@H](C)NCC2([S@](C)=O)CC2)cc1[N+](=O)[O-] ZINC000282476961 273568388 /nfs/dbraw/zinc/56/83/88/273568388.db2.gz WRKKQIASHXKGPX-SAHAZLINSA-N 0 3 326.418 2.555 20 5 EFBDHN CN(C)C[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)c1ccc(Cl)cc1 ZINC000282851083 273629178 /nfs/dbraw/zinc/62/91/78/273629178.db2.gz LOUSEIQWKSXHRK-GFCCVEGCSA-N 0 3 337.763 2.874 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H](N3CCCCC3)C2)c1 ZINC000283890766 273771722 /nfs/dbraw/zinc/77/17/22/273771722.db2.gz IUKBXYWLQJGLDW-CQSZACIVSA-N 0 3 347.415 2.694 20 5 EFBDHN O=C(Nc1cccc(CN2CCCCC2)c1)c1cc([N+](=O)[O-])n[nH]1 ZINC000285154986 273951266 /nfs/dbraw/zinc/95/12/66/273951266.db2.gz MEDBECGHTITDCQ-UHFFFAOYSA-N 0 3 329.360 2.556 20 5 EFBDHN COc1cccc([C@H](CNc2ccc(N)cc2[N+](=O)[O-])N(C)C)c1 ZINC000285567383 274026883 /nfs/dbraw/zinc/02/68/83/274026883.db2.gz JPHDIIZBOYFMTR-KRWDZBQOSA-N 0 3 330.388 2.900 20 5 EFBDHN COCCN1CCC[C@@H]1CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000436402879 274027524 /nfs/dbraw/zinc/02/75/24/274027524.db2.gz CHBKBKUQVNNESD-SNVBAGLBSA-N 0 3 348.325 2.531 20 5 EFBDHN C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000285985162 274112305 /nfs/dbraw/zinc/11/23/05/274112305.db2.gz XKQAOISHKHXRNW-UKRRQHHQSA-N 0 3 349.456 2.772 20 5 EFBDHN CN(C)CCN1CCC(Nc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000286246172 274161422 /nfs/dbraw/zinc/16/14/22/274161422.db2.gz UZRPDTUGMZHFNW-UHFFFAOYSA-N 0 3 326.828 2.686 20 5 EFBDHN C[C@@H](C(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@@H](N)c1ccccc1 ZINC000150845234 274195115 /nfs/dbraw/zinc/19/51/15/274195115.db2.gz DUWHQDSAAKHFDK-SJKOYZFVSA-N 0 3 325.368 2.820 20 5 EFBDHN CCCN(CCN1CCCC1)C(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000286431628 274199901 /nfs/dbraw/zinc/19/99/01/274199901.db2.gz BQEKRFDZYZROHX-UHFFFAOYSA-N 0 3 335.404 2.551 20 5 EFBDHN CCN1CCN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@H](C)C1 ZINC000286480846 274210351 /nfs/dbraw/zinc/21/03/51/274210351.db2.gz LHESUIPTLCQJJH-CQSZACIVSA-N 0 3 344.415 2.818 20 5 EFBDHN C[C@@H](NCCCn1c2cc([N+](=O)[O-])ccc2oc1=O)c1ccccn1 ZINC000361146169 274247170 /nfs/dbraw/zinc/24/71/70/274247170.db2.gz AMOGBJFACZWZFO-GFCCVEGCSA-N 0 3 342.355 2.639 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[C@@H](C(=O)N2CCCC2)C1 ZINC000286702750 274255132 /nfs/dbraw/zinc/25/51/32/274255132.db2.gz AFDPASFULCMMHI-HUUCEWRRSA-N 0 3 331.416 2.909 20 5 EFBDHN C[C@@H]1CCCC[C@@H]1N(C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000192632099 274287119 /nfs/dbraw/zinc/28/71/19/274287119.db2.gz NFFXHKXVLGHQKD-CJNGLKHVSA-N 0 3 331.416 2.994 20 5 EFBDHN C[C@@H](NC(=O)Nc1ccncc1[N+](=O)[O-])[C@@H](c1ccccc1)N(C)C ZINC000287019572 274323431 /nfs/dbraw/zinc/32/34/31/274323431.db2.gz IERZLYSKMPBSBO-WBMJQRKESA-N 0 3 343.387 2.803 20 5 EFBDHN COc1cc(C(=O)N2CC[C@H](N3CCCC3)[C@@H]2C)cc([N+](=O)[O-])c1C ZINC000287086734 274338592 /nfs/dbraw/zinc/33/85/92/274338592.db2.gz KSGMKTASSUAAIZ-ZFWWWQNUSA-N 0 3 347.415 2.611 20 5 EFBDHN COc1cc(C(=O)N2CC[C@H](N3CCCC3)[C@H]2C)cc([N+](=O)[O-])c1C ZINC000287086729 274338668 /nfs/dbraw/zinc/33/86/68/274338668.db2.gz KSGMKTASSUAAIZ-HIFRSBDPSA-N 0 3 347.415 2.611 20 5 EFBDHN CCC[C@@H](NC[C@@H]1CCCS(=O)(=O)C1)c1cccc([N+](=O)[O-])c1 ZINC000287149224 274354365 /nfs/dbraw/zinc/35/43/65/274354365.db2.gz SQXUQCYHTNJIPH-XJKSGUPXSA-N 0 3 340.445 2.850 20 5 EFBDHN C[C@@H]1[C@H](N2CCCC2)CCN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000287296072 274387855 /nfs/dbraw/zinc/38/78/55/274387855.db2.gz UCJDSGULMVOXIL-IUODEOHRSA-N 0 3 342.399 2.775 20 5 EFBDHN C[C@H]1[C@@H](N2CCCC2)CCN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000287296091 274387893 /nfs/dbraw/zinc/38/78/93/274387893.db2.gz UCJDSGULMVOXIL-WFASDCNBSA-N 0 3 342.399 2.775 20 5 EFBDHN C[C@H](N[C@@H](C)[C@@H]1CCOC1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000266292586 274518394 /nfs/dbraw/zinc/51/83/94/274518394.db2.gz KGTRMOALSJVZIG-GARJFASQSA-N 0 3 341.795 2.590 20 5 EFBDHN CCn1c(C)nc([N+](=O)[O-])c1NC[C@H](c1cccc(F)c1)N(C)C ZINC000288041800 274519621 /nfs/dbraw/zinc/51/96/21/274519621.db2.gz DMWIEVPWFLOEJG-CQSZACIVSA-N 0 3 335.383 2.974 20 5 EFBDHN CCn1c(C)nc([N+](=O)[O-])c1NCc1ccccc1OCCN(C)C ZINC000288264375 274559765 /nfs/dbraw/zinc/55/97/65/274559765.db2.gz YTSSTPKQYRQAMD-UHFFFAOYSA-N 0 3 347.419 2.672 20 5 EFBDHN O=[N+]([O-])c1ccccc1CNCCCn1cc(Br)cn1 ZINC000288451503 274595951 /nfs/dbraw/zinc/59/59/51/274595951.db2.gz MZAGSTZSYJNQNE-UHFFFAOYSA-N 0 3 339.193 2.734 20 5 EFBDHN CCO[C@H]1C[C@H](NCc2ccc(C(N)=O)cc2[N+](=O)[O-])C12CCCC2 ZINC000289290100 274736002 /nfs/dbraw/zinc/73/60/02/274736002.db2.gz HAXQTZQSECBZLH-HOTGVXAUSA-N 0 3 347.415 2.521 20 5 EFBDHN CCCCO[C@@H]1C[C@H](NCc2ccc(C(N)=O)cc2[N+](=O)[O-])C1(C)C ZINC000289352284 274745762 /nfs/dbraw/zinc/74/57/62/274745762.db2.gz NDFMCODRHCVWTQ-JKSUJKDBSA-N 0 3 349.431 2.767 20 5 EFBDHN COc1ccc(CN(CCN(C)C)Cc2ccco2)cc1[N+](=O)[O-] ZINC000289428109 274759010 /nfs/dbraw/zinc/75/90/10/274759010.db2.gz KEHHJHBEBFSPBP-UHFFFAOYSA-N 0 3 333.388 2.760 20 5 EFBDHN Cn1cc(N2CC[C@@H](N[C@@H]3CCCc4ccc([N+](=O)[O-])cc43)C2)cn1 ZINC000375717202 274893187 /nfs/dbraw/zinc/89/31/87/274893187.db2.gz DEVRJAZTOLMQAR-RDTXWAMCSA-N 0 3 341.415 2.574 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@@H]2CCN(C3CC3)C2)nc1-c1ccc(F)cc1 ZINC000362360464 275035041 /nfs/dbraw/zinc/03/50/41/275035041.db2.gz UKXBQPLONXXCEC-CQSZACIVSA-N 0 3 342.374 2.866 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCN(C3CCCCC3)CC2)c([N+](=O)[O-])c1 ZINC000152442047 275036240 /nfs/dbraw/zinc/03/62/40/275036240.db2.gz MCQZLDLIBODKRG-UHFFFAOYSA-N 0 3 334.376 2.958 20 5 EFBDHN O=[N+]([O-])c1cnc(C(F)(F)F)cc1N1CC[C@H](N2CCCC2)C1 ZINC000364610754 275040700 /nfs/dbraw/zinc/04/07/00/275040700.db2.gz FBAWFYASCMZBTC-JTQLQIEISA-N 0 3 330.310 2.683 20 5 EFBDHN CC(C)(C)c1ccc(C(=O)N[C@@H]2CNCCC2(F)F)cc1[N+](=O)[O-] ZINC000449664171 275846701 /nfs/dbraw/zinc/84/67/01/275846701.db2.gz PMIURZUVCORXCC-CYBMUJFWSA-N 0 3 341.358 2.619 20 5 EFBDHN CN(C)[C@@H]1Cc2ccccc2N(C(=O)c2ccccc2[N+](=O)[O-])C1 ZINC000067203574 276847146 /nfs/dbraw/zinc/84/71/46/276847146.db2.gz JVAOHLJNEUXCEC-CQSZACIVSA-N 0 3 325.368 2.728 20 5 EFBDHN CN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000164127769 277182529 /nfs/dbraw/zinc/18/25/29/277182529.db2.gz BVYPDPJRWMZDRQ-OCCSQVGLSA-N 0 3 337.807 2.805 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)N(C)C(C)(C)CN1CCCC1 ZINC000416104397 277389310 /nfs/dbraw/zinc/38/93/10/277389310.db2.gz JGWBHNMGAFAVBM-UHFFFAOYSA-N 0 3 335.404 2.550 20 5 EFBDHN COCC[C@@H](Cc1ccco1)NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000344331876 277546401 /nfs/dbraw/zinc/54/64/01/277546401.db2.gz XRBOYKVMRWWTOD-AWEZNQCLSA-N 0 3 334.372 2.934 20 5 EFBDHN CC(C)c1ccc(CN[C@@H](C)CCN2CCOCC2)cc1[N+](=O)[O-] ZINC000076898004 278037359 /nfs/dbraw/zinc/03/73/59/278037359.db2.gz NSYQSYZEDOTYFD-HNNXBMFYSA-N 0 3 335.448 2.919 20 5 EFBDHN CC(=O)NC[C@H]1CCCN(C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000347337126 278122880 /nfs/dbraw/zinc/12/28/80/278122880.db2.gz MCIIRPDZLGTNOS-CRPZLVSXSA-N 0 3 331.416 2.846 20 5 EFBDHN C[C@@H](CCS(C)(=O)=O)N[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433288795 278235212 /nfs/dbraw/zinc/23/52/12/278235212.db2.gz OCKFVHDCXJYHDX-XHDPSFHLSA-N 0 3 340.445 2.730 20 5 EFBDHN C[C@H](C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)N1[C@H](C)CC[C@@H]1C ZINC000408438622 279205343 /nfs/dbraw/zinc/20/53/43/279205343.db2.gz JNQUAFJHYAPHJC-HZSPNIEDSA-N 0 3 331.416 2.741 20 5 EFBDHN Cc1ccc([C@@H](CNC(=O)c2ccccc2[N+](=O)[O-])N(C)C)cc1 ZINC000010017878 280946137 /nfs/dbraw/zinc/94/61/37/280946137.db2.gz DWPPVSHLGOOQHW-QGZVFWFLSA-N 0 3 327.384 2.936 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCN([C@@H]2C[C@H]2C)C[C@@H](C)C1 ZINC000346257713 281256831 /nfs/dbraw/zinc/25/68/31/281256831.db2.gz HBZMVHMCJIPUJO-XNRPHZJLSA-N 0 3 331.416 2.706 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H](C)CN1C[C@@H](C)C[C@H](C)C1 ZINC000194484736 281257775 /nfs/dbraw/zinc/25/77/75/281257775.db2.gz IJCKOFFLEZHQRO-YDHLFZDLSA-N 0 3 333.432 2.999 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H](C)CN1C[C@H](C)C[C@@H](C)C1 ZINC000248756254 281258584 /nfs/dbraw/zinc/25/85/84/281258584.db2.gz IJCKOFFLEZHQRO-UMVBOHGHSA-N 0 3 333.432 2.999 20 5 EFBDHN CN(C)CCN(C/C=C\c1ccccc1[N+](=O)[O-])C[C@H]1CCCO1 ZINC000349065146 289133746 /nfs/dbraw/zinc/13/37/46/289133746.db2.gz XVJHGGVMTFNXOE-CTEOGUNLSA-N 0 3 333.432 2.651 20 5 EFBDHN Cn1cc(CNCCc2cscn2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000076331574 292752642 /nfs/dbraw/zinc/75/26/42/292752642.db2.gz MZNIWBROJOZVMA-UHFFFAOYSA-N 0 3 343.412 2.784 20 5 EFBDHN CCCNC(=O)C1(NCCc2ccc([N+](=O)[O-])cc2)CCCCC1 ZINC000078655403 292778850 /nfs/dbraw/zinc/77/88/50/292778850.db2.gz WEPJDCJFZRNBRS-UHFFFAOYSA-N 0 3 333.432 2.956 20 5 EFBDHN C[C@H](CN1CCCCC1)NC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000079292647 292786418 /nfs/dbraw/zinc/78/64/18/292786418.db2.gz UEPCJKGVDYZSTO-CQSZACIVSA-N 0 3 334.420 2.611 20 5 EFBDHN C[C@@H]1CCCN1C(=O)CCN(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000130402829 293164784 /nfs/dbraw/zinc/16/47/84/293164784.db2.gz PFYPPQHPHWISQE-CQSZACIVSA-N 0 3 331.416 2.960 20 5 EFBDHN CN(C)Cc1ccc(CNC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cc1 ZINC000255345189 293849434 /nfs/dbraw/zinc/84/94/34/293849434.db2.gz UKAPREZXURQLFX-XFXZXTDPSA-N 0 3 339.395 2.986 20 5 EFBDHN Cc1cc([N+](=O)[O-])cc(C(=O)N2C[C@@H](N3CCCC3)C[C@H]2C)c1F ZINC000290060011 293988743 /nfs/dbraw/zinc/98/87/43/293988743.db2.gz YDUXNRMHDQATDT-OCCSQVGLSA-N 0 3 335.379 2.741 20 5 EFBDHN C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000290339254 294060916 /nfs/dbraw/zinc/06/09/16/294060916.db2.gz FLAWIWXNFLSUGC-WCQYABFASA-N 0 3 337.807 2.947 20 5 EFBDHN CN(C)C[C@H](NC(=O)Cc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000290352241 294064552 /nfs/dbraw/zinc/06/45/52/294064552.db2.gz GBAKYCYNVIWKGG-KRWDZBQOSA-N 0 3 345.374 2.696 20 5 EFBDHN CN(C[C@H](O)CSc1nc2ccc([N+](=O)[O-])cc2s1)C1CC1 ZINC000290742651 294172661 /nfs/dbraw/zinc/17/26/61/294172661.db2.gz HMVSZTTYSZSXMC-NSHDSACASA-N 0 3 339.442 2.752 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CN2CC3(CCC3)[C@H]2C2CC2)c1 ZINC000290830674 294197562 /nfs/dbraw/zinc/19/75/62/294197562.db2.gz UNFICRGEONFRCH-NVXWUHKLSA-N 0 3 332.400 2.599 20 5 EFBDHN CC(C)NC(=O)c1ccc(N[C@H]2C[C@H](C)N(C3CC3)C2)c([N+](=O)[O-])c1 ZINC000290865969 294206924 /nfs/dbraw/zinc/20/69/24/294206924.db2.gz ZDURZDMPSMLDMU-JSGCOSHPSA-N 0 3 346.431 2.770 20 5 EFBDHN C[C@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H](c1ccccc1)N(C)C ZINC000290920375 294220460 /nfs/dbraw/zinc/22/04/60/294220460.db2.gz IFQKSFFSSLQBDH-SJCJKPOMSA-N 0 3 342.399 2.797 20 5 EFBDHN COC(=O)C1=C(C)O[C@H](CNC(C)(C)c2ccccc2[N+](=O)[O-])C1 ZINC000292108400 294581580 /nfs/dbraw/zinc/58/15/80/294581580.db2.gz IRDHUXQWKAJELN-LBPRGKRZSA-N 0 3 334.372 2.655 20 5 EFBDHN COc1cc(C[NH2+]C[C@@H](CO)C2CCCCC2)c([N+](=O)[O-])cc1[O-] ZINC000292877901 294813134 /nfs/dbraw/zinc/81/31/34/294813134.db2.gz BUZFWVDBBMHAQX-AWEZNQCLSA-N 0 3 338.404 2.587 20 5 EFBDHN CN(CCc1ccccc1[N+](=O)[O-])C[C@H](O)Cc1ccc(F)cc1 ZINC000293614387 295011800 /nfs/dbraw/zinc/01/18/00/295011800.db2.gz PWZUTEUUKAINDC-QGZVFWFLSA-N 0 3 332.375 2.812 20 5 EFBDHN COc1cc(C(=O)N2CCN(C3CCC3)C[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000293720013 295035681 /nfs/dbraw/zinc/03/56/81/295035681.db2.gz PKRVEPGSAIDUNC-CYBMUJFWSA-N 0 3 347.415 2.550 20 5 EFBDHN Cc1cccc(OC[C@@H](O)CN[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000293913843 295077893 /nfs/dbraw/zinc/07/78/93/295077893.db2.gz WZYSZGBQVDXBNC-HIFRSBDPSA-N 0 3 345.399 2.576 20 5 EFBDHN C[C@H](NC[C@@]1(CO)C[C@H]1c1ccccc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294016164 295098300 /nfs/dbraw/zinc/09/83/00/295098300.db2.gz DNUIYTRUNQZZPE-IYJAJMOOSA-N 0 3 341.411 2.994 20 5 EFBDHN CN1CCC[C@]2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3Cl)C2)C1 ZINC000294226167 295131292 /nfs/dbraw/zinc/13/12/92/295131292.db2.gz RIJRPLNKFAGXIZ-INIZCTEOSA-N 0 3 337.807 2.806 20 5 EFBDHN CSc1ccc([C@@H](CNC(=O)c2ccc([N+](=O)[O-])[nH]2)N(C)C)cc1 ZINC000294481620 295174156 /nfs/dbraw/zinc/17/41/56/295174156.db2.gz QHJYHAVSMQPNQL-CQSZACIVSA-N 0 3 348.428 2.678 20 5 EFBDHN CC(C)N1CCC(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000294485881 295174503 /nfs/dbraw/zinc/17/45/03/295174503.db2.gz RCMFKFIZDVJSKT-UHFFFAOYSA-N 0 3 347.415 2.547 20 5 EFBDHN CN1CCC(Nc2ccccc2NC(=O)CCC(C)(C)[N+](=O)[O-])CC1 ZINC000294500632 295176757 /nfs/dbraw/zinc/17/67/57/295176757.db2.gz JNXGQRKFGJNMBT-UHFFFAOYSA-N 0 3 348.447 2.967 20 5 EFBDHN Cc1cccc(CN(CCN(C)C)C(=O)CCC(C)(C)[N+](=O)[O-])c1 ZINC000294544675 295183842 /nfs/dbraw/zinc/18/38/42/295183842.db2.gz JQLGIGXUCBSQAR-UHFFFAOYSA-N 0 3 335.448 2.721 20 5 EFBDHN NC(=O)[C@H]1CCCC[C@H]1NCc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000294563296 295186403 /nfs/dbraw/zinc/18/64/03/295186403.db2.gz LQOSBMHRKWGICR-WCQYABFASA-N 0 3 345.321 2.747 20 5 EFBDHN NC(=O)[C@H]1CCCC[C@@H]1NCc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000294563292 295186592 /nfs/dbraw/zinc/18/65/92/295186592.db2.gz LQOSBMHRKWGICR-AAEUAGOBSA-N 0 3 345.321 2.747 20 5 EFBDHN CC[S@](=O)[C@@H]1CCC[C@H](N[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)C1 ZINC000294638203 295198584 /nfs/dbraw/zinc/19/85/84/295198584.db2.gz GEUSDRFPHVRNQR-ROENXZJSSA-N 0 3 339.461 2.907 20 5 EFBDHN CC[S@](=O)[C@@H]1CCC[C@@H](N[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)C1 ZINC000294638202 295198691 /nfs/dbraw/zinc/19/86/91/295198691.db2.gz GEUSDRFPHVRNQR-NYSPKHBTSA-N 0 3 339.461 2.907 20 5 EFBDHN O=[N+]([O-])c1ccc(C(F)(F)F)c(CN(CCO)C2CCOCC2)c1 ZINC000294729615 295216254 /nfs/dbraw/zinc/21/62/54/295216254.db2.gz WEWIYRFKGQXRPG-UHFFFAOYSA-N 0 3 348.321 2.587 20 5 EFBDHN C[C@@H](NCCOc1ncccc1Cl)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294757406 295221748 /nfs/dbraw/zinc/22/17/48/295221748.db2.gz MHYSDNHHMAEDCI-SNVBAGLBSA-N 0 3 336.779 2.955 20 5 EFBDHN COc1ccc2c(c1)ncc([N+](=O)[O-])c2N1CC[C@H]2CCN(C)C[C@H]21 ZINC000294827076 295233547 /nfs/dbraw/zinc/23/35/47/295233547.db2.gz AHHYOADWMVNVLC-SJKOYZFVSA-N 0 3 342.399 2.682 20 5 EFBDHN CCOc1ccc([C@@H](C)NCCc2nccnc2C)cc1[N+](=O)[O-] ZINC000294967579 295252246 /nfs/dbraw/zinc/25/22/46/295252246.db2.gz JSFXJDJHMDOFRY-GFCCVEGCSA-N 0 3 330.388 2.985 20 5 EFBDHN CS[C@@H]1CCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000295018131 295258215 /nfs/dbraw/zinc/25/82/15/295258215.db2.gz KFYFYXOMZMUJEH-OAHLLOKOSA-N 0 3 332.429 2.933 20 5 EFBDHN Cc1cc(Cl)c(C(=O)N[C@@H]2C[C@@H](C)N(C3CC3)C2)cc1[N+](=O)[O-] ZINC000295055943 295262690 /nfs/dbraw/zinc/26/26/90/295262690.db2.gz GXEVNNVSRFVAHK-GHMZBOCLSA-N 0 3 337.807 2.912 20 5 EFBDHN CN(C)C(=O)C1(NC/C=C/c2ccccc2[N+](=O)[O-])CCCCC1 ZINC000295074418 295264831 /nfs/dbraw/zinc/26/48/31/295264831.db2.gz RGOIITVGXHHLDZ-CSKARUKUSA-N 0 3 331.416 2.989 20 5 EFBDHN COc1ccc(NC(=O)CCN2CCC(CF)CC2)c([N+](=O)[O-])c1 ZINC000295083054 295265882 /nfs/dbraw/zinc/26/58/82/295265882.db2.gz FFKFESAQXAOHPH-UHFFFAOYSA-N 0 3 339.367 2.614 20 5 EFBDHN CCN1CCN(c2cccc(Nc3ncc([N+](=O)[O-])c(C)n3)c2)CC1 ZINC000295115324 295270052 /nfs/dbraw/zinc/27/00/52/295270052.db2.gz VYTMMRJFAQBMHI-UHFFFAOYSA-N 0 3 342.403 2.579 20 5 EFBDHN O=C(c1ccc(Cl)c([N+](=O)[O-])c1)N1CC[C@H](N2CCCCC2)C1 ZINC000295257694 295288765 /nfs/dbraw/zinc/28/87/65/295288765.db2.gz NJAQLLXTWGXEET-ZDUSSCGKSA-N 0 3 337.807 2.949 20 5 EFBDHN C[C@@H](NCCn1cc([N+](=O)[O-])ccc1=O)c1cccc(C2CC2)c1 ZINC000295315791 295298981 /nfs/dbraw/zinc/29/89/81/295298981.db2.gz GKGMQKKWQAVFJN-CYBMUJFWSA-N 0 3 327.384 2.985 20 5 EFBDHN C[C@H]1CN(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CCN(C2CC2)C1 ZINC000295386007 295311524 /nfs/dbraw/zinc/31/15/24/295311524.db2.gz PZMVFHMFEBLURK-LLVKDONJSA-N 0 3 337.807 2.805 20 5 EFBDHN Cc1cc(Cl)c(C(=O)N(C)[C@H]2CCN(C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000295756052 295371459 /nfs/dbraw/zinc/37/14/59/295371459.db2.gz HJGPMKVLDLDGKF-FZMZJTMJSA-N 0 3 339.823 2.969 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@@H]2[C@@H]3CCO[C@H]3C23CCC3)c([N+](=O)[O-])c1 ZINC000295908135 295395154 /nfs/dbraw/zinc/39/51/54/295395154.db2.gz HHGLSPHGRFDDPT-NWANDNLSSA-N 0 3 333.344 2.550 20 5 EFBDHN CCO[C@@H]1C[C@@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C12CCC2 ZINC000296052106 295417594 /nfs/dbraw/zinc/41/75/94/295417594.db2.gz FTSVUXPECKHHED-HZPDHXFCSA-N 0 3 347.415 2.779 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCCC3)c([N+](=O)[O-])c1 ZINC000296146229 295431398 /nfs/dbraw/zinc/43/13/98/295431398.db2.gz XOWHAAAFCQAQQN-BMFZPTHFSA-N 0 3 347.371 2.940 20 5 EFBDHN C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000354287997 297260350 /nfs/dbraw/zinc/26/03/50/297260350.db2.gz ASUJCSHGUDHYNU-HUUCEWRRSA-N 0 3 345.443 2.958 20 5 EFBDHN C[C@H](C(=O)NC(C)(C)CN1CCCC1)c1ccc([N+](=O)[O-])cc1F ZINC000457058030 298132024 /nfs/dbraw/zinc/13/20/24/298132024.db2.gz VIDAHIJCLVSPFC-LBPRGKRZSA-N 0 3 337.395 2.828 20 5 EFBDHN C[C@@H](CN(C)C)Nc1ccc(I)cc1[N+](=O)[O-] ZINC000168987086 310734793 /nfs/dbraw/zinc/73/47/93/310734793.db2.gz HSEZXVWONWJPHS-QMMMGPOBSA-N 0 3 349.172 2.561 20 5 EFBDHN Cc1ccccc1CN(C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000298711639 311016933 /nfs/dbraw/zinc/01/69/33/311016933.db2.gz GQGYPKAMIJKVAT-MRXNPFEDSA-N 0 3 330.384 2.775 20 5 EFBDHN CCN1CCC[C@H]1CNc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000298777117 311022696 /nfs/dbraw/zinc/02/26/96/311022696.db2.gz LUTBNNMQECOVJS-HNNXBMFYSA-N 0 3 346.431 2.727 20 5 EFBDHN CN(C)CCOc1cccc(CNC(=O)c2ccc([N+](=O)[O-])s2)c1 ZINC000298883045 311031356 /nfs/dbraw/zinc/03/13/56/311031356.db2.gz LBUQIMCSIZYOIB-UHFFFAOYSA-N 0 3 349.412 2.527 20 5 EFBDHN Cc1ccccc1CN1CCC(NC(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 ZINC000299076469 311048461 /nfs/dbraw/zinc/04/84/61/311048461.db2.gz PWWXXSYQMYXFSX-UHFFFAOYSA-N 0 3 342.399 2.626 20 5 EFBDHN CCCNC(=O)CCCN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000299198870 311060967 /nfs/dbraw/zinc/06/09/67/311060967.db2.gz FSBZLRMWBBBKLL-UHFFFAOYSA-N 0 3 349.431 2.744 20 5 EFBDHN CN(C)CCN(Cc1ccccc1F)C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000299197110 311060999 /nfs/dbraw/zinc/06/09/99/311060999.db2.gz PLIQNDYPZUMDJZ-UHFFFAOYSA-N 0 3 345.374 2.938 20 5 EFBDHN Cc1ccc([C@@H](CNC(=O)c2ccc(N)c([N+](=O)[O-])c2)N(C)C)cc1 ZINC000299311035 311071619 /nfs/dbraw/zinc/07/16/19/311071619.db2.gz BSPTVBVIKMMGHO-QGZVFWFLSA-N 0 3 342.399 2.518 20 5 EFBDHN CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCN(CCC(C)(C)C)CC1 ZINC000301081639 311117960 /nfs/dbraw/zinc/11/79/60/311117960.db2.gz KPACPUMTMMKPGS-UHFFFAOYSA-N 0 3 348.447 2.513 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1NC[C@@H](O)CN1CCc2ccccc2C1 ZINC000301523741 311142413 /nfs/dbraw/zinc/14/24/13/311142413.db2.gz MJLGKQXPSDUFCP-QGZVFWFLSA-N 0 3 341.411 2.734 20 5 EFBDHN O=[N+]([O-])c1ccccc1N[C@H]1CN(Cc2ccccc2)CC[C@H]1CO ZINC000301742466 311155920 /nfs/dbraw/zinc/15/59/20/311155920.db2.gz YSMVNUFAEQSZSD-WMZOPIPTSA-N 0 3 341.411 2.890 20 5 EFBDHN Cc1ccc(NC[C@@H]2C[C@@H](O)CN2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000301887316 311164847 /nfs/dbraw/zinc/16/48/47/311164847.db2.gz QQLWKKPAHZTKHF-DLBZAZTESA-N 0 3 341.411 2.951 20 5 EFBDHN CN(CCN(C)C1CC1)c1ccc([N+](=O)[O-])cc1Br ZINC000302277834 311187761 /nfs/dbraw/zinc/18/77/61/311187761.db2.gz UFOPOZLTALBTDG-UHFFFAOYSA-N 0 3 328.210 2.888 20 5 EFBDHN CCN1CCN(c2cccc(Nc3ncccc3[N+](=O)[O-])c2)CC1 ZINC000302295595 311188254 /nfs/dbraw/zinc/18/82/54/311188254.db2.gz XKLKEFZCDASDCM-UHFFFAOYSA-N 0 3 327.388 2.875 20 5 EFBDHN CCN1CCN(C[C@@H](C)CNc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000302665267 311195882 /nfs/dbraw/zinc/19/58/82/311195882.db2.gz MKPQWQVQOJSIQC-ZDUSSCGKSA-N 0 3 340.855 2.934 20 5 EFBDHN Cc1cc(C)cc(OC[C@H](O)CNCc2cccc([N+](=O)[O-])c2)c1 ZINC000324626011 311242048 /nfs/dbraw/zinc/24/20/48/311242048.db2.gz RBPOXAFIOPDMBK-QGZVFWFLSA-N 0 3 330.384 2.741 20 5 EFBDHN COc1ccc(CNCCOc2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000324972552 311242617 /nfs/dbraw/zinc/24/26/17/311242617.db2.gz PYJHRSLDZVTXQZ-UHFFFAOYSA-N 0 3 332.356 2.781 20 5 EFBDHN CCN1CCC(N(C)C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000330498497 311319780 /nfs/dbraw/zinc/31/97/80/311319780.db2.gz BIUIOLVTZZUVST-UHFFFAOYSA-N 0 3 325.796 2.805 20 5 EFBDHN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CC[C@H](N2CCCCC2)C1 ZINC000330802595 311336207 /nfs/dbraw/zinc/33/62/07/311336207.db2.gz HLJXLDGFXCVDRH-AWEZNQCLSA-N 0 3 337.807 2.949 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCN(C)[C@@H](C)C1 ZINC000330897762 311342412 /nfs/dbraw/zinc/34/24/12/311342412.db2.gz HVBTUVJEXSYZDS-RWMBFGLXSA-N 0 3 337.445 2.674 20 5 EFBDHN CCN1C[C@H](C)N(Cc2cc(OC)c(F)cc2[N+](=O)[O-])C[C@@H]1C ZINC000330988224 311347494 /nfs/dbraw/zinc/34/74/94/311347494.db2.gz RBGVBVCOUPRSSB-RYUDHWBXSA-N 0 3 325.384 2.657 20 5 EFBDHN CCN1C[C@@H](C)N(Cc2cc(OC)c(F)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000331312059 311366810 /nfs/dbraw/zinc/36/68/10/311366810.db2.gz CAMLROJUZFWJHN-VXGBXAGGSA-N 0 3 325.384 2.657 20 5 EFBDHN CC(C)c1n[nH]c(C(=O)N2CCC[C@@H]2CN2CCCCC2)c1[N+](=O)[O-] ZINC000331449490 311378573 /nfs/dbraw/zinc/37/85/73/311378573.db2.gz YVGYBAFLKIHFBP-CYBMUJFWSA-N 0 3 349.435 2.532 20 5 EFBDHN CC(C)c1[nH]nc(C(=O)N2CCC[C@@H]2CN2CCCCC2)c1[N+](=O)[O-] ZINC000331449490 311378574 /nfs/dbraw/zinc/37/85/74/311378574.db2.gz YVGYBAFLKIHFBP-CYBMUJFWSA-N 0 3 349.435 2.532 20 5 EFBDHN CCN(CCN1CCCCCC1)C(=O)c1ccc([N+](=O)[O-])s1 ZINC000331515490 311385339 /nfs/dbraw/zinc/38/53/39/311385339.db2.gz NIHZIYWRWZVQQS-UHFFFAOYSA-N 0 3 325.434 2.994 20 5 EFBDHN Cc1c(CNC(=O)N2CCN(C3CCCC3)CC2)cccc1[N+](=O)[O-] ZINC000331893160 311431743 /nfs/dbraw/zinc/43/17/43/311431743.db2.gz KLLXLEKNYJZGJZ-UHFFFAOYSA-N 0 3 346.431 2.673 20 5 EFBDHN C[C@H](C1CCN(C)CC1)N(C)C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000332378784 311496109 /nfs/dbraw/zinc/49/61/09/311496109.db2.gz UJOFICQMQLAZJU-GFCCVEGCSA-N 0 3 344.415 2.878 20 5 EFBDHN CCc1ccccc1[C@@H](N)CNCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000415066230 312087081 /nfs/dbraw/zinc/08/70/81/312087081.db2.gz OFEDOLVCXRKBJB-INIZCTEOSA-N 0 3 329.400 2.955 20 5 EFBDHN COCCN1CC[C@@H](N[C@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417304781 312206449 /nfs/dbraw/zinc/20/64/49/312206449.db2.gz FOGGAWCMTZAHIT-QAPCUYQASA-N 0 3 333.432 2.673 20 5 EFBDHN COCCN1CC[C@H](N[C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417304780 312206558 /nfs/dbraw/zinc/20/65/58/312206558.db2.gz FOGGAWCMTZAHIT-MAUKXSAKSA-N 0 3 333.432 2.673 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](NC[C@@H](O)C1CCOCC1)CCCC2 ZINC000417314191 312207748 /nfs/dbraw/zinc/20/77/48/312207748.db2.gz YHVYWWQIPRSNTB-QZTJIDSGSA-N 0 3 334.416 2.739 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)N(C)C[C@@H]2CCCN2C)cc1[N+](=O)[O-] ZINC000420811167 312395344 /nfs/dbraw/zinc/39/53/44/312395344.db2.gz SUUTYXSCZURLRX-HIFRSBDPSA-N 0 3 334.420 2.700 20 5 EFBDHN CC1(C)CCCN[C@H]1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000423848934 312470621 /nfs/dbraw/zinc/47/06/21/312470621.db2.gz PTORWGSENFUOSZ-ZDUSSCGKSA-N 0 3 325.796 2.643 20 5 EFBDHN CCc1ccccc1[C@H](N)CNC(=O)c1cccc([N+](=O)[O-])c1C ZINC000423954612 312488545 /nfs/dbraw/zinc/48/85/45/312488545.db2.gz BVFXQYFGSLIOAG-MRXNPFEDSA-N 0 3 327.384 2.895 20 5 EFBDHN CCc1ccccc1[C@@H](N)CNC(=O)c1ccc([N+](=O)[O-])cc1C ZINC000423975266 312493054 /nfs/dbraw/zinc/49/30/54/312493054.db2.gz LSGIYUYGNBUELC-KRWDZBQOSA-N 0 3 327.384 2.895 20 5 EFBDHN Cc1cc(C(=O)N2C[C@@H](c3ccccc3F)[C@H](N)C2)cc([N+](=O)[O-])c1 ZINC000424040816 312501543 /nfs/dbraw/zinc/50/15/43/312501543.db2.gz RYQXSFCOGXLZLP-DOTOQJQBSA-N 0 3 343.358 2.609 20 5 EFBDHN CC1(C)C[C@H](NC[C@H](O)COCC2CC2)c2cc([N+](=O)[O-])ccc21 ZINC000433164197 312597008 /nfs/dbraw/zinc/59/70/08/312597008.db2.gz ZOHAVIZUZDTUCT-YOEHRIQHSA-N 0 3 334.416 2.694 20 5 EFBDHN CN(C)[C@H](CNc1cccc(C(N)=O)c1[N+](=O)[O-])c1cccc(F)c1 ZINC000439130508 312635366 /nfs/dbraw/zinc/63/53/66/312635366.db2.gz KIESDWYTTLDEQA-OAHLLOKOSA-N 0 3 346.362 2.548 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])NCc1c2c(nn1C)CCCC2 ZINC000449337925 312684685 /nfs/dbraw/zinc/68/46/85/312684685.db2.gz TWTCGTVWXHOWJY-ZDUSSCGKSA-N 0 3 328.416 2.928 20 5 EFBDHN COc1cc(CNCCc2ccc(C)cn2)c([N+](=O)[O-])cc1OC ZINC000453605574 312916401 /nfs/dbraw/zinc/91/64/01/312916401.db2.gz UJLMABUWNDMLIJ-UHFFFAOYSA-N 0 3 331.372 2.648 20 5 EFBDHN C[C@H](CCCc1cccnc1)NCc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000459636404 313111345 /nfs/dbraw/zinc/11/13/45/313111345.db2.gz HJSOJBOAQRRURI-CYBMUJFWSA-N 0 3 342.399 2.590 20 5 EFBDHN CNC(=O)CC1CCN(C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC1 ZINC000470175399 313129230 /nfs/dbraw/zinc/12/92/30/313129230.db2.gz CSKCJQLJWZZAIS-UVTDQMKNSA-N 0 3 331.416 2.846 20 5 EFBDHN COC(=O)[C@](C)(CNCc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000470139195 313129347 /nfs/dbraw/zinc/12/93/47/313129347.db2.gz ZHIQFBUKXNELPJ-GOSISDBHSA-N 0 3 346.358 2.954 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@@](C)(CO)C1CCCCC1 ZINC000471229325 313140208 /nfs/dbraw/zinc/14/02/08/313140208.db2.gz WVQUPPFBEDOENS-SFHVURJKSA-N 0 3 349.431 2.763 20 5 EFBDHN COc1ccc(-c2ccc(CN3C[C@H](O)C[C@@H]3C)o2)c([N+](=O)[O-])c1 ZINC000471809594 313162568 /nfs/dbraw/zinc/16/25/68/313162568.db2.gz IOCKMKCPEYJDQB-NWDGAFQWSA-N 0 3 332.356 2.819 20 5 EFBDHN COc1c(C(=O)NC[C@H]2CCCCN2CC(C)C)cccc1[N+](=O)[O-] ZINC000476395999 313232689 /nfs/dbraw/zinc/23/26/89/313232689.db2.gz KBJBCEPFLHZWOT-CQSZACIVSA-N 0 3 349.431 2.844 20 5 EFBDHN CN(CC[C@@H]1CCCCN1C)c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000486985259 313355275 /nfs/dbraw/zinc/35/52/75/313355275.db2.gz VCJXFAFHWNAZIH-AWEZNQCLSA-N 0 3 345.403 2.955 20 5 EFBDHN CCNC(=O)C1(CNc2cc(C)nc3ccc([N+](=O)[O-])cc32)CCC1 ZINC000487145010 313370521 /nfs/dbraw/zinc/37/05/21/313370521.db2.gz FCMVETAZUOPEKS-UHFFFAOYSA-N 0 3 342.399 2.592 20 5 EFBDHN CC(=Cc1cccc([N+](=O)[O-])c1)CN1CCC2(COC(=O)N2)CC1 ZINC000492186489 313905238 /nfs/dbraw/zinc/90/52/38/313905238.db2.gz CBTVTYXTKPORQU-LCYFTJDESA-N 0 3 331.372 2.573 20 5 EFBDHN CCOc1cc(CN(C[C@@H](C)C(=O)OC)C2CC2)ccc1[N+](=O)[O-] ZINC000492693959 314088766 /nfs/dbraw/zinc/08/87/66/314088766.db2.gz AUQRBEYJVDCUKI-GFCCVEGCSA-N 0 3 336.388 2.767 20 5 EFBDHN O=C(/C=C/c1ccccc1)NCCCNCc1ccccc1[N+](=O)[O-] ZINC000492849436 314150804 /nfs/dbraw/zinc/15/08/04/314150804.db2.gz CKYDHILRLXVYSA-VAWYXSNFSA-N 0 3 339.395 2.904 20 5 EFBDHN C[C@H]1C[C@H]1N1CCN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000492898934 314169276 /nfs/dbraw/zinc/16/92/76/314169276.db2.gz UXYUWWSOLULGQT-XQJSUTPGSA-N 0 3 343.427 2.797 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)N2CCN(C)CC[C@H]2C)cc1[N+](=O)[O-] ZINC000492964006 314193800 /nfs/dbraw/zinc/19/38/00/314193800.db2.gz UZYVKOLVECRHQU-ZIAGYGMSSA-N 0 3 334.420 2.700 20 5 EFBDHN CC[C@H](NC(=O)N1CCN(C)CC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000493046045 314222246 /nfs/dbraw/zinc/22/22/46/314222246.db2.gz DBLVTFSQKHBCFP-CJNGLKHVSA-N 0 3 334.420 2.782 20 5 EFBDHN C[C@H]1CN(C(=O)/C=C\c2cccc([N+](=O)[O-])c2)CCN(C2CC2)C1 ZINC000493169732 314264940 /nfs/dbraw/zinc/26/49/40/314264940.db2.gz HBVTXHXPIXJMNJ-BMWLXYDHSA-N 0 3 329.400 2.551 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N(C)CCN2CCCC2)cc1[N+](=O)[O-] ZINC000493248763 314290519 /nfs/dbraw/zinc/29/05/19/314290519.db2.gz ASNDNHBKFYEVQU-AWEZNQCLSA-N 0 3 334.420 2.701 20 5 EFBDHN CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(CNCc2ccccc2[N+](=O)[O-])C1 ZINC000496290356 315014232 /nfs/dbraw/zinc/01/42/32/315014232.db2.gz CWRJOWXXGJBIMA-RDTXWAMCSA-N 0 3 347.415 2.941 20 5 EFBDHN C[C@@H]1C[C@]1(NCCn1cc([N+](=O)[O-])ccc1=O)c1ccc(Cl)cc1 ZINC000503389879 315443416 /nfs/dbraw/zinc/44/34/16/315443416.db2.gz IEEUEIOYNYEFMI-SJKOYZFVSA-N 0 3 347.802 2.935 20 5 EFBDHN CN(C)C[C@@H]1CCCCN1C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000519140906 315846208 /nfs/dbraw/zinc/84/62/08/315846208.db2.gz AJTRDWYIJJHIKZ-ZDUSSCGKSA-N 0 3 330.388 2.632 20 5 EFBDHN CN(C)C[C@H]1CCCCN1C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000519140905 315846507 /nfs/dbraw/zinc/84/65/07/315846507.db2.gz AJTRDWYIJJHIKZ-CYBMUJFWSA-N 0 3 330.388 2.632 20 5 EFBDHN C[C@H](CNC(=O)NCc1cccc([N+](=O)[O-])c1)N1CCCC[C@H]1C ZINC000522238001 316082344 /nfs/dbraw/zinc/08/23/44/316082344.db2.gz ZOYJFLWPFKSQQZ-ZIAGYGMSSA-N 0 3 334.420 2.657 20 5 EFBDHN CC(C)N1CCN([C@@H]2CCN([C@H](C)c3ccccc3[N+](=O)[O-])C2)CC1 ZINC000525686487 316226971 /nfs/dbraw/zinc/22/69/71/316226971.db2.gz SGAIVWWXRSCFKW-IAGOWNOFSA-N 0 3 346.475 2.756 20 5 EFBDHN CN1CCN(CCCCNc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000526073747 316286834 /nfs/dbraw/zinc/28/68/34/316286834.db2.gz TURLCYIHOXHEEE-UHFFFAOYSA-N 0 3 326.828 2.688 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H]1CN(CC(C)C)CCO1 ZINC000531931487 317334382 /nfs/dbraw/zinc/33/43/82/317334382.db2.gz OMUAXRBRAYHNPC-DOTOQJQBSA-N 0 3 335.448 2.911 20 5 EFBDHN CN(C)C[C@@H]1CCCCN1C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000534248283 317536379 /nfs/dbraw/zinc/53/63/79/317536379.db2.gz UDNQKOVTHNNNPO-LBPRGKRZSA-N 0 3 330.388 2.632 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H]1CCC[C@H](S(C)(=O)=O)C1 ZINC000537985028 317687259 /nfs/dbraw/zinc/68/72/59/317687259.db2.gz QBERBCNFOFJBGY-GUTXKFCHSA-N 0 3 340.445 2.910 20 5 EFBDHN Cc1cc(NC[C@H](CO)Cc2ccco2)c2cc([N+](=O)[O-])ccc2n1 ZINC000541174948 317769583 /nfs/dbraw/zinc/76/95/83/317769583.db2.gz WOVKSNPTTFDSFM-CYBMUJFWSA-N 0 3 341.367 2.729 20 5 EFBDHN C[C@H](C(=O)NC[C@H]1N(C)CCCC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000548403923 318104170 /nfs/dbraw/zinc/10/41/70/318104170.db2.gz WVOQZKARFOQJDK-XJKSGUPXSA-N 0 3 333.432 2.935 20 5 EFBDHN CN(CCCN(C)C(=O)c1ccccc1[N+](=O)[O-])Cc1ccncc1 ZINC000552112434 318243251 /nfs/dbraw/zinc/24/32/51/318243251.db2.gz AULFVQRVJOMKHA-UHFFFAOYSA-N 0 3 342.399 2.584 20 5 EFBDHN CNc1ccc(C(=O)N2CCN(C3CCC3)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000553526367 318286289 /nfs/dbraw/zinc/28/62/89/318286289.db2.gz TZHHSQIVKDIXGL-ZDUSSCGKSA-N 0 3 346.431 2.583 20 5 EFBDHN Cc1ccc(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000554720315 318334053 /nfs/dbraw/zinc/33/40/53/318334053.db2.gz MPYFCBLNPZMEOK-INIZCTEOSA-N 0 3 330.384 2.741 20 5 EFBDHN C[C@@H](C(=O)NC[C@H]1CCCCN1C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000555321482 318353314 /nfs/dbraw/zinc/35/33/14/318353314.db2.gz CAAMDXMQTPBQFE-CXAGYDPISA-N 0 3 331.416 2.831 20 5 EFBDHN CC(C)c1[nH]nc(C(=O)Nc2ccccc2CN(C)C)c1[N+](=O)[O-] ZINC000555808260 318369741 /nfs/dbraw/zinc/36/97/41/318369741.db2.gz HATBVPUTHDNCMF-UHFFFAOYSA-N 0 3 331.376 2.755 20 5 EFBDHN CCOC(=O)c1cc(CNCCOc2ccc([N+](=O)[O-])cc2)[nH]c1C ZINC000560119864 318528475 /nfs/dbraw/zinc/52/84/75/318528475.db2.gz RECISHZWKQGITO-UHFFFAOYSA-N 0 3 347.371 2.577 20 5 EFBDHN CCC1(CC)[C@H](NCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H](C)[C@H]1OC ZINC000561466922 318604379 /nfs/dbraw/zinc/60/43/79/318604379.db2.gz ARIBFBNELKLXTK-JCURWCKSSA-N 0 3 349.431 2.963 20 5 EFBDHN CN(C)C[C@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000563253910 318759802 /nfs/dbraw/zinc/75/98/02/318759802.db2.gz FYUHVJKJQFEMPG-IXDOHACOSA-N 0 3 331.416 2.641 20 5 EFBDHN CCc1nncn1CCN[C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000563572224 318797795 /nfs/dbraw/zinc/79/77/95/318797795.db2.gz PFBVEEGXEAVDSH-INIZCTEOSA-N 0 3 329.404 2.806 20 5 EFBDHN CCc1ccc(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])s1 ZINC000564118225 318843509 /nfs/dbraw/zinc/84/35/09/318843509.db2.gz FVTUCBXMKJFOMW-GFCCVEGCSA-N 0 3 336.413 2.748 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCc1cc2ccccc2o1 ZINC000564754393 318888351 /nfs/dbraw/zinc/88/83/51/318888351.db2.gz RWKJRALWPZHPON-AWEZNQCLSA-N 0 3 342.351 2.871 20 5 EFBDHN CC[C@H](C)C[C@@H](C)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000565593776 318985628 /nfs/dbraw/zinc/98/56/28/318985628.db2.gz DOUMOHHLUCDTNJ-QWHCGFSZSA-N 0 3 328.434 2.783 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@@H]2C[C@H]2c2ccc(F)cc2)c1 ZINC000566125073 319036550 /nfs/dbraw/zinc/03/65/50/319036550.db2.gz OQJOHISTKCYNDM-RYQLBKOJSA-N 0 3 346.358 2.619 20 5 EFBDHN CN1CCN(CCOc2ccccc2[N+](=O)[O-])CC12CCCCC2 ZINC000566423773 319073134 /nfs/dbraw/zinc/07/31/34/319073134.db2.gz PXMBTTFQFBGGGA-UHFFFAOYSA-N 0 3 333.432 2.924 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2NC[C@@H](O)COc1ccc(F)cc1 ZINC000566476046 319081983 /nfs/dbraw/zinc/08/19/83/319081983.db2.gz SGIZUQFWXPONFO-DYVFJYSZSA-N 0 3 346.358 2.751 20 5 EFBDHN CC[C@H](CC(F)(F)F)NC[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000567710594 319201600 /nfs/dbraw/zinc/20/16/00/319201600.db2.gz NOVQZUGVAAYVFF-MNOVXSKESA-N 0 3 336.310 2.655 20 5 EFBDHN C[C@@H]1CN(CCCN[C@@H]2CCc3c2cccc3[N+](=O)[O-])C[C@@H](C)O1 ZINC000568662580 319307213 /nfs/dbraw/zinc/30/72/13/319307213.db2.gz DGHFCSLJURFVMT-CKEIUWERSA-N 0 3 333.432 2.671 20 5 EFBDHN COc1ccc(CNCCC(=O)Nc2ccccc2[N+](=O)[O-])cc1F ZINC000572619016 319688938 /nfs/dbraw/zinc/68/89/38/319688938.db2.gz VGSXSPOZAMLPNL-UHFFFAOYSA-N 0 3 347.346 2.861 20 5 EFBDHN Cc1noc([C@@H]2CC[C@H](CN[C@H]3CCc4c3cccc4[N+](=O)[O-])O2)n1 ZINC000576530244 320024339 /nfs/dbraw/zinc/02/43/39/320024339.db2.gz VMWVVFNFDRECFG-WPGHFRTFSA-N 0 3 344.371 2.783 20 5 EFBDHN CC(C)N1CCCC[C@H]1Cn1c(=O)onc1-c1cccc([N+](=O)[O-])c1 ZINC000577848865 320150390 /nfs/dbraw/zinc/15/03/90/320150390.db2.gz KGCFOGDNHDBCGD-HNNXBMFYSA-N 0 3 346.387 2.674 20 5 EFBDHN COc1ccc(CNC[C@@H](O)[C@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000578725744 320232812 /nfs/dbraw/zinc/23/28/12/320232812.db2.gz VWOLWCVFKMEGQE-CXAGYDPISA-N 0 3 330.384 2.858 20 5 EFBDHN CCN(C)CCNC(=O)c1cc([N+](=O)[O-])ccc1SC(C)C ZINC000181354785 323232842 /nfs/dbraw/zinc/23/28/42/323232842.db2.gz HXNUDFKVEAPUSL-UHFFFAOYSA-N 0 3 325.434 2.777 20 5 EFBDHN CCC1(CC)[C@H](NCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1OC ZINC000181844272 323252948 /nfs/dbraw/zinc/25/29/48/323252948.db2.gz MRFBITYODCYOJA-CABCVRRESA-N 0 3 335.404 2.717 20 5 EFBDHN CC[C@H](N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C)[C@@H]1CCCO1 ZINC000182336639 323277787 /nfs/dbraw/zinc/27/77/87/323277787.db2.gz KQCHZXKOQSXQQC-XEZPLFJOSA-N 0 3 335.404 2.777 20 5 EFBDHN C[C@@H](C(=O)NCCN1CCC(C)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000185008240 323380054 /nfs/dbraw/zinc/38/00/54/323380054.db2.gz UKTXTWSGXRQTFB-CYBMUJFWSA-N 0 3 337.395 2.686 20 5 EFBDHN C[C@H](C(=O)NCCN1CCC[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1F ZINC000185003590 323380159 /nfs/dbraw/zinc/38/01/59/323380159.db2.gz YVIIXTMWADLRPL-OLZOCXBDSA-N 0 3 337.395 2.686 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000185235858 323388303 /nfs/dbraw/zinc/38/83/03/323388303.db2.gz KWWZNUAORRQJNR-JSGCOSHPSA-N 0 3 337.395 2.828 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN[C@H]1CCc2cc(F)ccc21 ZINC000580737433 324223466 /nfs/dbraw/zinc/22/34/66/324223466.db2.gz UCLZAHINEMEBDG-HOCLYGCPSA-N 0 3 346.358 2.751 20 5 EFBDHN COc1ccc(OCCN2CC[C@@H](c3cccnc3)C2)c([N+](=O)[O-])c1 ZINC000581188616 324323773 /nfs/dbraw/zinc/32/37/73/324323773.db2.gz DNGZKXDQENDDFA-OAHLLOKOSA-N 0 3 343.383 2.867 20 5 EFBDHN CC(C)Oc1cc(C(=O)N2CC[C@H](N3CCCC3)C2)ccc1[N+](=O)[O-] ZINC000584099455 324929028 /nfs/dbraw/zinc/92/90/28/324929028.db2.gz DLRSONRRXBCUPU-HNNXBMFYSA-N 0 3 347.415 2.692 20 5 EFBDHN Cc1cocc1C(=O)N[C@H]1C[C@H](CNCc2csc([N+](=O)[O-])c2)C1 ZINC000984569523 724384578 /nfs/dbraw/zinc/38/45/78/724384578.db2.gz TWFKCYMWYBQZBP-AULYBMBSSA-N 0 3 349.412 2.856 20 5 EFBDHN CCO[C@@H]1CCCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000155450075 472551268 /nfs/dbraw/zinc/55/12/68/472551268.db2.gz YQAKCZAMLGKMRG-QGZVFWFLSA-N 0 3 344.415 2.996 20 5 EFBDHN CN(Cc1ccc(Br)c([N+](=O)[O-])c1)C[C@@H]1CCOC1 ZINC000093839821 473149361 /nfs/dbraw/zinc/14/93/61/473149361.db2.gz RGWLTHOOTQUYDH-NSHDSACASA-N 0 3 329.194 2.826 20 5 EFBDHN CCOc1ccc([C@H](C)NCCCNC(=O)C2CCC2)cc1[N+](=O)[O-] ZINC000090184556 472607883 /nfs/dbraw/zinc/60/78/83/472607883.db2.gz KEJWLENLMLKTHP-ZDUSSCGKSA-N 0 3 349.431 2.951 20 5 EFBDHN Cc1ccc(NC(=O)CCN[C@@H](C)c2ccc([N+](=O)[O-])cc2)nc1 ZINC000095967983 473233385 /nfs/dbraw/zinc/23/33/85/473233385.db2.gz MEYQASBIIKIQLO-ZDUSSCGKSA-N 0 3 328.372 2.978 20 5 EFBDHN CCN1CCN([C@H](C)CNc2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000112074317 473241746 /nfs/dbraw/zinc/24/17/46/473241746.db2.gz XFIMBSFFRMABIP-CQSZACIVSA-N 0 3 343.431 2.581 20 5 EFBDHN Cc1c(CC(=O)NC[C@H](C)N2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000161682233 473252164 /nfs/dbraw/zinc/25/21/64/473252164.db2.gz WGNGESZVXYDEAA-KBPBESRZSA-N 0 3 333.432 2.682 20 5 EFBDHN CCCCN(C)CCNC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000112310070 473255232 /nfs/dbraw/zinc/25/52/32/473255232.db2.gz VSAPZZDQQMNHPS-UHFFFAOYSA-N 0 3 325.434 2.535 20 5 EFBDHN Cn1ncc([N+](=O)[O-])c1C(=O)Nc1cccc(CN2CCCCC2)c1 ZINC000161853504 473271349 /nfs/dbraw/zinc/27/13/49/473271349.db2.gz DYIKYKXRTARMCP-UHFFFAOYSA-N 0 3 343.387 2.567 20 5 EFBDHN O=C(Cc1ccccc1[N+](=O)[O-])N[C@H]1CCN(Cc2ccccc2)C1 ZINC000143087446 473272118 /nfs/dbraw/zinc/27/21/18/473272118.db2.gz QQCCBSQHHVXKDZ-KRWDZBQOSA-N 0 3 339.395 2.528 20 5 EFBDHN O=[N+]([O-])c1ccc2oc(CN3CCN(C4CCCC4)CC3)nc2c1 ZINC000177001804 473284734 /nfs/dbraw/zinc/28/47/34/473284734.db2.gz LIAGATCSQSMNSV-UHFFFAOYSA-N 0 3 330.388 2.796 20 5 EFBDHN COc1cc(CN(C)CCOc2ccc([N+](=O)[O-])cc2)ccc1O ZINC000177055473 473297140 /nfs/dbraw/zinc/29/71/40/473297140.db2.gz XYTKMHSABIUHBI-UHFFFAOYSA-N 0 3 332.356 2.820 20 5 EFBDHN CN(C)C[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000124817732 473307830 /nfs/dbraw/zinc/30/78/30/473307830.db2.gz LAPDSMKBJHTLPN-KRWDZBQOSA-N 0 3 345.374 2.696 20 5 EFBDHN CC(C)[C@H](CCO)N[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000162183900 473313952 /nfs/dbraw/zinc/31/39/52/473313952.db2.gz SJFBYDNHUHFQEN-GWCFXTLKSA-N 0 3 343.811 2.572 20 5 EFBDHN CC(C)[C@@H](CCO)N[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000162183755 473314035 /nfs/dbraw/zinc/31/40/35/473314035.db2.gz SJFBYDNHUHFQEN-GXFFZTMASA-N 0 3 343.811 2.572 20 5 EFBDHN CN(C)Cc1ccccc1CNC(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000177274306 473346696 /nfs/dbraw/zinc/34/66/96/473346696.db2.gz GYSTVZMJYSNYAN-UHFFFAOYSA-N 0 3 331.347 2.726 20 5 EFBDHN CNC(=O)[C@@H]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000125056238 473348221 /nfs/dbraw/zinc/34/82/21/473348221.db2.gz AIHHIKZNEWGSPK-CQSZACIVSA-N 0 3 343.383 2.813 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000162497960 473348429 /nfs/dbraw/zinc/34/84/29/473348429.db2.gz BUCXELWZHLEMOY-HIFRSBDPSA-N 0 3 332.404 2.994 20 5 EFBDHN CCN1CCC(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)CC1 ZINC000162521301 473351335 /nfs/dbraw/zinc/35/13/35/473351335.db2.gz VRKDDBZLNZRWLM-UHFFFAOYSA-N 0 3 346.431 2.753 20 5 EFBDHN C[C@@H](C(=O)N(C)C[C@@H]1CCCN(C)C1)c1ccc([N+](=O)[O-])cc1F ZINC000185246569 473375431 /nfs/dbraw/zinc/37/54/31/473375431.db2.gz JWLAIZVJSCUGDX-CHWSQXEVSA-N 0 3 337.395 2.638 20 5 EFBDHN Cn1c(CCNCc2ccccc2[N+](=O)[O-])nc2c1cccc2F ZINC000113358749 473388011 /nfs/dbraw/zinc/38/80/11/473388011.db2.gz OITYJNOAEYUPMI-UHFFFAOYSA-N 0 3 328.347 2.953 20 5 EFBDHN O=C(NCc1ccccc1)[C@H]1CCN(Cc2ccccc2[N+](=O)[O-])C1 ZINC000592154817 478800613 /nfs/dbraw/zinc/80/06/13/478800613.db2.gz XXYNTDTYGPKTTI-KRWDZBQOSA-N 0 3 339.395 2.733 20 5 EFBDHN COC1(CNCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCOCC1 ZINC000602579570 479407227 /nfs/dbraw/zinc/40/72/27/479407227.db2.gz APXWWEODEZGUJW-UHFFFAOYSA-N 0 3 348.321 2.899 20 5 EFBDHN CO[C@@]1(CNCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCOC1 ZINC000602638126 479441388 /nfs/dbraw/zinc/44/13/88/479441388.db2.gz CRTDELWBPZLOTP-CYBMUJFWSA-N 0 3 334.294 2.509 20 5 EFBDHN CN1CCCC(C)(C)[C@H]1CNCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602643878 479444239 /nfs/dbraw/zinc/44/42/39/479444239.db2.gz NUVFXZLXQVPSJV-OAHLLOKOSA-N 0 3 332.404 2.946 20 5 EFBDHN C[C@H](C(=O)N(C)CCN1CCCCC1)c1ccc([N+](=O)[O-])cc1F ZINC000593882654 479495090 /nfs/dbraw/zinc/49/50/90/479495090.db2.gz JJSSQLAZBMUFKI-ZDUSSCGKSA-N 0 3 337.395 2.782 20 5 EFBDHN CN(CCN1CCCCC1)C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000593882926 479495162 /nfs/dbraw/zinc/49/51/62/479495162.db2.gz LMQZQPWVTMGKHB-UHFFFAOYSA-N 0 3 330.388 2.634 20 5 EFBDHN Cc1c(CC(=O)N2CCCN(CC3CCC3)CC2)cccc1[N+](=O)[O-] ZINC000619868439 479898494 /nfs/dbraw/zinc/89/84/94/479898494.db2.gz UVGSPEKSYREMBY-UHFFFAOYSA-N 0 3 345.443 2.780 20 5 EFBDHN O=C(c1ccc([N+](=O)[O-])cc1F)N1CCCN(CC2CCC2)CC1 ZINC000619868442 479898705 /nfs/dbraw/zinc/89/87/05/479898705.db2.gz WPDSBCCTFJEPCM-UHFFFAOYSA-N 0 3 335.379 2.682 20 5 EFBDHN O=[N+]([O-])c1c(N[C@@H]2CCN(Cc3ccccc3)C2)nc2sccn21 ZINC000008337262 471682289 /nfs/dbraw/zinc/68/22/89/471682289.db2.gz NBZHZICMTFIWIG-CYBMUJFWSA-N 0 3 343.412 2.990 20 5 EFBDHN Cc1cc(C(=O)NC[C@H](c2ccccc2)N(C)C)ccc1[N+](=O)[O-] ZINC000010017725 471725830 /nfs/dbraw/zinc/72/58/30/471725830.db2.gz AZPYIKMDHISLPJ-QGZVFWFLSA-N 0 3 327.384 2.936 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000067022408 471983524 /nfs/dbraw/zinc/98/35/24/471983524.db2.gz MBVPSLSRJADTOV-QGZVFWFLSA-N 0 3 327.384 2.936 20 5 EFBDHN NC(=O)c1ccc(CN2CCC[C@@H]2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000025441587 472097260 /nfs/dbraw/zinc/09/72/60/472097260.db2.gz MQNVZNMJPNMKPI-QGZVFWFLSA-N 0 3 339.395 2.901 20 5 EFBDHN C[C@@H](CNC(=O)NCCc1ccc([N+](=O)[O-])cc1)N1CCC[C@H](C)C1 ZINC000054647076 472105100 /nfs/dbraw/zinc/10/51/00/472105100.db2.gz XGGVQKWGJFDJTA-GJZGRUSLSA-N 0 3 348.447 2.557 20 5 EFBDHN CN(CCOc1ccccc1)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000026222714 472128466 /nfs/dbraw/zinc/12/84/66/472128466.db2.gz JJDZMVGPZMLEQG-UHFFFAOYSA-N 0 3 343.383 2.934 20 5 EFBDHN C[C@@H]1CCCN(CCNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000068122187 472137643 /nfs/dbraw/zinc/13/76/43/472137643.db2.gz DHYKPIYWDXLZQL-OAHLLOKOSA-N 0 3 348.447 2.635 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@@H](N(C)C)C1 ZINC000068341924 472172373 /nfs/dbraw/zinc/17/23/73/472172373.db2.gz RQRKAUGGWYPPPG-TZMCWYRMSA-N 0 3 337.445 2.628 20 5 EFBDHN CN(C)[C@@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000075956263 472227228 /nfs/dbraw/zinc/22/72/28/472227228.db2.gz YYXKYCRBNUVJCN-LLVKDONJSA-N 0 3 326.784 2.806 20 5 EFBDHN Cc1c(C(=O)N[C@@H](C)CN2C[C@H](C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000055748359 472232974 /nfs/dbraw/zinc/23/29/74/472232974.db2.gz HGDNXQRYDKJWKL-MJBXVCDLSA-N 0 3 333.432 2.999 20 5 EFBDHN CC(C)N1CCCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC000069081729 472287824 /nfs/dbraw/zinc/28/78/24/472287824.db2.gz ZNEQHDWFZYCMDV-UHFFFAOYSA-N 0 3 345.403 2.561 20 5 EFBDHN O=[N+]([O-])c1cc(Br)cnc1NCCN1CCCCC1 ZINC000044389424 472303995 /nfs/dbraw/zinc/30/39/95/472303995.db2.gz JJLZYHKZMLJHRX-UHFFFAOYSA-N 0 3 329.198 2.650 20 5 EFBDHN Cc1ccccc1CN1CCC(NC(=O)c2cc([N+](=O)[O-])c[nH]2)CC1 ZINC000056327970 472305656 /nfs/dbraw/zinc/30/56/56/472305656.db2.gz VPWZWILCNKULNO-UHFFFAOYSA-N 0 3 342.399 2.626 20 5 EFBDHN C[C@@H](CNC(=O)CCc1cccc([N+](=O)[O-])c1)N1CCCC[C@@H]1C ZINC000087105638 472306263 /nfs/dbraw/zinc/30/62/63/472306263.db2.gz QKDBGOAXSXZJGA-GJZGRUSLSA-N 0 3 333.432 2.907 20 5 EFBDHN O=C(CCc1cccc([N+](=O)[O-])c1)N1CC[C@@H](N2CCCCC2)C1 ZINC000087323943 472325892 /nfs/dbraw/zinc/32/58/92/472325892.db2.gz PTFPOKDREQRIJF-QGZVFWFLSA-N 0 3 331.416 2.614 20 5 EFBDHN CN(C)Cc1ccc(NC(=O)COc2ccccc2[N+](=O)[O-])cc1 ZINC000030771189 472347992 /nfs/dbraw/zinc/34/79/92/472347992.db2.gz CYSIQPZYLKNTRD-UHFFFAOYSA-N 0 3 329.356 2.674 20 5 EFBDHN CC(C)CN1CCCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000154221121 472405275 /nfs/dbraw/zinc/40/52/75/472405275.db2.gz LSHHAGOCOHSIQB-CQSZACIVSA-N 0 3 337.395 2.974 20 5 EFBDHN Cc1c(C(=O)NC[C@H](Cc2ccccc2)N(C)C)cccc1[N+](=O)[O-] ZINC000057287905 472410110 /nfs/dbraw/zinc/41/01/10/472410110.db2.gz OVBNXDAKEFAGOR-INIZCTEOSA-N 0 3 341.411 2.806 20 5 EFBDHN C[C@@H](CNC(=O)NCc1ccccc1[N+](=O)[O-])N1CCC[C@@H](C)C1 ZINC000045625284 472436220 /nfs/dbraw/zinc/43/62/20/472436220.db2.gz NVAWJOBVALTHEZ-KGLIPLIRSA-N 0 3 334.420 2.514 20 5 EFBDHN CCc1ccc([C@@H](CNC(=O)c2ccc([N+](=O)[O-])o2)N(C)C)cc1 ZINC000032735603 472461030 /nfs/dbraw/zinc/46/10/30/472461030.db2.gz VFXZYXOYDUWJML-CQSZACIVSA-N 0 3 331.372 2.783 20 5 EFBDHN Cc1ccc([C@H](CNc2c([N+](=O)[O-])ncn2C)N2CCCC2)cc1 ZINC000057829773 472480955 /nfs/dbraw/zinc/48/09/55/472480955.db2.gz PDNCEWDHPMHFNY-HNNXBMFYSA-N 0 3 329.404 2.886 20 5 EFBDHN COc1ccc(-c2ccc(CNCCn3ccnc3)o2)c([N+](=O)[O-])c1 ZINC000102419809 472577789 /nfs/dbraw/zinc/57/77/89/472577789.db2.gz ZJFBZWXREGPHFZ-UHFFFAOYSA-N 0 3 342.355 2.850 20 5 EFBDHN CN(C)CCOc1ccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000046723264 472590417 /nfs/dbraw/zinc/59/04/17/472590417.db2.gz UZARFLIBKBDSFC-UHFFFAOYSA-N 0 3 343.383 2.716 20 5 EFBDHN Cc1nn(C)c(N[C@H]2CCCN(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000071952822 472625188 /nfs/dbraw/zinc/62/51/88/472625188.db2.gz RXBLOMLMDKERRJ-HNNXBMFYSA-N 0 3 329.404 2.713 20 5 EFBDHN CCOc1ccc([C@@H](C)NCCn2cc([N+](=O)[O-])cn2)cc1OCC ZINC000090538973 472632442 /nfs/dbraw/zinc/63/24/42/472632442.db2.gz GGUOEXBQUJUFKB-CYBMUJFWSA-N 0 3 348.403 2.940 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@H]1CCN(CC2CC2)C1 ZINC000120118696 472633324 /nfs/dbraw/zinc/63/33/24/472633324.db2.gz SIIKFFPCSUNLFL-AWEZNQCLSA-N 0 3 332.404 2.817 20 5 EFBDHN C[C@@H]1[C@H](c2ccccc2)CCN1CCn1cc([N+](=O)[O-])ccc1=O ZINC000090552050 472634892 /nfs/dbraw/zinc/63/48/92/472634892.db2.gz SSFOZIJYRADJAM-RHSMWYFYSA-N 0 3 327.384 2.635 20 5 EFBDHN O=C(CN(C1CC1)C1CCCC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000103466344 472635403 /nfs/dbraw/zinc/63/54/03/472635403.db2.gz GUBBLAIBDBCEQS-UHFFFAOYSA-N 0 3 329.400 2.891 20 5 EFBDHN CCN(CCn1cc([N+](=O)[O-])ccc1=O)[C@@H](C)c1cccc(O)c1 ZINC000090551806 472635393 /nfs/dbraw/zinc/63/53/93/472635393.db2.gz APNZBVJCDIDXCK-ZDUSSCGKSA-N 0 3 331.372 2.545 20 5 EFBDHN CC[C@H](NC(=O)N[C@H]1C[C@H](C)N(C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000090610777 472642540 /nfs/dbraw/zinc/64/25/40/472642540.db2.gz KPGWMQQSOZCRFE-JDFRZJQESA-N 0 3 346.431 2.970 20 5 EFBDHN CCN1CCN(C[C@@H](C)CNc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000060380207 472650138 /nfs/dbraw/zinc/65/01/38/472650138.db2.gz WQILDAQJUQAHRH-ZDUSSCGKSA-N 0 3 340.855 2.934 20 5 EFBDHN Cc1ccc(CN(CCN(C)C)C(=O)c2ccc([N+](=O)[O-])s2)o1 ZINC000060407550 472654224 /nfs/dbraw/zinc/65/42/24/472654224.db2.gz XBCPXIGYDTUNQI-UHFFFAOYSA-N 0 3 337.401 2.762 20 5 EFBDHN CCCCN(CCO)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000104673757 472681538 /nfs/dbraw/zinc/68/15/38/472681538.db2.gz HJUWYZQVPQVEQT-UHFFFAOYSA-N 0 3 333.388 2.887 20 5 EFBDHN O=[N+]([O-])c1ccccc1CNCC1(N2CCOCC2)CCCCC1 ZINC000061013550 472688060 /nfs/dbraw/zinc/68/80/60/472688060.db2.gz OQXXRRKYWQHSMZ-UHFFFAOYSA-N 0 3 333.432 2.720 20 5 EFBDHN C[C@@H]1CCN(CCOc2cccc([N+](=O)[O-])c2)C[C@@H]1n1ccnc1 ZINC000156530204 472719789 /nfs/dbraw/zinc/71/97/89/472719789.db2.gz MNUJDIUFHUCQNK-PBHICJAKSA-N 0 3 330.388 2.753 20 5 EFBDHN O=C1CC[C@@H](NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)CN1 ZINC000105481599 472754431 /nfs/dbraw/zinc/75/44/31/472754431.db2.gz OUMVSRQZISRQHD-LLVKDONJSA-N 0 3 331.397 2.692 20 5 EFBDHN C[C@H]1CN(CC2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C[C@H](C)O1 ZINC000091478887 472771008 /nfs/dbraw/zinc/77/10/08/472771008.db2.gz VZINTOXJBNXSKZ-GJZGRUSLSA-N 0 3 333.432 2.920 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N(C)[C@@H]2CCN(C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000120998726 472781003 /nfs/dbraw/zinc/78/10/03/472781003.db2.gz CSZIHUSJHDUTTI-OFQRWUPVSA-N 0 3 348.447 2.946 20 5 EFBDHN CSc1ccc(C(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)cc1[N+](=O)[O-] ZINC000157203786 472795233 /nfs/dbraw/zinc/79/52/33/472795233.db2.gz PMRUSLNELAIKJD-ZIAGYGMSSA-N 0 3 349.456 2.873 20 5 EFBDHN CN(C)CCN(Cc1cccc(O)c1)C(=O)c1cccc([N+](=O)[O-])c1 ZINC000157226243 472798247 /nfs/dbraw/zinc/79/82/47/472798247.db2.gz SBGFPMMTWSLWIL-UHFFFAOYSA-N 0 3 343.383 2.504 20 5 EFBDHN CN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000157246078 472799900 /nfs/dbraw/zinc/79/99/00/472799900.db2.gz VBSNZECEUMWDMB-BXUZGUMPSA-N 0 3 337.807 2.805 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCCN(C(C)(C)C)CC1 ZINC000063725315 472806431 /nfs/dbraw/zinc/80/64/31/472806431.db2.gz UYUPHJQVJRLAJI-UHFFFAOYSA-N 0 3 335.404 2.550 20 5 EFBDHN CN(Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C[C@@H]1CCC[C@@H]1O ZINC000091898705 472824396 /nfs/dbraw/zinc/82/43/96/472824396.db2.gz CTWKFLUGALDYDI-YOEHRIQHSA-N 0 3 344.415 2.588 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000134196330 472884735 /nfs/dbraw/zinc/88/47/35/472884735.db2.gz DPNJJJFAIIYYMK-OAHLLOKOSA-N 0 3 344.415 2.609 20 5 EFBDHN COc1ccc(OCCN(C)CCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000065208846 472907797 /nfs/dbraw/zinc/90/77/97/472907797.db2.gz VEVJXGAGQBUDSG-UHFFFAOYSA-N 0 3 346.383 2.993 20 5 EFBDHN COc1ccc(-c2ccc(CN3CCC[C@@H]3CO)o2)c([N+](=O)[O-])c1 ZINC000092470903 472919500 /nfs/dbraw/zinc/91/95/00/472919500.db2.gz PZIKOHPQUNVIQU-GFCCVEGCSA-N 0 3 332.356 2.820 20 5 EFBDHN Cc1cc(C(=O)N(CCN(C)C)Cc2ccccn2)cc([N+](=O)[O-])c1 ZINC000107262125 472936835 /nfs/dbraw/zinc/93/68/35/472936835.db2.gz UAHRCPMQNHATOW-UHFFFAOYSA-N 0 3 342.399 2.502 20 5 EFBDHN C[C@@H](NC(=O)N[C@@H](C)CN1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000079985118 472953283 /nfs/dbraw/zinc/95/32/83/472953283.db2.gz XHPIRSVEHAEHAI-UONOGXRCSA-N 0 3 334.420 2.829 20 5 EFBDHN CC(C)(CNC(=O)NCc1ccccc1[N+](=O)[O-])N1CCCCC1 ZINC000049786314 472964635 /nfs/dbraw/zinc/96/46/35/472964635.db2.gz GLPYMDXDXRKOJZ-UHFFFAOYSA-N 0 3 334.420 2.659 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)NCCN2CCC(C)CC2)c1 ZINC000107605975 472967045 /nfs/dbraw/zinc/96/70/45/472967045.db2.gz FWFGADXPPWOESG-UHFFFAOYSA-N 0 3 337.445 2.778 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)NCCN2CCC[C@H](C)C2)c1 ZINC000107594533 472967178 /nfs/dbraw/zinc/96/71/78/472967178.db2.gz VTKXVYRJTHQQDL-LBPRGKRZSA-N 0 3 337.445 2.778 20 5 EFBDHN CN(CC1CCN(C)CC1)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000134840810 472975048 /nfs/dbraw/zinc/97/50/48/472975048.db2.gz KOMQEDKVESIOBS-UHFFFAOYSA-N 0 3 325.796 2.662 20 5 EFBDHN CC(C)C[C@@H](CN[C@@H](C)c1ccc([N+](=O)[O-])cc1)N1CCOCC1 ZINC000122140233 472979379 /nfs/dbraw/zinc/97/93/79/472979379.db2.gz JGYJHRGJRLUMNV-YJBOKZPZSA-N 0 3 335.448 2.992 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2)CN1Cc1ccccc1 ZINC000134931195 472993842 /nfs/dbraw/zinc/99/38/42/472993842.db2.gz NOTZGVQBOPUDIA-WMLDXEAASA-N 0 3 339.395 2.988 20 5 EFBDHN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N1CC[C@@H](N2CCCC2)C1 ZINC000066157942 473050414 /nfs/dbraw/zinc/05/04/14/473050414.db2.gz MYRUETURGDTGIE-GFCCVEGCSA-N 0 3 338.795 2.950 20 5 EFBDHN CC(C(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000074729866 473053168 /nfs/dbraw/zinc/05/31/68/473053168.db2.gz PAHXQRGESJCOOY-QMMMGPOBSA-N 0 3 328.250 2.917 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCN1CCC(c2ccccc2)CC1 ZINC000159711729 473053770 /nfs/dbraw/zinc/05/37/70/473053770.db2.gz RPBSZYQWBGSABU-UHFFFAOYSA-N 0 3 327.384 2.636 20 5 EFBDHN O=C(CCN1CCC[C@H](c2ncc[nH]2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000080959059 473112603 /nfs/dbraw/zinc/11/26/03/473112603.db2.gz UABKFQRPKJLOCX-ZDUSSCGKSA-N 0 3 343.387 2.526 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H](C)N1CCCC1 ZINC000052641298 473136562 /nfs/dbraw/zinc/13/65/62/473136562.db2.gz GXQWYJTVVVLVHV-STQMWFEESA-N 0 3 337.445 2.676 20 5 EFBDHN O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CCC[C@H]1CN1CCCC1 ZINC000066944116 473180543 /nfs/dbraw/zinc/18/05/43/473180543.db2.gz INYUBOPCKJJFHD-AWEZNQCLSA-N 0 3 342.399 2.777 20 5 EFBDHN CCc1nn(C)c(N2CCN(CC3CCCCC3)CC2)c1[N+](=O)[O-] ZINC000094151126 473181711 /nfs/dbraw/zinc/18/17/11/473181711.db2.gz JHHVQKUVVJIYJC-UHFFFAOYSA-N 0 3 335.452 2.593 20 5 EFBDHN CCOc1ccc(C(=O)N2CCCC[C@H]2CN(C)C)cc1[N+](=O)[O-] ZINC000066948233 473183394 /nfs/dbraw/zinc/18/33/94/473183394.db2.gz RRLKEYKMCJQYGY-AWEZNQCLSA-N 0 3 335.404 2.550 20 5 EFBDHN CC(=O)Nc1cccc([C@H](C)NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000136914419 473184972 /nfs/dbraw/zinc/18/49/72/473184972.db2.gz ZPZRIJVNXPCZCW-KPZWWZAWSA-N 0 3 343.383 2.937 20 5 EFBDHN Cn1ccnc1C[C@@H]1CCCN(CCOc2ccccc2[N+](=O)[O-])C1 ZINC000123838021 473192041 /nfs/dbraw/zinc/19/20/41/473192041.db2.gz XQAMOWRTLQBLJS-HNNXBMFYSA-N 0 3 344.415 2.662 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CCN(C3CCCCC3)CC2)c1 ZINC000137076067 473193047 /nfs/dbraw/zinc/19/30/47/473193047.db2.gz AAEXZEJSZXGGKX-GOSISDBHSA-N 0 3 333.432 2.579 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000177679570 473415261 /nfs/dbraw/zinc/41/52/61/473415261.db2.gz NGQRRLWTPDLPLJ-OCCSQVGLSA-N 0 3 348.403 2.694 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CN2CCCc3ccccc3C2)c1 ZINC000171595252 473418428 /nfs/dbraw/zinc/41/84/28/473418428.db2.gz JTEJQGHKZSLHJJ-GOSISDBHSA-N 0 3 342.395 2.783 20 5 EFBDHN COc1ccc(C(=O)N[C@@H](C)CN2CCCCCC2)cc1[N+](=O)[O-] ZINC000185414629 473420550 /nfs/dbraw/zinc/42/05/50/473420550.db2.gz IIAYRSWYZHIVRN-ZDUSSCGKSA-N 0 3 335.404 2.598 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)CN2CCCCCC2)c1 ZINC000185417743 473421553 /nfs/dbraw/zinc/42/15/53/473421553.db2.gz OTFDYQXFMYZPHS-ZDUSSCGKSA-N 0 3 335.404 2.598 20 5 EFBDHN C[C@H](C(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000185489515 473439780 /nfs/dbraw/zinc/43/97/80/473439780.db2.gz JSHAQSBINFWIPY-SDDRHHMPSA-N 0 3 335.379 2.579 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)N(C)CCN(C)C2CC2)cc1[N+](=O)[O-] ZINC000185511155 473445794 /nfs/dbraw/zinc/44/57/94/473445794.db2.gz CVSUHUNZGYNKBN-CYBMUJFWSA-N 0 3 334.420 2.700 20 5 EFBDHN COc1cccc(NC2CCN(CCOC(C)C)CC2)c1[N+](=O)[O-] ZINC000185514609 473445822 /nfs/dbraw/zinc/44/58/22/473445822.db2.gz CUPMJYOHTUCROU-UHFFFAOYSA-N 0 3 337.420 2.905 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000171838251 473467453 /nfs/dbraw/zinc/46/74/53/473467453.db2.gz KXEQWXUAMMLVAM-BBRMVZONSA-N 0 3 334.420 2.829 20 5 EFBDHN CCN(CCNC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)C1CC1 ZINC000151521122 473468179 /nfs/dbraw/zinc/46/81/79/473468179.db2.gz ZNPKAINYAOGMAJ-UHFFFAOYSA-N 0 3 346.431 2.753 20 5 EFBDHN CN(Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H]1CCc2ccccc2C1 ZINC000114489987 473476623 /nfs/dbraw/zinc/47/66/23/473476623.db2.gz FZTCTWXEFJAXGV-KRWDZBQOSA-N 0 3 339.395 2.683 20 5 EFBDHN CCNc1ccc(C(=O)N2CCC[C@H]3CN(C)CC[C@H]32)cc1[N+](=O)[O-] ZINC000164068635 473476724 /nfs/dbraw/zinc/47/67/24/473476724.db2.gz WQXUAAOYSBKUNX-GOEBONIOSA-N 0 3 346.431 2.583 20 5 EFBDHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000114643909 473489007 /nfs/dbraw/zinc/48/90/07/473489007.db2.gz NJRIBBBHMLKYSQ-SFHVURJKSA-N 0 3 339.395 2.989 20 5 EFBDHN Cc1ccc([C@@H](C)NC[C@H]2CN(CC(C)C)CCO2)cc1[N+](=O)[O-] ZINC000178329814 473492493 /nfs/dbraw/zinc/49/24/93/473492493.db2.gz LRDXTICJSQMVLE-WBVHZDCISA-N 0 3 335.448 2.911 20 5 EFBDHN COCC[C@](C)(O)CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000172071702 473515090 /nfs/dbraw/zinc/51/50/90/473515090.db2.gz NQLSLCXDELCWEH-KRWDZBQOSA-N 0 3 334.372 2.732 20 5 EFBDHN COCC[C@@](C)(O)CNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000172070362 473515124 /nfs/dbraw/zinc/51/51/24/473515124.db2.gz CRFGHMPVLIYVIY-QGZVFWFLSA-N 0 3 334.372 2.732 20 5 EFBDHN Cc1c(Br)c(N[C@@H]2CCN(C)[C@H](C)C2)ncc1[N+](=O)[O-] ZINC000165794851 473516886 /nfs/dbraw/zinc/51/68/86/473516886.db2.gz UVBDHYDYMXNADP-PSASIEDQSA-N 0 3 343.225 2.955 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N[C@H]2C[C@H](C)N(C3CC3)C2)cc1[N+](=O)[O-] ZINC000126504783 473522828 /nfs/dbraw/zinc/52/28/28/473522828.db2.gz ULZUEVFEXWPSMS-YDHLFZDLSA-N 0 3 346.431 2.889 20 5 EFBDHN N[C@@H](CNC(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000152144395 473528617 /nfs/dbraw/zinc/52/86/17/473528617.db2.gz KXRDFHWUPNRJNT-KRWDZBQOSA-N 0 3 342.399 2.603 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)CCN(C)Cc1ccoc1C ZINC000178724020 473548698 /nfs/dbraw/zinc/54/86/98/473548698.db2.gz QBZMPVPUNVIHSK-UHFFFAOYSA-N 0 3 347.371 2.965 20 5 EFBDHN CC[C@@H]1CCCCN1CCNC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000172252086 473561335 /nfs/dbraw/zinc/56/13/35/473561335.db2.gz QESGHNVXDQFVTK-OAHLLOKOSA-N 0 3 334.420 2.659 20 5 EFBDHN CN(CCN(C)C1CC1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000185983287 473564986 /nfs/dbraw/zinc/56/49/86/473564986.db2.gz BJULNZVMEALLIK-UHFFFAOYSA-N 0 3 326.784 2.806 20 5 EFBDHN Cn1cc(CNC[C@@H](O)CC(C)(C)C)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000172269389 473565886 /nfs/dbraw/zinc/56/58/86/473565886.db2.gz KTHVVKNFAFUMQR-INIZCTEOSA-N 0 3 346.431 2.882 20 5 EFBDHN CN(C[C@@H]1CCCN(C)C1)C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000115442282 473570400 /nfs/dbraw/zinc/57/04/00/473570400.db2.gz OOUVFDBLCHRDBQ-LLVKDONJSA-N 0 3 325.796 2.662 20 5 EFBDHN CSc1ccc(C(=O)N(C)C[C@H]2CCCN(C)C2)cc1[N+](=O)[O-] ZINC000115442571 473571109 /nfs/dbraw/zinc/57/11/09/473571109.db2.gz LFJZXEZQQFGQFN-LBPRGKRZSA-N 0 3 337.445 2.731 20 5 EFBDHN O=C(Cc1ccccc1[N+](=O)[O-])N1CCCN(C2CCCC2)CC1 ZINC000172419888 473606539 /nfs/dbraw/zinc/60/65/39/473606539.db2.gz BLZZDIHEEICIEC-UHFFFAOYSA-N 0 3 331.416 2.614 20 5 EFBDHN CCOc1ccc([C@@H](C)N[C@@H](CCO)CSC)cc1[N+](=O)[O-] ZINC000153940554 473652524 /nfs/dbraw/zinc/65/25/24/473652524.db2.gz WAWKJYWDRKUKDI-YPMHNXCESA-N 0 3 328.434 2.758 20 5 EFBDHN CN1CCC[C@H](CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 ZINC000170977484 473658969 /nfs/dbraw/zinc/65/89/69/473658969.db2.gz GFDHAQGKFRFEGN-LLVKDONJSA-N 0 3 333.413 2.881 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCN(CC2CC2)C1 ZINC000154023871 473661170 /nfs/dbraw/zinc/66/11/70/473661170.db2.gz SQMIPSUDAKGBAZ-ZDUSSCGKSA-N 0 3 349.456 2.921 20 5 EFBDHN CC(C)CN1CCCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])s1 ZINC000154102821 473667179 /nfs/dbraw/zinc/66/71/79/473667179.db2.gz IEUYJPZRXQQFSX-GFCCVEGCSA-N 0 3 325.434 2.897 20 5 EFBDHN C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1N)[C@@H](c1ccccc1)N(C)C ZINC000186481768 473680439 /nfs/dbraw/zinc/68/04/39/473680439.db2.gz LPDRVFVCANJBLH-SJCJKPOMSA-N 0 3 342.399 2.598 20 5 EFBDHN COCCCN(C)CCNc1ccc(Br)cc1[N+](=O)[O-] ZINC000172771430 473682514 /nfs/dbraw/zinc/68/25/14/473682514.db2.gz PVXACYSLHHNAKR-UHFFFAOYSA-N 0 3 346.225 2.738 20 5 EFBDHN CCOc1ccc([C@@H](C)NCCNC(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000179395489 473684540 /nfs/dbraw/zinc/68/45/40/473684540.db2.gz XFSILSXUIFTOBH-GFCCVEGCSA-N 0 3 347.371 2.667 20 5 EFBDHN CCOc1ccc([C@@H](C)N[C@H](C)CN2CCCC2=O)cc1[N+](=O)[O-] ZINC000179405572 473685057 /nfs/dbraw/zinc/68/50/57/473685057.db2.gz KTWXVBLNKYTNDL-CHWSQXEVSA-N 0 3 335.404 2.655 20 5 EFBDHN C[C@@H]1NCCN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)[C@H]1C ZINC000262745167 473718966 /nfs/dbraw/zinc/71/89/66/473718966.db2.gz FSOYJVUJEVOTDG-QWRGUYRKSA-N 0 3 346.412 2.541 20 5 EFBDHN C[C@H]1NCCN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H]1C ZINC000262763008 473720676 /nfs/dbraw/zinc/72/06/76/473720676.db2.gz ISLKRYJPNJJHGG-MNOVXSKESA-N 0 3 346.412 2.541 20 5 EFBDHN C[C@@H]1CCCC[C@H]1N(C)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000192799225 473727870 /nfs/dbraw/zinc/72/78/70/473727870.db2.gz SWDYRKRKWBGNDM-DGCLKSJQSA-N 0 3 349.387 2.773 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CN2CCC[C@H]2c2ccncc2)c1 ZINC000245718303 473739850 /nfs/dbraw/zinc/73/98/50/473739850.db2.gz QQVGLHMLDOWVIC-AEFFLSMTSA-N 0 3 343.383 2.567 20 5 EFBDHN C[C@H](NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CCOCC1 ZINC000179870480 473745206 /nfs/dbraw/zinc/74/52/06/473745206.db2.gz KTKZHOPTSICRER-NSHDSACASA-N 0 3 332.360 2.550 20 5 EFBDHN C[C@H](NCc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CCOCC1 ZINC000179865761 473745817 /nfs/dbraw/zinc/74/58/17/473745817.db2.gz MJOAWYBURWBOKJ-NSHDSACASA-N 0 3 332.360 2.550 20 5 EFBDHN C[S@@](=O)C1(CNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000281511776 473746860 /nfs/dbraw/zinc/74/68/60/473746860.db2.gz ABOQNGMQYSOAGE-HSZRJFAPSA-N 0 3 334.397 2.856 20 5 EFBDHN CN(Cc1cccc(F)c1)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000193315889 473780938 /nfs/dbraw/zinc/78/09/38/473780938.db2.gz FBYFSVCDAVMPLB-OAHLLOKOSA-N 0 3 334.347 2.606 20 5 EFBDHN CN1CCN(CCNc2ccc([N+](=O)[O-])c3cccnc23)CC1(C)C ZINC000281686134 473806125 /nfs/dbraw/zinc/80/61/25/473806125.db2.gz RFPLSITYTWMYES-UHFFFAOYSA-N 0 3 343.431 2.581 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCN2CC[C@@H](OCc3ccncc3)C2)cc1 ZINC000287950605 473807229 /nfs/dbraw/zinc/80/72/29/473807229.db2.gz YCDXZYDJYMYDSV-GOSISDBHSA-N 0 3 343.383 2.660 20 5 EFBDHN C[C@@H](NCCN1C(=O)c2ccccc2C1=O)c1cccc([N+](=O)[O-])c1 ZINC000173357956 473815173 /nfs/dbraw/zinc/81/51/73/473815173.db2.gz BNNWJPRMKKNZND-GFCCVEGCSA-N 0 3 339.351 2.542 20 5 EFBDHN CC(C)N1CCC[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000274429914 473819753 /nfs/dbraw/zinc/81/97/53/473819753.db2.gz FSTXZLJAZUNVSU-ZDUSSCGKSA-N 0 3 339.823 2.780 20 5 EFBDHN O=C1CC[C@H]2CN(Cc3ccc([N+](=O)[O-])cc3)CC[C@@H]2N1C1CC1 ZINC000246299373 473822269 /nfs/dbraw/zinc/82/22/69/473822269.db2.gz PORRKLROZJUCOY-YOEHRIQHSA-N 0 3 329.400 2.570 20 5 EFBDHN CN1C[C@@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1=O ZINC000263754284 473833886 /nfs/dbraw/zinc/83/38/86/473833886.db2.gz PVBFFASXMUIBBC-LBPRGKRZSA-N 0 3 331.397 2.644 20 5 EFBDHN CN(C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)C1CCN(C)CC1 ZINC000194118370 473845266 /nfs/dbraw/zinc/84/52/66/473845266.db2.gz OGUMZPVJKRTDBG-UHFFFAOYSA-N 0 3 333.413 2.976 20 5 EFBDHN CN(C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H](CCO)c1ccccc1 ZINC000269632496 473849432 /nfs/dbraw/zinc/84/94/32/473849432.db2.gz FZWRZSHXYHIHPN-ROUUACIJSA-N 0 3 330.384 2.684 20 5 EFBDHN CN(C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@H](CCO)c1ccccc1 ZINC000269632493 473850752 /nfs/dbraw/zinc/85/07/52/473850752.db2.gz FZWRZSHXYHIHPN-QZTJIDSGSA-N 0 3 330.384 2.684 20 5 EFBDHN C[C@H](CCN1CCN(C)CC1)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000274513095 473857418 /nfs/dbraw/zinc/85/74/18/473857418.db2.gz VDAGYYYHKNMPDI-CQSZACIVSA-N 0 3 343.431 2.581 20 5 EFBDHN CCN1CCN(C[C@H](C)CNc2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC000269676597 473857843 /nfs/dbraw/zinc/85/78/43/473857843.db2.gz YYSGYHLYUWUXMP-GFCCVEGCSA-N 0 3 342.390 2.559 20 5 EFBDHN CC(C)N1CCC[C@H](NC(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000274532557 473865366 /nfs/dbraw/zinc/86/53/66/473865366.db2.gz UPGINMCMERVTPE-ZDUSSCGKSA-N 0 3 337.445 2.676 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H]2CCN(C)C[C@@H]21 ZINC000281880950 473869965 /nfs/dbraw/zinc/86/99/65/473869965.db2.gz GFTWLGNJWDVLDS-DOMZBBRYSA-N 0 3 348.403 2.551 20 5 EFBDHN Cc1nn(C)c(N[C@H]2CCN(Cc3ccccc3)[C@H]2C)c1[N+](=O)[O-] ZINC000288208585 473876124 /nfs/dbraw/zinc/87/61/24/473876124.db2.gz LKLYFIUVSHQXPC-ZFWWWQNUSA-N 0 3 329.404 2.712 20 5 EFBDHN CN(CCN(C)C1CC1)C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000274583790 473883789 /nfs/dbraw/zinc/88/37/89/473883789.db2.gz OZDOZJAEOQWRJP-UHFFFAOYSA-N 0 3 337.395 2.564 20 5 EFBDHN CN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000246534794 473892604 /nfs/dbraw/zinc/89/26/04/473892604.db2.gz GEUIUSQJXSJESX-XHDPSFHLSA-N 0 3 337.807 2.805 20 5 EFBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N(C)CC(C)(C)CN1CCOCC1 ZINC000269850505 473896705 /nfs/dbraw/zinc/89/67/05/473896705.db2.gz XLVSETKQPBSLBD-HNNXBMFYSA-N 0 3 335.448 2.946 20 5 EFBDHN CS[C@H]1CN(c2ncc([N+](=O)[O-])cc2Cl)C[C@@H]1N1CCCC1 ZINC000274681744 473919551 /nfs/dbraw/zinc/91/95/51/473919551.db2.gz OAMKQTYDAAENCB-STQMWFEESA-N 0 3 342.852 2.659 20 5 EFBDHN O=[N+]([O-])c1cc(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)c2c(c1)COCO2 ZINC000269936447 473924982 /nfs/dbraw/zinc/92/49/82/473924982.db2.gz OCVBHCRSKCOFDI-OIISXLGYSA-N 0 3 346.383 2.509 20 5 EFBDHN CS[C@@H]1CN(c2ccc([N+](=O)[O-])cc2F)C[C@H]1N1CCCC1 ZINC000274713172 473930570 /nfs/dbraw/zinc/93/05/70/473930570.db2.gz YSKNJVXDXUQMTQ-HUUCEWRRSA-N 0 3 325.409 2.750 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)N1C[C@H](N2CCCC2)C[C@@H]1C ZINC000288489761 473956817 /nfs/dbraw/zinc/95/68/17/473956817.db2.gz RLWVWKWAXUDZGZ-UONOGXRCSA-N 0 3 347.415 2.692 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1C(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1 ZINC000194814539 473957539 /nfs/dbraw/zinc/95/75/39/473957539.db2.gz UUYDGJPJLUWPOY-HUUCEWRRSA-N 0 3 349.431 2.522 20 5 EFBDHN C[C@H](N[C@H]1CCCC12CCOCC2)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000282146486 473960491 /nfs/dbraw/zinc/96/04/91/473960491.db2.gz SHIKMFFGTSXLSZ-BBRMVZONSA-N 0 3 347.415 2.861 20 5 EFBDHN CSc1cccc(C(=O)NCCN2CCCCCC2)c1[N+](=O)[O-] ZINC000188043656 473961179 /nfs/dbraw/zinc/96/11/79/473961179.db2.gz OJCCEZINIHEZKN-UHFFFAOYSA-N 0 3 337.445 2.923 20 5 EFBDHN Cc1cc(NC(=O)N2CC[C@@H](N3CCCCC3)C2)ccc1[N+](=O)[O-] ZINC000274812996 473969294 /nfs/dbraw/zinc/96/92/94/473969294.db2.gz NBHKRQDCHCFAHP-OAHLLOKOSA-N 0 3 332.404 2.995 20 5 EFBDHN Cc1cc(NC[C@@H]2CCCN(C(N)=O)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000288630458 474005309 /nfs/dbraw/zinc/00/53/09/474005309.db2.gz WNABQMXDVJACCS-LBPRGKRZSA-N 0 3 343.387 2.654 20 5 EFBDHN Cc1c(NC(=O)N2CC[C@@H](N3CCCCC3)C2)cccc1[N+](=O)[O-] ZINC000264525507 474023827 /nfs/dbraw/zinc/02/38/27/474023827.db2.gz XGEXHYSPWBNZPC-CQSZACIVSA-N 0 3 332.404 2.995 20 5 EFBDHN CN(C)c1ccccc1CN(C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000288764093 474044206 /nfs/dbraw/zinc/04/42/06/474044206.db2.gz HSMTWGIVJCURAK-SFHVURJKSA-N 0 3 329.400 2.826 20 5 EFBDHN CN(CCc1cccc([N+](=O)[O-])c1)C[C@@H](O)COc1ccccc1F ZINC000282381678 474045564 /nfs/dbraw/zinc/04/55/64/474045564.db2.gz GALPMIRPPQZCPT-MRXNPFEDSA-N 0 3 348.374 2.648 20 5 EFBDHN COCCN1CC[C@H](NCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000264583322 474048429 /nfs/dbraw/zinc/04/84/29/474048429.db2.gz KAWMFRGEAGXJFK-HNNXBMFYSA-N 0 3 345.399 2.665 20 5 EFBDHN COc1ccc(CNC[C@@](C)(O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000270295524 474061950 /nfs/dbraw/zinc/06/19/50/474061950.db2.gz PZOXBDMWHIXKRA-QGZVFWFLSA-N 0 3 334.347 2.740 20 5 EFBDHN C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000247148538 474075685 /nfs/dbraw/zinc/07/56/85/474075685.db2.gz ABJRHMVHGSZDGH-QMTHXVAHSA-N 0 3 325.796 2.660 20 5 EFBDHN Cn1cccc1[C@@H]1CCCN1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182043863 474087330 /nfs/dbraw/zinc/08/73/30/474087330.db2.gz MMJBCWIEZYNKSP-HOCLYGCPSA-N 0 3 345.399 2.510 20 5 EFBDHN Cc1cc(CN(C)C)cc(NC(=O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000270380836 474096484 /nfs/dbraw/zinc/09/64/84/474096484.db2.gz NLTDMNPWDVQGSZ-UHFFFAOYSA-N 0 3 343.383 2.982 20 5 EFBDHN COc1cc(C(=O)NCCN2CCCCCC2)cc([N+](=O)[O-])c1C ZINC000188483078 474107766 /nfs/dbraw/zinc/10/77/66/474107766.db2.gz LHQDTCOHGOSBCG-UHFFFAOYSA-N 0 3 335.404 2.518 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000264762332 474118771 /nfs/dbraw/zinc/11/87/71/474118771.db2.gz UKHALEIBHUSTGP-GFCCVEGCSA-N 0 3 325.796 2.852 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000264762334 474119342 /nfs/dbraw/zinc/11/93/42/474119342.db2.gz UKHALEIBHUSTGP-LBPRGKRZSA-N 0 3 325.796 2.852 20 5 EFBDHN C[C@H](O)C1CCN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000264766395 474120399 /nfs/dbraw/zinc/12/03/99/474120399.db2.gz ZNBJEPISMUSHLG-ZDUSSCGKSA-N 0 3 345.399 2.885 20 5 EFBDHN CN(C)CCN(C(=O)c1ccc(N)c([N+](=O)[O-])c1)C1CCCCC1 ZINC000264773386 474122905 /nfs/dbraw/zinc/12/29/05/474122905.db2.gz QLQCTPMLXDUTBQ-UHFFFAOYSA-N 0 3 334.420 2.514 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCCN2CCS[C@@H]3COCC[C@H]32)cc1 ZINC000247343872 474125226 /nfs/dbraw/zinc/12/52/26/474125226.db2.gz XRUKFWUCKWIURN-HZPDHXFCSA-N 0 3 338.429 2.570 20 5 EFBDHN C[C@H](NCc1cc([N+](=O)[O-])ccc1Cl)C1CCS(=O)(=O)CC1 ZINC000275299711 474135661 /nfs/dbraw/zinc/13/56/61/474135661.db2.gz HSCQINBWJVBARU-JTQLQIEISA-N 0 3 346.836 2.551 20 5 EFBDHN CC[C@H](c1ccncc1)N(C)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182292083 474143656 /nfs/dbraw/zinc/14/36/56/474143656.db2.gz IOHKXDGPZSCPAL-JKSUJKDBSA-N 0 3 345.399 2.813 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@@H]2CCCN2C[C@H]1C ZINC000247474369 474156978 /nfs/dbraw/zinc/15/69/78/474156978.db2.gz RZZCWYXMSBROOI-IPYPFGDCSA-N 0 3 349.456 2.771 20 5 EFBDHN C[C@H](NC(=O)N1CCC[C@H]2CN(C)CC[C@@H]21)c1cccc([N+](=O)[O-])c1 ZINC000182406006 474168826 /nfs/dbraw/zinc/16/88/26/474168826.db2.gz NYALQTLXRURIMD-QRTARXTBSA-N 0 3 346.431 2.782 20 5 EFBDHN Cc1ccnc(N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)c1[N+](=O)[O-] ZINC000265245244 474170429 /nfs/dbraw/zinc/17/04/29/474170429.db2.gz PRUUEAQSMSHYPX-GASCZTMLSA-N 0 3 348.447 2.624 20 5 EFBDHN CN(CCC(N)=O)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000289190882 474178193 /nfs/dbraw/zinc/17/81/93/474178193.db2.gz AUCIZLWHLMDAIL-UHFFFAOYSA-N 0 3 337.763 2.815 20 5 EFBDHN C[C@@H]1CN(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)[C@H]2CCCC[C@H]12 ZINC000182501985 474191504 /nfs/dbraw/zinc/19/15/04/474191504.db2.gz SOVYYXCVYHLGIG-QBIMZIAESA-N 0 3 343.427 2.994 20 5 EFBDHN O=[N+]([O-])c1cnc(N[C@@H]2CCN3CCCC[C@@H]23)c(Br)c1 ZINC000223863131 474191792 /nfs/dbraw/zinc/19/17/92/474191792.db2.gz GUZWNNRFQLMBRR-NEPJUHHUSA-N 0 3 341.209 2.791 20 5 EFBDHN COc1cc(C(=O)Nc2ccccc2CCN(C)C)ccc1[N+](=O)[O-] ZINC000275478184 474200940 /nfs/dbraw/zinc/20/09/40/474200940.db2.gz BOOZABSEWHRZEA-UHFFFAOYSA-N 0 3 343.383 2.960 20 5 EFBDHN Cc1ccc([C@@H]2CCCCN2C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000247703274 474202156 /nfs/dbraw/zinc/20/21/56/474202156.db2.gz YILLCPAKJSJRLD-MSOLQXFVSA-N 0 3 344.415 2.688 20 5 EFBDHN Cc1cccc(N2CCC(N3CCN(C(C)C)CC3)CC2)c1[N+](=O)[O-] ZINC000275503875 474213026 /nfs/dbraw/zinc/21/30/26/474213026.db2.gz STSQUIYYVPGVFI-UHFFFAOYSA-N 0 3 346.475 2.898 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)ccc1CN1CCN(C2CCOCC2)CC1 ZINC000175465277 474226643 /nfs/dbraw/zinc/22/66/43/474226643.db2.gz OIBRRNPWMHDUOS-UHFFFAOYSA-N 0 3 339.823 2.545 20 5 EFBDHN CCN1CCCN([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000265502511 474236816 /nfs/dbraw/zinc/23/68/16/474236816.db2.gz PRXZZSARRRVWLW-CYBMUJFWSA-N 0 3 345.403 2.733 20 5 EFBDHN COc1cc(CNCCCc2nccs2)c([N+](=O)[O-])cc1OC ZINC000265503575 474237068 /nfs/dbraw/zinc/23/70/68/474237068.db2.gz DOMQNMGNPHVGTI-UHFFFAOYSA-N 0 3 337.401 2.791 20 5 EFBDHN CN(C)CCc1ccccc1NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000275597504 474246711 /nfs/dbraw/zinc/24/67/11/474246711.db2.gz GMZUXPQEQOTYFK-UHFFFAOYSA-N 0 3 327.384 2.880 20 5 EFBDHN Cc1c(Br)c(N[C@H]2CCN(C)[C@@H](C)C2)ncc1[N+](=O)[O-] ZINC000228016415 474248071 /nfs/dbraw/zinc/24/80/71/474248071.db2.gz UVBDHYDYMXNADP-WPRPVWTQSA-N 0 3 343.225 2.955 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)c1 ZINC000282947029 474250095 /nfs/dbraw/zinc/25/00/95/474250095.db2.gz YWJLHNIZTJAAEL-BBRMVZONSA-N 0 3 347.415 2.550 20 5 EFBDHN C[C@@H]1C[C@@H](N(C)c2c([N+](=O)[O-])ncn2C)CCN1Cc1ccccc1 ZINC000265624418 474271702 /nfs/dbraw/zinc/27/17/02/474271702.db2.gz YMESTFKSJKOAKB-ZBFHGGJFSA-N 0 3 343.431 2.818 20 5 EFBDHN CN(C)CCN(Cc1cccs1)C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000175662040 474276905 /nfs/dbraw/zinc/27/69/05/474276905.db2.gz NBWIDGMURZOELP-UHFFFAOYSA-N 0 3 347.440 2.789 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)NCCN2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000175782100 474307688 /nfs/dbraw/zinc/30/76/88/474307688.db2.gz LFYWCEAAMBALCY-ZFWWWQNUSA-N 0 3 348.447 2.995 20 5 EFBDHN C[C@@H]1CN(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)[C@@H]2CCCC[C@@H]21 ZINC000248437617 474322213 /nfs/dbraw/zinc/32/22/13/474322213.db2.gz SOVYYXCVYHLGIG-MZMPZRCHSA-N 0 3 343.427 2.994 20 5 EFBDHN Cc1nccn1CCN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000270936311 474329088 /nfs/dbraw/zinc/32/90/88/474329088.db2.gz XSXZCYKVTFRPPV-UHFFFAOYSA-N 0 3 330.388 2.643 20 5 EFBDHN CN(CCN(C)C1CC1)C(=O)Nc1cccc([N+](=O)[O-])c1Cl ZINC000289608766 474342996 /nfs/dbraw/zinc/34/29/96/474342996.db2.gz JAPLRCZOJDBWSE-UHFFFAOYSA-N 0 3 326.784 2.806 20 5 EFBDHN Cc1cc(C(=O)Nc2ccccc2CCN(C)C)c(N)c([N+](=O)[O-])c1 ZINC000275916447 474360812 /nfs/dbraw/zinc/36/08/12/474360812.db2.gz TXAIVAUQPPBOOD-UHFFFAOYSA-N 0 3 342.399 2.842 20 5 EFBDHN CCNC(=O)[C@H](C)N[C@@H](CC)CSc1ccccc1[N+](=O)[O-] ZINC000271025873 474373765 /nfs/dbraw/zinc/37/37/65/474373765.db2.gz BDWHRVVFYUEJTQ-RYUDHWBXSA-N 0 3 325.434 2.580 20 5 EFBDHN C[C@@H](C1CCN(C)CC1)N(C)C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000271040185 474380780 /nfs/dbraw/zinc/38/07/80/474380780.db2.gz QVVIJZIHGLXJFU-AWEZNQCLSA-N 0 3 348.447 2.586 20 5 EFBDHN C[C@@H]1CN(CC(C)(C)O)CCN1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000189424589 474391984 /nfs/dbraw/zinc/39/19/84/474391984.db2.gz WIQHBWZATFCPBA-GFCCVEGCSA-N 0 3 341.839 2.525 20 5 EFBDHN CN(CCn1ccc([N+](=O)[O-])n1)Cc1ccc(C(F)(F)F)cc1 ZINC000176193370 474404841 /nfs/dbraw/zinc/40/48/41/474404841.db2.gz HJBHTNCMLURKMP-UHFFFAOYSA-N 0 3 328.294 2.942 20 5 EFBDHN CN(CCn1ccc([N+](=O)[O-])n1)Cc1ccc(OC(F)F)cc1 ZINC000176192489 474405186 /nfs/dbraw/zinc/40/51/86/474405186.db2.gz ZHDJAIZUCDYULV-UHFFFAOYSA-N 0 3 326.303 2.525 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CC[C@]3(C2)OCc2ccccc23)c1 ZINC000248694761 474406399 /nfs/dbraw/zinc/40/63/99/474406399.db2.gz JJJIGLZSMVOOQR-RTBURBONSA-N 0 3 340.379 2.760 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](C)N2CCC(C)CC2)c1 ZINC000283452972 474407047 /nfs/dbraw/zinc/40/70/47/474407047.db2.gz LAGYFCOIHODNNH-AWEZNQCLSA-N 0 3 349.431 2.844 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CCC[C@@H](c3nc4ccccc4o3)C2)n1 ZINC000176207206 474408765 /nfs/dbraw/zinc/40/87/65/474408765.db2.gz DLALLZJILXWRIY-CYBMUJFWSA-N 0 3 341.371 2.812 20 5 EFBDHN CCN(CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H]1CCOC(C)(C)C1 ZINC000289759867 474412529 /nfs/dbraw/zinc/41/25/29/474412529.db2.gz KOUFFTBOPJRWQX-ZDUSSCGKSA-N 0 3 335.404 2.813 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)[C@H](CN)c2ccccc2)cc1[N+](=O)[O-] ZINC000237499276 474418274 /nfs/dbraw/zinc/41/82/74/474418274.db2.gz RONSAWACUXLRDT-XJKSGUPXSA-N 0 3 327.384 2.823 20 5 EFBDHN C[C@H](C(=O)NCCc1ccccc1[N+](=O)[O-])[C@H](N)c1ccccc1 ZINC000237572893 474431265 /nfs/dbraw/zinc/43/12/65/474431265.db2.gz SBAZXBUPAUTNPC-GUYCJALGSA-N 0 3 327.384 2.590 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](C)N2CCC[C@H](C)C2)c1 ZINC000283578856 474441155 /nfs/dbraw/zinc/44/11/55/474441155.db2.gz WHUAWSSTYZMCOG-KBPBESRZSA-N 0 3 349.431 2.844 20 5 EFBDHN CN(Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C[C@H]1CCC[C@H]1O ZINC000271233856 474454758 /nfs/dbraw/zinc/45/47/58/474454758.db2.gz CTWKFLUGALDYDI-RHSMWYFYSA-N 0 3 344.415 2.588 20 5 EFBDHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1csc([N+](=O)[O-])c1 ZINC000248851825 474457531 /nfs/dbraw/zinc/45/75/31/474457531.db2.gz OVLHJMLXIFAOOS-SWLSCSKDSA-N 0 3 345.424 2.907 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1csc([N+](=O)[O-])c1 ZINC000248851819 474457775 /nfs/dbraw/zinc/45/77/75/474457775.db2.gz OVLHJMLXIFAOOS-IUODEOHRSA-N 0 3 345.424 2.907 20 5 EFBDHN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000289908194 474480309 /nfs/dbraw/zinc/48/03/09/474480309.db2.gz UVYCDVWHQIQWQM-HNNXBMFYSA-N 0 3 330.388 2.635 20 5 EFBDHN C[C@@H]1CN(CC2CCN(c3ccc(N)cc3[N+](=O)[O-])CC2)C[C@@H](C)O1 ZINC000283738241 474482900 /nfs/dbraw/zinc/48/29/00/474482900.db2.gz ITBZGCJDUCWARJ-ZIAGYGMSSA-N 0 3 348.447 2.503 20 5 EFBDHN C[C@H](N[C@@H]1CCC[C@@H](S(C)(=O)=O)C1)c1cccc([N+](=O)[O-])c1 ZINC000266792409 474484334 /nfs/dbraw/zinc/48/43/34/474484334.db2.gz PQPHDYXDOAKIJG-NJZAAPMLSA-N 0 3 326.418 2.601 20 5 EFBDHN CS[C@@H]1CN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)C[C@@H]1N(C)C ZINC000271308063 474486415 /nfs/dbraw/zinc/48/64/15/474486415.db2.gz IAVFRLBCPZUFOA-WCQYABFASA-N 0 3 347.387 2.678 20 5 EFBDHN N[C@H](CC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC000237843970 474487191 /nfs/dbraw/zinc/48/71/91/474487191.db2.gz GKILFNBQTOLTCM-QGZVFWFLSA-N 0 3 325.368 2.570 20 5 EFBDHN CN(C(=O)c1ccc([N+](=O)[O-])[nH]1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000266824385 474493772 /nfs/dbraw/zinc/49/37/72/474493772.db2.gz WNPRSFJAMAMPCD-HNNXBMFYSA-N 0 3 342.399 2.660 20 5 EFBDHN COc1ccc([C@@H](CN(C)C)NCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000283804675 474499445 /nfs/dbraw/zinc/49/94/45/474499445.db2.gz AYVSLDZWAVNGJW-GOSISDBHSA-N 0 3 329.400 2.996 20 5 EFBDHN O=[N+]([O-])c1ccc(CCN2CCCN(Cc3cscn3)CC2)cc1 ZINC000608977484 480107865 /nfs/dbraw/zinc/10/78/65/480107865.db2.gz NPADKLMSOZFHTP-UHFFFAOYSA-N 0 3 346.456 2.802 20 5 EFBDHN CC(C)CN1CCO[C@@H](CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000248997798 474502917 /nfs/dbraw/zinc/50/29/17/474502917.db2.gz PKWKVCIVIAJYOG-HKUYNNGSSA-N 0 3 347.459 2.919 20 5 EFBDHN COc1ccc(CC(=O)NC[C@@H](C)N2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000609011273 480108548 /nfs/dbraw/zinc/10/85/48/480108548.db2.gz MNFTWVLAPPHGFX-ZIAGYGMSSA-N 0 3 349.431 2.525 20 5 EFBDHN Cc1c(C(=O)NC2CCN(CCOC(C)C)CC2)cccc1[N+](=O)[O-] ZINC000176686216 474516811 /nfs/dbraw/zinc/51/68/11/474516811.db2.gz DCBPVZOPOYJKAW-UHFFFAOYSA-N 0 3 349.431 2.522 20 5 EFBDHN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CC[C@H]2CCN(C)C[C@@H]21 ZINC000276383640 474520594 /nfs/dbraw/zinc/52/05/94/474520594.db2.gz GXJOEEGBJVGYEF-CJNGLKHVSA-N 0 3 332.404 2.770 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)N2CC[C@H]3CC[C@@H](C2)N3C)cc1[N+](=O)[O-] ZINC000176749419 474524448 /nfs/dbraw/zinc/52/44/48/474524448.db2.gz AMUIEFMMCSRLDY-BMFZPTHFSA-N 0 3 346.431 2.842 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2ccc(CNC[C@]3(O)CCSC3)o2)c1 ZINC000176752919 474525024 /nfs/dbraw/zinc/52/50/24/474525024.db2.gz CDFCJTXRAXPTDW-MRXNPFEDSA-N 0 3 334.397 2.812 20 5 EFBDHN CSc1cccc(C(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)c1[N+](=O)[O-] ZINC000249131772 474534674 /nfs/dbraw/zinc/53/46/74/474534674.db2.gz LTJCLVVHMIKODL-JSGCOSHPSA-N 0 3 349.456 2.873 20 5 EFBDHN O=C(c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N1CCCNCC1 ZINC000238170247 474539306 /nfs/dbraw/zinc/53/93/06/474539306.db2.gz PNRFWILULXGBLF-UHFFFAOYSA-N 0 3 341.367 2.823 20 5 EFBDHN C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)N[C@@H]1CCCc2c[nH]nc21 ZINC000271432788 474544626 /nfs/dbraw/zinc/54/46/26/474544626.db2.gz BHINKUBQSLWRKM-IAQYHMDHSA-N 0 3 343.387 2.702 20 5 EFBDHN C[C@@H](CO)N(Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCCC1 ZINC000276471412 474555852 /nfs/dbraw/zinc/55/58/52/474555852.db2.gz QLHXEFLCRWSUFC-LBPRGKRZSA-N 0 3 346.387 2.770 20 5 EFBDHN Cn1cccc1[C@H]1CCCN1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000249330239 474558477 /nfs/dbraw/zinc/55/84/77/474558477.db2.gz OTZKATLGKXCUDX-CRAIPNDOSA-N 0 3 345.399 2.510 20 5 EFBDHN CC(C)OCCN1CCC(Nc2ncc([N+](=O)[O-])cc2Cl)CC1 ZINC000267012586 474565393 /nfs/dbraw/zinc/56/53/93/474565393.db2.gz HCBMBNVEAXLOLD-UHFFFAOYSA-N 0 3 342.827 2.945 20 5 EFBDHN CC[C@H](N[C@@H]1CCC[C@@H](S(C)(=O)=O)C1)c1cccc([N+](=O)[O-])c1 ZINC000271506500 474573938 /nfs/dbraw/zinc/57/39/38/474573938.db2.gz NYOJOLONMJMHMJ-BMFZPTHFSA-N 0 3 340.445 2.991 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@H](N2CCCC2)C1 ZINC000184726561 474595694 /nfs/dbraw/zinc/59/56/94/474595694.db2.gz YNUFVKBYAWQNNL-SJLPKXTDSA-N 0 3 345.443 2.860 20 5 EFBDHN C[C@@H](CN1CCC[C@H](C)C1)NC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000249756815 474611963 /nfs/dbraw/zinc/61/19/63/474611963.db2.gz DOGNFRHJNUSRNZ-GJZGRUSLSA-N 0 3 348.447 2.857 20 5 EFBDHN CCNC(=O)C[C@H]1CCCCN1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000284295362 474612719 /nfs/dbraw/zinc/61/27/19/474612719.db2.gz BGSOMEBESVXPCR-MNDMWVCDSA-N 0 3 331.416 2.989 20 5 EFBDHN C[C@@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000249760305 474613303 /nfs/dbraw/zinc/61/33/03/474613303.db2.gz XFZANVFTLJAGIJ-UPJWGTAASA-N 0 3 337.395 2.830 20 5 EFBDHN CN(C)CCNc1cc(C(F)(F)C(F)(F)F)ncc1[N+](=O)[O-] ZINC000278367582 474624062 /nfs/dbraw/zinc/62/40/62/474624062.db2.gz DGXLWSDBQYAFLP-UHFFFAOYSA-N 0 3 328.241 2.617 20 5 EFBDHN Cc1cc([N+](=O)[O-])cc(C(=O)N2CCC[C@H]3CN(C)CC[C@H]32)c1F ZINC000284365371 474628445 /nfs/dbraw/zinc/62/84/45/474628445.db2.gz ZMAVYCBHSGJRSE-SWLSCSKDSA-N 0 3 335.379 2.599 20 5 EFBDHN O=[N+]([O-])c1cnc(NC2CCN(C3CC3)CC2)c(Br)c1 ZINC000267279435 474635945 /nfs/dbraw/zinc/63/59/45/474635945.db2.gz UZAZAOVUNJUSTN-UHFFFAOYSA-N 0 3 341.209 2.791 20 5 EFBDHN C[C@H](NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)C1=CCN(C)CC1 ZINC000272957023 474650317 /nfs/dbraw/zinc/65/03/17/474650317.db2.gz NDGXUKOWYGBOPG-STQMWFEESA-N 0 3 349.456 2.842 20 5 EFBDHN Cn1nccc1N1CCC[C@H](NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000278500617 474663068 /nfs/dbraw/zinc/66/30/68/474663068.db2.gz NVACXCAZWVHJAL-ZDUSSCGKSA-N 0 3 349.822 2.740 20 5 EFBDHN CCN1CCC[C@@H]1CNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-] ZINC000291747352 474666570 /nfs/dbraw/zinc/66/65/70/474666570.db2.gz NOPSUOMKCQDEDH-CQSZACIVSA-N 0 3 334.420 2.629 20 5 EFBDHN CN1CC[C@@]2(CCN(C(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)C2)C1 ZINC000292856087 474676953 /nfs/dbraw/zinc/67/69/53/474676953.db2.gz ROUIHPFYOCKROF-OAHLLOKOSA-N 0 3 338.795 2.808 20 5 EFBDHN CN(C)CCOc1ccc(CCNc2cccnc2[N+](=O)[O-])cc1 ZINC000609150078 480119572 /nfs/dbraw/zinc/11/95/72/480119572.db2.gz IVUZICXXCCODQC-UHFFFAOYSA-N 0 3 330.388 2.585 20 5 EFBDHN COc1cc(CNC[C@H]2CCCCS2)c([N+](=O)[O-])cc1OC ZINC000344370840 474695359 /nfs/dbraw/zinc/69/53/59/474695359.db2.gz YWIOZTKUYHLQBR-GFCCVEGCSA-N 0 3 326.418 2.987 20 5 EFBDHN CO[C@]1(C)C[C@@H](N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1(C)C ZINC000340830556 474698257 /nfs/dbraw/zinc/69/82/57/474698257.db2.gz ZKSNUBGOHUIWSK-JDSLSITLSA-N 0 3 335.404 2.715 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1CC[C@@]2(C1)CCCN(C)C2 ZINC000292900760 474704950 /nfs/dbraw/zinc/70/49/50/474704950.db2.gz WQWZLAOUBKTYJF-SFHVURJKSA-N 0 3 347.415 2.612 20 5 EFBDHN COc1cc(C(=O)NC[C@H](C)N2CCC[C@@H](C)C2)cc([N+](=O)[O-])c1C ZINC000253282449 474719743 /nfs/dbraw/zinc/71/97/43/474719743.db2.gz ZLCYDHMTHXIKDR-OLZOCXBDSA-N 0 3 349.431 2.762 20 5 EFBDHN CN(Cc1ccccc1)C[C@H](O)COc1ccc(F)cc1[N+](=O)[O-] ZINC000305301758 474730074 /nfs/dbraw/zinc/73/00/74/474730074.db2.gz JSFAMNNZLGSZIA-HNNXBMFYSA-N 0 3 334.347 2.606 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)CN1C1CC1 ZINC000267976839 474733256 /nfs/dbraw/zinc/73/32/56/474733256.db2.gz NRXQGBHDXNABHZ-GXTWGEPZSA-N 0 3 331.416 2.614 20 5 EFBDHN C[C@@H]1C[C@H](NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)CN1C1CC1 ZINC000267976843 474733739 /nfs/dbraw/zinc/73/37/39/474733739.db2.gz NRXQGBHDXNABHZ-OCCSQVGLSA-N 0 3 331.416 2.614 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@@H](CO)CN2CCCCC2)cc1C(F)(F)F ZINC000253431873 474756439 /nfs/dbraw/zinc/75/64/39/474756439.db2.gz YASIPMVOASGDCI-GFCCVEGCSA-N 0 3 347.337 2.872 20 5 EFBDHN CC(C)(O)[C@@H]1CCCN1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000305753028 474767242 /nfs/dbraw/zinc/76/72/42/474767242.db2.gz UCSVPGBWABWFTQ-HNNXBMFYSA-N 0 3 331.372 2.985 20 5 EFBDHN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)C12CCCN1CCC2 ZINC000278679572 474771937 /nfs/dbraw/zinc/77/19/37/474771937.db2.gz QHWSKSYZJDXEBD-UHFFFAOYSA-N 0 3 337.807 2.835 20 5 EFBDHN CCN(CCNC(=O)NCc1cc([N+](=O)[O-])ccc1Cl)C1CC1 ZINC000268076042 474785194 /nfs/dbraw/zinc/78/51/94/474785194.db2.gz BSZFLDYULBXCHT-UHFFFAOYSA-N 0 3 340.811 2.532 20 5 EFBDHN O=[N+]([O-])c1ccc(NCc2ccccc2CN2CC[C@H](O)C2)c(F)c1 ZINC000273233579 474792414 /nfs/dbraw/zinc/79/24/14/474792414.db2.gz SDTHVFPGXVBFEE-INIZCTEOSA-N 0 3 345.374 2.913 20 5 EFBDHN CN(C)CCN(Cc1ccco1)C(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000255063315 474797056 /nfs/dbraw/zinc/79/70/56/474797056.db2.gz YEMRJOIXMHMQGA-YFHOEESVSA-N 0 3 343.383 2.791 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CNCCC(=O)N1CCCCC1 ZINC000344834965 474798831 /nfs/dbraw/zinc/79/88/31/474798831.db2.gz QLVDIOBHHHMQHN-NTCAYCPXSA-N 0 3 331.416 2.990 20 5 EFBDHN C[C@]1(CNc2ncc([N+](=O)[O-])cn2)CCN(Cc2ccccc2)C1 ZINC000310330795 474827142 /nfs/dbraw/zinc/82/71/42/474827142.db2.gz ADZJBRQEICAHCA-QGZVFWFLSA-N 0 3 327.388 2.709 20 5 EFBDHN CN(C)CCOc1cccc(NC(=O)c2ccc([N+](=O)[O-])s2)c1 ZINC000337253530 474828681 /nfs/dbraw/zinc/82/86/81/474828681.db2.gz LUCGQWIELMLTNG-UHFFFAOYSA-N 0 3 335.385 2.849 20 5 EFBDHN COCCn1cc(CNC/C(C)=C/c2cccc([N+](=O)[O-])c2)cn1 ZINC000337258788 474835047 /nfs/dbraw/zinc/83/50/47/474835047.db2.gz ORQAKDPPILUPBY-RIYZIHGNSA-N 0 3 330.388 2.631 20 5 EFBDHN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@H](C1CC1)N1CCCC1 ZINC000345037188 474836233 /nfs/dbraw/zinc/83/62/33/474836233.db2.gz PSRODTUZPMJLSS-HNNXBMFYSA-N 0 3 337.807 2.739 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N2CC[C@@]3(CCN(C)C3)C2)cc1[N+](=O)[O-] ZINC000293153077 474842010 /nfs/dbraw/zinc/84/20/10/474842010.db2.gz BYKYGPCIKGKSDR-KBXCAEBGSA-N 0 3 346.431 2.701 20 5 EFBDHN COC(=O)C1=C(C)O[C@@H](CNC(C)(C)c2ccccc2[N+](=O)[O-])C1 ZINC000292108395 474851654 /nfs/dbraw/zinc/85/16/54/474851654.db2.gz IRDHUXQWKAJELN-GFCCVEGCSA-N 0 3 334.372 2.655 20 5 EFBDHN CN(C)Cc1cccc(CNC(=O)/C=C\c2cccc([N+](=O)[O-])c2)c1 ZINC000255499544 474861522 /nfs/dbraw/zinc/86/15/22/474861522.db2.gz WOBKQBGBMURKTC-KTKRTIGZSA-N 0 3 339.395 2.986 20 5 EFBDHN CN(CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C1(CO)CCC1 ZINC000292146138 474873096 /nfs/dbraw/zinc/87/30/96/474873096.db2.gz NAOABZSZKFMUIX-UHFFFAOYSA-N 0 3 331.372 2.639 20 5 EFBDHN C[C@H](CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-])N1CCCC[C@@H]1C ZINC000337336236 474909759 /nfs/dbraw/zinc/90/97/59/474909759.db2.gz LXHUOMQVEMSJDS-LSDHHAIUSA-N 0 3 348.447 2.999 20 5 EFBDHN CN(CCOc1ccccc1[N+](=O)[O-])C[C@@H](O)Cc1ccccc1 ZINC000293296006 474914266 /nfs/dbraw/zinc/91/42/66/474914266.db2.gz KNEVACYOEDOVLP-INIZCTEOSA-N 0 3 330.384 2.509 20 5 EFBDHN CC1(C)CCC[C@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000273467396 474914307 /nfs/dbraw/zinc/91/43/07/474914307.db2.gz RJPRNGCVAVWATG-ZDUSSCGKSA-N 0 3 340.445 2.927 20 5 EFBDHN CS[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2C)C[C@H]1N1CCCC1 ZINC000273475195 474919044 /nfs/dbraw/zinc/91/90/44/474919044.db2.gz HQVXVVMCWWBZGH-CVEARBPZSA-N 0 3 349.456 2.555 20 5 EFBDHN NC(=O)[C@H](Cc1ccccc1)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000273504249 474934803 /nfs/dbraw/zinc/93/48/03/474934803.db2.gz PRGXNKNMUSPGCD-SFHVURJKSA-N 0 3 341.411 2.604 20 5 EFBDHN C[C@@H](CNC(=O)NC(C)(C)c1ccccc1[N+](=O)[O-])N(C)C1CC1 ZINC000292283384 474939925 /nfs/dbraw/zinc/93/99/25/474939925.db2.gz MMRHSVKSADXYJT-LBPRGKRZSA-N 0 3 334.420 2.612 20 5 EFBDHN O=[N+]([O-])c1cnc(NC[C@H]2CCCN(Cc3cccs3)C2)nc1 ZINC000273580324 474974350 /nfs/dbraw/zinc/97/43/50/474974350.db2.gz FQIFFJYWOBPRHV-GFCCVEGCSA-N 0 3 333.417 2.770 20 5 EFBDHN O=C(CN(C1CCC1)C1CCC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000292351479 474977130 /nfs/dbraw/zinc/97/71/30/474977130.db2.gz HKJQJAPUJHGBMA-UHFFFAOYSA-N 0 3 329.400 2.891 20 5 EFBDHN CCCCN(C)C[C@@H](C)Nc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000341111187 474986126 /nfs/dbraw/zinc/98/61/26/474986126.db2.gz DLAXGUSAQYRFOZ-GFCCVEGCSA-N 0 3 343.449 2.531 20 5 EFBDHN CC(C)c1ccc(C(=O)N2CC[C@]3(CCN(C)C3)C2)cc1[N+](=O)[O-] ZINC000292398569 475004957 /nfs/dbraw/zinc/00/49/57/475004957.db2.gz SWSYKAANHNHQIU-SFHVURJKSA-N 0 3 331.416 2.886 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)CN(C1CCC1)C1CCC1 ZINC000292439414 475028288 /nfs/dbraw/zinc/02/82/88/475028288.db2.gz OGXGTQXMSUYRLM-UHFFFAOYSA-N 0 3 333.388 2.949 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCN1CCCC[C@H]1c1ccccc1 ZINC000273839843 475076280 /nfs/dbraw/zinc/07/62/80/475076280.db2.gz JFUQJBQYGXRGKP-KRWDZBQOSA-N 0 3 327.384 2.984 20 5 EFBDHN COC[C@@H](O)CN[C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000268965110 475099646 /nfs/dbraw/zinc/09/96/46/475099646.db2.gz YOIHUTNWXSIGJV-NEPJUHHUSA-N 0 3 336.413 2.981 20 5 EFBDHN C[C@@H]1C[C@@H](NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)CN1C1CC1 ZINC000273889499 475102990 /nfs/dbraw/zinc/10/29/90/475102990.db2.gz VDDNCWGDTLQAOY-VXGBXAGGSA-N 0 3 349.406 2.753 20 5 EFBDHN CNC(=O)[C@@]1(C)CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000281217787 475120282 /nfs/dbraw/zinc/12/02/82/475120282.db2.gz UTKGZVBYGNVFRN-SFHVURJKSA-N 0 3 343.383 2.813 20 5 EFBDHN COc1cc(CN[C@@H]2CCOC3(CCC3)C2)c([N+](=O)[O-])cc1OC ZINC000268999173 475120949 /nfs/dbraw/zinc/12/09/49/475120949.db2.gz ZAFWRNXYVQJHNL-CYBMUJFWSA-N 0 3 336.388 2.803 20 5 EFBDHN CCc1ccc([C@@H](CNC(=O)c2ccc([N+](=O)[O-])n2C)N(C)C)cc1 ZINC000345364114 475128948 /nfs/dbraw/zinc/12/89/48/475128948.db2.gz YNIIQIXJAABPLG-MRXNPFEDSA-N 0 3 344.415 2.528 20 5 EFBDHN CN(CCC1CCN(c2ccncc2)CC1)c1ncc([N+](=O)[O-])cn1 ZINC000273999558 475158078 /nfs/dbraw/zinc/15/80/78/475158078.db2.gz STZGZWLYZZGWQC-UHFFFAOYSA-N 0 3 342.403 2.523 20 5 EFBDHN CC[C@@H](C)N1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000296007595 475163793 /nfs/dbraw/zinc/16/37/93/475163793.db2.gz LBSPKKNEIBPBOL-OAHLLOKOSA-N 0 3 348.447 2.648 20 5 EFBDHN C[C@@H](N[C@H]1CCCN(C(=O)N2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000287495646 475170958 /nfs/dbraw/zinc/17/09/58/475170958.db2.gz NMVBWAQSXBXQJE-ZBFHGGJFSA-N 0 3 346.431 2.926 20 5 EFBDHN Cc1ccccc1CN(CCn1cc([N+](=O)[O-])ccc1=O)C1CC1 ZINC000341623303 475191220 /nfs/dbraw/zinc/19/12/20/475191220.db2.gz SETNBGRZSHNDBA-UHFFFAOYSA-N 0 3 327.384 2.730 20 5 EFBDHN CN(C)C1(CN(C)C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCC1 ZINC000296087678 475191663 /nfs/dbraw/zinc/19/16/63/475191663.db2.gz WJDFTCYIGWLODG-UHFFFAOYSA-N 0 3 347.415 2.500 20 5 EFBDHN Cc1ccc(NC(=O)N2CC[C@]3(C2)CCCN(C)C3)cc1[N+](=O)[O-] ZINC000296229207 475230877 /nfs/dbraw/zinc/23/08/77/475230877.db2.gz PFYWBWMUTGZHDM-QGZVFWFLSA-N 0 3 332.404 2.853 20 5 EFBDHN C[C@@H](C(=O)NC[C@@H]1CCCCN1C1CC1)c1ccc([N+](=O)[O-])cc1F ZINC000347328432 475235216 /nfs/dbraw/zinc/23/52/16/475235216.db2.gz AHUWBESNACVISU-DOMZBBRYSA-N 0 3 349.406 2.971 20 5 EFBDHN CCO[C@H]1C[C@H](N(C)CCn2ccc([N+](=O)[O-])n2)C12CCCCC2 ZINC000357904918 475249844 /nfs/dbraw/zinc/24/98/44/475249844.db2.gz BNQVIFRCBQOIQY-GJZGRUSLSA-N 0 3 336.436 2.851 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CCC(Cc3ccc(F)cc3)CC2)n1 ZINC000357913865 475256152 /nfs/dbraw/zinc/25/61/52/475256152.db2.gz OJCIRLVOCURXTR-UHFFFAOYSA-N 0 3 332.379 2.885 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(C)CC[C@H]1C ZINC000361197753 475263307 /nfs/dbraw/zinc/26/33/07/475263307.db2.gz AHRLJDBZJRTNTA-GDBMZVCRSA-N 0 3 333.432 2.716 20 5 EFBDHN C[C@@H](NC(=O)c1ccc([N+](=O)[O-])c2cccnc12)C1=CCN(C)CC1 ZINC000357922722 475264999 /nfs/dbraw/zinc/26/49/99/475264999.db2.gz TWCUVKCIXUQYPP-GFCCVEGCSA-N 0 3 340.383 2.523 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC(CCC(N)=O)CC1 ZINC000347360068 475265070 /nfs/dbraw/zinc/26/50/70/475265070.db2.gz NVBZVTHNOMILEK-SDNWHVSQSA-N 0 3 331.416 2.976 20 5 EFBDHN CNc1c(C(=O)N2CCCN(C3CCCC3)CC2)cccc1[N+](=O)[O-] ZINC000361206403 475269086 /nfs/dbraw/zinc/26/90/86/475269086.db2.gz YPIBLEDAGOWOBD-UHFFFAOYSA-N 0 3 346.431 2.727 20 5 EFBDHN CN(C)CCN(Cc1cccc(Cl)c1)c1ncc([N+](=O)[O-])cn1 ZINC000354586596 475270957 /nfs/dbraw/zinc/27/09/57/475270957.db2.gz LVTACTLOKZTERJ-UHFFFAOYSA-N 0 3 335.795 2.606 20 5 EFBDHN C[C@@H](CN1CCCCC1)NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000345601994 475297593 /nfs/dbraw/zinc/29/75/93/475297593.db2.gz XGNFMVSOARXZTM-AWEZNQCLSA-N 0 3 344.415 2.540 20 5 EFBDHN Cc1nc(N[C@H]2CCCN(Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000296485442 475337250 /nfs/dbraw/zinc/33/72/50/475337250.db2.gz KRJUNQXYLIVQQO-HNNXBMFYSA-N 0 3 327.388 2.770 20 5 EFBDHN CCO[C@@H]1C[C@@H](N[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C12CCC2 ZINC000296504699 475346474 /nfs/dbraw/zinc/34/64/74/475346474.db2.gz ZIEOBKUZROULPS-APHBMKBZSA-N 0 3 347.415 2.859 20 5 EFBDHN COCC[C@@H](N[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)C(C)(C)C ZINC000337836728 475364880 /nfs/dbraw/zinc/36/48/80/475364880.db2.gz CMRLEIRAUOAGCT-JKSUJKDBSA-N 0 3 349.431 2.741 20 5 EFBDHN COCC[C@H](N[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)C(C)(C)C ZINC000337836722 475364986 /nfs/dbraw/zinc/36/49/86/475364986.db2.gz CMRLEIRAUOAGCT-CVEARBPZSA-N 0 3 349.431 2.741 20 5 EFBDHN COCC[C@H](N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000337845450 475372346 /nfs/dbraw/zinc/37/23/46/475372346.db2.gz HBWNPHWQCCSBJJ-WFASDCNBSA-N 0 3 337.420 2.963 20 5 EFBDHN COCC[C@H](N[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)C(C)(C)C ZINC000337853047 475378729 /nfs/dbraw/zinc/37/87/29/475378729.db2.gz KBEUZJIXWLFQAJ-DOMZBBRYSA-N 0 3 337.420 2.963 20 5 EFBDHN C[C@H](NC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)C1=CCN(C)CC1 ZINC000358087239 475387406 /nfs/dbraw/zinc/38/74/06/475387406.db2.gz CUWVYGBNKJJIFS-ZDUSSCGKSA-N 0 3 346.431 2.780 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CNC1CCC(NC(C)=O)CC1 ZINC000337866469 475390034 /nfs/dbraw/zinc/39/00/34/475390034.db2.gz OZVHEBMOBTUKLZ-UHFFFAOYSA-N 0 3 335.404 2.530 20 5 EFBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H](C(=O)N2CCCC2)C1 ZINC000331737979 475398546 /nfs/dbraw/zinc/39/85/46/475398546.db2.gz USPGGZRYWCIJFG-LSDHHAIUSA-N 0 3 331.416 2.990 20 5 EFBDHN Cc1cc(N2CCN(C)CC[C@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000339684315 475407449 /nfs/dbraw/zinc/40/74/49/475407449.db2.gz USYSAGUPTPXPNX-CQSZACIVSA-N 0 3 341.415 2.891 20 5 EFBDHN C[C@H]1[C@@H](NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)CCCN1C ZINC000345740976 475409879 /nfs/dbraw/zinc/40/98/79/475409879.db2.gz HXTQSOYNRIATNU-BBRMVZONSA-N 0 3 346.431 2.752 20 5 EFBDHN C[C@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCCOC1 ZINC000348140345 475420487 /nfs/dbraw/zinc/42/04/87/475420487.db2.gz BBHVWTOZGYHIIU-WDEREUQCSA-N 0 3 341.795 2.591 20 5 EFBDHN CCOc1ccc([C@@H](C)NCCC(=O)NC(C)(C)C)cc1[N+](=O)[O-] ZINC000358132764 475427859 /nfs/dbraw/zinc/42/78/59/475427859.db2.gz OKPZLMQSXWENNU-GFCCVEGCSA-N 0 3 337.420 2.949 20 5 EFBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCCN(C)[C@H]1C ZINC000345778191 475443685 /nfs/dbraw/zinc/44/36/85/475443685.db2.gz LEOMHAFAWVTKMK-YOEHRIQHSA-N 0 3 348.447 2.998 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC1(CN(C)C)CCC1 ZINC000341955748 475448455 /nfs/dbraw/zinc/44/84/55/475448455.db2.gz ZGRFDASUNWFHCP-OAHLLOKOSA-N 0 3 333.432 2.764 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@H](C(C)C)C1(CO)CCC1 ZINC000339732188 475450807 /nfs/dbraw/zinc/45/08/07/475450807.db2.gz ZDQRKUVTAOQLKF-QGZVFWFLSA-N 0 3 349.431 2.619 20 5 EFBDHN Cc1cc(Cl)c(C(=O)N2CC[C@@H]3CCN(C)C[C@@H]32)cc1[N+](=O)[O-] ZINC000296791800 475478666 /nfs/dbraw/zinc/47/86/66/475478666.db2.gz OFKHLBYHGIZMLG-NHYWBVRUSA-N 0 3 337.807 2.723 20 5 EFBDHN CNC(=O)[C@H]1CCC[C@@H]1NCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000345828291 475487801 /nfs/dbraw/zinc/48/78/01/475487801.db2.gz IYIWRSIVVMEIRC-ZFWWWQNUSA-N 0 3 343.383 2.859 20 5 EFBDHN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](C)N(C)C ZINC000342002135 475496034 /nfs/dbraw/zinc/49/60/34/475496034.db2.gz DQQYTWCHNSZCOW-NSHDSACASA-N 0 3 325.434 2.775 20 5 EFBDHN CS[C@H]1CN(C(=O)c2cc(C)ccc2[N+](=O)[O-])C[C@@H]1N1CCCC1 ZINC000332070169 475500596 /nfs/dbraw/zinc/50/05/96/475500596.db2.gz BMMODXNMCKQEDI-HOTGVXAUSA-N 0 3 349.456 2.555 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1C[C@@H](N2CCCC2)C[C@H]1C ZINC000332083667 475504207 /nfs/dbraw/zinc/50/42/07/475504207.db2.gz PBAZGGIMQLZDIG-CABCVRRESA-N 0 3 331.416 2.910 20 5 EFBDHN Cn1nccc1[C@H]1CCCN(CCOc2ccccc2[N+](=O)[O-])C1 ZINC000338026626 475519197 /nfs/dbraw/zinc/51/91/97/475519197.db2.gz DUSLEUPRGORTOD-AWEZNQCLSA-N 0 3 330.388 2.587 20 5 EFBDHN Cc1cccc(C(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@@H](C)C2)c1[N+](=O)[O-] ZINC000346160226 475566687 /nfs/dbraw/zinc/56/66/87/475566687.db2.gz FEOFWTABEPXWCJ-IVMMDQJWSA-N 0 3 331.416 2.706 20 5 EFBDHN CC(C)[C@H](CN(C)Cc1ccccc1)NCc1c([N+](=O)[O-])ncn1C ZINC000348306068 475580255 /nfs/dbraw/zinc/58/02/55/475580255.db2.gz WWSZLQMLWYTRGB-INIZCTEOSA-N 0 3 345.447 2.575 20 5 EFBDHN CC(C)(NC[C@H](O)COc1ccccc1[N+](=O)[O-])c1cccs1 ZINC000348356928 475616033 /nfs/dbraw/zinc/61/60/33/475616033.db2.gz ODDCAHWIPPNYIK-LBPRGKRZSA-N 0 3 336.413 2.921 20 5 EFBDHN CSc1cccc(C(=O)N2CCCN(C(C)C)CC2)c1[N+](=O)[O-] ZINC000332378700 475617541 /nfs/dbraw/zinc/61/75/41/475617541.db2.gz YGFBYRGMKHKWJF-UHFFFAOYSA-N 0 3 337.445 2.873 20 5 EFBDHN COc1ccc(-c2ccc(CN3C[C@@H](C)[C@H](CO)C3)o2)c([N+](=O)[O-])c1 ZINC000361659685 475639939 /nfs/dbraw/zinc/63/99/39/475639939.db2.gz IQAVMGBAYMGFEF-OLZOCXBDSA-N 0 3 346.383 2.924 20 5 EFBDHN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000358416588 475662349 /nfs/dbraw/zinc/66/23/49/475662349.db2.gz CTQHFZVSSOMEEV-CHWSQXEVSA-N 0 3 337.395 2.656 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[C@@]2(CCN(C)C2)C1 ZINC000297250986 475674860 /nfs/dbraw/zinc/67/48/60/475674860.db2.gz RVRYEXIFTTWUAT-QGZVFWFLSA-N 0 3 332.404 2.771 20 5 EFBDHN CCCN(CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)CC(C)C ZINC000346588688 475681848 /nfs/dbraw/zinc/68/18/48/475681848.db2.gz BFLGJBPVNNBNBH-UHFFFAOYSA-N 0 3 337.376 2.630 20 5 EFBDHN CCS[C@@H]1CCC[C@@H]1N[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000348471369 475686030 /nfs/dbraw/zinc/68/60/30/475686030.db2.gz UKUGBFYMZJMXFX-HRCADAONSA-N 0 3 349.456 2.964 20 5 EFBDHN CCS[C@@H]1CCC[C@@H]1N[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000348471367 475686066 /nfs/dbraw/zinc/68/60/66/475686066.db2.gz UKUGBFYMZJMXFX-ARFHVFGLSA-N 0 3 349.456 2.964 20 5 EFBDHN CC(C)c1nc2n(n1)C[C@H](N[C@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000332644780 475698556 /nfs/dbraw/zinc/69/85/56/475698556.db2.gz MBJDVLLJUUKQBB-CHWSQXEVSA-N 0 3 329.404 2.975 20 5 EFBDHN COCC1(C[NH2+]Cc2cc(OC)c([O-])cc2[N+](=O)[O-])CCCCC1 ZINC000353148081 475720220 /nfs/dbraw/zinc/72/02/20/475720220.db2.gz GGKAJYDXHGGFNU-UHFFFAOYSA-N 0 3 338.404 2.996 20 5 EFBDHN COc1cc(C(=O)NC[C@H](C)N2CCCC[C@H]2C)cc([N+](=O)[O-])c1C ZINC000358499786 475727302 /nfs/dbraw/zinc/72/73/02/475727302.db2.gz UAYSVNYTWBBRMR-OLZOCXBDSA-N 0 3 349.431 2.905 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@H]1CCC[C@H]1OC(F)F ZINC000348538667 475738948 /nfs/dbraw/zinc/73/89/48/475738948.db2.gz UPSFNBNPILZABE-QWHCGFSZSA-N 0 3 343.330 2.592 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](C)N1CCCC[C@H]1C ZINC000343068629 475739741 /nfs/dbraw/zinc/73/97/41/475739741.db2.gz UNMLAVZIRQKLDQ-CHWSQXEVSA-N 0 3 335.404 2.596 20 5 EFBDHN NC(=O)[C@@H](CNCc1ccccc1[N+](=O)[O-])Cc1ccccc1Cl ZINC000346675086 475753678 /nfs/dbraw/zinc/75/36/78/475753678.db2.gz OAUOVSDXUHNZTQ-CQSZACIVSA-N 0 3 347.802 2.682 20 5 EFBDHN C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000340095846 475755489 /nfs/dbraw/zinc/75/54/89/475755489.db2.gz TYACZWGSRMVEPM-CABCVRRESA-N 0 3 348.447 2.557 20 5 EFBDHN Cc1c(CNC(=O)NC[C@@H](C)N2CCCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000358548140 475762400 /nfs/dbraw/zinc/76/24/00/475762400.db2.gz TUNBVAQDMBGHAE-ZIAGYGMSSA-N 0 3 348.447 2.965 20 5 EFBDHN Cc1cccc(CN(C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)n1 ZINC000348577577 475767597 /nfs/dbraw/zinc/76/75/97/475767597.db2.gz MDUWMABUOJGXHM-UHFFFAOYSA-N 0 3 328.372 2.759 20 5 EFBDHN C[C@H](NC(=O)N1CCN(C2CC2)C[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000297472577 475770447 /nfs/dbraw/zinc/77/04/47/475770447.db2.gz UVXKMGNOFIOTAK-KBPBESRZSA-N 0 3 346.431 2.782 20 5 EFBDHN C[C@@H](C(=O)N(C)CCc1cccc([N+](=O)[O-])c1)N1[C@H](C)CC[C@@H]1C ZINC000338334935 475798230 /nfs/dbraw/zinc/79/82/30/475798230.db2.gz UCGHKKGJRRQIOF-ZNMIVQPWSA-N 0 3 333.432 2.857 20 5 EFBDHN Cc1c(NC(=O)[C@H](C)N[C@@H](C)[C@@H]2CCCOC2)cccc1[N+](=O)[O-] ZINC000355341438 475843167 /nfs/dbraw/zinc/84/31/67/475843167.db2.gz JRPJECJLTAESSV-MELADBBJSA-N 0 3 335.404 2.635 20 5 EFBDHN C[C@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1)N(C)Cc1ccccc1 ZINC000346847685 475907802 /nfs/dbraw/zinc/90/78/02/475907802.db2.gz MQTYAHSEABALSA-CYBMUJFWSA-N 0 3 345.374 2.984 20 5 EFBDHN Cc1cc(CN(C)C)cc(NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)c1 ZINC000340333991 475956165 /nfs/dbraw/zinc/95/61/65/475956165.db2.gz LIAVHCHSUCNGOB-UHFFFAOYSA-N 0 3 345.403 2.535 20 5 EFBDHN CS[C@H]1CN(Cc2c(F)cccc2[N+](=O)[O-])C[C@@H]1N1CCCC1 ZINC000358814477 475961424 /nfs/dbraw/zinc/96/14/24/475961424.db2.gz UKZKCXOODKHVBL-HOTGVXAUSA-N 0 3 339.436 2.746 20 5 EFBDHN CC(C)n1nccc1[C@H]1OCC[C@H]1NCc1cccc([N+](=O)[O-])c1 ZINC000343391326 476013938 /nfs/dbraw/zinc/01/39/38/476013938.db2.gz CLKWYXSMVXSWGH-WBVHZDCISA-N 0 3 330.388 2.992 20 5 EFBDHN CCn1ccnc1[C@H]1OCC[C@H]1NCc1ccc(C)c([N+](=O)[O-])c1 ZINC000343392254 476015624 /nfs/dbraw/zinc/01/56/24/476015624.db2.gz TXVYXLJIPMXHJX-ZBFHGGJFSA-N 0 3 330.388 2.739 20 5 EFBDHN CC(C)n1nccc1[C@@H]1OCC[C@H]1NCc1ccc([N+](=O)[O-])cc1 ZINC000343406320 476034691 /nfs/dbraw/zinc/03/46/91/476034691.db2.gz UVIZLXMZRXUXPZ-NVXWUHKLSA-N 0 3 330.388 2.992 20 5 EFBDHN CC[C@@H]1CCCCN1CCNC(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000358913516 476035522 /nfs/dbraw/zinc/03/55/22/476035522.db2.gz DXDSHRVMHHTTMD-MRXNPFEDSA-N 0 3 348.447 2.967 20 5 EFBDHN CCn1ccnc1[C@@H]1OCC[C@@H]1NC/C=C/c1ccccc1[N+](=O)[O-] ZINC000343409023 476036848 /nfs/dbraw/zinc/03/68/48/476036848.db2.gz ZSNHXVJGPMBQHY-MCKRRDHZSA-N 0 3 342.399 2.944 20 5 EFBDHN CCCCN(C)CCN[C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000353515294 476037416 /nfs/dbraw/zinc/03/74/16/476037416.db2.gz DNEMYIZAVJKSLA-KRWDZBQOSA-N 0 3 345.447 2.739 20 5 EFBDHN C[C@@H](CN1CCC[C@H](C)C1)NC(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000334043571 476096160 /nfs/dbraw/zinc/09/61/60/476096160.db2.gz JNLJIXJZEIRUTC-RYUDHWBXSA-N 0 3 338.383 2.976 20 5 EFBDHN Cc1ccc(C(C)(C)NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cn1 ZINC000353583227 476100306 /nfs/dbraw/zinc/10/03/06/476100306.db2.gz WSLLXTLNDJYUNR-MRXNPFEDSA-N 0 3 345.399 2.563 20 5 EFBDHN Cc1ccc(C(C)(C)NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cn1 ZINC000353583226 476101384 /nfs/dbraw/zinc/10/13/84/476101384.db2.gz WSLLXTLNDJYUNR-INIZCTEOSA-N 0 3 345.399 2.563 20 5 EFBDHN COc1c(C(=O)N[C@H](C)CN2C[C@@H](C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000334065086 476102296 /nfs/dbraw/zinc/10/22/96/476102296.db2.gz SOCVJWNJVULUGZ-MELADBBJSA-N 0 3 349.431 2.700 20 5 EFBDHN O=[N+]([O-])c1ccc(CNC[C@@H](CO)Cc2ccc(F)cc2)c(F)c1 ZINC000350287976 476121258 /nfs/dbraw/zinc/12/12/58/476121258.db2.gz NCXLMRLMZYDNQU-ZDUSSCGKSA-N 0 3 336.338 2.814 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CNC[C@@H]3COCCO3)s2)cc1 ZINC000338716217 476129054 /nfs/dbraw/zinc/12/90/54/476129054.db2.gz NYXQKAUBHHLEAF-CQSZACIVSA-N 0 3 334.397 2.828 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CN(C2CC2)C[C@H]1C ZINC000343896044 476129933 /nfs/dbraw/zinc/12/99/33/476129933.db2.gz MBWIMRZQRTYHEV-IAQYHMDHSA-N 0 3 349.456 2.919 20 5 EFBDHN COc1ccc(CN(C)C[C@@H](O)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000338728283 476140596 /nfs/dbraw/zinc/14/05/96/476140596.db2.gz OMBOFMLAUMOAET-INIZCTEOSA-N 0 3 330.384 2.639 20 5 EFBDHN CN(C)c1cccnc1CN[C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000353633050 476140925 /nfs/dbraw/zinc/14/09/25/476140925.db2.gz VRXOPMJQQRLXPI-BBRMVZONSA-N 0 3 344.419 2.526 20 5 EFBDHN Cc1cc(NCCC(=O)NC(C)(C)C)c2cc([N+](=O)[O-])ccc2n1 ZINC000336879263 476166967 /nfs/dbraw/zinc/16/69/67/476166967.db2.gz LTQLWQITAJVRGW-UHFFFAOYSA-N 0 3 330.388 2.590 20 5 EFBDHN C[C@@H]1[C@H](C)N(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CCN1C ZINC000357031883 476173912 /nfs/dbraw/zinc/17/39/12/476173912.db2.gz CTZDTNLJNQNNQG-KGLIPLIRSA-N 0 3 344.415 2.817 20 5 EFBDHN Cc1cc(N2C[C@H](C)N(C)[C@@H](C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000338784456 476183773 /nfs/dbraw/zinc/18/37/73/476183773.db2.gz KAYRGOUHUSWMFL-KBPBESRZSA-N 0 3 341.415 2.889 20 5 EFBDHN Cc1ccccc1[C@@H]([C@H](C)NC(=O)c1ccc([N+](=O)[O-])o1)N(C)C ZINC000344270194 476204203 /nfs/dbraw/zinc/20/42/03/476204203.db2.gz MWIHFZIUFASCKB-BLLLJJGKSA-N 0 3 331.372 2.917 20 5 EFBDHN CCOc1ccc(C(=O)N(C)C2CCN(CC)CC2)cc1[N+](=O)[O-] ZINC000340686407 476204907 /nfs/dbraw/zinc/20/49/07/476204907.db2.gz SRJSCAGFXQLQGC-UHFFFAOYSA-N 0 3 335.404 2.550 20 5 EFBDHN CC[C@H](NC(=O)N[C@@H]1CCCN(C)[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000344285398 476217170 /nfs/dbraw/zinc/21/71/70/476217170.db2.gz KKYDUDWDQBFGCO-UHOFOFEASA-N 0 3 334.420 2.828 20 5 EFBDHN C[C@@H](CNC(=O)Nc1cc(F)cc([N+](=O)[O-])c1)N1CCC[C@H](C)C1 ZINC000347297917 476240516 /nfs/dbraw/zinc/24/05/16/476240516.db2.gz IDJCJRIANXJUGB-RYUDHWBXSA-N 0 3 338.383 2.976 20 5 EFBDHN CS[C@H]1CN(c2ccc3cc([N+](=O)[O-])ccc3n2)C[C@H]1N(C)C ZINC000340733950 476241136 /nfs/dbraw/zinc/24/11/36/476241136.db2.gz BUGCZPRRWBVHBC-CABCVRRESA-N 0 3 332.429 2.625 20 5 EFBDHN COc1ccc(C(=O)N(CCN(C)C)C2CCCC2)cc1[N+](=O)[O-] ZINC000353845108 476298691 /nfs/dbraw/zinc/29/86/91/476298691.db2.gz NCKOEOTZUBXLNY-UHFFFAOYSA-N 0 3 335.404 2.550 20 5 EFBDHN O=[N+]([O-])c1ccccc1NCCCN1CCN(c2ccncc2)CC1 ZINC000353959189 476336606 /nfs/dbraw/zinc/33/66/06/476336606.db2.gz CQCCYXUNFKZHOD-UHFFFAOYSA-N 0 3 341.415 2.614 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2ccc(CN3CCC(OCCO)CC3)o2)c1 ZINC000354044043 476388049 /nfs/dbraw/zinc/38/80/49/476388049.db2.gz DSKDRZPJTXJVAZ-UHFFFAOYSA-N 0 3 346.383 2.828 20 5 EFBDHN CCn1c(C)nc([N+](=O)[O-])c1NC[C@@H](Cc1ccccc1)N(C)C ZINC000360842588 476420704 /nfs/dbraw/zinc/42/07/04/476420704.db2.gz OUUUHTCBYFLKEY-OAHLLOKOSA-N 0 3 331.420 2.704 20 5 EFBDHN CCn1c(C)nc([N+](=O)[O-])c1NC[C@H](Cc1ccccc1)N(C)C ZINC000360842587 476421185 /nfs/dbraw/zinc/42/11/85/476421185.db2.gz OUUUHTCBYFLKEY-HNNXBMFYSA-N 0 3 331.420 2.704 20 5 EFBDHN CC(C)N1CCC(N(C)c2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC000362825688 476427549 /nfs/dbraw/zinc/42/75/49/476427549.db2.gz IYCCNFCXSYNCJS-UHFFFAOYSA-N 0 3 345.403 2.954 20 5 EFBDHN Cc1c(CN2CCC(CCN3CCOCC3)CC2)cccc1[N+](=O)[O-] ZINC000363593605 476450454 /nfs/dbraw/zinc/45/04/54/476450454.db2.gz OPHNDWYVXROOEW-UHFFFAOYSA-N 0 3 347.459 2.838 20 5 EFBDHN CN(CCNC(=O)Nc1ccc([N+](=O)[O-])cc1F)Cc1ccccc1 ZINC000351655430 476487871 /nfs/dbraw/zinc/48/78/71/476487871.db2.gz LEPPYECHVXXQMB-UHFFFAOYSA-N 0 3 346.362 2.987 20 5 EFBDHN CNc1c(C(=O)NC[C@@H]2CCCCN2CC(C)C)cccc1[N+](=O)[O-] ZINC000360951890 476498804 /nfs/dbraw/zinc/49/88/04/476498804.db2.gz UIVSVTNGYDYSPP-AWEZNQCLSA-N 0 3 348.447 2.877 20 5 EFBDHN CCn1c(C)nc([N+](=O)[O-])c1N1CCN(CC2CCCCC2)CC1 ZINC000360962346 476507987 /nfs/dbraw/zinc/50/79/87/476507987.db2.gz XTGDTBYJYKWMDX-UHFFFAOYSA-N 0 3 335.452 2.822 20 5 EFBDHN CCN(CC)CCO[C@H]1CCN(c2cc([N+](=O)[O-])ccc2C(C)=O)C1 ZINC000360983151 476523411 /nfs/dbraw/zinc/52/34/11/476523411.db2.gz DOQYKESXWWEFOR-INIZCTEOSA-N 0 3 349.431 2.735 20 5 EFBDHN Cc1ccc(CN(CCO)CCOc2cccc([N+](=O)[O-])c2)cc1 ZINC000361064015 476578131 /nfs/dbraw/zinc/57/81/31/476578131.db2.gz YOCBOQIJZLNFHV-UHFFFAOYSA-N 0 3 330.384 2.777 20 5 EFBDHN Cc1cc(N[C@@H]2CCN(C)[C@@H](C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000361066821 476579087 /nfs/dbraw/zinc/57/90/87/476579087.db2.gz PVAHRXKBRAIUJV-DZGCQCFKSA-N 0 3 341.415 2.677 20 5 EFBDHN C[C@H](NCCCn1c2cc([N+](=O)[O-])ccc2oc1=O)c1cccnc1 ZINC000361089939 476593909 /nfs/dbraw/zinc/59/39/09/476593909.db2.gz ZBMQEHPYHNQYEJ-LBPRGKRZSA-N 0 3 342.355 2.639 20 5 EFBDHN Cc1cc(N2CCC(C)(CN3CCN(C)CC3)CC2)ccc1[N+](=O)[O-] ZINC000374933005 476601398 /nfs/dbraw/zinc/60/13/98/476601398.db2.gz WSDQOGAFVSKNHN-UHFFFAOYSA-N 0 3 346.475 2.757 20 5 EFBDHN COc1ccc(C[C@@H]2CCCN(CCn3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000365727147 476681390 /nfs/dbraw/zinc/68/13/90/476681390.db2.gz XLXPFIDGEPPWEO-INIZCTEOSA-N 0 3 344.415 2.755 20 5 EFBDHN CC(C)Oc1cc(C(=O)N[C@H]2CCCN(C(C)C)C2)ccc1[N+](=O)[O-] ZINC000413715457 476702896 /nfs/dbraw/zinc/70/28/96/476702896.db2.gz RNYKSEQQJLUXSQ-HNNXBMFYSA-N 0 3 349.431 2.985 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CN[C@@H](C)c1ccc(CN)nc1C ZINC000422720396 476743242 /nfs/dbraw/zinc/74/32/42/476743242.db2.gz SKCVOQFXWFOYJQ-NSHDSACASA-N 0 3 330.388 2.616 20 5 EFBDHN CC(C)[C@H](CC(F)(F)F)NCc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000445886507 476788881 /nfs/dbraw/zinc/78/88/81/476788881.db2.gz NZLIUBFUGIEWKA-NSHDSACASA-N 0 3 333.310 2.760 20 5 EFBDHN Cc1n[nH]cc1C1CCN(CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000375379041 476806192 /nfs/dbraw/zinc/80/61/92/476806192.db2.gz NTSUOESLIJBNKQ-UHFFFAOYSA-N 0 3 330.388 2.885 20 5 EFBDHN CC(C)N1CC[C@H](N(C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000452125230 476842944 /nfs/dbraw/zinc/84/29/44/476842944.db2.gz XNVNZTXILGTYBS-HNNXBMFYSA-N 0 3 345.403 2.559 20 5 EFBDHN CN(C)C[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2)c2ccccc2O1 ZINC000370502287 476843409 /nfs/dbraw/zinc/84/34/09/476843409.db2.gz BYTXANIYKJQLEC-OAHLLOKOSA-N 0 3 341.367 2.564 20 5 EFBDHN CN(C)C[C@@H]1CN(C(=O)c2csc([N+](=O)[O-])c2)c2ccccc2O1 ZINC000370504075 476845141 /nfs/dbraw/zinc/84/51/41/476845141.db2.gz CEWFTTCDJUFKSJ-GFCCVEGCSA-N 0 3 347.396 2.626 20 5 EFBDHN CSc1cccc(C(=O)NCCN2CCCC2(C)C)c1[N+](=O)[O-] ZINC000457052159 476847048 /nfs/dbraw/zinc/84/70/48/476847048.db2.gz IPRUHWHNUQUEQK-UHFFFAOYSA-N 0 3 337.445 2.921 20 5 EFBDHN Cc1nn(C)cc1[C@@H]1CCCN1CCOc1cccc([N+](=O)[O-])c1 ZINC000366071442 476847142 /nfs/dbraw/zinc/84/71/42/476847142.db2.gz FNYURUBBXNEHDS-KRWDZBQOSA-N 0 3 330.388 2.853 20 5 EFBDHN CC(C)(CN1CCCC1)NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000457058112 476849874 /nfs/dbraw/zinc/84/98/74/476849874.db2.gz VTLLMIWHMNUHAZ-UHFFFAOYSA-N 0 3 330.388 2.680 20 5 EFBDHN CC(C)N1CC[C@H](N(C)C(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000457064165 476853369 /nfs/dbraw/zinc/85/33/69/476853369.db2.gz CFVPDBQASWJLKO-LBPRGKRZSA-N 0 3 325.796 2.803 20 5 EFBDHN CC1(C)CCCN1CCNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000457068547 476857105 /nfs/dbraw/zinc/85/71/05/476857105.db2.gz DKLXRDSDPXHGTN-UHFFFAOYSA-N 0 3 330.388 2.680 20 5 EFBDHN CSc1ccc(C(=O)N(C)[C@@H]2CCN(C(C)C)C2)cc1[N+](=O)[O-] ZINC000457084521 476865185 /nfs/dbraw/zinc/86/51/85/476865185.db2.gz LOEGUNPLJRSHMD-CYBMUJFWSA-N 0 3 337.445 2.871 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CCN(C(C)C)C2)c1 ZINC000457106030 476879816 /nfs/dbraw/zinc/87/98/16/476879816.db2.gz CTQDCYFLEKTQJL-LBPRGKRZSA-N 0 3 337.445 2.871 20 5 EFBDHN CC(C)N1CC[C@@H](N(C)C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000457114989 476885161 /nfs/dbraw/zinc/88/51/61/476885161.db2.gz KMMSCPIJFBRKGQ-CQSZACIVSA-N 0 3 331.372 2.896 20 5 EFBDHN CC(C)N1CC[C@H](N(C)C(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000457124375 476889258 /nfs/dbraw/zinc/88/92/58/476889258.db2.gz PSEZKAFIIPLIGR-KRWDZBQOSA-N 0 3 348.447 2.728 20 5 EFBDHN Cc1cc(N)cc(CN[C@@H](C)CC(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000414958426 476901446 /nfs/dbraw/zinc/90/14/46/476901446.db2.gz CZRDIYFKBXHFTC-ZDUSSCGKSA-N 0 3 342.399 2.992 20 5 EFBDHN Cc1cc(OCC(=O)NC[C@H]2N(C)CCCC2(C)C)ccc1[N+](=O)[O-] ZINC000430833418 476923593 /nfs/dbraw/zinc/92/35/93/476923593.db2.gz OXRPHBUDGCFBTK-MRXNPFEDSA-N 0 3 349.431 2.519 20 5 EFBDHN CN(C)C[C@@H]1CCCCN1C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000405100883 476924716 /nfs/dbraw/zinc/92/47/16/476924716.db2.gz MMJCTYDSBQQHQD-LBPRGKRZSA-N 0 3 325.796 2.805 20 5 EFBDHN COc1c(C(=O)N[C@@H](CC(C)C)CN2CCCC2)cccc1[N+](=O)[O-] ZINC000452344515 476924812 /nfs/dbraw/zinc/92/48/12/476924812.db2.gz OFSVMYOZDWDHLI-AWEZNQCLSA-N 0 3 349.431 2.844 20 5 EFBDHN CC(C)C[C@@H](CN1CCCC1)NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000452343765 476925455 /nfs/dbraw/zinc/92/54/55/476925455.db2.gz YFWVLPVJZMVULJ-LBPRGKRZSA-N 0 3 325.434 2.897 20 5 EFBDHN COc1cccc(C[C@H](C)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)n1 ZINC000446841534 476927516 /nfs/dbraw/zinc/92/75/16/476927516.db2.gz QTXVUBPGIFLTMG-NSHDSACASA-N 0 3 341.371 2.596 20 5 EFBDHN C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCNCc2ccccc21 ZINC000430926228 476936678 /nfs/dbraw/zinc/93/66/78/476936678.db2.gz NANARVPYRKJOOF-CYBMUJFWSA-N 0 3 340.383 2.532 20 5 EFBDHN O=C([C@@H]1CCCN1C1CCCC1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000408420859 476952002 /nfs/dbraw/zinc/95/20/02/476952002.db2.gz AYEVQVAKPKUVCD-SFHVURJKSA-N 0 3 343.427 2.887 20 5 EFBDHN Cc1c(NC(=O)[C@@H](C)NC2(C3CC3)CCOCC2)cccc1[N+](=O)[O-] ZINC000375700149 476960128 /nfs/dbraw/zinc/96/01/28/476960128.db2.gz DEYLAKZAIDIEFE-CYBMUJFWSA-N 0 3 347.415 2.779 20 5 EFBDHN COc1cccc(C(=O)N(C)C(C)(C)CN2CCCC2)c1[N+](=O)[O-] ZINC000416113481 477024118 /nfs/dbraw/zinc/02/41/18/477024118.db2.gz ZAOFBRQXFAHAPC-UHFFFAOYSA-N 0 3 335.404 2.550 20 5 EFBDHN CN1CC[C@@H]2[C@H](CCCN2C(=O)C(C)(C)c2ccccc2[N+](=O)[O-])C1 ZINC000410592847 477025999 /nfs/dbraw/zinc/02/59/99/477025999.db2.gz QEPUWUUMYRREPY-GDBMZVCRSA-N 0 3 345.443 2.815 20 5 EFBDHN Cc1cc(OCC(=O)NC[C@@H](C)N2CCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000431576087 477055326 /nfs/dbraw/zinc/05/53/26/477055326.db2.gz SMGJAWFLGMDVPD-UKRRQHHQSA-N 0 3 349.431 2.519 20 5 EFBDHN Cc1c([C@H]2OCC[C@@H]2NCc2ccc(C)c([N+](=O)[O-])c2)cnn1C ZINC000431708658 477079291 /nfs/dbraw/zinc/07/92/91/477079291.db2.gz IQDXVXJEUAUSFT-DOTOQJQBSA-N 0 3 330.388 2.565 20 5 EFBDHN CN(C)[C@@H](CC(=O)NCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000431728162 477083574 /nfs/dbraw/zinc/08/35/74/477083574.db2.gz NDQKOIXCIDSKSR-KRWDZBQOSA-N 0 3 327.384 2.904 20 5 EFBDHN C[C@@H]1[C@H](C)NCCN1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000423614956 477087155 /nfs/dbraw/zinc/08/71/55/477087155.db2.gz QRJBSRXIOBWRAZ-VHSXEESVSA-N 0 3 343.836 2.549 20 5 EFBDHN CC(C)[C@@H](C(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)N(C)C ZINC000452850644 477107000 /nfs/dbraw/zinc/10/70/00/477107000.db2.gz MQZPVKZNTFSXBM-RDJZCZTQSA-N 0 3 333.432 2.887 20 5 EFBDHN CN1CCCC(C)(C)[C@H]1CNC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000447980458 477108870 /nfs/dbraw/zinc/10/88/70/477108870.db2.gz XAUARRPTNGPOOE-OAHLLOKOSA-N 0 3 334.420 2.514 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H](CO)[C@@H]2CCCO2)s1 ZINC000447990197 477111473 /nfs/dbraw/zinc/11/14/73/477111473.db2.gz RDDVGRAFVFGCGZ-HOCLYGCPSA-N 0 3 348.424 2.953 20 5 EFBDHN Cc1cc(OCC(=O)NC[C@H](C)N2CCC(C)CC2)ccc1[N+](=O)[O-] ZINC000431864714 477111403 /nfs/dbraw/zinc/11/14/03/477111403.db2.gz YBFOKMAARLOCFX-HNNXBMFYSA-N 0 3 349.431 2.519 20 5 EFBDHN Cc1c([C@H]2OCC[C@@H]2NCc2cccc([N+](=O)[O-])c2C)cnn1C ZINC000431933482 477122582 /nfs/dbraw/zinc/12/25/82/477122582.db2.gz CPDAACPLHZVRGW-DOTOQJQBSA-N 0 3 330.388 2.565 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN1CC(C2CCCCC2)C1 ZINC000453007972 477141371 /nfs/dbraw/zinc/14/13/71/477141371.db2.gz DFIYWWBTHCONIG-INIZCTEOSA-N 0 3 334.416 2.847 20 5 EFBDHN CN(C)C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])s2)c2ccccc2O1 ZINC000371212240 477179281 /nfs/dbraw/zinc/17/92/81/477179281.db2.gz IHOGQYHJUVHSKM-NSHDSACASA-N 0 3 347.396 2.626 20 5 EFBDHN CS[C@H]1CN(c2ccnc3c2cccc3[N+](=O)[O-])C[C@H]1N(C)C ZINC000432331675 477196830 /nfs/dbraw/zinc/19/68/30/477196830.db2.gz PIFSQGDPFOFLCF-CABCVRRESA-N 0 3 332.429 2.625 20 5 EFBDHN CC1(C)C[C@H](NCCN2C[C@H]3CC[C@@H](C2)O3)c2cc([N+](=O)[O-])ccc21 ZINC000453331962 477207725 /nfs/dbraw/zinc/20/77/25/477207725.db2.gz HZCHDRKDEXECKF-DAYGRLMNSA-N 0 3 345.443 2.770 20 5 EFBDHN Cc1cc(OCC(=O)NCCN2CCCC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000432402159 477209605 /nfs/dbraw/zinc/20/96/05/477209605.db2.gz PGHXGYJFTORDLW-UHFFFAOYSA-N 0 3 349.431 2.520 20 5 EFBDHN C[C@@H](CN1CCCCC1)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411385323 477212988 /nfs/dbraw/zinc/21/29/88/477212988.db2.gz JWQJLDFRJCGPQF-RRQGHBQHSA-N 0 3 331.416 2.689 20 5 EFBDHN CCc1ccccc1[C@H](N)CNC(=O)c1cccc(OC)c1[N+](=O)[O-] ZINC000423937608 477224647 /nfs/dbraw/zinc/22/46/47/477224647.db2.gz HHWCTRHTDPKOME-OAHLLOKOSA-N 0 3 343.383 2.596 20 5 EFBDHN CC1CCN(CCNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CC1 ZINC000411431592 477232099 /nfs/dbraw/zinc/23/20/99/477232099.db2.gz UHBBJDQBSDPQNL-DLBZAZTESA-N 0 3 331.416 2.546 20 5 EFBDHN CCc1ccccc1[C@H](N)CNC(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000423983293 477245668 /nfs/dbraw/zinc/24/56/68/477245668.db2.gz SSCJWCDKIKVITE-OAHLLOKOSA-N 0 3 343.383 2.596 20 5 EFBDHN Cc1c(CN2CCC[C@H]2C[C@H](O)c2cnn(C)c2)cccc1[N+](=O)[O-] ZINC000371333731 477250656 /nfs/dbraw/zinc/25/06/56/477250656.db2.gz BLMYACGLPVOVDG-WMZOPIPTSA-N 0 3 344.415 2.725 20 5 EFBDHN Cc1ccc(CN2CC[C@H](N3CCN(C(C)C)CC3)C2)cc1[N+](=O)[O-] ZINC000371337965 477251870 /nfs/dbraw/zinc/25/18/70/477251870.db2.gz XNNGLSNCPRXWLW-SFHVURJKSA-N 0 3 346.475 2.504 20 5 EFBDHN C[C@@H]1CC[C@H](CNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)O1 ZINC000453635369 477258309 /nfs/dbraw/zinc/25/83/09/477258309.db2.gz USDPLRAPXISLEK-MLGOLLRUSA-N 0 3 330.388 2.652 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1C[C@@H](N)Cc2ccccc21 ZINC000424084085 477287002 /nfs/dbraw/zinc/28/70/02/477287002.db2.gz XFGIZMNCTUGLOJ-AWEZNQCLSA-N 0 3 325.368 2.742 20 5 EFBDHN C[C@@]1(CNC(=O)c2ccc([N+](=O)[O-])o2)CCN(Cc2ccccc2)C1 ZINC000366987188 477287423 /nfs/dbraw/zinc/28/74/23/477287423.db2.gz DJFXEZOXWSZTNZ-SFHVURJKSA-N 0 3 343.383 2.830 20 5 EFBDHN CC1(C)C[C@H](NC[C@@H](O)COCC2CC2)c2cc([N+](=O)[O-])ccc21 ZINC000433164193 477311978 /nfs/dbraw/zinc/31/19/78/477311978.db2.gz ZOHAVIZUZDTUCT-PBHICJAKSA-N 0 3 334.416 2.694 20 5 EFBDHN CN(C)CCN(Cc1ccsc1)C(=O)c1ccc([N+](=O)[O-])s1 ZINC000458203941 477317630 /nfs/dbraw/zinc/31/76/30/477317630.db2.gz QAJWBYIEPRKXKL-UHFFFAOYSA-N 0 3 339.442 2.922 20 5 EFBDHN CN(C)CCOc1ccc(NC(=O)c2ccc([N+](=O)[O-])o2)cc1F ZINC000458331173 477355683 /nfs/dbraw/zinc/35/56/83/477355683.db2.gz ZNZOQMYVZXRZQP-UHFFFAOYSA-N 0 3 337.307 2.520 20 5 EFBDHN CC1(C)CCCN(CCNC(=O)Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC000436094551 477419331 /nfs/dbraw/zinc/41/93/31/477419331.db2.gz UMMGJIVZPYHKCX-UHFFFAOYSA-N 0 3 338.383 2.977 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N[C@@H](C)c1nnc2ccccn21 ZINC000449067258 477420355 /nfs/dbraw/zinc/42/03/55/477420355.db2.gz JVHQXJVKMSNPGA-OLZOCXBDSA-N 0 3 325.372 2.919 20 5 EFBDHN COCCOc1ncccc1CN[C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449082177 477427449 /nfs/dbraw/zinc/42/74/49/477427449.db2.gz LFUHFCHRWOAJDS-CQSZACIVSA-N 0 3 345.399 2.736 20 5 EFBDHN COCCOc1ncccc1CN[C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449082176 477427670 /nfs/dbraw/zinc/42/76/70/477427670.db2.gz LFUHFCHRWOAJDS-AWEZNQCLSA-N 0 3 345.399 2.736 20 5 EFBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CN[C@H]2CC[C@H](CO)CC2)c1 ZINC000449192242 477478877 /nfs/dbraw/zinc/47/88/77/477478877.db2.gz TYJFTGQUXDSZNF-UMSPYCQHSA-N 0 3 330.331 2.837 20 5 EFBDHN Cc1c(CNC(=O)N(C)[C@H]2CCN(C(C)C)C2)cccc1[N+](=O)[O-] ZINC000458693618 477550362 /nfs/dbraw/zinc/55/03/62/477550362.db2.gz NXRLLQIAUSEOFY-HNNXBMFYSA-N 0 3 334.420 2.527 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN1CCN(C2CC2)C[C@@H](C)C1 ZINC000449350112 477558013 /nfs/dbraw/zinc/55/80/13/477558013.db2.gz YXVIJTNGEUBZHI-AWEZNQCLSA-N 0 3 333.432 2.910 20 5 EFBDHN O=C(c1ccc([N+](=O)[O-])o1)N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1 ZINC000425000577 477591136 /nfs/dbraw/zinc/59/11/36/477591136.db2.gz IMLQCKRJLMKOBN-LSDHHAIUSA-N 0 3 341.367 2.534 20 5 EFBDHN COC(=O)Cc1ccc(NC[C@@H]2CCCCN2C2CC2)c([N+](=O)[O-])c1 ZINC000450481234 477601895 /nfs/dbraw/zinc/60/18/95/477601895.db2.gz DKKWTPOEUWEDDR-HNNXBMFYSA-N 0 3 347.415 2.739 20 5 EFBDHN CCN1CCC(N(C)C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CC1 ZINC000413328606 477630707 /nfs/dbraw/zinc/63/07/07/477630707.db2.gz PFZASRPXADBPRF-DLBZAZTESA-N 0 3 331.416 2.641 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1NC[C@@H]1CCCN1CCCO ZINC000450599743 477647984 /nfs/dbraw/zinc/64/79/84/477647984.db2.gz TYTAIAMONFUAHO-LBPRGKRZSA-N 0 3 347.337 2.872 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@H]2CCCN(CCCO)C2)cc1C(F)(F)F ZINC000450621881 477657817 /nfs/dbraw/zinc/65/78/17/477657817.db2.gz XZHONTROAISSDO-LBPRGKRZSA-N 0 3 347.337 2.872 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CN3C[C@H]4[C@H](CO)[C@H]4C3)s2)cc1 ZINC000367839963 477713214 /nfs/dbraw/zinc/71/32/14/477713214.db2.gz OJAKHKXKZHUEME-ZSHCYNCHSA-N 0 3 330.409 2.993 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)CCN(c2ncccc2[N+](=O)[O-])C1 ZINC000450805122 477723961 /nfs/dbraw/zinc/72/39/61/477723961.db2.gz CKXKQCXDWCQMIT-OAHLLOKOSA-N 0 3 326.400 2.948 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCN2CCNC[C@H]2c2ccccc2)c1 ZINC000420410828 477754231 /nfs/dbraw/zinc/75/42/31/477754231.db2.gz RMOOPQMTNVCCRT-SFHVURJKSA-N 0 3 327.384 2.620 20 5 EFBDHN CN1CC[C@@H]2[C@@H](CCCN2C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000413621532 477754603 /nfs/dbraw/zinc/75/46/03/477754603.db2.gz CNQWRHZPJLWQAG-DZJNRPSUSA-N 0 3 343.427 2.641 20 5 EFBDHN CCCCN1CCCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000426961511 477762575 /nfs/dbraw/zinc/76/25/75/477762575.db2.gz ALYINBIKKQYVPS-OAHLLOKOSA-N 0 3 349.431 2.988 20 5 EFBDHN CN(C)CCCC(C)(C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000456203144 477817875 /nfs/dbraw/zinc/81/78/75/477817875.db2.gz VTEICSUDSISGKB-UHFFFAOYSA-N 0 3 349.431 2.794 20 5 EFBDHN Cc1ccccc1OC[C@H](O)CN[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000451109686 477829169 /nfs/dbraw/zinc/82/91/69/477829169.db2.gz YFBKEJBWDGXYBG-WMLDXEAASA-N 0 3 330.384 2.994 20 5 EFBDHN CNc1c(C(=O)Nc2ccccc2CCN(C)C)cccc1[N+](=O)[O-] ZINC000438556881 477863519 /nfs/dbraw/zinc/86/35/19/477863519.db2.gz YAONMARQJXJFKQ-UHFFFAOYSA-N 0 3 342.399 2.993 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1C[C@H](N2CCOCC2)C[C@H]1C ZINC000558411622 477864020 /nfs/dbraw/zinc/86/40/20/477864020.db2.gz JWQHBSUVKJUHAU-AEDISCFBSA-N 0 3 345.443 2.793 20 5 EFBDHN O=C(NCCNc1ccccc1[N+](=O)[O-])[C@H]1CCCN1C1CCCC1 ZINC000438579284 477868480 /nfs/dbraw/zinc/86/84/80/477868480.db2.gz JNUZIMMMVPBMLQ-QGZVFWFLSA-N 0 3 346.431 2.530 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCN[C@H](CC(F)F)c1ccccc1 ZINC000420999412 477888935 /nfs/dbraw/zinc/88/89/35/477888935.db2.gz UUKKYRWYIASXIU-CQSZACIVSA-N 0 3 337.326 2.743 20 5 EFBDHN CCCN(CCN(C)C)C(=O)[C@@H](CC)Cc1ccc([N+](=O)[O-])cc1 ZINC000462621438 477911638 /nfs/dbraw/zinc/91/16/38/477911638.db2.gz HUJLLIGGTLTXSG-INIZCTEOSA-N 0 3 335.448 2.964 20 5 EFBDHN O=[N+]([O-])c1ccccc1CNC[C@]1(CO)C[C@@H]1c1ccc(F)cc1 ZINC000428533360 477921849 /nfs/dbraw/zinc/92/18/49/477921849.db2.gz GXDSZEFHRFVDDF-AEFFLSMTSA-N 0 3 330.359 2.990 20 5 EFBDHN O=c1oc2ccc([N+](=O)[O-])cc2n1CCCN1CCC(CF)CC1 ZINC000451397020 477991458 /nfs/dbraw/zinc/99/14/58/477991458.db2.gz UEGHKKLBPQUUIU-UHFFFAOYSA-N 0 3 337.351 2.574 20 5 EFBDHN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000451414596 478002092 /nfs/dbraw/zinc/00/20/92/478002092.db2.gz IJYVDDWMIZOPEI-VJUNAUMWSA-N 0 3 347.415 2.547 20 5 EFBDHN C[C@H]1CCN(CCNC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000560097536 478018887 /nfs/dbraw/zinc/01/88/87/478018887.db2.gz WCGVJNXFNDAEII-JTQLQIEISA-N 0 3 345.321 2.685 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H](C)N1CCCC[C@H]1C ZINC000494657235 478035680 /nfs/dbraw/zinc/03/56/80/478035680.db2.gz YXNFBVVWGCLWJZ-OLZOCXBDSA-N 0 3 335.404 2.596 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@@H]1[C@@H]2CCCO[C@@H]2C1(C)C ZINC000451474533 478036119 /nfs/dbraw/zinc/03/61/19/478036119.db2.gz APSGHPUYRSTOAL-XKQJLSEDSA-N 0 3 347.415 2.635 20 5 EFBDHN CCO[C@H]1C[C@@H](NCC(=O)Nc2c(C)cccc2[N+](=O)[O-])C12CCC2 ZINC000451478615 478040274 /nfs/dbraw/zinc/04/02/74/478040274.db2.gz JXOPERBCNJTFFV-CABCVRRESA-N 0 3 347.415 2.779 20 5 EFBDHN CO[C@@]1(C)C[C@@H](NCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1(C)C ZINC000451483475 478042971 /nfs/dbraw/zinc/04/29/71/478042971.db2.gz FGXDDPWQKZVRAU-PBHICJAKSA-N 0 3 335.404 2.635 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)CCN1CCCC1 ZINC000439903364 478046767 /nfs/dbraw/zinc/04/67/67/478046767.db2.gz PSMMPTUXJZRZKJ-UHFFFAOYSA-N 0 3 336.392 2.553 20 5 EFBDHN NC(=O)CC1(CNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000421349813 478046982 /nfs/dbraw/zinc/04/69/82/478046982.db2.gz JOLGXHMIDCTCTG-UHFFFAOYSA-N 0 3 329.356 2.600 20 5 EFBDHN CCCN1C[C@@H](CNCc2ccc([N+](=O)[O-])cc2Cl)CC1=O ZINC000421351944 478047606 /nfs/dbraw/zinc/04/76/06/478047606.db2.gz NGRCQZPXKHAOKJ-LLVKDONJSA-N 0 3 325.796 2.596 20 5 EFBDHN COc1cc(CN[C@@H]2[C@H](C)[C@H](OC)C2(C)C)c([N+](=O)[O-])cc1F ZINC000451506878 478057697 /nfs/dbraw/zinc/05/76/97/478057697.db2.gz WJBJVHSXKUPGIF-AMFBXLIHSA-N 0 3 326.368 2.892 20 5 EFBDHN COC(=O)CC1(NCc2ccc(OC)c([N+](=O)[O-])c2)CCCCC1 ZINC000533390647 478074104 /nfs/dbraw/zinc/07/41/04/478074104.db2.gz NACPIRDZYXOLPY-UHFFFAOYSA-N 0 3 336.388 2.959 20 5 EFBDHN CO[C@@H]1COC[C@@H]1NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000459756336 478075564 /nfs/dbraw/zinc/07/55/64/478075564.db2.gz OCGFPZZQMSQRCL-DZGCQCFKSA-N 0 3 334.397 2.827 20 5 EFBDHN CON1CCC(NCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000421404182 478076260 /nfs/dbraw/zinc/07/62/60/478076260.db2.gz YFNHQPBZYVHMBG-UHFFFAOYSA-N 0 3 331.372 2.970 20 5 EFBDHN COc1ccc([C@@H](CO)CNCc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000459769022 478083675 /nfs/dbraw/zinc/08/36/75/478083675.db2.gz YVKTUYFRTKXXEP-CQSZACIVSA-N 0 3 334.347 2.608 20 5 EFBDHN CCO[C@H]1CCN(CCOc2ccc(OC)cc2[N+](=O)[O-])C[C@H]1C ZINC000451550040 478084352 /nfs/dbraw/zinc/08/43/52/478084352.db2.gz WJFBMAMWMKOZFG-CJNGLKHVSA-N 0 3 338.404 2.729 20 5 EFBDHN CO[C@@H]1C[C@H](N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C12CCC2 ZINC000459777442 478087082 /nfs/dbraw/zinc/08/70/82/478087082.db2.gz VWTQVCNEXVPCTO-UHOFOFEASA-N 0 3 347.415 2.777 20 5 EFBDHN COc1ccc(NC(=O)[C@H](C)N[C@@H]2CCC[C@@H]3C[C@@H]32)c([N+](=O)[O-])c1 ZINC000459794695 478097717 /nfs/dbraw/zinc/09/77/17/478097717.db2.gz WUULNVJUDDGKQL-UZGDPCLZSA-N 0 3 333.388 2.709 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N[C@H]1CCC[C@@H]2C[C@@H]21 ZINC000459796382 478097786 /nfs/dbraw/zinc/09/77/86/478097786.db2.gz YMOSVCLUTPCVQJ-XCCSTKFXSA-N 0 3 333.388 2.709 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCN(C)[C@@H](C(C)C)C1 ZINC000488005253 478105325 /nfs/dbraw/zinc/10/53/25/478105325.db2.gz CKYDDCHDMRUWPF-QGZVFWFLSA-N 0 3 348.447 2.504 20 5 EFBDHN COc1ccc(CCN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000440497921 478125382 /nfs/dbraw/zinc/12/53/82/478125382.db2.gz WSTGJLRQCOYWLC-OAHLLOKOSA-N 0 3 342.399 2.727 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCCN1CC[C@@H](C)C1 ZINC000534279542 478134736 /nfs/dbraw/zinc/13/47/36/478134736.db2.gz SBMWDARZBZQNRF-GFCCVEGCSA-N 0 3 337.445 2.778 20 5 EFBDHN CCOc1cc(CN(C)CCCNC(=O)C2CCC2)ccc1[N+](=O)[O-] ZINC000429531836 478147924 /nfs/dbraw/zinc/14/79/24/478147924.db2.gz WUIBDBVQDDOVPE-UHFFFAOYSA-N 0 3 349.431 2.732 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCN[C@]1(CO)CCCc2ccccc21 ZINC000440822383 478166396 /nfs/dbraw/zinc/16/63/96/478166396.db2.gz TWNSNHVJBUXHLK-IBGZPJMESA-N 0 3 342.395 2.787 20 5 EFBDHN COc1cc(N2CCN([C@@H]3C[C@H]3C)C[C@@H](C)C2)c(F)cc1[N+](=O)[O-] ZINC000488716349 478173648 /nfs/dbraw/zinc/17/36/48/478173648.db2.gz BTZMEGBHBKHMSU-YRGRVCCFSA-N 0 3 337.395 2.909 20 5 EFBDHN O=[N+]([O-])c1ccn(C2CCN(CCCOc3ccccc3)CC2)n1 ZINC000488738901 478177290 /nfs/dbraw/zinc/17/72/90/478177290.db2.gz VEHCIJZDPRKOBZ-UHFFFAOYSA-N 0 3 330.388 2.897 20 5 EFBDHN CC(=O)c1cc(N2CCN([C@@H]3C[C@@H]3C)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000488750667 478178485 /nfs/dbraw/zinc/17/84/85/478178485.db2.gz OGPRWAMBIYHINH-FHSNZYRGSA-N 0 3 331.416 2.964 20 5 EFBDHN COC(=O)c1ccc([N+](=O)[O-])c(N2CCN([C@@H]3C[C@@H]3C)C[C@H](C)C2)c1 ZINC000488763652 478180840 /nfs/dbraw/zinc/18/08/40/478180840.db2.gz JSXKSTKVZSRSFZ-HEHGZKQESA-N 0 3 347.415 2.548 20 5 EFBDHN CC[C@H]1CN(CC)CCN1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000451733540 478183393 /nfs/dbraw/zinc/18/33/93/478183393.db2.gz VIGBOMIXBGOEBA-HNNXBMFYSA-N 0 3 348.447 2.648 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)N[C@@H]2CCN(C3CC3)C2)cc1[N+](=O)[O-] ZINC000489540612 478255315 /nfs/dbraw/zinc/25/53/15/478255315.db2.gz IUUKYEJTRSRTQU-TZMCWYRMSA-N 0 3 332.404 2.500 20 5 EFBDHN C[C@@H](CNCc1cccc([N+](=O)[O-])c1)c1ccc(S(C)(=O)=O)cc1 ZINC000590643884 478274014 /nfs/dbraw/zinc/27/40/14/478274014.db2.gz DEDJXKBKXSSSKR-ZDUSSCGKSA-N 0 3 348.424 2.892 20 5 EFBDHN O=[N+]([O-])c1cc(CN2CCC[C@H]2[C@@H]2CCCOC2)c2c(c1)COCO2 ZINC000579350058 478276559 /nfs/dbraw/zinc/27/65/59/478276559.db2.gz YQKFKZOIJWOCTI-DYVFJYSZSA-N 0 3 348.399 2.852 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1CNC[C@@H]1CCCC1(F)F)OCCO2 ZINC000590658513 478277199 /nfs/dbraw/zinc/27/71/99/478277199.db2.gz FTPDLPAHWPRRBG-NSHDSACASA-N 0 3 328.315 2.891 20 5 EFBDHN COCCN1CCC[C@H](Nc2nccc3c2cccc3[N+](=O)[O-])C1 ZINC000590689615 478291354 /nfs/dbraw/zinc/29/13/54/478291354.db2.gz AAIAWJZQNGEXPN-ZDUSSCGKSA-N 0 3 330.388 2.666 20 5 EFBDHN CCC(O)(CC)CN(C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000600215414 478292701 /nfs/dbraw/zinc/29/27/01/478292701.db2.gz KGLZAUXRUGTELM-UHFFFAOYSA-N 0 3 346.431 2.978 20 5 EFBDHN C[C@@H]1[C@H](NC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])CCCN1C ZINC000489990655 478297217 /nfs/dbraw/zinc/29/72/17/478297217.db2.gz GAPCEGVRLBVARK-TZMCWYRMSA-N 0 3 334.420 2.612 20 5 EFBDHN O=[N+]([O-])c1ccc2oc(CN[C@H]([C@@H](CO)C3CC3)C3CC3)nc2c1 ZINC000590758054 478323424 /nfs/dbraw/zinc/32/34/24/478323424.db2.gz BSWXLPFZROUYTQ-GUYCJALGSA-N 0 3 331.372 2.623 20 5 EFBDHN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2CCN(C)[C@@H]2C1 ZINC000590776507 478332855 /nfs/dbraw/zinc/33/28/55/478332855.db2.gz AIZXMQDARGEALL-SWLSCSKDSA-N 0 3 349.456 2.871 20 5 EFBDHN CCC(C)(C)N1CCN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000594388884 478355251 /nfs/dbraw/zinc/35/52/51/478355251.db2.gz CEERQFFYLUBCCK-UHFFFAOYSA-N 0 3 337.395 2.609 20 5 EFBDHN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CC[C@]2(CCN(C)C2)C1 ZINC000590830515 478360321 /nfs/dbraw/zinc/36/03/21/478360321.db2.gz MGNOQXUPGGYQMQ-KRWDZBQOSA-N 0 3 332.404 2.771 20 5 EFBDHN O=C(N[C@@H]1CCCN2CCCC[C@@H]12)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000594418184 478373753 /nfs/dbraw/zinc/37/37/53/478373753.db2.gz GYTGNPZFPRRPMX-KGLIPLIRSA-N 0 3 337.807 2.995 20 5 EFBDHN COc1ccc(CNC2CCC(O)(C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000539072405 478400245 /nfs/dbraw/zinc/40/02/45/478400245.db2.gz IDAZGSZQKJZTPZ-UHFFFAOYSA-N 0 3 348.321 2.929 20 5 EFBDHN C[C@H](NC(=O)N1CC[C@H](N2CCCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000590942711 478409267 /nfs/dbraw/zinc/40/92/67/478409267.db2.gz LTRZLPZIHRSBKB-BBRMVZONSA-N 0 3 332.404 2.536 20 5 EFBDHN COc1cc(C(=O)NC[C@@H]2CCCCN2C2CC2)cc([N+](=O)[O-])c1C ZINC000570655443 478409960 /nfs/dbraw/zinc/40/99/60/478409960.db2.gz FWFKOGDJVIHXOR-HNNXBMFYSA-N 0 3 347.415 2.659 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN[C@@H]1C[C@H]1c1cccc(F)c1 ZINC000563002469 478411624 /nfs/dbraw/zinc/41/16/24/478411624.db2.gz GTMNHNUOBRANEN-HRCADAONSA-N 0 3 346.358 2.619 20 5 EFBDHN CC(C)[C@H](N[C@H]1CCc2c1cccc2[N+](=O)[O-])C(=O)N1CCCC1 ZINC000594500690 478414057 /nfs/dbraw/zinc/41/40/57/478414057.db2.gz ASBYTECOPKWUSH-RDJZCZTQSA-N 0 3 331.416 2.819 20 5 EFBDHN O=C(C1CCCC1)N1CC[C@@H](N[C@@H]2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000594502801 478415325 /nfs/dbraw/zinc/41/53/25/478415325.db2.gz OUUAHGVQLZXCRO-RHSMWYFYSA-N 0 3 343.427 2.963 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2NC[C@@H](O)Cc1cccc(F)c1 ZINC000594505941 478416225 /nfs/dbraw/zinc/41/62/25/478416225.db2.gz FZLAAMXIQVVKTJ-WMLDXEAASA-N 0 3 330.359 2.914 20 5 EFBDHN O=[N+]([O-])c1ccc(S(=O)(=O)CCNCC23CCC(CC2)C3)cc1 ZINC000570676141 478417863 /nfs/dbraw/zinc/41/78/63/478417863.db2.gz KBHMGMDASJUOFS-UHFFFAOYSA-N 0 3 338.429 2.538 20 5 EFBDHN CC(C)(C)C(=O)N1CCC(NCc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000594515606 478421961 /nfs/dbraw/zinc/42/19/61/478421961.db2.gz OJPUDSSKCXEBJB-UHFFFAOYSA-N 0 3 337.395 2.861 20 5 EFBDHN COc1cc(CNCCc2ncc(C)cc2C)c([N+](=O)[O-])cc1OC ZINC000594520188 478424674 /nfs/dbraw/zinc/42/46/74/478424674.db2.gz INXVYFFUJZGVKZ-UHFFFAOYSA-N 0 3 345.399 2.956 20 5 EFBDHN O=C(CCNC/C=C/c1ccccc1[N+](=O)[O-])Nc1ccccn1 ZINC000539709572 478427348 /nfs/dbraw/zinc/42/73/48/478427348.db2.gz CYRGZPFUMPOXOD-FNORWQNLSA-N 0 3 326.356 2.621 20 5 EFBDHN CC[C@@H]1CN(C)CCCN1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000597604501 478429403 /nfs/dbraw/zinc/42/94/03/478429403.db2.gz JDNDRYOVYDZZRY-HYVNUMGLSA-N 0 3 331.416 2.641 20 5 EFBDHN CC1(C)CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C(C)(C)CO1 ZINC000591014775 478433574 /nfs/dbraw/zinc/43/35/74/478433574.db2.gz QKJQJZSOGYJEEL-UHFFFAOYSA-N 0 3 335.404 2.813 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@H]1[C@H]1CCCOC1 ZINC000581882197 478458267 /nfs/dbraw/zinc/45/82/67/478458267.db2.gz IOAVCTNMZUBNRK-YOEHRIQHSA-N 0 3 347.415 2.733 20 5 EFBDHN O=[N+]([O-])c1cccc2ncnc(N[C@@H]3CCCN4CCCC[C@@H]34)c21 ZINC000594603322 478462584 /nfs/dbraw/zinc/46/25/84/478462584.db2.gz UCORFUDUILPVLA-OCCSQVGLSA-N 0 3 327.388 2.967 20 5 EFBDHN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N1CCN(C2CCCC2)CC1 ZINC000491183212 478463832 /nfs/dbraw/zinc/46/38/32/478463832.db2.gz AZNJFFWAJRKXIL-YFHOEESVSA-N 0 3 329.400 2.695 20 5 EFBDHN CSc1ccc(C(=O)N2CCC[C@]3(CCN(C)C3)C2)cc1[N+](=O)[O-] ZINC000597713586 478475857 /nfs/dbraw/zinc/47/58/57/478475857.db2.gz CVLJNPVUXVIGGN-QGZVFWFLSA-N 0 3 349.456 2.875 20 5 EFBDHN CSc1ccc(C(=O)N2CCC[C@@]3(CCN(C)C3)C2)cc1[N+](=O)[O-] ZINC000597713585 478476098 /nfs/dbraw/zinc/47/60/98/478476098.db2.gz CVLJNPVUXVIGGN-KRWDZBQOSA-N 0 3 349.456 2.875 20 5 EFBDHN CCOc1ccc(C(=O)N2CCC[C@]3(CCN(C)C3)C2)cc1[N+](=O)[O-] ZINC000597714789 478476289 /nfs/dbraw/zinc/47/62/89/478476289.db2.gz JNGJRMCIJUJTCN-GOSISDBHSA-N 0 3 347.415 2.551 20 5 EFBDHN COC(=O)[C@@H]1CCCC[C@@]1(C)NCc1cc([N+](=O)[O-])ccc1OC ZINC000540578299 478482366 /nfs/dbraw/zinc/48/23/66/478482366.db2.gz WNFXLISCTOBIMB-WMLDXEAASA-N 0 3 336.388 2.815 20 5 EFBDHN Cc1cc(C)cc(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])c1 ZINC000594716000 478509490 /nfs/dbraw/zinc/50/94/90/478509490.db2.gz GATNEXPUSXERAZ-INIZCTEOSA-N 0 3 330.384 2.741 20 5 EFBDHN Cc1c(NC(=O)N2CC[C@@]3(C2)CCCN(C)C3)cccc1[N+](=O)[O-] ZINC000582104828 478511569 /nfs/dbraw/zinc/51/15/69/478511569.db2.gz ZJVWNPRWRKEFBZ-KRWDZBQOSA-N 0 3 332.404 2.853 20 5 EFBDHN COC(=O)c1ccc(-c2cccc([C@@H]3CNCCO3)c2)c([N+](=O)[O-])c1 ZINC000600784482 478519807 /nfs/dbraw/zinc/51/98/07/478519807.db2.gz KLCPVQLUMMMWNB-KRWDZBQOSA-N 0 3 342.351 2.709 20 5 EFBDHN COC[C@@H](N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)C ZINC000541597046 478571951 /nfs/dbraw/zinc/57/19/51/478571951.db2.gz KQXFGEIHHPVPFJ-QMTHXVAHSA-N 0 3 343.811 2.836 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCN(C2CC2)C[C@@H](C)C1 ZINC000591533926 478575487 /nfs/dbraw/zinc/57/54/87/478575487.db2.gz KEVCLRANJLMQJF-GFCCVEGCSA-N 0 3 331.416 2.768 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCN(C(C)(C)C)C1 ZINC000597921980 478576312 /nfs/dbraw/zinc/57/63/12/478576312.db2.gz IRIVCFVRNAPCRN-GFCCVEGCSA-N 0 3 335.404 2.596 20 5 EFBDHN C[C@@H](NC(=O)C[C@@H](N)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000582354739 478576867 /nfs/dbraw/zinc/57/68/67/478576867.db2.gz FAEXAINHTONHSH-CJNGLKHVSA-N 0 3 327.384 2.732 20 5 EFBDHN CC(C)(C)N1CC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000597923737 478577829 /nfs/dbraw/zinc/57/78/29/478577829.db2.gz OVGDYAOSAXHJCZ-VNQPRFMTSA-N 0 3 331.416 2.687 20 5 EFBDHN CC(C)(C)N1CC[C@H](NC(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000597925464 478579633 /nfs/dbraw/zinc/57/96/33/478579633.db2.gz VQLKVBKAFATCCK-JTQLQIEISA-N 0 3 325.796 2.851 20 5 EFBDHN CC(C)(C)N1CC[C@H](NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC000597925791 478580075 /nfs/dbraw/zinc/58/00/75/478580075.db2.gz RFONRUUSSIUOFG-LBPRGKRZSA-N 0 3 330.388 2.679 20 5 EFBDHN CCOc1ccc(C(=O)N[C@H]2CCN(C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000597926256 478581091 /nfs/dbraw/zinc/58/10/91/478581091.db2.gz WVZFIGGQCIXEFZ-ZDUSSCGKSA-N 0 3 335.404 2.596 20 5 EFBDHN COc1cc(CN[C@@H](C)CN2CCCCC2)c([N+](=O)[O-])cc1OC ZINC000594914176 478581691 /nfs/dbraw/zinc/58/16/91/478581691.db2.gz DZINEJQWGHYRSX-ZDUSSCGKSA-N 0 3 337.420 2.576 20 5 EFBDHN O=C(/C=C/c1ccc(F)cc1[N+](=O)[O-])N1CC[C@@H](N2CCCCC2)C1 ZINC000491559888 478587357 /nfs/dbraw/zinc/58/73/57/478587357.db2.gz CAQSPLSOSKSSJB-BIENSFFJSA-N 0 3 347.390 2.834 20 5 EFBDHN Cn1nc(C(F)(F)F)cc1CNCCc1ccccc1[N+](=O)[O-] ZINC000594930392 478592352 /nfs/dbraw/zinc/59/23/52/478592352.db2.gz VVDDDJSKWYFIBS-UHFFFAOYSA-N 0 3 328.294 2.679 20 5 EFBDHN CC[C@H]1CC[C@@H](C)N1Cc1ccc(OCC(=O)OC)c([N+](=O)[O-])c1 ZINC000582448069 478600892 /nfs/dbraw/zinc/60/08/92/478600892.db2.gz PZURWHYZRCVNOL-OCCSQVGLSA-N 0 3 336.388 2.910 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@@H]1CCC[C@@H]([S@@](C)=O)C1 ZINC000594960642 478607050 /nfs/dbraw/zinc/60/70/50/478607050.db2.gz JPRVOYYUACJTFA-BZHBSQSBSA-N 0 3 340.445 2.773 20 5 EFBDHN C[C@@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000601014022 478613612 /nfs/dbraw/zinc/61/36/12/478613612.db2.gz SQNAMWLLYBAPEI-UPJWGTAASA-N 0 3 337.395 2.830 20 5 EFBDHN C[C@@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000601014023 478614345 /nfs/dbraw/zinc/61/43/45/478614345.db2.gz SQNAMWLLYBAPEI-XQQFMLRXSA-N 0 3 337.395 2.830 20 5 EFBDHN CCC[C@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)c1ccccn1 ZINC000591734505 478615603 /nfs/dbraw/zinc/61/56/03/478615603.db2.gz HPFGAFUNRSYEFN-RDJZCZTQSA-N 0 3 345.399 2.861 20 5 EFBDHN COc1cc(CN[C@H]2CC[N@@H+](C3CCCCC3)C2)c([N+](=O)[O-])cc1[O-] ZINC000594978610 478616227 /nfs/dbraw/zinc/61/62/27/478616227.db2.gz SUTBIVNREFDFBA-AWEZNQCLSA-N 0 3 349.431 2.806 20 5 EFBDHN COc1cc(CN[C@H]2CC[N@H+](C3CCCCC3)C2)c([N+](=O)[O-])cc1[O-] ZINC000594978610 478616233 /nfs/dbraw/zinc/61/62/33/478616233.db2.gz SUTBIVNREFDFBA-AWEZNQCLSA-N 0 3 349.431 2.806 20 5 EFBDHN C[C@]1(c2ccccc2)C[C@@H]1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000591744333 478617866 /nfs/dbraw/zinc/61/78/66/478617866.db2.gz UFMLVEMMLUQWQF-NZSAHSFTSA-N 0 3 342.395 2.654 20 5 EFBDHN CCSC1(CNCc2cc(OC)c(OC)cc2[N+](=O)[O-])CC1 ZINC000594986971 478619311 /nfs/dbraw/zinc/61/93/11/478619311.db2.gz PXZSLQVVHIDNMR-UHFFFAOYSA-N 0 3 326.418 2.987 20 5 EFBDHN CN(c1ccccc1)c1ccc(CN[C@H]2C[C@H](O)C2)cc1[N+](=O)[O-] ZINC000594998574 478624042 /nfs/dbraw/zinc/62/40/42/478624042.db2.gz JUGVZIJDLDKOIK-KOMQPUFPSA-N 0 3 327.384 2.976 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)N[C@H]1CCc2nc(C)ncc2C1 ZINC000595006029 478626593 /nfs/dbraw/zinc/62/65/93/478626593.db2.gz DZUBARBHQYUEHI-RISCZKNCSA-N 0 3 342.399 2.910 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCCCOC[C@H]1CCOC1 ZINC000595007940 478627036 /nfs/dbraw/zinc/62/70/36/478627036.db2.gz LIDRRRSBUWXTCO-ZIAGYGMSSA-N 0 3 338.404 2.697 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@]1(N(C)C)CCSC1 ZINC000595014270 478629272 /nfs/dbraw/zinc/62/92/72/478629272.db2.gz WAOHSQUNAOXOMQ-BLLLJJGKSA-N 0 3 339.461 2.691 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)N[C@@H]1CCN(CC(F)(F)F)C1 ZINC000595017518 478629475 /nfs/dbraw/zinc/62/94/75/478629475.db2.gz WGXJANGATDKZNA-GHMZBOCLSA-N 0 3 347.337 2.891 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NCCc1cccc(C(N)=O)c1 ZINC000595014416 478630090 /nfs/dbraw/zinc/63/00/90/478630090.db2.gz PHJPLYKZMXLGFQ-LBPRGKRZSA-N 0 3 343.383 2.596 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCCCOC1CCOCC1 ZINC000595025089 478632752 /nfs/dbraw/zinc/63/27/52/478632752.db2.gz GBCQWIZEXZMTDG-CYBMUJFWSA-N 0 3 338.404 2.840 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@H]1CCN(c2ccccn2)C1 ZINC000595035190 478637462 /nfs/dbraw/zinc/63/74/62/478637462.db2.gz HPGCHYAXBIGFSO-KBPBESRZSA-N 0 3 342.399 2.928 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NCC1([S@](C)=O)CCC1 ZINC000595040325 478638382 /nfs/dbraw/zinc/63/83/82/478638382.db2.gz UAVOQQYZYJJIIZ-SAHAZLINSA-N 0 3 326.418 2.555 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@H](C)C1(OC)CCOCC1 ZINC000595044281 478638542 /nfs/dbraw/zinc/63/85/42/478638542.db2.gz KSHZSBWMOWKGHT-QWHCGFSZSA-N 0 3 338.404 2.838 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H]1CCC[C@@H]([S@](C)=O)C1 ZINC000595059719 478644909 /nfs/dbraw/zinc/64/49/09/478644909.db2.gz JRRJQLBKEALCGM-FHGZLIBBSA-N 0 3 340.445 2.944 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H]1CCC[C@H]([S@](C)=O)C1 ZINC000595059728 478644969 /nfs/dbraw/zinc/64/49/69/478644969.db2.gz JRRJQLBKEALCGM-VMBHHYDMSA-N 0 3 340.445 2.944 20 5 EFBDHN CC(C)(CN[C@H]1CCc2c1cccc2[N+](=O)[O-])[C@@]1(O)CCCOC1 ZINC000595095645 478657436 /nfs/dbraw/zinc/65/74/36/478657436.db2.gz SCVLXYAPDJUTEU-MAUKXSAKSA-N 0 3 334.416 2.739 20 5 EFBDHN O=[N+]([O-])c1sccc1NC[C@]1(O)CCN(Cc2ccccc2)C1 ZINC000601119406 478666662 /nfs/dbraw/zinc/66/66/62/478666662.db2.gz RMOZCOZVOLBJNY-MRXNPFEDSA-N 0 3 333.413 2.705 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C\CNC[C@@H](n1cncn1)C(F)(F)F ZINC000601144177 478684991 /nfs/dbraw/zinc/68/49/91/478684991.db2.gz FYTKTCOBJQMFOE-HSBHDXMMSA-N 0 3 341.293 2.593 20 5 EFBDHN CCc1ccc(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])s1 ZINC000564118226 478696568 /nfs/dbraw/zinc/69/65/68/478696568.db2.gz FVTUCBXMKJFOMW-LBPRGKRZSA-N 0 3 336.413 2.748 20 5 EFBDHN CCOC(=O)Cc1ccc(N[C@@H]2C[C@H](C)N(C3CC3)C2)c([N+](=O)[O-])c1 ZINC000591926907 478710862 /nfs/dbraw/zinc/71/08/62/478710862.db2.gz WUVWKYWFDCYLSN-GXTWGEPZSA-N 0 3 347.415 2.738 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCN(C2CCCCC2)C1 ZINC000598220494 478711985 /nfs/dbraw/zinc/71/19/85/478711985.db2.gz QAOQOQANAVHFDX-CYBMUJFWSA-N 0 3 347.415 2.740 20 5 EFBDHN CC(C)N(CCN1C[C@H](C)O[C@@H](C)C1)Cc1ccc([N+](=O)[O-])cc1 ZINC000595294973 478719547 /nfs/dbraw/zinc/71/95/47/478719547.db2.gz DRGZVRFFXXXUBK-HOTGVXAUSA-N 0 3 335.448 2.914 20 5 EFBDHN C[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1CNc1cc[n-]c(=O)c1[N+](=O)[O-] ZINC000601211045 478724671 /nfs/dbraw/zinc/72/46/71/478724671.db2.gz VRHJJUQSCDPTTC-DZGCQCFKSA-N 0 3 342.399 2.875 20 5 EFBDHN C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNc1cc[n-]c(=O)c1[N+](=O)[O-] ZINC000601211045 478724677 /nfs/dbraw/zinc/72/46/77/478724677.db2.gz VRHJJUQSCDPTTC-DZGCQCFKSA-N 0 3 342.399 2.875 20 5 EFBDHN C[C@@H](CN1CCC(C)CC1)NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000598262000 478730376 /nfs/dbraw/zinc/73/03/76/478730376.db2.gz WUUUPUMLJYHYTP-GJZGRUSLSA-N 0 3 333.432 2.935 20 5 EFBDHN Cc1noc(CN2CC[C@@H](C)N(Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000595333571 478735267 /nfs/dbraw/zinc/73/52/67/478735267.db2.gz KMBQKFLPLDMTSQ-CQSZACIVSA-N 0 3 344.415 2.988 20 5 EFBDHN CCC[C@H]1CN(Cc2ccc(F)cc2[N+](=O)[O-])CCN1CCOC ZINC000595403964 478762355 /nfs/dbraw/zinc/76/23/55/478762355.db2.gz KKWHRYYPPLOXOK-INIZCTEOSA-N 0 3 339.411 2.667 20 5 EFBDHN CCCN1CC[C@H](NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC000598341391 478774918 /nfs/dbraw/zinc/77/49/18/478774918.db2.gz ALYQHNSTNCWKNJ-NSHDSACASA-N 0 3 345.321 2.828 20 5 EFBDHN CCCN1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000598341380 478775301 /nfs/dbraw/zinc/77/53/01/478775301.db2.gz AEBUPTGCISGPJO-GFCCVEGCSA-N 0 3 345.321 2.828 20 5 EFBDHN CCCN1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000598343908 478777773 /nfs/dbraw/zinc/77/77/73/478777773.db2.gz YGENNMQSZJRZTJ-JTQLQIEISA-N 0 3 345.321 2.828 20 5 EFBDHN C[C@@H](CN1CCC(C)CC1)NC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000595445425 478788133 /nfs/dbraw/zinc/78/81/33/478788133.db2.gz BOSHVFYVQKKSJY-AWEZNQCLSA-N 0 3 334.420 2.514 20 5 EFBDHN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC2(C[C@H]1C)CCOCC2 ZINC000592181489 478814878 /nfs/dbraw/zinc/81/48/78/478814878.db2.gz FNHPTRKTFSSLPR-ZIAGYGMSSA-N 0 3 347.415 2.813 20 5 EFBDHN C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC2(C[C@H]1C)CCOCC2 ZINC000592181487 478814920 /nfs/dbraw/zinc/81/49/20/478814920.db2.gz FNHPTRKTFSSLPR-KGLIPLIRSA-N 0 3 347.415 2.813 20 5 EFBDHN C[C@H](CN(C)Cc1ccccc1)NC(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000601410261 478824130 /nfs/dbraw/zinc/82/41/30/478824130.db2.gz JGSLBNIBJUVCJO-CYBMUJFWSA-N 0 3 345.374 2.984 20 5 EFBDHN CCCN(C(=O)Nc1cc([N+](=O)[O-])ccc1OC)[C@@H]1CCN(C)C1 ZINC000592211792 478828457 /nfs/dbraw/zinc/82/84/57/478828457.db2.gz IYDSZELEAXGAMA-CYBMUJFWSA-N 0 3 336.392 2.551 20 5 EFBDHN C[C@@H]1CN(CCN2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C[C@H](C)O1 ZINC000595527549 478835786 /nfs/dbraw/zinc/83/57/86/478835786.db2.gz VBIPZXHXEGCOCD-JZXOWHBKSA-N 0 3 347.459 2.883 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCC1(CS(C)(=O)=O)CCC1 ZINC000572463502 478840445 /nfs/dbraw/zinc/84/04/45/478840445.db2.gz ZHTJCFWSYBSKST-CYBMUJFWSA-N 0 3 340.445 2.769 20 5 EFBDHN Cc1c(CNC(=O)N[C@@H](C)CN2CCC(C)CC2)cccc1[N+](=O)[O-] ZINC000595587350 478871824 /nfs/dbraw/zinc/87/18/24/478871824.db2.gz GVONIYSOGQGSRN-AWEZNQCLSA-N 0 3 348.447 2.823 20 5 EFBDHN COc1ccc(CN(C)[C@H](CO)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000595595166 478874359 /nfs/dbraw/zinc/87/43/59/478874359.db2.gz HPNJLGWCXXHZOK-INIZCTEOSA-N 0 3 330.384 2.639 20 5 EFBDHN C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)NCc1ccc(CO)cc1 ZINC000592392954 478881628 /nfs/dbraw/zinc/88/16/28/478881628.db2.gz KYXOMPXTYZEBGB-ZDUSSCGKSA-N 0 3 343.383 2.594 20 5 EFBDHN CN(C)[C@H](CNc1ncc([N+](=O)[O-])s1)c1ccc(Cl)cc1 ZINC000572685618 478894343 /nfs/dbraw/zinc/89/43/43/478894343.db2.gz LISZPJRSXYCQJW-LLVKDONJSA-N 0 3 326.809 2.841 20 5 EFBDHN CC(C)[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)CCN1 ZINC000598576733 478906396 /nfs/dbraw/zinc/90/63/96/478906396.db2.gz ZAQUQRVGXAGKFS-ZDUSSCGKSA-N 0 3 345.321 2.684 20 5 EFBDHN COc1cc(CN(C)C)ccc1NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000601620033 478911954 /nfs/dbraw/zinc/91/19/54/478911954.db2.gz FKIPYXIFHNEFDI-UHFFFAOYSA-N 0 3 343.383 2.846 20 5 EFBDHN O=c1[nH]cnc2cc(NC[C@H]3CCCCN3C3CC3)c([N+](=O)[O-])cc21 ZINC000572798352 478922131 /nfs/dbraw/zinc/92/21/31/478922131.db2.gz UMFUYIOYWXWGCX-GFCCVEGCSA-N 0 3 343.387 2.672 20 5 EFBDHN COC(=O)c1ccnc(N[C@@H]2CCN(C3CCCCC3)C2)c1[N+](=O)[O-] ZINC000598636239 478938120 /nfs/dbraw/zinc/93/81/20/478938120.db2.gz DOLYUWDNAPOZCI-GFCCVEGCSA-N 0 3 348.403 2.595 20 5 EFBDHN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1CCN(C(C)(C)C)C1 ZINC000595703609 478947746 /nfs/dbraw/zinc/94/77/46/478947746.db2.gz MKOKFIQWSCRNBG-HNNXBMFYSA-N 0 3 348.447 2.652 20 5 EFBDHN CC(C)Oc1nc(N2CCN([C@@H]3C[C@H]3C)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000565227077 478957531 /nfs/dbraw/zinc/95/75/31/478957531.db2.gz VAFUGCGZJJJMOX-SQWLQELKSA-N 0 3 348.447 2.944 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN(C)CC1=CCCOC1 ZINC000595753138 478976887 /nfs/dbraw/zinc/97/68/87/478976887.db2.gz PTYWJACXYNNGBL-UHFFFAOYSA-N 0 3 333.388 2.510 20 5 EFBDHN C[C@@H](NC(=O)N1CC[C@@]2(C1)CCCN(C)C2)c1cccc([N+](=O)[O-])c1 ZINC000583979100 478983957 /nfs/dbraw/zinc/98/39/57/478983957.db2.gz MFYZDHYWZMKKMR-KDOFPFPSSA-N 0 3 346.431 2.783 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C/CN1CCC[C@H](N2CCOCC2)CC1 ZINC000565373406 478992713 /nfs/dbraw/zinc/99/27/13/478992713.db2.gz VBCZCESZNTWYMC-PXPSOEEZSA-N 0 3 345.443 2.795 20 5 EFBDHN CC(C)CC1(NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000595832999 479025137 /nfs/dbraw/zinc/02/51/37/479025137.db2.gz ZARIQXSKNLDEEJ-UHFFFAOYSA-N 0 3 326.418 2.537 20 5 EFBDHN O=C(Nc1ccc([N+](=O)[O-])cc1)C(C[C@H]1COCCO1)C(F)(F)F ZINC000598804286 479030613 /nfs/dbraw/zinc/03/06/13/479030613.db2.gz ZMBYXYLTAGOHJG-NWDGAFQWSA-N 0 3 348.277 2.517 20 5 EFBDHN C[C@@H]1[C@H](C(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)CCN1C ZINC000592767315 479032914 /nfs/dbraw/zinc/03/29/14/479032914.db2.gz VPIFZRCGAQQPIF-DJSGYFEHSA-N 0 3 335.429 2.509 20 5 EFBDHN O=C(CN(CC1CC1)C1CCC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000573419956 479061573 /nfs/dbraw/zinc/06/15/73/479061573.db2.gz POKAHDQQPWYKEC-UHFFFAOYSA-N 0 3 329.400 2.748 20 5 EFBDHN CCCN(C(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F)[C@H]1CCN(C)C1 ZINC000592828035 479062589 /nfs/dbraw/zinc/06/25/89/479062589.db2.gz ADLILAVYQJGXPD-OCCSQVGLSA-N 0 3 337.395 2.780 20 5 EFBDHN CCCN(C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)[C@H]1CCN(C)C1 ZINC000592830317 479065139 /nfs/dbraw/zinc/06/51/39/479065139.db2.gz CVQQNBSCWWCMHC-HNNXBMFYSA-N 0 3 346.431 2.725 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)c2cccc3c2CNC3)cc1[N+](=O)[O-] ZINC000595928716 479077972 /nfs/dbraw/zinc/07/79/72/479077972.db2.gz FJVUHFHAQXCNAF-LBPRGKRZSA-N 0 3 325.368 2.997 20 5 EFBDHN CSC1(CNC(=O)/C=C\c2ccccc2[N+](=O)[O-])CCN(C)CC1 ZINC000493681968 479112413 /nfs/dbraw/zinc/11/24/13/479112413.db2.gz AFMQANRCWRODRM-FPLPWBNLSA-N 0 3 349.456 2.552 20 5 EFBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC(N2CCOC[C@H]2C)CC1 ZINC000573664530 479115674 /nfs/dbraw/zinc/11/56/74/479115674.db2.gz FCDABZKMQZGEFX-CABCVRRESA-N 0 3 333.432 2.841 20 5 EFBDHN O=c1ccc([C@@H]2OCC[C@H]2NCC=Cc2ccccc2[N+](=O)[O-])c[nH]1 ZINC000599002328 479122173 /nfs/dbraw/zinc/12/21/73/479122173.db2.gz OJUWIMIUOITCFN-RINBSWIBSA-N 0 3 341.367 2.828 20 5 EFBDHN O=c1[n-]ccc(NC2CC[NH+](CCc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000596078310 479124384 /nfs/dbraw/zinc/12/43/84/479124384.db2.gz WAJYYAPRUGZSIN-UHFFFAOYSA-N 0 3 342.399 2.814 20 5 EFBDHN O=c1[n-]ccc(NCCC[N@@H+]2CCc3ccccc3C2)c1[N+](=O)[O-] ZINC000596079031 479124528 /nfs/dbraw/zinc/12/45/28/479124528.db2.gz ZNOURPDSZBYSGW-UHFFFAOYSA-N 0 3 328.372 2.556 20 5 EFBDHN O=c1[n-]ccc(NCCC[N@H+]2CCc3ccccc3C2)c1[N+](=O)[O-] ZINC000596079031 479124535 /nfs/dbraw/zinc/12/45/35/479124535.db2.gz ZNOURPDSZBYSGW-UHFFFAOYSA-N 0 3 328.372 2.556 20 5 EFBDHN CCN1CCN([C@@H](C)CNc2ccc(C(F)F)cc2[N+](=O)[O-])CC1 ZINC000596077516 479124950 /nfs/dbraw/zinc/12/49/50/479124950.db2.gz JXYBVNPJHHTOHZ-LBPRGKRZSA-N 0 3 342.390 2.970 20 5 EFBDHN O=c1[n-]ccc(N2CCC[N@H+](CC3CCCCC3)CC2)c1[N+](=O)[O-] ZINC000596082020 479127461 /nfs/dbraw/zinc/12/74/61/479127461.db2.gz GGOHWLBLXNGWPO-UHFFFAOYSA-N 0 3 334.420 2.788 20 5 EFBDHN O=c1[n-]ccc(N2CCC[N@@H+](CC3CCCCC3)CC2)c1[N+](=O)[O-] ZINC000596082020 479127470 /nfs/dbraw/zinc/12/74/70/479127470.db2.gz GGOHWLBLXNGWPO-UHFFFAOYSA-N 0 3 334.420 2.788 20 5 EFBDHN O=c1[n-]ccc(N2CCC[C@@H](C[NH+]3CCCCCC3)C2)c1[N+](=O)[O-] ZINC000596112321 479145038 /nfs/dbraw/zinc/14/50/38/479145038.db2.gz NSDWZXKGBFZKMU-AWEZNQCLSA-N 0 3 334.420 2.788 20 5 EFBDHN CN(C)C/C=C/C(=O)N[C@@H](c1cccc([N+](=O)[O-])c1F)C(F)(F)F ZINC000493759963 479149205 /nfs/dbraw/zinc/14/92/05/479149205.db2.gz RYABGMHBVHYHMB-LVDDQXARSA-N 0 3 349.284 2.571 20 5 EFBDHN C[C@H](CCc1ccccc1[N+](=O)[O-])N[C@@H]1CCN(C(C)(C)C)C1=O ZINC000573844806 479158454 /nfs/dbraw/zinc/15/84/54/479158454.db2.gz LQJZGWGRVFHAAG-UKRRQHHQSA-N 0 3 333.432 2.905 20 5 EFBDHN CN(C)CCN(C(=O)Cc1ccc(F)cc1[N+](=O)[O-])C1CCCC1 ZINC000593085222 479164645 /nfs/dbraw/zinc/16/46/45/479164645.db2.gz WLKWYRPZPBTWRW-UHFFFAOYSA-N 0 3 337.395 2.609 20 5 EFBDHN O=[N+]([O-])c1cc(Br)cnc1N[C@H]1CCN(CC2CC2)C1 ZINC000610769700 479182252 /nfs/dbraw/zinc/18/22/52/479182252.db2.gz GWXBFJULKXRIMM-NSHDSACASA-N 0 3 341.209 2.649 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCC(C)(F)CC1 ZINC000602992830 479184811 /nfs/dbraw/zinc/18/48/11/479184811.db2.gz HHAAUOZYVPDRSE-UHFFFAOYSA-N 0 3 339.367 2.756 20 5 EFBDHN CC(C)(NCCOc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1 ZINC000610844501 479205262 /nfs/dbraw/zinc/20/52/62/479205262.db2.gz SVWAXDMQTQKBKF-UHFFFAOYSA-N 0 3 343.383 2.981 20 5 EFBDHN C[C@H](Nc1ccc([N+](=O)[O-])c(C(N)=O)c1)[C@H](c1ccccc1)N(C)C ZINC000596216736 479205792 /nfs/dbraw/zinc/20/57/92/479205792.db2.gz LKKNWEYFCFSWER-YVEFUNNKSA-N 0 3 342.399 2.797 20 5 EFBDHN C[C@@H]1[C@H](Nc2cc[n-]c(=O)c2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000596235845 479215715 /nfs/dbraw/zinc/21/57/15/479215715.db2.gz NFWLISVEQQPQRI-TZMCWYRMSA-N 0 3 328.372 2.770 20 5 EFBDHN C[C@@H]1[C@H](Nc2cc[n-]c(=O)c2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000596235845 479215722 /nfs/dbraw/zinc/21/57/22/479215722.db2.gz NFWLISVEQQPQRI-TZMCWYRMSA-N 0 3 328.372 2.770 20 5 EFBDHN CC(C)(C)N1CC[C@H](Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1 ZINC000596337401 479258432 /nfs/dbraw/zinc/25/84/32/479258432.db2.gz WNJMGRFHUCRPRW-LBPRGKRZSA-N 0 3 332.404 2.764 20 5 EFBDHN C[C@@H]1CN(c2ncc([N+](=O)[O-])cn2)[C@H](C)[C@@H](C)N1Cc1ccccc1 ZINC000585090418 479278678 /nfs/dbraw/zinc/27/86/78/479278678.db2.gz LUZLHCKTXNGPAX-RBSFLKMASA-N 0 3 341.415 2.873 20 5 EFBDHN CCN1CCN(c2cc(C)nc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H]1C ZINC000611084747 479278982 /nfs/dbraw/zinc/27/89/82/479278982.db2.gz QHJIMFVSXWSEMF-CQSZACIVSA-N 0 3 341.415 2.891 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC[C@H]1[C@@H]1CCCOC1 ZINC000574397577 479278981 /nfs/dbraw/zinc/27/89/81/479278981.db2.gz VISSPDDMSGHNFF-PBHICJAKSA-N 0 3 347.415 2.733 20 5 EFBDHN CCN1CCN(c2cc(C)nc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H]1C ZINC000611084746 479279643 /nfs/dbraw/zinc/27/96/43/479279643.db2.gz QHJIMFVSXWSEMF-AWEZNQCLSA-N 0 3 341.415 2.891 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCn2cc(CNC3CCCCC3)nn2)c1 ZINC000603202785 479301970 /nfs/dbraw/zinc/30/19/70/479301970.db2.gz ZTVFFJSIZQMRHW-UHFFFAOYSA-N 0 3 345.403 2.688 20 5 EFBDHN COc1ccc(CN(C)CCCOc2ccc([N+](=O)[O-])cc2)cn1 ZINC000611209074 479311629 /nfs/dbraw/zinc/31/16/29/479311629.db2.gz DONGMWOBFOQCTQ-UHFFFAOYSA-N 0 3 331.372 2.899 20 5 EFBDHN COC(=O)c1cnc(N[C@H]2CCN(C3CCCCC3)C2)c([N+](=O)[O-])c1 ZINC000596481048 479312259 /nfs/dbraw/zinc/31/22/59/479312259.db2.gz WMIJNXUFSORYAJ-ZDUSSCGKSA-N 0 3 348.403 2.595 20 5 EFBDHN C[C@@H](CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-])N1CCC[C@H](C)C1 ZINC000593408529 479328708 /nfs/dbraw/zinc/32/87/08/479328708.db2.gz PFDIIZXSFRFTJC-STQMWFEESA-N 0 3 337.395 2.513 20 5 EFBDHN CC(C)c1ccc(CN2CCN([C@H]3CCC[C@H]3O)CC2)cc1[N+](=O)[O-] ZINC000611268469 479330638 /nfs/dbraw/zinc/33/06/38/479330638.db2.gz SWMNTISLJRXIMX-PKOBYXMFSA-N 0 3 347.459 2.749 20 5 EFBDHN CCOc1cc(N2CCCN(C[C@H]3CCCO3)CC2)ccc1[N+](=O)[O-] ZINC000611296550 479340494 /nfs/dbraw/zinc/34/04/94/479340494.db2.gz ZBJQKNAWNIIVKG-MRXNPFEDSA-N 0 3 349.431 2.685 20 5 EFBDHN O=C(Cc1ccc(F)cc1[N+](=O)[O-])N1CCC[C@@H]1CN1CCCCC1 ZINC000593448656 479344832 /nfs/dbraw/zinc/34/48/32/479344832.db2.gz UWBDVBKMSJAFMQ-MRXNPFEDSA-N 0 3 349.406 2.753 20 5 EFBDHN CCOCCN(CCn1ccc([N+](=O)[O-])n1)[C@@H]1CCc2ccccc21 ZINC000599625485 479358339 /nfs/dbraw/zinc/35/83/39/479358339.db2.gz MCGTYVASJMHEMA-QGZVFWFLSA-N 0 3 344.415 2.817 20 5 EFBDHN C[C@H](NC[C@H](O)CN(C)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000611383428 479363241 /nfs/dbraw/zinc/36/32/41/479363241.db2.gz KHIWOZKOOAOOIQ-KXBFYZLASA-N 0 3 343.427 2.738 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNCCCn1cccn1 ZINC000602512466 479376112 /nfs/dbraw/zinc/37/61/12/479376112.db2.gz YTABURIOOCPIPR-UHFFFAOYSA-N 0 3 328.294 2.990 20 5 EFBDHN O=[N+]([O-])c1sc(CNC[C@H]2CCCOC2)cc1Br ZINC000602518457 479379416 /nfs/dbraw/zinc/37/94/16/479379416.db2.gz NPGOOTWRSCZVIQ-MRVPVSSYSA-N 0 3 335.223 2.935 20 5 EFBDHN C[C@H](CN1CCC[C@@H](C)C1)NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602524509 479381160 /nfs/dbraw/zinc/38/11/60/479381160.db2.gz KVJHZCMUFBHBGP-CHWSQXEVSA-N 0 3 332.404 2.946 20 5 EFBDHN C[C@](O)(CNCc1cc(Br)c([N+](=O)[O-])s1)C1CC1 ZINC000602546984 479391016 /nfs/dbraw/zinc/39/10/16/479391016.db2.gz VTMHHTKWBIUJHH-NSHDSACASA-N 0 3 335.223 2.669 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN[C@@H]1CCN(C2CC2)C1 ZINC000602545812 479391088 /nfs/dbraw/zinc/39/10/88/479391088.db2.gz PYGIGSBYSQXYHM-GFCCVEGCSA-N 0 3 329.322 2.940 20 5 EFBDHN CSC[C@@](C)(O)CNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602550674 479392933 /nfs/dbraw/zinc/39/29/33/479392933.db2.gz MKGLHDLUWRSUIV-LBPRGKRZSA-N 0 3 338.351 2.817 20 5 EFBDHN C[C@@]1(CNCc2cc(Br)c([N+](=O)[O-])s2)CCOC1 ZINC000602550541 479393056 /nfs/dbraw/zinc/39/30/56/479393056.db2.gz KHIDMWVHHLOSLB-NSHDSACASA-N 0 3 335.223 2.935 20 5 EFBDHN O=[N+]([O-])c1sc(CN[C@H](CO)CC2CC2)cc1Br ZINC000602583467 479409573 /nfs/dbraw/zinc/40/95/73/479409573.db2.gz WYPJBNQDQFBPNX-QMMMGPOBSA-N 0 3 335.223 2.669 20 5 EFBDHN O=[N+]([O-])c1sc(CNCC2(CO)CCC2)cc1Br ZINC000602606193 479419852 /nfs/dbraw/zinc/41/98/52/479419852.db2.gz BYAYQEUHAWZWJU-UHFFFAOYSA-N 0 3 335.223 2.671 20 5 EFBDHN CC[C@H](CN1CCCC1)NC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000588623167 479422929 /nfs/dbraw/zinc/42/29/29/479422929.db2.gz NAZZELYXOBSRNW-MRXNPFEDSA-N 0 3 348.447 2.653 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN[C@@H]1CCn2ccnc2C1 ZINC000602621669 479428531 /nfs/dbraw/zinc/42/85/31/479428531.db2.gz ISNOBYVEZQMJSZ-GFCCVEGCSA-N 0 3 340.305 2.915 20 5 EFBDHN Cc1nccc([C@H]2CCCN(CCOc3cccc([N+](=O)[O-])c3)C2)n1 ZINC000603834185 479435313 /nfs/dbraw/zinc/43/53/13/479435313.db2.gz KLZHDFIEEGASPI-HNNXBMFYSA-N 0 3 342.399 2.952 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN[C@H]3CCc4cccnc4CC3)nc2c1 ZINC000602636476 479439332 /nfs/dbraw/zinc/43/93/32/479439332.db2.gz HQQWZKNPNLYPMF-ZDUSSCGKSA-N 0 3 337.383 2.903 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN[C@@H]3CCc4cccnc4CC3)nc2c1 ZINC000602636473 479439380 /nfs/dbraw/zinc/43/93/80/479439380.db2.gz HQQWZKNPNLYPMF-CYBMUJFWSA-N 0 3 337.383 2.903 20 5 EFBDHN CC(=O)c1ccc([N+](=O)[O-])cc1N1CCN(c2ccncc2)CC1 ZINC000588806979 479443501 /nfs/dbraw/zinc/44/35/01/479443501.db2.gz SRLBZOWWSZSBSP-UHFFFAOYSA-N 0 3 326.356 2.519 20 5 EFBDHN CN(CCN(C)C1CC1)Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602662328 479457296 /nfs/dbraw/zinc/45/72/96/479457296.db2.gz LCLIBMUWXGHMFG-UHFFFAOYSA-N 0 3 348.266 2.945 20 5 EFBDHN C[C@@H](CCO)CCNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602670966 479464597 /nfs/dbraw/zinc/46/45/97/479464597.db2.gz GHDHUTZDDHZCEO-MRVPVSSYSA-N 0 3 337.239 2.917 20 5 EFBDHN O=[N+]([O-])c1ccc(CCNc2cccc(CN3CC[C@H](O)C3)c2)cc1 ZINC000602676294 479468098 /nfs/dbraw/zinc/46/80/98/479468098.db2.gz LVNPBFXJSLHBDU-IBGZPJMESA-N 0 3 341.411 2.816 20 5 EFBDHN CN1CC[C@@H]2CN(Cc3ccc(C(F)(F)F)cc3[N+](=O)[O-])C[C@@H]21 ZINC000602683488 479473556 /nfs/dbraw/zinc/47/35/56/479473556.db2.gz BYZPOIKBBGLYKU-RISCZKNCSA-N 0 3 329.322 2.750 20 5 EFBDHN CN(C)[C@H](CNc1c(Cl)cncc1[N+](=O)[O-])c1cccs1 ZINC000589104257 479478091 /nfs/dbraw/zinc/47/80/91/479478091.db2.gz YJGQOGKTSDHIHG-SNVBAGLBSA-N 0 3 326.809 2.841 20 5 EFBDHN Cn1c(C(=O)N2CCCN(CC3CCCCC3)CC2)ccc1[N+](=O)[O-] ZINC000604187838 479482420 /nfs/dbraw/zinc/48/24/20/479482420.db2.gz CZWNRHKLRRMXES-UHFFFAOYSA-N 0 3 348.447 2.662 20 5 EFBDHN CCOc1ccc(C(=O)N(CC)C2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000599986780 479488527 /nfs/dbraw/zinc/48/85/27/479488527.db2.gz ZZZSBJWTZRVNMJ-UHFFFAOYSA-N 0 3 335.404 2.550 20 5 EFBDHN O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2NCc2ccccc2CO)n1 ZINC000618564662 479494080 /nfs/dbraw/zinc/49/40/80/479494080.db2.gz BJDRXOMGGFLQOM-JKSUJKDBSA-N 0 3 330.388 2.557 20 5 EFBDHN CC[C@H](CN1CCCC1)NC(=O)Nc1ccc(OC)c([N+](=O)[O-])c1 ZINC000611824589 479494741 /nfs/dbraw/zinc/49/47/41/479494741.db2.gz ROCCHGUPNFKPQR-GFCCVEGCSA-N 0 3 336.392 2.599 20 5 EFBDHN CN(CCN1CCCCC1)C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000593884124 479496879 /nfs/dbraw/zinc/49/68/79/479496879.db2.gz SZJSPJKGMXTZQW-DLBZAZTESA-N 0 3 331.416 2.643 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1CN[C@@H]1[C@H]3Cc4ccccc4[C@@H]13)OCCO2 ZINC000589199353 479497618 /nfs/dbraw/zinc/49/76/18/479497618.db2.gz FPDHSHURWQXDTR-GDIGMMSISA-N 0 3 338.363 2.794 20 5 EFBDHN CCOc1ccccc1CNC[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000575916639 479500596 /nfs/dbraw/zinc/50/05/96/479500596.db2.gz TVFIJDDVSYGZQI-HNNXBMFYSA-N 0 3 346.383 2.523 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@H]2CCN(Cc3cccc4n[nH]cc43)C2)nc1 ZINC000600117553 479525367 /nfs/dbraw/zinc/52/53/67/479525367.db2.gz WVMQTDWDWHBGMX-ZDUSSCGKSA-N 0 3 338.371 2.553 20 5 EFBDHN CN(C)CCN(CC1CCCCC1)C(=O)c1cc([N+](=O)[O-])cn1C ZINC000604549988 479538611 /nfs/dbraw/zinc/53/86/11/479538611.db2.gz KZYBFTMXSICWDL-UHFFFAOYSA-N 0 3 336.436 2.517 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN(C)CCCOc1ccccc1C ZINC000602768313 479539427 /nfs/dbraw/zinc/53/94/27/479539427.db2.gz MVHAGMHVLWCSSA-UHFFFAOYSA-N 0 3 332.404 2.809 20 5 EFBDHN COc1ccccc1[C@H]1CCCN1CCn1c(C)ncc1[N+](=O)[O-] ZINC000602771427 479541268 /nfs/dbraw/zinc/54/12/68/479541268.db2.gz ACGKIOMDTRZJII-OAHLLOKOSA-N 0 3 330.388 2.945 20 5 EFBDHN CCC(C)(C)N1CCN(CC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000594020877 479551734 /nfs/dbraw/zinc/55/17/34/479551734.db2.gz NGHFHQWPRGZFAP-UHFFFAOYSA-N 0 3 348.447 2.648 20 5 EFBDHN CCC(C)(C)N1CCN([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000594020667 479551749 /nfs/dbraw/zinc/55/17/49/479551749.db2.gz KRZMDRPBTMWQKQ-CQSZACIVSA-N 0 3 348.447 2.728 20 5 EFBDHN COCc1csc(CN2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1 ZINC000597115701 479580696 /nfs/dbraw/zinc/58/06/96/479580696.db2.gz BPKMLMVRHMHRDC-UHFFFAOYSA-N 0 3 336.417 2.836 20 5 EFBDHN COc1ccc(CN[C@@H]2CC[C@](O)(C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000589939147 479584068 /nfs/dbraw/zinc/58/40/68/479584068.db2.gz ULUSQKAMMFWZLT-ZWNOBZJWSA-N 0 3 334.294 2.539 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1CN1CCCN(c2ccncc2)CC1 ZINC000602847221 479589785 /nfs/dbraw/zinc/58/97/85/479589785.db2.gz JUMLRQVJVWPUSV-UHFFFAOYSA-N 0 3 342.399 2.711 20 5 EFBDHN O=C(N[C@H]1CCCN2CCCC[C@H]12)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000594195114 479625398 /nfs/dbraw/zinc/62/53/98/479625398.db2.gz CCGQMLURLYMMEX-XWTMOSNGSA-N 0 3 343.427 2.831 20 5 EFBDHN COC(=O)[C@H]1C[C@@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000597217335 479625517 /nfs/dbraw/zinc/62/55/17/479625517.db2.gz CJRXOLVUMOLBRM-BETUJISGSA-N 0 3 330.340 2.896 20 5 EFBDHN C[C@H](C(=O)N[C@@H]1CCCN2CCCC[C@@H]12)c1ccc([N+](=O)[O-])cc1F ZINC000594196056 479626685 /nfs/dbraw/zinc/62/66/85/479626685.db2.gz KMYKXGFMCBRJPV-VUCTXSBTSA-N 0 3 349.406 2.971 20 5 EFBDHN O=C(CCNc1ccccc1[N+](=O)[O-])N[C@@H]1CCCN2CCCC[C@H]12 ZINC000594204032 479631202 /nfs/dbraw/zinc/63/12/02/479631202.db2.gz WMONILSEJXTTID-HZPDHXFCSA-N 0 3 346.431 2.530 20 5 EFBDHN O=C(CCNc1ccccc1[N+](=O)[O-])N[C@H]1CCCN2CCCC[C@@H]12 ZINC000594204029 479631676 /nfs/dbraw/zinc/63/16/76/479631676.db2.gz WMONILSEJXTTID-HOTGVXAUSA-N 0 3 346.431 2.530 20 5 EFBDHN CCOC(=O)[C@]1(C)CCC[C@H]1NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000597240070 479638880 /nfs/dbraw/zinc/63/88/80/479638880.db2.gz NRBZUOLZBZGXJO-NVXWUHKLSA-N 0 3 336.388 2.815 20 5 EFBDHN COC(=O)COc1ccc(CN(C)C[C@H]2CC2(C)C)cc1[N+](=O)[O-] ZINC000597255767 479646614 /nfs/dbraw/zinc/64/66/14/479646614.db2.gz ZHPQJULNPBWBJW-CYBMUJFWSA-N 0 3 336.388 2.625 20 5 EFBDHN C[C@H](C(=O)NCCN(C)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000579184484 479669621 /nfs/dbraw/zinc/66/96/21/479669621.db2.gz KCHOJUMPNWDHKE-HNNXBMFYSA-N 0 3 341.411 2.947 20 5 EFBDHN C[C@@H](C(=O)NCCN(C)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000579184485 479669878 /nfs/dbraw/zinc/66/98/78/479669878.db2.gz KCHOJUMPNWDHKE-OAHLLOKOSA-N 0 3 341.411 2.947 20 5 EFBDHN C[C@H](CC1CCC1)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000612576124 479697772 /nfs/dbraw/zinc/69/77/72/479697772.db2.gz LXTKAQBLFDUDCP-GFCCVEGCSA-N 0 3 326.418 2.537 20 5 EFBDHN COc1c(C(=O)N2CCC[C@@H]2CN2CCCCC2)cccc1[N+](=O)[O-] ZINC000619434412 479788838 /nfs/dbraw/zinc/78/88/38/479788838.db2.gz ZXQBVVXBMYUICZ-CQSZACIVSA-N 0 3 347.415 2.694 20 5 EFBDHN CC[C@H]1CN(C)CCCN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000619566936 479829826 /nfs/dbraw/zinc/82/98/26/479829826.db2.gz BGDYUUFOGFHNJD-HNNXBMFYSA-N 0 3 346.431 2.725 20 5 EFBDHN CC[C@H]1CN(C)CCCN1C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000619579022 479834627 /nfs/dbraw/zinc/83/46/27/479834627.db2.gz ZEEWZBQVTNSBQD-ZDUSSCGKSA-N 0 3 339.823 2.733 20 5 EFBDHN C[C@@H](CN1CCN(c2ccc([N+](=O)[O-])nc2)CC1)c1ccccc1 ZINC000609739460 480200618 /nfs/dbraw/zinc/20/06/18/480200618.db2.gz ODUBXBQDBAYXQN-HNNXBMFYSA-N 0 3 326.400 2.916 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1CNCC1(O)CCCCCC1)OCCO2 ZINC000609804999 480207420 /nfs/dbraw/zinc/20/74/20/480207420.db2.gz JIZOYYPKAJEJAP-UHFFFAOYSA-N 0 3 336.388 2.541 20 5 EFBDHN CC[C@@H](CN1CCCC1)NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000609833417 480211016 /nfs/dbraw/zinc/21/10/16/480211016.db2.gz HPTKJJFOZDLSIC-LBPRGKRZSA-N 0 3 325.796 2.852 20 5 EFBDHN CC[C@@H](CN1CCCC1)NC(=O)c1ccc(SC)c([N+](=O)[O-])c1 ZINC000609877121 480215841 /nfs/dbraw/zinc/21/58/41/480215841.db2.gz JUNKOFWXTIIXOE-ZDUSSCGKSA-N 0 3 337.445 2.921 20 5 EFBDHN CC[C@@H](CN1CCCC1)NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000609877965 480216550 /nfs/dbraw/zinc/21/65/50/480216550.db2.gz RHWSSUUPDKDQKA-LBPRGKRZSA-N 0 3 330.388 2.680 20 5 EFBDHN CN(C)Cc1ccccc1NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000610290322 480273583 /nfs/dbraw/zinc/27/35/83/480273583.db2.gz OCMWDEZFWBMHJB-UHFFFAOYSA-N 0 3 342.399 2.731 20 5 EFBDHN C[C@@H](NC[C@H]1CCCN1c1cccnn1)c1ccccc1[N+](=O)[O-] ZINC000610342234 480284300 /nfs/dbraw/zinc/28/43/00/480284300.db2.gz ALKLNQLSDNIRLK-ZIAGYGMSSA-N 0 3 327.388 2.704 20 5 EFBDHN Cc1ccc([C@H](C)NCc2ccc(CC(N)=O)cc2)cc1[N+](=O)[O-] ZINC000610517936 480327466 /nfs/dbraw/zinc/32/74/66/480327466.db2.gz WMPMNXXJHHPHJQ-ZDUSSCGKSA-N 0 3 327.384 2.782 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N[C@@H]2CCN(CC3CC3)C2)cc1[N+](=O)[O-] ZINC000610595838 480347132 /nfs/dbraw/zinc/34/71/32/480347132.db2.gz MSPQCYJOFUIQGF-XJKSGUPXSA-N 0 3 346.431 2.748 20 5 EFBDHN C[C@@H]1C[C@H](c2ccccc2)CN1CCn1cc([N+](=O)[O-])ccc1=O ZINC000132069536 533995751 /nfs/dbraw/zinc/99/57/51/533995751.db2.gz VVVWNQZUEFBRMX-ZBFHGGJFSA-N 0 3 327.384 2.635 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCNC1(c2cccc(Cl)c2)CC1 ZINC000179667512 534320670 /nfs/dbraw/zinc/32/06/70/534320670.db2.gz QMSBXAPQPSIIKI-UHFFFAOYSA-N 0 3 333.775 2.689 20 5 EFBDHN CC(C)[C@H](C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)N1CCCCC1 ZINC000088349637 519809205 /nfs/dbraw/zinc/80/92/05/519809205.db2.gz PMFOYILVBMUGKU-GOSISDBHSA-N 0 3 345.443 2.990 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@@H](C)CO[C@H]2CCOC2)cc1[N+](=O)[O-] ZINC000245507339 521260320 /nfs/dbraw/zinc/26/03/20/521260320.db2.gz PTGLQQYDUBDHBO-YDHLFZDLSA-N 0 3 338.404 2.838 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@@H](C)[C@H](CO)SC)cc1[N+](=O)[O-] ZINC000245507640 521260936 /nfs/dbraw/zinc/26/09/36/521260936.db2.gz QMKXIYZITLRQQT-PGUXBMHVSA-N 0 3 328.434 2.757 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000078638043 521589685 /nfs/dbraw/zinc/58/96/85/521589685.db2.gz FQHIXAJCJXXULP-MRXNPFEDSA-N 0 3 344.415 2.540 20 5 EFBDHN COc1cc(C(=O)NCc2ccc(CN(C)C)cc2)ccc1[N+](=O)[O-] ZINC000101629150 522124334 /nfs/dbraw/zinc/12/43/34/522124334.db2.gz VYYIDYABEZOVRK-UHFFFAOYSA-N 0 3 343.383 2.595 20 5 EFBDHN CC[C@@H]1CCCCN1CCNC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000154767908 523169499 /nfs/dbraw/zinc/16/94/99/523169499.db2.gz GVSCYKWRPRNYKM-CQSZACIVSA-N 0 3 337.395 2.657 20 5 EFBDHN CC[C@H]1CN(C)c2ccccc2CN1CCn1cc([N+](=O)[O-])cn1 ZINC000088562284 523267793 /nfs/dbraw/zinc/26/77/93/523267793.db2.gz KWQPMJOSLALLJN-HNNXBMFYSA-N 0 3 329.404 2.522 20 5 EFBDHN CN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000119171530 523975179 /nfs/dbraw/zinc/97/51/79/523975179.db2.gz GEUIUSQJXSJESX-IAQYHMDHSA-N 0 3 337.807 2.805 20 5 EFBDHN C[C@H]1CCN(CCOc2ccc([N+](=O)[O-])cc2)C[C@H]1n1ccnc1 ZINC000245608565 524289749 /nfs/dbraw/zinc/28/97/49/524289749.db2.gz NPUJQBVMCJZASI-WMLDXEAASA-N 0 3 330.388 2.753 20 5 EFBDHN C[C@@H](CNC(=O)NCCCCc1ccc([N+](=O)[O-])cc1)N(C)C1CC1 ZINC000120178913 524676654 /nfs/dbraw/zinc/67/66/54/524676654.db2.gz URKXKYDYFDIBOH-AWEZNQCLSA-N 0 3 348.447 2.699 20 5 EFBDHN C[C@@H](CNC(=O)NCCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](C)C1 ZINC000119279109 524679302 /nfs/dbraw/zinc/67/93/02/524679302.db2.gz IFRSTZDLFRWGBA-CABCVRRESA-N 0 3 348.447 2.557 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)c2ccccc2[N+](=O)[O-])CN1Cc1ccccc1 ZINC000137457162 524918591 /nfs/dbraw/zinc/91/85/91/524918591.db2.gz NQYBJGQNILBBBE-HOCLYGCPSA-N 0 3 339.395 2.988 20 5 EFBDHN C[C@H](NCCn1cc([N+](=O)[O-])ccc1=O)c1ccc2c(c1)CCCC2 ZINC000181924502 525377003 /nfs/dbraw/zinc/37/70/03/525377003.db2.gz DOQDQRLDGQEFDF-AWEZNQCLSA-N 0 3 341.411 2.986 20 5 EFBDHN C[C@@H](NCCNC(=O)c1c(F)cccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000178655930 525450779 /nfs/dbraw/zinc/45/07/79/525450779.db2.gz FNUUIYUXRAWMHQ-LLVKDONJSA-N 0 3 349.337 2.954 20 5 EFBDHN Cc1c(CN2CCC[C@@H](c3nnc4n3CCC4)C2)cccc1[N+](=O)[O-] ZINC000195520585 525706192 /nfs/dbraw/zinc/70/61/92/525706192.db2.gz JIWSAUPCQFNZOS-OAHLLOKOSA-N 0 3 341.415 2.821 20 5 EFBDHN C[C@H](C(=O)N1CC[C@H](N2CCCC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000185170785 525996478 /nfs/dbraw/zinc/99/64/78/525996478.db2.gz FEWKSDJUTQJXHE-JSGCOSHPSA-N 0 3 335.379 2.534 20 5 EFBDHN CC(C)[C@H](C(=O)NCCc1ccccc1[N+](=O)[O-])N1CCCCC1 ZINC000359522469 534897479 /nfs/dbraw/zinc/89/74/79/534897479.db2.gz XQQNOBMZJAJIBK-QGZVFWFLSA-N 0 3 333.432 2.764 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[C@H](N2CCCC2)C1 ZINC000085621059 526058157 /nfs/dbraw/zinc/05/81/57/526058157.db2.gz IUAWNBMBTIWQPH-AWEZNQCLSA-N 0 3 332.404 2.914 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN[C@H](C)c1cccnc1 ZINC000182883425 526078533 /nfs/dbraw/zinc/07/85/33/526078533.db2.gz PYESDUGSKSYHNQ-CYBMUJFWSA-N 0 3 328.372 2.978 20 5 EFBDHN CCCN1CCC[C@H]1CNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000343624421 534908869 /nfs/dbraw/zinc/90/88/69/534908869.db2.gz WMWXSNMQEGQHEZ-ZDUSSCGKSA-N 0 3 325.796 2.852 20 5 EFBDHN O=C(CC1CCN(CCc2ccc([N+](=O)[O-])cc2)CC1)N1CCCC1 ZINC000079997849 526366391 /nfs/dbraw/zinc/36/63/91/526366391.db2.gz FKERHDXLRFQWGJ-UHFFFAOYSA-N 0 3 345.443 2.862 20 5 EFBDHN O=C(NC[C@H]1CCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000193776884 526614610 /nfs/dbraw/zinc/61/46/10/526614610.db2.gz DADCGALLNGLTLX-MRXNPFEDSA-N 0 3 339.395 2.847 20 5 EFBDHN CC(C)(NCCn1cc([N+](=O)[O-])ccc1=O)c1cccc(Cl)c1 ZINC000179599512 527292132 /nfs/dbraw/zinc/29/21/32/527292132.db2.gz PFLQXDWYVPOMDI-UHFFFAOYSA-N 0 3 335.791 2.935 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@H]2CCN(CCOc3ccccc3)C2)nc1 ZINC000118866411 527368080 /nfs/dbraw/zinc/36/80/80/527368080.db2.gz JEWLCRGACKLXAI-AWEZNQCLSA-N 0 3 328.372 2.555 20 5 EFBDHN Cc1nccn1CCCCN1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000119136032 527394686 /nfs/dbraw/zinc/39/46/86/527394686.db2.gz WBUFKBHFYDFNIJ-UHFFFAOYSA-N 0 3 343.431 2.702 20 5 EFBDHN CC(C)C1CCC(N2CCN(CCn3ccc([N+](=O)[O-])n3)CC2)CC1 ZINC000175925910 527641608 /nfs/dbraw/zinc/64/16/08/527641608.db2.gz CTIVBZWKTWALEE-UHFFFAOYSA-N 0 3 349.479 2.624 20 5 EFBDHN CCN(CC)CCCCNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000181489369 528100490 /nfs/dbraw/zinc/10/04/90/528100490.db2.gz BCTQTURCUYNVNU-UHFFFAOYSA-N 0 3 349.478 2.594 20 5 EFBDHN CC(C)C[C@H](CNC(=O)c1cc(Cl)ccc1[N+](=O)[O-])N(C)C ZINC000132486168 528529843 /nfs/dbraw/zinc/52/98/43/528529843.db2.gz ANPJHUBEQCFRIJ-GFCCVEGCSA-N 0 3 327.812 2.954 20 5 EFBDHN CCOc1ccc([C@@H](C)N[C@H](C)CO[C@@H]2CCOC2)cc1[N+](=O)[O-] ZINC000154192780 528598869 /nfs/dbraw/zinc/59/88/69/528598869.db2.gz PTGLQQYDUBDHBO-UMVBOHGHSA-N 0 3 338.404 2.838 20 5 EFBDHN CCOc1ccc([C@H](C)NC[C@@]2(O)CCSC2)cc1[N+](=O)[O-] ZINC000154118864 528606903 /nfs/dbraw/zinc/60/69/03/528606903.db2.gz GMMVRNHUJXHEHW-NHYWBVRUSA-N 0 3 326.418 2.512 20 5 EFBDHN CCOC[C@H](N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C)C(C)C ZINC000189804181 528993663 /nfs/dbraw/zinc/99/36/63/528993663.db2.gz LZXRDYLBIOBZCY-ZFWWWQNUSA-N 0 3 337.420 2.881 20 5 EFBDHN CC(C)Oc1cc(C(=O)N2CC[C@@]3(CCN(C)C3)C2)ccc1[N+](=O)[O-] ZINC000412354545 534944111 /nfs/dbraw/zinc/94/41/11/534944111.db2.gz BNKZHZDMOIUGGE-GOSISDBHSA-N 0 3 347.415 2.550 20 5 EFBDHN CC(C)[C@H](CN(C)Cc1ccccc1)Nc1c([N+](=O)[O-])ncn1C ZINC000346224641 534985318 /nfs/dbraw/zinc/98/53/18/534985318.db2.gz RVZRMKZQXAPQJO-HNNXBMFYSA-N 0 3 331.420 2.897 20 5 EFBDHN CC(C)CN(C(=O)COc1cccc([N+](=O)[O-])c1)C1CCN(C)CC1 ZINC000265078503 535006566 /nfs/dbraw/zinc/00/65/66/535006566.db2.gz WMFVHZONFKMQPO-UHFFFAOYSA-N 0 3 349.431 2.552 20 5 EFBDHN CC(C)(C(=O)N1CCC[C@@H](N2CCCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000352041908 535015757 /nfs/dbraw/zinc/01/57/57/535015757.db2.gz FRGHPVXZAXSGLL-QGZVFWFLSA-N 0 3 345.443 2.959 20 5 EFBDHN CC1(C)[C@H](NCc2cc([N+](=O)[O-])cc3c2OCOC3)[C@H]2CCCO[C@H]21 ZINC000344680554 535072492 /nfs/dbraw/zinc/07/24/92/535072492.db2.gz NZSPRINOBIOIDN-DJIMGWMZSA-N 0 3 348.399 2.755 20 5 EFBDHN CCOc1cccc(NC2CCN([C@H]3CCOC3)CC2)c1[N+](=O)[O-] ZINC000364855847 535469622 /nfs/dbraw/zinc/46/96/22/535469622.db2.gz NFVTXIMTXWIKJV-AWEZNQCLSA-N 0 3 335.404 2.659 20 5 EFBDHN CCN1CCCC[C@H]1C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000351630705 535496831 /nfs/dbraw/zinc/49/68/31/535496831.db2.gz QNSKJSAEGJMUPB-AWEZNQCLSA-N 0 3 339.823 2.781 20 5 EFBDHN CCN1CCCN(Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000425393320 535517509 /nfs/dbraw/zinc/51/75/09/535517509.db2.gz ISDUSELYPCPADO-UHFFFAOYSA-N 0 3 342.237 2.885 20 5 EFBDHN CN(C)CCOC1CCN(c2ccc([N+](=O)[O-])c3cnccc32)CC1 ZINC000352938945 535893182 /nfs/dbraw/zinc/89/31/82/535893182.db2.gz JHZDTSRRKQTRPU-UHFFFAOYSA-N 0 3 344.415 2.690 20 5 EFBDHN CC[C@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@@H]1CC1(C)C ZINC000419324269 535895630 /nfs/dbraw/zinc/89/56/30/535895630.db2.gz VKYFOXIXLNZGSP-STQMWFEESA-N 0 3 335.404 2.956 20 5 EFBDHN CN(C)CCOc1cccc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)c1 ZINC000344209562 535913176 /nfs/dbraw/zinc/91/31/76/535913176.db2.gz BAWJPEQDSPGLJW-UHFFFAOYSA-N 0 3 347.346 2.927 20 5 EFBDHN CN(C)Cc1ccccc1C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000433311060 536044191 /nfs/dbraw/zinc/04/41/91/536044191.db2.gz KVSSGQFVBLOLID-UHFFFAOYSA-N 0 3 327.384 2.629 20 5 EFBDHN CN1CCCC(C)(C)[C@H]1CNC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000344718651 536350466 /nfs/dbraw/zinc/35/04/66/536350466.db2.gz PXLYWFZRAZEIRK-MRXNPFEDSA-N 0 3 349.431 2.600 20 5 EFBDHN CN1CCCC(C)(C)[C@H]1CNC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000344721274 536350728 /nfs/dbraw/zinc/35/07/28/536350728.db2.gz SAFMFKZQVBQGQY-OAHLLOKOSA-N 0 3 337.395 2.513 20 5 EFBDHN COC1([C@@H](C)NCC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CCC1 ZINC000412018787 536704700 /nfs/dbraw/zinc/70/47/00/536704700.db2.gz CIJMGIAYBBHHBQ-SNVBAGLBSA-N 0 3 341.795 2.734 20 5 EFBDHN C[C@@H](NC[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1cccc([N+](=O)[O-])c1 ZINC000754250514 575410700 /nfs/dbraw/zinc/41/07/00/575410700.db2.gz JBXPGHSXVIPXKU-BDJLRTHQSA-N 0 3 331.328 2.887 20 5 EFBDHN C[C@@H](C(=O)NC[C@H](C)N1CCCCC1)c1ccc([N+](=O)[O-])cc1F ZINC000754364011 575425136 /nfs/dbraw/zinc/42/51/36/575425136.db2.gz DZIKZIKCFWJUQS-QWHCGFSZSA-N 0 3 337.395 2.828 20 5 EFBDHN C[C@H](CNC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F)N1CCCCC1 ZINC000754364007 575425354 /nfs/dbraw/zinc/42/53/54/575425354.db2.gz DZIKZIKCFWJUQS-CHWSQXEVSA-N 0 3 337.395 2.828 20 5 EFBDHN CN(C)CCN(Cc1ccco1)C(=S)Nc1ccc([N+](=O)[O-])cc1 ZINC000755733429 575625190 /nfs/dbraw/zinc/62/51/90/575625190.db2.gz RSKHPMHEIXCQTQ-UHFFFAOYSA-N 0 3 348.428 2.948 20 5 EFBDHN CN(CCCNC(=O)C1CCC1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000759998065 575969792 /nfs/dbraw/zinc/96/97/92/575969792.db2.gz GQBQOXKXMGIBKQ-UHFFFAOYSA-N 0 3 339.823 2.986 20 5 EFBDHN CN(C)[C@@]1(CNCc2ccc([N+](=O)[O-])c(Cl)c2)CCSC1 ZINC000761527220 576174931 /nfs/dbraw/zinc/17/49/31/576174931.db2.gz QGRDKQXPIOLYJJ-CQSZACIVSA-N 0 3 329.853 2.775 20 5 EFBDHN Cc1nn(CN(C[C@@H]2CCOC2)C2CC2)c2ccc([N+](=O)[O-])cc12 ZINC000764887966 576517901 /nfs/dbraw/zinc/51/79/01/576517901.db2.gz YTTIGCVYSLCVFC-ZDUSSCGKSA-N 0 3 330.388 2.711 20 5 EFBDHN C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12)N1CCCCC1 ZINC000765648572 577062878 /nfs/dbraw/zinc/06/28/78/577062878.db2.gz JJSBSRCIQDIOSH-ZDUSSCGKSA-N 0 3 342.399 2.747 20 5 EFBDHN Cc1nn(C)cc1[C@@H](C)NC1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000765756208 577073385 /nfs/dbraw/zinc/07/33/85/577073385.db2.gz BOUMXVSSILRKQA-CYBMUJFWSA-N 0 3 343.431 2.956 20 5 EFBDHN O=[N+]([O-])c1ccc([C@H](O)CN[C@H]2CCOc3ccc(F)cc32)cc1 ZINC000765848000 577082611 /nfs/dbraw/zinc/08/26/11/577082611.db2.gz DIHUZMUYDFTVMP-JKSUJKDBSA-N 0 3 332.331 2.881 20 5 EFBDHN O=[N+]([O-])c1ccc([C@H](O)CN[C@@H]2CCOc3ccc(F)cc32)cc1 ZINC000765847997 577082653 /nfs/dbraw/zinc/08/26/53/577082653.db2.gz DIHUZMUYDFTVMP-HZPDHXFCSA-N 0 3 332.331 2.881 20 5 EFBDHN CN1CC[C@@H]2[C@@H](CCCN2C(=S)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000768480477 577277556 /nfs/dbraw/zinc/27/75/56/577277556.db2.gz RWMIWLMXPXSSNS-SWLSCSKDSA-N 0 3 334.445 2.708 20 5 EFBDHN CN1CC[C@H]2[C@@H](CCCN2C(=S)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000768480479 577277583 /nfs/dbraw/zinc/27/75/83/577277583.db2.gz RWMIWLMXPXSSNS-WFASDCNBSA-N 0 3 334.445 2.708 20 5 EFBDHN Cc1c(CN2CCC[C@@H]([C@H](O)c3nccn3C)C2)cccc1[N+](=O)[O-] ZINC000769939727 577394579 /nfs/dbraw/zinc/39/45/79/577394579.db2.gz AGURYVFFSWPLNJ-WBVHZDCISA-N 0 3 344.415 2.582 20 5 EFBDHN Cc1c(CN2CCC[C@H]([C@H](O)c3nccn3C)C2)cccc1[N+](=O)[O-] ZINC000769939724 577394588 /nfs/dbraw/zinc/39/45/88/577394588.db2.gz AGURYVFFSWPLNJ-RDJZCZTQSA-N 0 3 344.415 2.582 20 5 EFBDHN COc1cccc(NC2CCN(C[C@@H]3CCCO3)CC2)c1[N+](=O)[O-] ZINC000771969588 581265766 /nfs/dbraw/zinc/26/57/66/581265766.db2.gz HPCSJKVUDVFYSF-AWEZNQCLSA-N 0 3 335.404 2.659 20 5 EFBDHN CCN(CC)CCOC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000772241646 581298663 /nfs/dbraw/zinc/29/86/63/581298663.db2.gz RLILZENUNKOBCO-UHFFFAOYSA-N 0 3 332.303 2.695 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](NCCc1nnc3ccccn31)CCC2 ZINC000774110997 581483798 /nfs/dbraw/zinc/48/37/98/581483798.db2.gz RAFAITKKFHZNJD-INIZCTEOSA-N 0 3 337.383 2.847 20 5 EFBDHN C[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccc(-c2nnn[n-]2)cc1 ZINC000820428789 599368761 /nfs/dbraw/zinc/36/87/61/599368761.db2.gz ZXCMJHHOQWJKRN-LBPRGKRZSA-N 0 3 338.371 2.668 20 5 EFBDHN C[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccc(-c2nn[n-]n2)cc1 ZINC000820428789 599368764 /nfs/dbraw/zinc/36/87/64/599368764.db2.gz ZXCMJHHOQWJKRN-LBPRGKRZSA-N 0 3 338.371 2.668 20 5 EFBDHN COC(=O)N(C)CCNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000850390003 1250461538 /nfs/dbraw/zinc/46/15/38/1250461538.db2.gz OTZGKLWYYKGVRD-UHFFFAOYSA-N 0 3 333.344 2.643 20 5 EFBDHN CN(CC(=O)NC/C=C\CNc1ccccc1[N+](=O)[O-])CC(C)(C)C ZINC001107513940 1256020943 /nfs/dbraw/zinc/02/09/43/1256020943.db2.gz QIFALSXZOBIUJN-FPLPWBNLSA-N 0 3 348.447 2.657 20 5 EFBDHN O=C(c1ccoc1)N1CCC(CNCc2csc([N+](=O)[O-])c2)CC1 ZINC000997540425 1257922291 /nfs/dbraw/zinc/92/22/91/1257922291.db2.gz PHPGVZHWHJIYGU-UHFFFAOYSA-N 0 3 349.412 2.891 20 5 EFBDHN C/C=C(/C)C(=O)N1CCC(CNCc2csc([N+](=O)[O-])c2)CC1 ZINC000997665121 1258194247 /nfs/dbraw/zinc/19/42/47/1258194247.db2.gz YKJZCLISSRMFAW-BASWHVEKSA-N 0 3 337.445 2.951 20 5 EFBDHN COc1ccc(CNC[C@](C)(O)c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000922563668 1266258399 /nfs/dbraw/zinc/25/83/99/1266258399.db2.gz KOHADVULQWKFCR-KRWDZBQOSA-N 0 3 334.347 2.740 20 5 EFBDHN C[C@@H](NC(=O)N[C@H](C)C1=CCN(C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000921880603 1263110498 /nfs/dbraw/zinc/11/04/98/1263110498.db2.gz KAUBZFQQUXARTP-CHWSQXEVSA-N 0 3 332.404 2.605 20 5 EFBDHN O=C(Cc1ccc([N+](=O)[O-])cc1)O[C@@H]1CCN(Cc2ccccc2)C1 ZINC000735209902 1267231454 /nfs/dbraw/zinc/23/14/54/1267231454.db2.gz CTTNRTAFSPUGGU-GOSISDBHSA-N 0 3 340.379 2.955 20 5 EFBDHN C[C@@H](CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1)N1CCCCC1 ZINC000739700263 1268736714 /nfs/dbraw/zinc/73/67/14/1268736714.db2.gz FLTTTXTWXPQQGQ-AWEZNQCLSA-N 0 3 333.432 2.863 20 5 EFBDHN O=C(NC[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1)C1=CCCC1 ZINC001086060420 1269731104 /nfs/dbraw/zinc/73/11/04/1269731104.db2.gz SDCBWESLMXOFQZ-AKAXFMLLSA-N 0 3 329.400 2.690 20 5 EFBDHN Cc1coc(C(=O)NC[C@H]2C[C@@H](NCc3ccccc3[N+](=O)[O-])C2)c1 ZINC001086172789 1270344733 /nfs/dbraw/zinc/34/47/33/1270344733.db2.gz LKMAEDIHURICLY-OTVXOJSOSA-N 0 3 343.383 2.794 20 5 EFBDHN O=C(N[C@H]1CC[C@H](NCc2csc([N+](=O)[O-])c2)CC1)c1ccc[nH]1 ZINC001034591965 1272340262 /nfs/dbraw/zinc/34/02/62/1272340262.db2.gz LBWFLKYHAAJOQP-JOCQHMNTSA-N 0 3 348.428 2.815 20 5 EFBDHN O=[N+]([O-])C[C@@H]1CC[C@@H](N2CCN(C/C=C/c3ccccc3)CC2)C1 ZINC001169009340 1272582518 /nfs/dbraw/zinc/58/25/18/1272582518.db2.gz VTNXXTQXYUIQEC-LVLPYEQSSA-N 0 3 329.444 2.763 20 5 EFBDHN CC(C)(C)OC(=O)N1C[C@@H]2[C@@H]1CCCN2[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169011849 1272584720 /nfs/dbraw/zinc/58/47/20/1272584720.db2.gz MTVVVWVVGADXIA-LJISPDSOSA-N 0 3 339.436 2.516 20 5 EFBDHN CC[C@H]1CN(C(=O)OC(C)(C)C)CCN1[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169035492 1272599097 /nfs/dbraw/zinc/59/90/97/1272599097.db2.gz BLVFFQGSEAYJDF-KKUMJFAQSA-N 0 3 341.452 2.763 20 5 EFBDHN CC[C@H]1CN(C(=O)OC(C)(C)C)CCN1[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169035493 1272599572 /nfs/dbraw/zinc/59/95/72/1272599572.db2.gz BLVFFQGSEAYJDF-QLFBSQMISA-N 0 3 341.452 2.763 20 5 EFBDHN C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H](C)N1[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169047916 1272626428 /nfs/dbraw/zinc/62/64/28/1272626428.db2.gz SMQFMRJTCYXZEM-TUVASFSCSA-N 0 3 341.452 2.762 20 5 EFBDHN C[C@H](c1ccc(F)cc1)N1CCN([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169056794 1272632094 /nfs/dbraw/zinc/63/20/94/1272632094.db2.gz SOWAWFFDLTUABG-RKVPGOIHSA-N 0 3 335.423 2.950 20 5 EFBDHN O=C(NCCCNCc1csc([N+](=O)[O-])c1)c1c[nH]cc1C1CC1 ZINC001169689804 1273094078 /nfs/dbraw/zinc/09/40/78/1273094078.db2.gz AGIJEXDJPPZHCS-UHFFFAOYSA-N 0 3 348.428 2.772 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1NCc1cccnc1N1CCCC1)CNC2 ZINC001169860397 1273211966 /nfs/dbraw/zinc/21/19/66/1273211966.db2.gz JVFZMSBSOYTDBY-UHFFFAOYSA-N 0 3 339.399 2.805 20 5 EFBDHN Cc1cc(NCCCN(C)C(=O)C2(N(C)C)CCC2)ccc1[N+](=O)[O-] ZINC001109547511 1274407394 /nfs/dbraw/zinc/40/73/94/1274407394.db2.gz COUALAPEWZFRTG-UHFFFAOYSA-N 0 3 348.447 2.648 20 5 EFBDHN CCOc1nccc(CN[C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])n1 ZINC001170324656 1279016835 /nfs/dbraw/zinc/01/68/35/1279016835.db2.gz RZGCYRQAHCOMDR-LBPRGKRZSA-N 0 3 346.387 2.513 20 5 EFBDHN COc1ccc(C[C@@H](C)N[C@H](CO)c2ccccc2F)c([N+](=O)[O-])c1 ZINC001170325586 1279016909 /nfs/dbraw/zinc/01/69/09/1279016909.db2.gz WFZYKSDOPCQJJO-SJKOYZFVSA-N 0 3 348.374 2.997 20 5 EFBDHN O=C(NCCNCc1ccc([N+](=O)[O-])cc1)c1csc(Cl)c1 ZINC001134806790 1287232998 /nfs/dbraw/zinc/23/29/98/1287232998.db2.gz RGUUZXKGDPCYEW-UHFFFAOYSA-N 0 3 339.804 2.829 20 5 EFBDHN O=[N+]([O-])c1ccc([C@@H](O)CNCc2ccc3c(n2)CCCC3)cc1 ZINC000819267218 1276718802 /nfs/dbraw/zinc/71/88/02/1276718802.db2.gz SBTYQCDHNZQPIE-SFHVURJKSA-N 0 3 327.384 2.692 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CNCc2ccnc(C(F)(F)F)c2)c1 ZINC000819342839 1276735686 /nfs/dbraw/zinc/73/56/86/1276735686.db2.gz WWSJGHAIYZVKGU-ZDUSSCGKSA-N 0 3 341.289 2.832 20 5 EFBDHN CC[C@H](C)N[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000819386747 1276767141 /nfs/dbraw/zinc/76/71/41/1276767141.db2.gz CJIHEPWWZZHQCK-XKQJLSEDSA-N 0 3 347.415 2.940 20 5 EFBDHN CC[C@H](C)N[C@@H](CNC[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000819386563 1276767189 /nfs/dbraw/zinc/76/71/89/1276767189.db2.gz AXEQHCOXNIMTKN-RRQGHBQHSA-N 0 3 347.415 2.940 20 5 EFBDHN COC(=O)COc1ccc(CN2CCC3(CCCC3)C2)cc1[N+](=O)[O-] ZINC000789513706 1276771641 /nfs/dbraw/zinc/77/16/41/1276771641.db2.gz MRRWIWQQTQHDMV-UHFFFAOYSA-N 0 3 348.399 2.913 20 5 EFBDHN COc1ccc(C[C@H](C)NCc2cncc(Cl)n2)c([N+](=O)[O-])c1 ZINC001170306604 1279028273 /nfs/dbraw/zinc/02/82/73/1279028273.db2.gz YJMANCMTCJZYQT-JTQLQIEISA-N 0 3 336.779 2.768 20 5 EFBDHN CC(C)(C(=O)NCCNCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC001150438225 1287276719 /nfs/dbraw/zinc/27/67/19/1287276719.db2.gz BICUVXHYQXCXEK-UHFFFAOYSA-N 0 3 341.411 2.778 20 5 EFBDHN CN1CC[C@@H]2CC[C@H](C1)N2C(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000923268461 1277423750 /nfs/dbraw/zinc/42/37/50/1277423750.db2.gz WJZZUFWCRWZINX-UONOGXRCSA-N 0 3 331.416 2.568 20 5 EFBDHN CN1CC[C@@H]2CC[C@H](C1)N2C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000923271501 1277440292 /nfs/dbraw/zinc/44/02/92/1277440292.db2.gz RQLXFTDFAIHTBD-GXTWGEPZSA-N 0 3 349.406 2.707 20 5 EFBDHN COc1cc(C(=O)NC[C@H](C)N2CCCCC2)cc([N+](=O)[O-])c1C ZINC000790380399 1277487378 /nfs/dbraw/zinc/48/73/78/1277487378.db2.gz WNKWUSPARPOBIV-LBPRGKRZSA-N 0 3 335.404 2.516 20 5 EFBDHN COc1cc(C(=O)NC[C@@H](C)N2CCCCC2)cc([N+](=O)[O-])c1C ZINC000790380398 1277487642 /nfs/dbraw/zinc/48/76/42/1277487642.db2.gz WNKWUSPARPOBIV-GFCCVEGCSA-N 0 3 335.404 2.516 20 5 EFBDHN CN(CCN(C)c1nc(Cl)ncc1[N+](=O)[O-])Cc1ccccc1 ZINC001157551666 1277835877 /nfs/dbraw/zinc/83/58/77/1277835877.db2.gz PEQKJFUHXBVONB-UHFFFAOYSA-N 0 3 335.795 2.606 20 5 EFBDHN CN(C)Cc1cccc(NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)c1 ZINC000791325867 1278035301 /nfs/dbraw/zinc/03/53/01/1278035301.db2.gz VEDAOZRCGMUDSH-UHFFFAOYSA-N 0 3 332.335 2.630 20 5 EFBDHN C[C@@H](CN1CCCC1)OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000845674678 1279760932 /nfs/dbraw/zinc/76/09/32/1279760932.db2.gz NQELQOIXGLADOG-AWEZNQCLSA-N 0 3 347.415 2.836 20 5 EFBDHN Cc1cc(C)n(CCC(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])n1 ZINC000845872235 1279900486 /nfs/dbraw/zinc/90/04/86/1279900486.db2.gz FEJUIXXQDPPYML-DYVFJYSZSA-N 0 3 349.362 2.979 20 5 EFBDHN CC([C@@H](OC(=O)c1ccnc(N(C)C)c1)c1ccccc1F)[N+](=O)[O-] ZINC000845874613 1279902227 /nfs/dbraw/zinc/90/22/27/1279902227.db2.gz ICJIVEPKCMYXDM-MEDUHNTESA-N 0 3 347.346 2.850 20 5 EFBDHN Cc1noc(C)c1CC(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845874253 1279902334 /nfs/dbraw/zinc/90/23/34/1279902334.db2.gz YOSXERZPWDCNNL-HWPZZCPQSA-N 0 3 336.319 2.923 20 5 EFBDHN CC([C@H](OC(=O)CC1CCOCC1)c1ccccc1F)[N+](=O)[O-] ZINC000845875934 1279902554 /nfs/dbraw/zinc/90/25/54/1279902554.db2.gz MBXXMNALMOFSCQ-BZNIZROVSA-N 0 3 325.336 2.892 20 5 EFBDHN CCCn1cc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])cn1 ZINC000845875973 1279902577 /nfs/dbraw/zinc/90/25/77/1279902577.db2.gz MIZBCPKNDXXWMF-XHDPSFHLSA-N 0 3 335.335 2.996 20 5 EFBDHN CCOc1cnc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])cn1 ZINC000845876770 1279902929 /nfs/dbraw/zinc/90/29/29/1279902929.db2.gz OOMHCIQKRNGCLD-ZUZCIYMTSA-N 0 3 349.318 2.578 20 5 EFBDHN CC([C@H](OC(=O)CC[C@H]1CCOC1)c1ccccc1F)[N+](=O)[O-] ZINC000845878799 1279903448 /nfs/dbraw/zinc/90/34/48/1279903448.db2.gz SRZBXMUKJRZAGU-WQGACYEGSA-N 0 3 325.336 2.892 20 5 EFBDHN CC([C@@H](OC(=O)[C@@H]1CCO[C@H](C)C1)c1ccccc1F)[N+](=O)[O-] ZINC000845876733 1279903459 /nfs/dbraw/zinc/90/34/59/1279903459.db2.gz ODCDZTNAIKOYBL-RTWAVKEYSA-N 0 3 325.336 2.890 20 5 EFBDHN CC([C@H](OC(=O)c1cnn(C)c1Cl)c1ccccc1F)[N+](=O)[O-] ZINC000845877618 1279903592 /nfs/dbraw/zinc/90/35/92/1279903592.db2.gz FPDJOYJSQFBSKC-UFBFGSQYSA-N 0 3 341.726 2.776 20 5 EFBDHN COCC1(CC(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])CC1 ZINC000845881656 1279904122 /nfs/dbraw/zinc/90/41/22/1279904122.db2.gz MZFSFBAVOLEKOS-ABAIWWIYSA-N 0 3 325.336 2.892 20 5 EFBDHN CC([C@H](OC(=O)[C@H]1CCc2n[nH]cc2C1)c1ccccc1F)[N+](=O)[O-] ZINC000845882029 1279905625 /nfs/dbraw/zinc/90/56/25/1279905625.db2.gz NMUJXVBPKQRZOH-GDLVEWKHSA-N 0 3 347.346 2.603 20 5 EFBDHN CC([C@@H](OC(=O)[C@@H]1C[C@H]2CC(=O)[C@@H]1C2)c1ccccc1F)[N+](=O)[O-] ZINC000845882266 1279906013 /nfs/dbraw/zinc/90/60/13/1279906013.db2.gz SBWUZVWRTFFYMI-RCJVZNENSA-N 0 3 335.331 2.690 20 5 EFBDHN CC([C@H](OC(=O)CCC(C)(C)[N+](=O)[O-])c1ccccc1F)[N+](=O)[O-] ZINC000845882873 1279907015 /nfs/dbraw/zinc/90/70/15/1279907015.db2.gz PYDKYHGMVJDATG-YGRLFVJLSA-N 0 3 342.323 2.911 20 5 EFBDHN CC([C@@H](OC(=O)[C@@H]1O[C@H](C)C[C@@H]1C)c1ccccc1F)[N+](=O)[O-] ZINC000845884545 1279907504 /nfs/dbraw/zinc/90/75/04/1279907504.db2.gz ZKSYZTVNMHWDCZ-BOVGIHKQSA-N 0 3 325.336 2.889 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H](C)CN1CCOCC1 ZINC000872021370 1287402319 /nfs/dbraw/zinc/40/23/19/1287402319.db2.gz CGZVKUROHOGFJP-QWHCGFSZSA-N 0 3 339.461 2.688 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H](O)C1CCOCC1 ZINC000872046960 1287410322 /nfs/dbraw/zinc/41/03/22/1287410322.db2.gz AFGCFJMWCFOLPM-NHYWBVRUSA-N 0 3 340.445 2.755 20 5 EFBDHN CNC(=O)C(C)(C)CN[C@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872052615 1287412462 /nfs/dbraw/zinc/41/24/62/1287412462.db2.gz DLUMRWOXICFTJW-SNVBAGLBSA-N 0 3 325.434 2.740 20 5 EFBDHN CO[C@@]1(CN[C@H](C)c2cc([N+](=O)[O-])ccc2SC)CCOC1 ZINC000872062385 1287416541 /nfs/dbraw/zinc/41/65/41/1287416541.db2.gz MKPOGKSWFJNLKL-IAQYHMDHSA-N 0 3 326.418 2.773 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@]1(O)CCO[C@@H]1C ZINC000872066089 1287417547 /nfs/dbraw/zinc/41/75/47/1287417547.db2.gz DMMQBQGLMUOVHW-RWSFTLGLSA-N 0 3 326.418 2.507 20 5 EFBDHN Cc1cc(F)c(C(=O)NCCNCc2ccc([N+](=O)[O-])cc2)cc1F ZINC001129965232 1280380364 /nfs/dbraw/zinc/38/03/64/1280380364.db2.gz UMUVDRVBHRISMK-UHFFFAOYSA-N 0 3 349.337 2.701 20 5 EFBDHN O=C(CCCc1ccsc1)NCCNCc1cccc([N+](=O)[O-])c1 ZINC001129967351 1280383104 /nfs/dbraw/zinc/38/31/04/1280383104.db2.gz BQQJMYTYPQBGSN-UHFFFAOYSA-N 0 3 347.440 2.885 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCC(C)(C)OCCO ZINC000872073178 1287420131 /nfs/dbraw/zinc/42/01/31/1287420131.db2.gz OBKCXFDSIGVGBO-LLVKDONJSA-N 0 3 328.434 2.755 20 5 EFBDHN O=C(NCCNCc1ccc([N+](=O)[O-])cc1)c1c[nH]c2ccccc12 ZINC001130928357 1281301320 /nfs/dbraw/zinc/30/13/20/1281301320.db2.gz GMFBKTTYPPLSBU-UHFFFAOYSA-N 0 3 338.367 2.596 20 5 EFBDHN Cc1cc(F)ccc1C(=O)NCCNCc1cccc([N+](=O)[O-])c1 ZINC001148510714 1281574973 /nfs/dbraw/zinc/57/49/73/1281574973.db2.gz DKFJNKJWSFBDMK-UHFFFAOYSA-N 0 3 331.347 2.562 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)F)ccc1N1CCN(C[C@H]2CCOC2)CC1 ZINC000809356015 1282172993 /nfs/dbraw/zinc/17/29/93/1282172993.db2.gz XULBJRKBNIHAHN-GFCCVEGCSA-N 0 3 341.358 2.691 20 5 EFBDHN Cc1cccc(CCC(=O)NCCNCc2cccc([N+](=O)[O-])c2)c1 ZINC001131969519 1282690394 /nfs/dbraw/zinc/69/03/94/1282690394.db2.gz MARQXASCTWRNTI-UHFFFAOYSA-N 0 3 341.411 2.742 20 5 EFBDHN O=[N+]([O-])c1ccc2nc(N3CCN(C4CCOCC4)CC3)sc2c1 ZINC000747620761 1283444335 /nfs/dbraw/zinc/44/43/35/1283444335.db2.gz MAYRFLXPNSQZJC-UHFFFAOYSA-N 0 3 348.428 2.506 20 5 EFBDHN Cc1c(C(=O)NCCNCc2cccc([N+](=O)[O-])c2)ccn1C(C)C ZINC001132721751 1284179584 /nfs/dbraw/zinc/17/95/84/1284179584.db2.gz BDTRLIXXBXKFCY-UHFFFAOYSA-N 0 3 344.415 2.805 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1NC1CCN(c3cccnc3)CC1)CNC2 ZINC001171474625 1285588946 /nfs/dbraw/zinc/58/89/46/1285588946.db2.gz YIEBGVPJCOJDRY-UHFFFAOYSA-N 0 3 339.399 2.674 20 5 EFBDHN CC(COC(=O)c1csc(-c2ccc(F)c(F)c2)n1)[N+](=O)[O-] ZINC000813102356 1285654713 /nfs/dbraw/zinc/65/47/13/1285654713.db2.gz DZHZGZGGVBJSGV-ZETCQYMHSA-N 0 3 328.296 2.910 20 5 EFBDHN Cc1nn(-c2ccc(C(=O)OCC(C)[N+](=O)[O-])cc2)c(C)c1Cl ZINC000813110068 1285681276 /nfs/dbraw/zinc/68/12/76/1285681276.db2.gz RTBDDJMGCXDUPC-SECBINFHSA-N 0 3 337.763 2.965 20 5 EFBDHN CC(COC(=O)c1ccc(C(=O)Nc2ccccc2)cc1)[N+](=O)[O-] ZINC000813110716 1285682184 /nfs/dbraw/zinc/68/21/84/1285682184.db2.gz IACZZKLFJNTFAR-LBPRGKRZSA-N 0 3 328.324 2.761 20 5 EFBDHN Cc1nc(COc2cccc(C(=O)OCC(C)[N+](=O)[O-])c2)cs1 ZINC000813109183 1285683083 /nfs/dbraw/zinc/68/30/83/1285683083.db2.gz PBXIRRFHQGLVOS-JTQLQIEISA-N 0 3 336.369 2.853 20 5 EFBDHN COc1ccc(C(=O)c2ccccc2C(=O)OCC(C)[N+](=O)[O-])cc1 ZINC000813113697 1285683509 /nfs/dbraw/zinc/68/35/09/1285683509.db2.gz HYOZBKAJHJLYST-LBPRGKRZSA-N 0 3 343.335 2.748 20 5 EFBDHN COc1ccc(-c2nc(C)c(C(=O)OCC(C)[N+](=O)[O-])s2)cc1 ZINC000813112332 1285683548 /nfs/dbraw/zinc/68/35/48/1285683548.db2.gz FQCHZAGNTJSSDD-SECBINFHSA-N 0 3 336.369 2.949 20 5 EFBDHN CC(COC(=O)c1ccc(CNC(=O)c2cccs2)cc1)[N+](=O)[O-] ZINC000813113237 1285684468 /nfs/dbraw/zinc/68/44/68/1285684468.db2.gz ORNQBODXWZVXJX-LLVKDONJSA-N 0 3 348.380 2.500 20 5 EFBDHN CCCc1noc2nc(C3CC3)cc(C(=O)OCC(C)[N+](=O)[O-])c12 ZINC000813114289 1285685353 /nfs/dbraw/zinc/68/53/53/1285685353.db2.gz OWTBITYPXOCIOH-SECBINFHSA-N 0 3 333.344 2.875 20 5 EFBDHN O=C(NCCCNCc1ccccc1[N+](=O)[O-])c1ncccc1Cl ZINC001171672806 1285706581 /nfs/dbraw/zinc/70/65/81/1285706581.db2.gz CJIFVQQNYSTLLX-UHFFFAOYSA-N 0 3 348.790 2.553 20 5 EFBDHN O=C(NCCCNCc1ccccc1[N+](=O)[O-])c1ccc(Cl)cn1 ZINC001171677785 1285711201 /nfs/dbraw/zinc/71/12/01/1285711201.db2.gz PBCZFEGQHKPKNU-UHFFFAOYSA-N 0 3 348.790 2.553 20 5 EFBDHN Cc1ccc(C(=O)NCCNCc2ccc([N+](=O)[O-])cc2)c(F)c1F ZINC001134189205 1286435528 /nfs/dbraw/zinc/43/55/28/1286435528.db2.gz BKRZXYMDUAZWAI-UHFFFAOYSA-N 0 3 349.337 2.701 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)NCc2cnc(C)cn2)c1F ZINC001173174914 1286451004 /nfs/dbraw/zinc/45/10/04/1286451004.db2.gz GATOYPXDJLYDTF-SNVBAGLBSA-N 0 3 334.351 2.562 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CC[C@@H](O)[C@@H](C)CC2)c1F ZINC001173178930 1286453817 /nfs/dbraw/zinc/45/38/17/1286453817.db2.gz CFGTUPZVDRVQRF-SLEUVZQESA-N 0 3 340.395 2.766 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)NCc2nccnc2C)c1F ZINC001173179134 1286453904 /nfs/dbraw/zinc/45/39/04/1286453904.db2.gz JUCFNRHHBARYQX-JTQLQIEISA-N 0 3 334.351 2.562 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CCC[C@H](CO)CC2)c1F ZINC001173180053 1286454973 /nfs/dbraw/zinc/45/49/73/1286454973.db2.gz ICRXHIQWTZNJMR-STQMWFEESA-N 0 3 340.395 2.768 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)N2CCCC[C@](C)(O)C2)c1F ZINC001173179785 1286455065 /nfs/dbraw/zinc/45/50/65/1286455065.db2.gz GTKNPWXTRJIMNC-PXAZEXFGSA-N 0 3 340.395 2.910 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CC[C@]3(CCOC3)C2)c1F ZINC001173180379 1286455158 /nfs/dbraw/zinc/45/51/58/1286455158.db2.gz KFZSBMPHEKVZBI-SJCJKPOMSA-N 0 3 338.379 2.786 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)N2CC[C@]3(CCOC3)C2)c1F ZINC001173180378 1286455174 /nfs/dbraw/zinc/45/51/74/1286455174.db2.gz KFZSBMPHEKVZBI-PXAZEXFGSA-N 0 3 338.379 2.786 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)NCc2cc(F)ccn2)c1F ZINC001173184523 1286456041 /nfs/dbraw/zinc/45/60/41/1286456041.db2.gz QZRRRFRXTNZKRB-SNVBAGLBSA-N 0 3 337.326 2.997 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)NCc2cc(F)ccn2)c1F ZINC001173184522 1286456129 /nfs/dbraw/zinc/45/61/29/1286456129.db2.gz QZRRRFRXTNZKRB-JTQLQIEISA-N 0 3 337.326 2.997 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N[C@@H](C)c2cnccn2)c1F ZINC001173191445 1286457690 /nfs/dbraw/zinc/45/76/90/1286457690.db2.gz LGXWPRKDPXEDDJ-QWRGUYRKSA-N 0 3 334.351 2.814 20 5 EFBDHN CCN1CCN([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])[C@H](C)C1 ZINC001173191538 1286457977 /nfs/dbraw/zinc/45/79/77/1286457977.db2.gz CZSNWBIHSOVWOB-QWHCGFSZSA-N 0 3 339.411 2.700 20 5 EFBDHN CC(C)Oc1cc(CN[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)ncn1 ZINC001173225610 1286480746 /nfs/dbraw/zinc/48/07/46/1286480746.db2.gz STMWAFATPVJYNB-ZDUSSCGKSA-N 0 3 330.388 2.893 20 5 EFBDHN CCNC(=O)OC1CCN([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173231106 1286483589 /nfs/dbraw/zinc/48/35/89/1286483589.db2.gz JQLGDJACHXYGBS-ZDUSSCGKSA-N 0 3 335.404 2.736 20 5 EFBDHN Cc1cc(F)cc(C(=O)NCCNCc2cccc([N+](=O)[O-])c2)c1 ZINC001134246470 1286483795 /nfs/dbraw/zinc/48/37/95/1286483795.db2.gz YVTJKAZRAJQQTL-UHFFFAOYSA-N 0 3 331.347 2.562 20 5 EFBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CCC[C@H](Oc2ncccn2)C1 ZINC001173238989 1286497244 /nfs/dbraw/zinc/49/72/44/1286497244.db2.gz ZTMCOVWLCLXMJS-PBHICJAKSA-N 0 3 342.399 2.859 20 5 EFBDHN CCN(CC)CC(=O)N1CCC(CNc2ccccc2[N+](=O)[O-])CC1 ZINC001095261843 1286798708 /nfs/dbraw/zinc/79/87/08/1286798708.db2.gz QKZLODXHKXAPLG-UHFFFAOYSA-N 0 3 348.447 2.587 20 5 EFBDHN CC(C)N(C)CC(=O)N1CCC(CNc2ccc([N+](=O)[O-])cc2)CC1 ZINC001095261759 1286799504 /nfs/dbraw/zinc/79/95/04/1286799504.db2.gz LCOLCQZVZKMZOW-UHFFFAOYSA-N 0 3 348.447 2.586 20 5 EFBDHN COC1([C@@H](C)NCc2cc(Cl)ccc2[N+](=O)[O-])CCOCC1 ZINC000817297610 1288526472 /nfs/dbraw/zinc/52/64/72/1288526472.db2.gz SZRHYMXZQVYGFL-LLVKDONJSA-N 0 3 328.796 2.922 20 5 EFBDHN O=[N+]([O-])c1ccc([C@@H](O)[C@@H](CO)NCc2cccc(C3CC3)c2)cc1 ZINC000817407464 1288589594 /nfs/dbraw/zinc/58/95/94/1288589594.db2.gz PPBPGPAJUOKHBS-RTBURBONSA-N 0 3 342.395 2.656 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1CNC[C@H](O)COc1ccccc1 ZINC000873011389 1289517623 /nfs/dbraw/zinc/51/76/23/1289517623.db2.gz WTYJTPJSMMRCEE-HNNXBMFYSA-N 0 3 330.384 2.741 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1CNC[C@H](O)COc1cccc(F)c1 ZINC000873020726 1289524514 /nfs/dbraw/zinc/52/45/14/1289524514.db2.gz BQOLKCXFQXUIMZ-HNNXBMFYSA-N 0 3 348.374 2.880 20 5 EFBDHN CN(CCN1CCCCC1)C(=O)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC000824115256 1289546916 /nfs/dbraw/zinc/54/69/16/1289546916.db2.gz PKEXBIWRAWEQDK-DLBZAZTESA-N 0 3 331.416 2.643 20 5 EFBDHN Cc1c(CN[C@@H]2CCN(C(=O)C3CCCC3)C2)cccc1[N+](=O)[O-] ZINC000873077783 1289556370 /nfs/dbraw/zinc/55/63/70/1289556370.db2.gz FFMIVNQGURRCPN-MRXNPFEDSA-N 0 3 331.416 2.784 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@@H]1CCCN2CCCC[C@@H]12 ZINC000824311336 1289601418 /nfs/dbraw/zinc/60/14/18/1289601418.db2.gz CHRKATKGQRWOLM-ZBFHGGJFSA-N 0 3 331.416 2.958 20 5 EFBDHN O=C(NCCCNCc1csc([N+](=O)[O-])c1)c1ccc(Cl)[nH]1 ZINC001166151561 1312737968 /nfs/dbraw/zinc/73/79/68/1312737968.db2.gz WIEMZJNFEBCSAU-UHFFFAOYSA-N 0 3 342.808 2.548 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1CCC(O[C@@H]2CCOC2)CC1 ZINC000876783432 1291022058 /nfs/dbraw/zinc/02/20/58/1291022058.db2.gz BVONSPKOGNMATH-MRXNPFEDSA-N 0 3 334.416 2.982 20 5 EFBDHN C[C@@H](C[C@@H]1CCCC(=O)N1)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000877087784 1291131140 /nfs/dbraw/zinc/13/11/40/1291131140.db2.gz RRAVJUKTSLBHMN-JQWIXIFHSA-N 0 3 325.796 2.785 20 5 EFBDHN CC(=O)N1CCC2(CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC000957476431 1291623001 /nfs/dbraw/zinc/62/30/01/1291623001.db2.gz YDXDUBJOYBTLCM-UHFFFAOYSA-N 0 3 331.416 2.819 20 5 EFBDHN CC(=O)N1CCC2(CCN(Cc3ccccc3[N+](=O)[O-])CC2)CC1 ZINC000957479147 1291626739 /nfs/dbraw/zinc/62/67/39/1291626739.db2.gz UNWLSZVXJMTTID-UHFFFAOYSA-N 0 3 331.416 2.819 20 5 EFBDHN COc1ccc([C@@H]2CN(Cc3ccccc3[N+](=O)[O-])CCN2)cc1 ZINC000879517000 1292165876 /nfs/dbraw/zinc/16/58/76/1292165876.db2.gz BUUFIWAZNQJESJ-KRWDZBQOSA-N 0 3 327.384 2.750 20 5 EFBDHN Cc1ccccc1[C@H](CO)N(C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000886439217 1294970321 /nfs/dbraw/zinc/97/03/21/1294970321.db2.gz RRCSJPALDWHZRH-ROUUACIJSA-N 0 3 330.384 2.602 20 5 EFBDHN C[C@H]1[C@H](C)N(Cc2ccc(Br)c([N+](=O)[O-])c2)CCN1C ZINC000775984568 1295571472 /nfs/dbraw/zinc/57/14/72/1295571472.db2.gz GXPULRSHJXABQH-QWRGUYRKSA-N 0 3 342.237 2.882 20 5 EFBDHN CCCN(CCN(C)C)C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC000889118696 1295690778 /nfs/dbraw/zinc/69/07/78/1295690778.db2.gz OZMOPBREXVAVKC-UHFFFAOYSA-N 0 3 344.415 2.744 20 5 EFBDHN CCC[C@H]1CN(Cn2nccc2[N+](=O)[O-])CCN1Cc1ccccc1 ZINC000776206764 1297014300 /nfs/dbraw/zinc/01/43/00/1297014300.db2.gz AJXIOUSQEIZEJH-KRWDZBQOSA-N 0 3 343.431 2.735 20 5 EFBDHN Cc1nn(C)cc1[C@@H]1CCCN1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776586392 1299613369 /nfs/dbraw/zinc/61/33/69/1299613369.db2.gz OBWJYZQFTYGXIF-DLBZAZTESA-N 0 3 330.388 2.507 20 5 EFBDHN CN1CCN(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)Cc2ccccc21 ZINC000776581857 1299630716 /nfs/dbraw/zinc/63/07/16/1299630716.db2.gz NRKCFBSOHNAGGL-GOSISDBHSA-N 0 3 327.384 2.580 20 5 EFBDHN Cc1nn(C)cc1[C@@H]1CCCN1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776586410 1299665858 /nfs/dbraw/zinc/66/58/58/1299665858.db2.gz OBWJYZQFTYGXIF-IRXDYDNUSA-N 0 3 330.388 2.507 20 5 EFBDHN CN(CCOCc1ccccc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776592630 1299692602 /nfs/dbraw/zinc/69/26/02/1299692602.db2.gz REFPKUPMYYEUFZ-SFHVURJKSA-N 0 3 330.384 2.777 20 5 EFBDHN COC[C@@H](NC[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1cccc(OC)c1 ZINC000852443017 1299706389 /nfs/dbraw/zinc/70/63/89/1299706389.db2.gz HZSNKNNYDUTDET-QZTJIDSGSA-N 0 3 346.383 2.614 20 5 EFBDHN O=[N+]([O-])c1ccc([C@H](O)CNC2(c3ccc4c(c3)OCO4)CC2)cc1 ZINC000776606130 1299791409 /nfs/dbraw/zinc/79/14/09/1299791409.db2.gz RWIHOIVPSBPVEC-OAHLLOKOSA-N 0 3 342.351 2.636 20 5 EFBDHN CN(C)[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1F)Cc1ccccc1 ZINC000854303211 1300505773 /nfs/dbraw/zinc/50/57/73/1300505773.db2.gz UGKZJWZSBPZEEM-OAHLLOKOSA-N 0 3 345.374 2.637 20 5 EFBDHN O=C(NC1CC2(CC(NCc3csc([N+](=O)[O-])c3)C2)C1)C1CCC1 ZINC000963468637 1300911866 /nfs/dbraw/zinc/91/18/66/1300911866.db2.gz WNXPUSRCOMKQGK-UHFFFAOYSA-N 0 3 349.456 2.973 20 5 EFBDHN CC[C@H](C)CN(CC)CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000748260807 1313840491 /nfs/dbraw/zinc/84/04/91/1313840491.db2.gz CFGIRYYEOXAYJV-ZDUSSCGKSA-N 0 3 348.403 2.689 20 5 EFBDHN CCN(C)C(C)(C)C(=O)N[C@H]1C[C@H](Nc2cc(C)ccc2[N+](=O)[O-])C1 ZINC001097078397 1313840619 /nfs/dbraw/zinc/84/06/19/1313840619.db2.gz NJSLHHBOHXVFNP-HDJSIYSDSA-N 0 3 348.447 2.693 20 5 EFBDHN CN(C)Cc1ccccc1CNC(=O)Cc1cccc(F)c1[N+](=O)[O-] ZINC000864586577 1302989312 /nfs/dbraw/zinc/98/93/12/1302989312.db2.gz UXTQXGFWMYBLPD-UHFFFAOYSA-N 0 3 345.374 2.654 20 5 EFBDHN CN1CCN(CCCNc2ccc([N+](=O)[O-])cc2C(F)F)CC1 ZINC000865415866 1303244687 /nfs/dbraw/zinc/24/46/87/1303244687.db2.gz RDDTXBQWBXDQMY-UHFFFAOYSA-N 0 3 328.363 2.582 20 5 EFBDHN CN(Cc1c2ccccc2cc2ccccc21)S(=O)(=O)CCN ZINC001239101677 1313902641 /nfs/dbraw/zinc/90/26/41/1313902641.db2.gz SKNMYDFGIKHMEA-UHFFFAOYSA-N 0 3 328.437 2.713 20 5 EFBDHN CC([C@H](OC(=O)c1cnn(C(F)F)c1)c1ccccc1F)[N+](=O)[O-] ZINC000870454930 1305330029 /nfs/dbraw/zinc/33/00/29/1305330029.db2.gz ROQUKHCAWNFNHX-UFBFGSQYSA-N 0 3 343.261 2.981 20 5 EFBDHN CC([C@@H](OC(=O)c1cnn(CC2CC2)c1)c1ccccc1F)[N+](=O)[O-] ZINC000870455385 1305331351 /nfs/dbraw/zinc/33/13/51/1305331351.db2.gz YLVBPTUIOJKYGE-BDJLRTHQSA-N 0 3 347.346 2.996 20 5 EFBDHN CC([C@H](OC(=O)c1cnn(CC2CC2)c1)c1ccccc1F)[N+](=O)[O-] ZINC000870455391 1305331390 /nfs/dbraw/zinc/33/13/90/1305331390.db2.gz YLVBPTUIOJKYGE-ZBEGNZNMSA-N 0 3 347.346 2.996 20 5 EFBDHN CCCN(CCN(C)C)C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC000900585873 1308357499 /nfs/dbraw/zinc/35/74/99/1308357499.db2.gz BGIMJXQPNLRZJR-UHFFFAOYSA-N 0 3 331.775 2.801 20 5 EFBDHN CN(CC(=O)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1)C1CCC1 ZINC000900837226 1308748895 /nfs/dbraw/zinc/74/88/95/1308748895.db2.gz CQDJKWSGBIOPHF-INIZCTEOSA-N 0 3 335.429 2.653 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)CN1C1CC1 ZINC000900998273 1309144929 /nfs/dbraw/zinc/14/49/29/1309144929.db2.gz YKITZAWDPMBBCF-WPRPVWTQSA-N 0 3 341.770 2.742 20 5 EFBDHN CC(=O)O[C@H]1C[C@@H]2C[C@H](O[C@@H](C)c3ccc([N+](=O)[O-])cc3)C[C@H]1N2C ZINC001224027133 1311333809 /nfs/dbraw/zinc/33/38/09/1311333809.db2.gz UPNDIMWPXFHSEF-QUJYTELESA-N 0 3 348.399 2.839 20 5 EFBDHN C[C@H](Nc1cc2ccc(Cl)nc2cc1[N+](=O)[O-])[C@@H]1CNCCO1 ZINC001159500659 1311527633 /nfs/dbraw/zinc/52/76/33/1311527633.db2.gz FHNQLYVJVZFBJW-XPTSAGLGSA-N 0 3 336.779 2.585 20 5 EFBDHN C[C@H](Nc1cc2ccc(Cl)nc2cc1[N+](=O)[O-])[C@H]1CNCCO1 ZINC001159500655 1311527714 /nfs/dbraw/zinc/52/77/14/1311527714.db2.gz FHNQLYVJVZFBJW-LKFCYVNXSA-N 0 3 336.779 2.585 20 5 EFBDHN C[C@@H](Nc1ccc2c(ccc(Cl)c2[N+](=O)[O-])n1)[C@H]1CNCCO1 ZINC001159500996 1311527983 /nfs/dbraw/zinc/52/79/83/1311527983.db2.gz UWJFUATWANOLHL-NOZJJQNGSA-N 0 3 336.779 2.585 20 5 EFBDHN O=[N+]([O-])c1cc([O-])cc(Nc2ccc(N3CC[NH2+]CC3)c(F)c2)c1 ZINC001159537820 1311535984 /nfs/dbraw/zinc/53/59/84/1311535984.db2.gz SCROTWKWCHCLHN-UHFFFAOYSA-N 0 3 332.335 2.593 20 5 EFBDHN CCN1CCC(Oc2ncc([N+](=O)[O-])cc2Br)CC1 ZINC001226339751 1311651964 /nfs/dbraw/zinc/65/19/64/1311651964.db2.gz POQMBCRAXPENEO-UHFFFAOYSA-N 0 3 330.182 2.615 20 5 EFBDHN Nc1cc(OC2CCN(c3cccc(F)c3[N+](=O)[O-])CC2)ccn1 ZINC001226653832 1311702984 /nfs/dbraw/zinc/70/29/84/1311702984.db2.gz QDMVZSJIPHLRQS-UHFFFAOYSA-N 0 3 332.335 2.759 20 5 EFBDHN Cc1nc(C(=O)NCCCNCc2ccccc2[N+](=O)[O-])c(C)s1 ZINC001160785984 1311780900 /nfs/dbraw/zinc/78/09/00/1311780900.db2.gz IHURZZWWULIBIX-UHFFFAOYSA-N 0 3 348.428 2.578 20 5 EFBDHN CCc1cccnc1C(=O)NCCCNCc1csc([N+](=O)[O-])c1 ZINC001161518437 1311905572 /nfs/dbraw/zinc/90/55/72/1311905572.db2.gz BVKBWVOKRIQGMN-UHFFFAOYSA-N 0 3 348.428 2.523 20 5 EFBDHN C[C@H]1CN(Cc2ccccc2)CC[C@@H]1Oc1ncncc1[N+](=O)[O-] ZINC001228655070 1311976514 /nfs/dbraw/zinc/97/65/14/1311976514.db2.gz PGZVDJRBNJQXTP-BBRMVZONSA-N 0 3 328.372 2.674 20 5 EFBDHN Cc1ccc(CC(=O)NCCCNCc2csc([N+](=O)[O-])c2)cc1 ZINC001161995791 1312024934 /nfs/dbraw/zinc/02/49/34/1312024934.db2.gz RGMGJRXEPRBRHY-UHFFFAOYSA-N 0 3 347.440 2.803 20 5 EFBDHN CC(C)(C)CC(=O)N1C[C@H]2CN(Cc3ccccc3[N+](=O)[O-])C[C@H]2C1 ZINC001048679998 1312038915 /nfs/dbraw/zinc/03/89/15/1312038915.db2.gz MIOXVMUIIFBPFU-IYBDPMFKSA-N 0 3 345.443 2.921 20 5 EFBDHN O=[N+]([O-])/C=C/c1ccc(O[C@H]2CC[C@@H](N3CCOCC3)CC2)cc1 ZINC001229116113 1312049958 /nfs/dbraw/zinc/04/99/58/1312049958.db2.gz UAWMMTUYHMZTSM-IOQMRAIMSA-N 0 3 332.400 2.956 20 5 EFBDHN Cc1cc(=O)oc2c1ccc(O[C@H]1CCN(C(C)C)C1)c2[N+](=O)[O-] ZINC001229942552 1312162004 /nfs/dbraw/zinc/16/20/04/1312162004.db2.gz ISDZJWVSVXQXSN-LBPRGKRZSA-N 0 3 332.356 2.871 20 5 EFBDHN Cc1cc(=O)oc2c1ccc(O[C@@H]1CCN(C(C)C)C1)c2[N+](=O)[O-] ZINC001229942551 1312162287 /nfs/dbraw/zinc/16/22/87/1312162287.db2.gz ISDZJWVSVXQXSN-GFCCVEGCSA-N 0 3 332.356 2.871 20 5 EFBDHN COC(=O)c1ccc([N+](=O)[O-])cc1-n1c2ccccc2nc1[C@@H](C)N ZINC001162765740 1312171404 /nfs/dbraw/zinc/17/14/04/1312171404.db2.gz ISZSHXMLVOJWDN-SNVBAGLBSA-N 0 3 340.339 2.740 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])cc(-n2c3ccccc3nc2[C@@H](C)N)c1 ZINC001162777840 1312174127 /nfs/dbraw/zinc/17/41/27/1312174127.db2.gz WAGKQCBZAARAAB-SNVBAGLBSA-N 0 3 340.339 2.740 20 5 EFBDHN CN1CCc2c(N[C@@H]3CNCc4ccsc43)ccc([N+](=O)[O-])c2C1 ZINC001163230205 1312269953 /nfs/dbraw/zinc/26/99/53/1312269953.db2.gz NAPMAVWJSVFAEJ-OAHLLOKOSA-N 0 3 344.440 2.901 20 5 EFBDHN CC(C)[C@H](N[C@@H](C)Cc1ccc(F)cc1[N+](=O)[O-])c1nncn1C ZINC000903065651 1312321098 /nfs/dbraw/zinc/32/10/98/1312321098.db2.gz RSFUKYVLFMTHKH-NHYWBVRUSA-N 0 3 335.383 2.780 20 5 EFBDHN O=[N+]([O-])c1cc(N[C@H]2CCCC[C@@]23CNCCO3)cc2cc[nH]c21 ZINC001163650315 1312354363 /nfs/dbraw/zinc/35/43/63/1312354363.db2.gz NGIDQKGVLJTWLM-DOTOQJQBSA-N 0 3 330.388 2.789 20 5 EFBDHN O=[N+]([O-])c1c(F)cc(F)cc1N[C@H]1CCCC[C@@]12CNCCO2 ZINC001163650185 1312354431 /nfs/dbraw/zinc/35/44/31/1312354431.db2.gz LWSWXTVWGIIPDK-DZGCQCFKSA-N 0 3 327.331 2.586 20 5 EFBDHN O=[N+]([O-])c1cnc(N2C[C@H]3CCN(Cc4ccccc4)[C@H]3C2)c(F)c1 ZINC001165084637 1312565003 /nfs/dbraw/zinc/56/50/03/1312565003.db2.gz KSVWJYOFJPSOEW-PBHICJAKSA-N 0 3 342.374 2.840 20 5 EFBDHN O=[N+]([O-])c1cnc2cccc(NCC3CN(Cc4ccccc4)C3)n21 ZINC001165469298 1312634537 /nfs/dbraw/zinc/63/45/37/1312634537.db2.gz OFGOYAMEMRERMQ-UHFFFAOYSA-N 0 3 337.383 2.786 20 5 EFBDHN Cc1cccc(CC(=O)NCCCNCc2csc([N+](=O)[O-])c2)c1 ZINC001165591091 1312650359 /nfs/dbraw/zinc/65/03/59/1312650359.db2.gz LMHVMUVMMIXXHO-UHFFFAOYSA-N 0 3 347.440 2.803 20 5 EFBDHN CN(C)C[C@@H]1CN(Cc2ccc3ccc4cccnc4c3n2)CCO1 ZINC001232218669 1312650807 /nfs/dbraw/zinc/65/08/07/1312650807.db2.gz JSAGAFBUUDLEMK-GOSISDBHSA-N 0 3 336.439 2.545 20 5 EFBDHN O=C1NCC2(CCN(Cc3ccc4ccc5cccnc5c4n3)CC2)O1 ZINC001232222884 1312651858 /nfs/dbraw/zinc/65/18/58/1312651858.db2.gz HZWXLGHBRADAQK-UHFFFAOYSA-N 0 3 348.406 2.857 20 5 EFBDHN CC(C(=O)N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1)=C1CCC1 ZINC001020136091 1314627106 /nfs/dbraw/zinc/62/71/06/1314627106.db2.gz RNKHTPVORNWIKF-WKILWMFISA-N 0 3 329.400 2.832 20 5 EFBDHN N[C@@H]1CN([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCC1(F)F ZINC001246603471 1314656128 /nfs/dbraw/zinc/65/61/28/1314656128.db2.gz YUJZAXMPNCWMAQ-DZGCQCFKSA-N 0 3 325.359 2.511 20 5 EFBDHN O=[N+]([O-])c1cc2[n-]c(O[C@H]3CCC[NH2+]C[C@@H]3F)nc2cc1Cl ZINC001217945971 1315123285 /nfs/dbraw/zinc/12/32/85/1315123285.db2.gz FUXUTQBWGFZTGH-UFBFGSQYSA-N 0 3 328.731 2.593 20 5 EFBDHN O=[N+]([O-])c1cc2nc(O[C@H]3CCC[NH2+]C[C@@H]3F)[n-]c2cc1Cl ZINC001217945971 1315123289 /nfs/dbraw/zinc/12/32/89/1315123289.db2.gz FUXUTQBWGFZTGH-UFBFGSQYSA-N 0 3 328.731 2.593 20 5 EFBDHN Cc1cc(Br)c(O[C@H]2CCNC[C@@H]2F)cc1[N+](=O)[O-] ZINC001218068685 1315142354 /nfs/dbraw/zinc/14/23/54/1315142354.db2.gz FPDBRMQBWWLSHH-ONGXEEELSA-N 0 3 333.157 2.745 20 5 EFBDHN CC(C)(C)c1cc([N+](=O)[O-])c(O[C@H]2CCNC[C@@H]2F)c([N+](=O)[O-])c1 ZINC001218071890 1315143026 /nfs/dbraw/zinc/14/30/26/1315143026.db2.gz QLGGANCTQLHORE-GWCFXTLKSA-N 0 3 341.339 2.879 20 5 EFBDHN COCCn1c(C)c(C)c2cc(C(=O)OCC(C)[N+](=O)[O-])ccc21 ZINC000813110739 1315166423 /nfs/dbraw/zinc/16/64/23/1315166423.db2.gz IKLFRWGFNQXGJH-LLVKDONJSA-N 0 3 334.372 2.727 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCCCC2)cc1O[C@@H]1CNCCC1(F)F ZINC001218451382 1315197802 /nfs/dbraw/zinc/19/78/02/1315197802.db2.gz FRSYUHHVEBVHBI-OAHLLOKOSA-N 0 3 341.358 2.961 20 5 EFBDHN COC(=O)c1ccc(O[C@H]2CNCc3ccccc32)cc1[N+](=O)[O-] ZINC001218491595 1315204756 /nfs/dbraw/zinc/20/47/56/1315204756.db2.gz VLMHMRHTJHGFOH-INIZCTEOSA-N 0 3 328.324 2.605 20 5 EFBDHN Nc1cc2nc3ccccc3nc2cc1NC(=O)[C@@H](N)CC1CCC1 ZINC001218857080 1315250776 /nfs/dbraw/zinc/25/07/76/1315250776.db2.gz IJIFVPPMRSLHBJ-ZDUSSCGKSA-N 0 3 335.411 2.821 20 5 EFBDHN COC(=O)C[C@@H](N[C@@H](C)Cc1ccccc1[N+](=O)[O-])c1cccnc1 ZINC001254542538 1315721934 /nfs/dbraw/zinc/72/19/34/1315721934.db2.gz OUSMKQNKRGRAII-XJKSGUPXSA-N 0 3 343.383 2.815 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])NCc1ccnc(OCC2CC2)n1 ZINC001254547014 1315722382 /nfs/dbraw/zinc/72/23/82/1315722382.db2.gz BTNRLZJXOCUCPR-CYBMUJFWSA-N 0 3 342.399 2.894 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N1CCC[C@]2(CCCC(=O)N2)C1 ZINC001254557692 1315723357 /nfs/dbraw/zinc/72/33/57/1315723357.db2.gz QSILTBIWXPETHI-RDTXWAMCSA-N 0 3 331.416 2.661 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N1CCC(NC(=O)C2CCC2)CC1 ZINC001254562879 1315723921 /nfs/dbraw/zinc/72/39/21/1315723921.db2.gz QLVAZPWQNVMNKL-AWEZNQCLSA-N 0 3 345.443 2.907 20 5 EFBDHN CCO[C@@H]1CN([C@@H](C)Cc2ccccc2[N+](=O)[O-])[C@@H]2CCCO[C@H]12 ZINC001254561173 1315724322 /nfs/dbraw/zinc/72/43/22/1315724322.db2.gz JQYGTSQPXAEDBQ-LIRZEXBASA-N 0 3 334.416 2.794 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N1CCC[C@@H](Oc2ncccn2)C1 ZINC001254570571 1315725206 /nfs/dbraw/zinc/72/52/06/1315725206.db2.gz NYOAJHQVAWHVLQ-GOEBONIOSA-N 0 3 342.399 2.859 20 5 EFBDHN CCOC(=O)NC1CCN([C@@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC001254570599 1315725265 /nfs/dbraw/zinc/72/52/65/1315725265.db2.gz OLFXLOQWMYZWTL-ZDUSSCGKSA-N 0 3 335.404 2.736 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N1CCC(Oc2ccncn2)CC1 ZINC001254569987 1315725311 /nfs/dbraw/zinc/72/53/11/1315725311.db2.gz LNKWVKQOKOSWHG-AWEZNQCLSA-N 0 3 342.399 2.859 20 5 EFBDHN Cc1ccnc(O[C@H]2CCN([C@H](C)Cc3ccccc3[N+](=O)[O-])C2)n1 ZINC001254571524 1315725503 /nfs/dbraw/zinc/72/55/03/1315725503.db2.gz XCNRQFAYVHOPCB-ZBFHGGJFSA-N 0 3 342.399 2.778 20 5 EFBDHN Cc1ccnc(O[C@@H]2CCN([C@@H](C)Cc3ccccc3[N+](=O)[O-])C2)n1 ZINC001254571522 1315725594 /nfs/dbraw/zinc/72/55/94/1315725594.db2.gz XCNRQFAYVHOPCB-GOEBONIOSA-N 0 3 342.399 2.778 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N1CCC(N2CCCOC2=O)CC1 ZINC001254571445 1315725778 /nfs/dbraw/zinc/72/57/78/1315725778.db2.gz VQRVIBZDNAGGTH-AWEZNQCLSA-N 0 3 347.415 2.833 20 5 EFBDHN CC(C)(C)OC(=O)N1CC(C)(N[C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254571973 1315726144 /nfs/dbraw/zinc/72/61/44/1315726144.db2.gz FNRHLQPGFNOKFC-CQSZACIVSA-N 0 3 347.415 2.661 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@@H](NCc1cn(CC(F)(F)F)cn1)C2 ZINC001254586491 1315727848 /nfs/dbraw/zinc/72/78/48/1315727848.db2.gz KJLOQIPFKWWXCF-LBPRGKRZSA-N 0 3 340.305 2.611 20 5 EFBDHN CCOC(=O)C[C@@H]1CCCN([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254592690 1315728286 /nfs/dbraw/zinc/72/82/86/1315728286.db2.gz FUKJGDWGQNNWIA-GUYCJALGSA-N 0 3 332.400 2.727 20 5 EFBDHN CC(C)(C)OC(=O)[C@@H]1CCN([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254597437 1315728893 /nfs/dbraw/zinc/72/88/93/1315728893.db2.gz DQIYUOYMJZDVRB-CJNGLKHVSA-N 0 3 332.400 2.726 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@H](N1CC[C@H](Oc3ccccn3)C1)C2 ZINC001254607246 1315730425 /nfs/dbraw/zinc/73/04/25/1315730425.db2.gz JWGVDWVGMRADHS-SJORKVTESA-N 0 3 325.368 2.610 20 5 EFBDHN COc1cc(N2CCC(NCc3conc3C)CC2)ccc1[N+](=O)[O-] ZINC001256082778 1315903323 /nfs/dbraw/zinc/90/33/23/1315903323.db2.gz JYCTZEPQUYBRAK-UHFFFAOYSA-N 0 3 346.387 2.658 20 5 EFBDHN CN(C)C[C@H](NC[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC001262562627 1316472458 /nfs/dbraw/zinc/47/24/58/1316472458.db2.gz GXWOQDQTDQUIEF-ROUUACIJSA-N 0 3 347.390 2.660 20 5 EFBDHN CN(C)C[C@@H](NC[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC001262562626 1316472503 /nfs/dbraw/zinc/47/25/03/1316472503.db2.gz GXWOQDQTDQUIEF-QZTJIDSGSA-N 0 3 347.390 2.660 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CCC[C@H](c3nc4ccccc4[nH]3)C2)c1 ZINC001319388391 1328869053 /nfs/dbraw/zinc/86/90/53/1328869053.db2.gz GARAUSDFTKDBPV-ZDUSSCGKSA-N 0 3 340.387 2.547 20 5 EFBDHN COC(=O)[C@H]1CCC[C@@H]1NCc1cc([N+](=O)[O-])ccc1OC(C)C ZINC001320947217 1329323067 /nfs/dbraw/zinc/32/30/67/1329323067.db2.gz TWYZUHZWMWYDJJ-GJZGRUSLSA-N 0 3 336.388 2.813 20 5 EFBDHN O=C(NC[C@@H]1CCCCN1C1CC1)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001321161139 1329351226 /nfs/dbraw/zinc/35/12/26/1329351226.db2.gz HGJMPLZFRGSZQB-KRWDZBQOSA-N 0 3 344.415 2.637 20 5 EFBDHN CCN1CCN(Cc2ccc([N+](=O)[O-])cc2Br)[C@H](C)C1 ZINC001322439668 1329458632 /nfs/dbraw/zinc/45/86/32/1329458632.db2.gz FCZKDWIDTHTHRY-LLVKDONJSA-N 0 3 342.237 2.883 20 5 EFBDHN Cc1cncc([N+](=O)[O-])c1N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC001322535501 1329465676 /nfs/dbraw/zinc/46/56/76/1329465676.db2.gz RWPUAGASXBOVFR-ZBFHGGJFSA-N 0 3 326.400 2.795 20 5 EFBDHN CN(C)[C@@H]1CCCC[C@H]1Nc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC001323107009 1329512439 /nfs/dbraw/zinc/51/24/39/1329512439.db2.gz GWDBZYGHCJNARM-ZIAGYGMSSA-N 0 3 331.376 2.528 20 5 EFBDHN C[C@@H]1CN(C)[C@@H](C)CN1c1ncnc2c(Cl)cc([N+](=O)[O-])cc21 ZINC001327662890 1330505877 /nfs/dbraw/zinc/50/58/77/1330505877.db2.gz RNNZSMGPYIRZMS-VHSXEESVSA-N 0 3 335.795 2.720 20 5 EFBDHN CC(C)CN1CCN(c2ncnc3c(Cl)cc([N+](=O)[O-])cc32)CC1 ZINC001328488452 1330596949 /nfs/dbraw/zinc/59/69/49/1330596949.db2.gz WDUGYFYUYYCSOY-UHFFFAOYSA-N 0 3 349.822 2.969 20 5 EFBDHN Cc1cccc(CN2CC[C@@H](Nc3ncc([N+](=O)[O-])c(C)n3)C2)c1 ZINC001329364329 1330698775 /nfs/dbraw/zinc/69/87/75/1330698775.db2.gz PSAVZAWWJCKSCR-OAHLLOKOSA-N 0 3 327.388 2.688 20 5 EFBDHN CN1CCN(c2ncnc3c(Cl)cc([N+](=O)[O-])cc32)CC1(C)C ZINC001331906031 1330889201 /nfs/dbraw/zinc/88/92/01/1330889201.db2.gz PNLSXEWNTZZIBZ-UHFFFAOYSA-N 0 3 335.795 2.722 20 5 EFBDHN CN1CCN(CCCNc2cccc(C(F)(F)F)c2[N+](=O)[O-])CC1 ZINC001333344707 1331122082 /nfs/dbraw/zinc/12/20/82/1331122082.db2.gz WLERTHFWQAUCMA-UHFFFAOYSA-N 0 3 346.353 2.663 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2Cc3ccccc3CN2)c1C ZINC001333643421 1331185998 /nfs/dbraw/zinc/18/59/98/1331185998.db2.gz QGQINWZCZPQBDB-INIZCTEOSA-N 0 3 339.395 2.656 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]C[C@@H]2CCCO[C@@H]2C(C)C)c1[N+](=O)[O-] ZINC001334185231 1331262813 /nfs/dbraw/zinc/26/28/13/1331262813.db2.gz AWMODTRXLLRPIL-XJKSGUPXSA-N 0 3 338.404 2.850 20 5 EFBDHN Cc1cccnc1[C@H](C)NCCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC001338436771 1331707629 /nfs/dbraw/zinc/70/76/29/1331707629.db2.gz QYUHASYIBHCWFS-ZDUSSCGKSA-N 0 3 328.372 2.978 20 5 EFBDHN C[C@H](NCCN1C(=O)COc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC001341684267 1332276570 /nfs/dbraw/zinc/27/65/70/1332276570.db2.gz OUJJJSGYBHWMNV-ZDUSSCGKSA-N 0 3 341.367 2.671 20 5 EFBDHN COc1cc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])ccn1 ZINC001343829631 1332384374 /nfs/dbraw/zinc/38/43/74/1332384374.db2.gz IOCWYVATSAGWIS-MEBBXXQBSA-N 0 3 334.303 2.793 20 5 EFBDHN CO[C@@H]1CCC[C@@H]1C(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC001345207368 1332521988 /nfs/dbraw/zinc/52/19/88/1332521988.db2.gz KLRYWEIGVAVEPW-OBCWZRDOSA-N 0 3 325.336 2.890 20 5 EFBDHN CC([C@@H](OC(=O)c1c2c(nn1C)CCC2)c1ccccc1F)[N+](=O)[O-] ZINC001345207383 1332522148 /nfs/dbraw/zinc/52/21/48/1332522148.db2.gz KTIFKXUFTXDGQA-MGPLVRAMSA-N 0 3 347.346 2.611 20 5 EFBDHN Cc1ccc(CN2CC[C@H](Nc3ncc([N+](=O)[O-])c(C)n3)C2)cc1 ZINC001348545946 1332847149 /nfs/dbraw/zinc/84/71/49/1332847149.db2.gz DPSWPAHOFVJPQO-HNNXBMFYSA-N 0 3 327.388 2.688 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2NC[C@@H](O)COc1cccc(F)c1 ZINC000848524270 1334773136 /nfs/dbraw/zinc/77/31/36/1334773136.db2.gz RMYCMBCSIFSVKL-DYVFJYSZSA-N 0 3 346.358 2.751 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)NC[C@@H]2CCCCN2C)cc1[N+](=O)[O-] ZINC001357291339 1335297163 /nfs/dbraw/zinc/29/71/63/1335297163.db2.gz KRUSNTLQRUKEGT-ZFWWWQNUSA-N 0 3 334.420 2.748 20 5 EFBDHN O=C(N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1)c1occc1Cl ZINC001020552898 713161764 /nfs/dbraw/zinc/16/17/64/713161764.db2.gz QRUGOJZPVYVAPM-HAQNSBGRSA-N 0 3 349.774 2.892 20 5 EFBDHN O=C(N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1)c1ccccc1 ZINC001021784700 714474963 /nfs/dbraw/zinc/47/49/63/714474963.db2.gz QPJZUELDBMYDOZ-IYBDPMFKSA-N 0 3 325.368 2.645 20 5 EFBDHN COCCN1[C@H](C)CN(C/C=C\c2ccccc2[N+](=O)[O-])C[C@@H]1C ZINC000255330917 714677527 /nfs/dbraw/zinc/67/75/27/714677527.db2.gz PNVBUSVIFSPJEV-HMDCADFTSA-N 0 3 333.432 2.649 20 5 EFBDHN COc1ccc(C[C@@](C)(CO)NCc2ccccc2[N+](=O)[O-])cc1 ZINC000933424978 714775329 /nfs/dbraw/zinc/77/53/29/714775329.db2.gz VXOKMSCHBUERDN-SFHVURJKSA-N 0 3 330.384 2.687 20 5 EFBDHN COc1ccc(C[C@@](C)(CO)NCc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000933432521 714780874 /nfs/dbraw/zinc/78/08/74/714780874.db2.gz NYQFRVRLTBFDFN-SFHVURJKSA-N 0 3 348.374 2.826 20 5 EFBDHN COc1c([O-])ccc(C[N@H+](C)C2Cc3ccccc3C2)c1[N+](=O)[O-] ZINC000891787682 715018358 /nfs/dbraw/zinc/01/83/58/715018358.db2.gz TZRLBNKWNZHCHZ-UHFFFAOYSA-N 0 3 328.368 2.908 20 5 EFBDHN COc1c([O-])ccc(C[N@@H+](C)C2Cc3ccccc3C2)c1[N+](=O)[O-] ZINC000891787682 715018361 /nfs/dbraw/zinc/01/83/61/715018361.db2.gz TZRLBNKWNZHCHZ-UHFFFAOYSA-N 0 3 328.368 2.908 20 5 EFBDHN COc1c(O)ccc(CN(C)C2Cc3ccccc3C2)c1[N+](=O)[O-] ZINC000891787682 715018364 /nfs/dbraw/zinc/01/83/64/715018364.db2.gz TZRLBNKWNZHCHZ-UHFFFAOYSA-N 0 3 328.368 2.908 20 5 EFBDHN C[C@H](CN1CCCCC1)Nc1c2ccccc2n(C)c(=O)c1[N+](=O)[O-] ZINC000891792366 715021613 /nfs/dbraw/zinc/02/16/13/715021613.db2.gz HHJIYGGRRSWQOB-CYBMUJFWSA-N 0 3 344.415 2.733 20 5 EFBDHN COc1c(O)ccc(CN(CCCO)CC(C)(C)C)c1[N+](=O)[O-] ZINC000891948847 715168947 /nfs/dbraw/zinc/16/89/47/715168947.db2.gz HRSFZYFHFASDLN-UHFFFAOYSA-N 0 3 326.393 2.540 20 5 EFBDHN Cc1cc(F)cc(C(=O)NC[C@@H]2NCCc3ccccc32)c1[N+](=O)[O-] ZINC000262413945 715210233 /nfs/dbraw/zinc/21/02/33/715210233.db2.gz QXQWUISHNVYDGT-INIZCTEOSA-N 0 3 343.358 2.659 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CN(C2CC2)C[C@@H]1C ZINC000934574375 715685577 /nfs/dbraw/zinc/68/55/77/715685577.db2.gz GIHRQOHATVUPAF-HZMBPMFUSA-N 0 3 335.429 2.529 20 5 EFBDHN C[C@@H](NCc1cccc([N+](=O)[O-])c1Br)[C@@H]1CCOC1 ZINC000235188409 716667068 /nfs/dbraw/zinc/66/70/68/716667068.db2.gz AFIRBHHHQOLKSW-MWLCHTKSSA-N 0 3 329.194 2.872 20 5 EFBDHN CC(C)N1CCC[C@@H]1C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000935277051 716887913 /nfs/dbraw/zinc/88/79/13/716887913.db2.gz QTWNARDOUBTBSI-CQSZACIVSA-N 0 3 339.823 2.780 20 5 EFBDHN COc1c(O)ccc(CN[C@H]2C[C@@H](OC(C)C)C2(C)C)c1[N+](=O)[O-] ZINC000893624020 717889173 /nfs/dbraw/zinc/88/91/73/717889173.db2.gz LLRYATAVXGYASC-UONOGXRCSA-N 0 3 338.404 2.991 20 5 EFBDHN COc1c([O-])ccc(C[NH2+][C@H]2C[C@@H](OC(C)C)C2(C)C)c1[N+](=O)[O-] ZINC000893624020 717889178 /nfs/dbraw/zinc/88/91/78/717889178.db2.gz LLRYATAVXGYASC-UONOGXRCSA-N 0 3 338.404 2.991 20 5 EFBDHN COc1c(O)ccc(CN[C@@H]2C[C@@H](OC(C)C)C2(C)C)c1[N+](=O)[O-] ZINC000893624022 717889431 /nfs/dbraw/zinc/88/94/31/717889431.db2.gz LLRYATAVXGYASC-ZIAGYGMSSA-N 0 3 338.404 2.991 20 5 EFBDHN COc1c([O-])ccc(C[NH2+][C@@H]2C[C@@H](OC(C)C)C2(C)C)c1[N+](=O)[O-] ZINC000893624022 717889436 /nfs/dbraw/zinc/88/94/36/717889436.db2.gz LLRYATAVXGYASC-ZIAGYGMSSA-N 0 3 338.404 2.991 20 5 EFBDHN COc1c(O)ccc(CNCCN(C)c2ccccc2)c1[N+](=O)[O-] ZINC000892526226 718211820 /nfs/dbraw/zinc/21/18/20/718211820.db2.gz DLHHUIQOAVNHMR-UHFFFAOYSA-N 0 3 331.372 2.535 20 5 EFBDHN CC[C@H](CN1CCCC1)Nc1c2ccccc2n(C)c(=O)c1[N+](=O)[O-] ZINC000892558669 718282352 /nfs/dbraw/zinc/28/23/52/718282352.db2.gz ARXBXSNLXQINQH-CYBMUJFWSA-N 0 3 344.415 2.733 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCCN3CCCC[C@H]23)c1C ZINC000892596069 718322331 /nfs/dbraw/zinc/32/23/31/718322331.db2.gz MVFXLEWNSCPKQD-LSDHHAIUSA-N 0 3 331.416 2.958 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCCN3CCCC[C@@H]23)c1C ZINC000892596067 718322407 /nfs/dbraw/zinc/32/24/07/718322407.db2.gz MVFXLEWNSCPKQD-GJZGRUSLSA-N 0 3 331.416 2.958 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)ccc1CNCCc1cn2c(n1)SCC2 ZINC000893639471 718981453 /nfs/dbraw/zinc/98/14/53/718981453.db2.gz DQWLPIUUIQDAHQ-UHFFFAOYSA-N 0 3 338.820 2.883 20 5 EFBDHN Cc1occc1C(=O)N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001019976213 719412645 /nfs/dbraw/zinc/41/26/45/719412645.db2.gz BHYCSNAVGMZFHU-HDJSIYSDSA-N 0 3 329.356 2.547 20 5 EFBDHN COc1c([O-])ccc(C[NH2+][C@@H]2[C@@H]3CCCO[C@@H]3C2(C)C)c1[N+](=O)[O-] ZINC000893092696 719625057 /nfs/dbraw/zinc/62/50/57/719625057.db2.gz MVRJQMHWTIENOH-XZJROXQQSA-N 0 3 336.388 2.602 20 5 EFBDHN COc1c([O-])ccc(C[NH2+][C@@H]2[C@@H]3CCO[C@H]3C23CCCC3)c1[N+](=O)[O-] ZINC000893210653 720059799 /nfs/dbraw/zinc/05/97/99/720059799.db2.gz RHAOFQKTEUGSDK-JCURWCKSSA-N 0 3 348.399 2.746 20 5 EFBDHN CSc1ccc([C@H](CNc2c([N+](=O)[O-])cnn2C)N(C)C)cc1 ZINC000893999247 720213505 /nfs/dbraw/zinc/21/35/05/720213505.db2.gz DKQULAHCSGONBG-ZDUSSCGKSA-N 0 3 335.433 2.765 20 5 EFBDHN COC(=O)c1cc(CNCCOc2ccc([N+](=O)[O-])cc2)cs1 ZINC000894228590 721336153 /nfs/dbraw/zinc/33/61/53/721336153.db2.gz GIUYLUCQNOAXRI-UHFFFAOYSA-N 0 3 336.369 2.612 20 5 EFBDHN O=C(N[C@H]1C[C@H](CNCc2csc([N+](=O)[O-])c2)C1)c1ccoc1 ZINC000983165937 721869642 /nfs/dbraw/zinc/86/96/42/721869642.db2.gz BQPKOUREEMYJJV-MJHDQNEOSA-N 0 3 335.385 2.548 20 5 EFBDHN C[C@H]1CN(C)c2ccccc2CN1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154425277 728752862 /nfs/dbraw/zinc/75/28/62/728752862.db2.gz SSCJCWVLMGSAOC-LIRRHRJNSA-N 0 3 341.411 2.969 20 5 EFBDHN Cc1cc(C(=O)N[C@H]2C[C@H](CNCc3csc([N+](=O)[O-])c3)C2)co1 ZINC000983547721 722709214 /nfs/dbraw/zinc/70/92/14/722709214.db2.gz VWDBCHUOPKPHPO-YEORSEQZSA-N 0 3 349.412 2.856 20 5 EFBDHN Cn1c2ccccc2c(N[C@H]2CCN(C(C)(C)C)C2)c([N+](=O)[O-])c1=O ZINC000894488751 722753362 /nfs/dbraw/zinc/75/33/62/722753362.db2.gz HXCQPWIDKUNOTP-LBPRGKRZSA-N 0 3 344.415 2.731 20 5 EFBDHN COc1c(O)ccc(CNC[C@]2(C)CC2(Cl)Cl)c1[N+](=O)[O-] ZINC000894714127 722823894 /nfs/dbraw/zinc/82/38/94/722823894.db2.gz CQVFKPZIKWIQEQ-LBPRGKRZSA-N 0 3 335.187 2.983 20 5 EFBDHN CC(C)C[C@H]1CN(C)CCN1c1ncnc2sc([N+](=O)[O-])cc21 ZINC000896649986 723423213 /nfs/dbraw/zinc/42/32/13/723423213.db2.gz APDNAWUINHUEQQ-NSHDSACASA-N 0 3 335.433 2.766 20 5 EFBDHN O=C(N[C@H]1C[C@H](CNCc2csc([N+](=O)[O-])c2)C1)C1CC2(CC2)C1 ZINC000984779915 723474459 /nfs/dbraw/zinc/47/44/59/723474459.db2.gz KIOAREJSROHBOR-YEORSEQZSA-N 0 3 349.456 2.831 20 5 EFBDHN CC1(C)CNC(=O)[C@@H]1NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000895317445 724021973 /nfs/dbraw/zinc/02/19/73/724021973.db2.gz ODIHGHCDSDMPGA-HNNXBMFYSA-N 0 3 345.424 2.938 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]CCC2(CSC)CC2)c1[N+](=O)[O-] ZINC000895338370 724047795 /nfs/dbraw/zinc/04/77/95/724047795.db2.gz UVCOAJZCJNKPFV-UHFFFAOYSA-N 0 3 326.418 2.932 20 5 EFBDHN CC(C)(CNCc1ccc(Cl)cc1[N+](=O)[O-])[C@@]1(O)CCCOC1 ZINC000895441716 724135192 /nfs/dbraw/zinc/13/51/92/724135192.db2.gz DXRUQHCEBKZBGV-MRXNPFEDSA-N 0 3 342.823 2.906 20 5 EFBDHN C[C@@H](CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CCCCC1 ZINC000918703325 728912016 /nfs/dbraw/zinc/91/20/16/728912016.db2.gz BDMPISLYKZBKGF-LBPRGKRZSA-N 0 3 330.388 2.680 20 5 EFBDHN CCN1CCCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000910280214 727426696 /nfs/dbraw/zinc/42/66/96/727426696.db2.gz AHPZHJFVFXRYAA-NSHDSACASA-N 0 3 325.796 2.805 20 5 EFBDHN CCN1CCCN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)[C@@H](C)C1 ZINC000910289273 727428022 /nfs/dbraw/zinc/42/80/22/727428022.db2.gz OYSCEHCMTFNWEQ-LBPRGKRZSA-N 0 3 330.388 2.632 20 5 EFBDHN CCN1CCCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000910296451 727431217 /nfs/dbraw/zinc/43/12/17/727431217.db2.gz NEVACDHENLQSGS-NSHDSACASA-N 0 3 325.796 2.805 20 5 EFBDHN C[C@@H]1CCCN(CCNC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000916053886 727652445 /nfs/dbraw/zinc/65/24/45/727652445.db2.gz KFNLAUATAQXVOE-LLVKDONJSA-N 0 3 325.796 2.710 20 5 EFBDHN CC[C@@H](C)C[C@H](N)C(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000912149989 727664632 /nfs/dbraw/zinc/66/46/32/727664632.db2.gz HMMBTQULXSWQTG-YGRLFVJLSA-N 0 3 327.812 2.970 20 5 EFBDHN CCN1CCN(c2ccc(Nc3ccc([N+](=O)[O-])nc3)cc2)CC1 ZINC000916568976 727698510 /nfs/dbraw/zinc/69/85/10/727698510.db2.gz SIENZZMUTRPQQZ-UHFFFAOYSA-N 0 3 327.388 2.875 20 5 EFBDHN CN(C)[C@H](CNc1ccc([N+](=O)[O-])c2nonc21)c1cccc(F)c1 ZINC000912728226 727738515 /nfs/dbraw/zinc/73/85/15/727738515.db2.gz FCNIRDXPHDRFLI-CQSZACIVSA-N 0 3 345.334 2.985 20 5 EFBDHN C[C@@H](C(=O)NC[C@@H]1Cc2ccccc2CN1)c1cccc([N+](=O)[O-])c1 ZINC001575069783 1088224694 /nfs/dbraw/zinc/22/46/94/1088224694.db2.gz NCYZGGZVUREXLI-DYVFJYSZSA-N 0 3 339.395 2.529 20 5 EFBDHN C[C@@H]1CN[C@@H](C)[C@H](C)N1C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC001576880902 1089504661 /nfs/dbraw/zinc/50/46/61/1089504661.db2.gz SAPLCIZYMUDRLP-UTLUCORTSA-N 0 3 345.321 2.825 20 5 EFBDHN C[C@@H]1OC(C)(C)N[C@@H]1CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC001576910753 1089523822 /nfs/dbraw/zinc/52/38/22/1089523822.db2.gz WACKGEITHBZFDS-JOYOIKCWSA-N 0 3 349.412 2.652 20 5 EFBDHN CCN[C@@H](C)C(=O)Nc1nc(-c2ccc(C)c([N+](=O)[O-])c2)cs1 ZINC001577814343 1090193868 /nfs/dbraw/zinc/19/38/68/1090193868.db2.gz XHSKYLWCQOWTIY-JTQLQIEISA-N 0 3 334.401 2.963 20 5 EFBDHN Cc1cc(NC(=O)c2ccc3c(c2)CNC3)c2cc([N+](=O)[O-])ccc2n1 ZINC001579635240 1090648174 /nfs/dbraw/zinc/64/81/74/1090648174.db2.gz QNMQIIZUMDFCBF-UHFFFAOYSA-N 0 3 348.362 2.729 20 5 EFBDHN O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1cc(F)cc([N+](=O)[O-])c1 ZINC001580765777 1091001513 /nfs/dbraw/zinc/00/15/13/1091001513.db2.gz SYWJDHUMBNZXSU-MRXNPFEDSA-N 0 3 345.330 2.647 20 5 EFBDHN CCN(CC)CC(=O)NCC1(Nc2ccc([N+](=O)[O-])cc2)CCCC1 ZINC001104396246 1092409254 /nfs/dbraw/zinc/40/92/54/1092409254.db2.gz UTONLHVIZKPUQH-UHFFFAOYSA-N 0 3 348.447 2.778 20 5 EFBDHN CC(C)c1cc(C(=O)NCCCNCc2ccccc2[N+](=O)[O-])on1 ZINC001167627929 1093148353 /nfs/dbraw/zinc/14/83/53/1093148353.db2.gz VFQSOTKUPRZOIR-UHFFFAOYSA-N 0 3 346.387 2.616 20 5 EFBDHN C/C=C/C[C@@H]1CCC[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590352617 1093387484 /nfs/dbraw/zinc/38/74/84/1093387484.db2.gz CGTKBQHKYAHABI-YWVDXFKGSA-N 0 3 342.403 2.953 20 5 EFBDHN C/C=C/C[C@@H]1CCC[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590352617 1093387495 /nfs/dbraw/zinc/38/74/95/1093387495.db2.gz CGTKBQHKYAHABI-YWVDXFKGSA-N 0 3 342.403 2.953 20 5 EFBDHN C/C=C/C[C@@H]1CCC[N@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590352617 1093387509 /nfs/dbraw/zinc/38/75/09/1093387509.db2.gz CGTKBQHKYAHABI-YWVDXFKGSA-N 0 3 342.403 2.953 20 5 EFBDHN C/C=C/C[C@@H]1CCC[N@@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590352617 1093387520 /nfs/dbraw/zinc/38/75/20/1093387520.db2.gz CGTKBQHKYAHABI-YWVDXFKGSA-N 0 3 342.403 2.953 20 5 EFBDHN CCC(CC)[C@H](CNc1cc(-c2nnn[n-]2)ccc1[N+](=O)[O-])[NH+](C)C ZINC001590432240 1093417772 /nfs/dbraw/zinc/41/77/72/1093417772.db2.gz GBAUNKRDAYGHQB-HNNXBMFYSA-N 0 3 347.423 2.553 20 5 EFBDHN CCC(CC)[C@H](CNc1cc(-c2nn[n-]n2)ccc1[N+](=O)[O-])[NH+](C)C ZINC001590432240 1093417776 /nfs/dbraw/zinc/41/77/76/1093417776.db2.gz GBAUNKRDAYGHQB-HNNXBMFYSA-N 0 3 347.423 2.553 20 5 EFBDHN CCC(CC)[N@H+](Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])C1CC1 ZINC001590434824 1093419495 /nfs/dbraw/zinc/41/94/95/1093419495.db2.gz HDVBLSHSCZWEQF-UHFFFAOYSA-N 0 3 330.392 2.928 20 5 EFBDHN CCC(CC)[N@@H+](Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])C1CC1 ZINC001590434824 1093419502 /nfs/dbraw/zinc/41/95/02/1093419502.db2.gz HDVBLSHSCZWEQF-UHFFFAOYSA-N 0 3 330.392 2.928 20 5 EFBDHN CCC(CC)[N@H+](Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])C1CC1 ZINC001590434824 1093419507 /nfs/dbraw/zinc/41/95/07/1093419507.db2.gz HDVBLSHSCZWEQF-UHFFFAOYSA-N 0 3 330.392 2.928 20 5 EFBDHN CCC(CC)[N@@H+](Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])C1CC1 ZINC001590434824 1093419512 /nfs/dbraw/zinc/41/95/12/1093419512.db2.gz HDVBLSHSCZWEQF-UHFFFAOYSA-N 0 3 330.392 2.928 20 5 EFBDHN CCC1(CC)CC[N@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001590490687 1093452520 /nfs/dbraw/zinc/45/25/20/1093452520.db2.gz FJBWDMJKFGXJKM-UHFFFAOYSA-N 0 3 330.392 2.787 20 5 EFBDHN CCC1(CC)CC[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001590490687 1093452524 /nfs/dbraw/zinc/45/25/24/1093452524.db2.gz FJBWDMJKFGXJKM-UHFFFAOYSA-N 0 3 330.392 2.787 20 5 EFBDHN CCC1(CC)CC[N@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001590490687 1093452527 /nfs/dbraw/zinc/45/25/27/1093452527.db2.gz FJBWDMJKFGXJKM-UHFFFAOYSA-N 0 3 330.392 2.787 20 5 EFBDHN CCC1(CC)CC[N@@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001590490687 1093452532 /nfs/dbraw/zinc/45/25/32/1093452532.db2.gz FJBWDMJKFGXJKM-UHFFFAOYSA-N 0 3 330.392 2.787 20 5 EFBDHN CC[NH+](CC)CCC[C@H](C)Nc1ccc(-c2nnn[n-]2)c([N+](=O)[O-])c1 ZINC001590687411 1093551202 /nfs/dbraw/zinc/55/12/02/1093551202.db2.gz MWRJPKATKPELNA-LBPRGKRZSA-N 0 3 347.423 2.697 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[N@@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC001593467404 1094312531 /nfs/dbraw/zinc/31/25/31/1094312531.db2.gz PVNUIHAVZMCBKJ-FZMZJTMJSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC001593467404 1094312539 /nfs/dbraw/zinc/31/25/39/1094312539.db2.gz PVNUIHAVZMCBKJ-FZMZJTMJSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1C[N@@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC001593467404 1094312547 /nfs/dbraw/zinc/31/25/47/1094312547.db2.gz PVNUIHAVZMCBKJ-FZMZJTMJSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1C[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC001593467404 1094312560 /nfs/dbraw/zinc/31/25/60/1094312560.db2.gz PVNUIHAVZMCBKJ-FZMZJTMJSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[NH2+]C1(C2CCCCC2)CC1 ZINC001593480903 1094326419 /nfs/dbraw/zinc/32/64/19/1094326419.db2.gz DWKPFCDIFLURAO-UHFFFAOYSA-N 0 3 342.403 2.977 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[NH2+]C1(C2CCCCC2)CC1 ZINC001593480903 1094326427 /nfs/dbraw/zinc/32/64/27/1094326427.db2.gz DWKPFCDIFLURAO-UHFFFAOYSA-N 0 3 342.403 2.977 20 5 EFBDHN Cc1cc(NC[C@@H]2COC3(CCCC3)O2)c2cc([N+](=O)[O-])ccc2n1 ZINC000782965192 1094606523 /nfs/dbraw/zinc/60/65/23/1094606523.db2.gz GZQUHBHSRRIJAM-CQSZACIVSA-N 0 3 343.383 2.971 20 5 EFBDHN CCOC(=O)c1cc(-n2nc(CN)c3ccccc32)ccc1[N+](=O)[O-] ZINC001167700430 1096024423 /nfs/dbraw/zinc/02/44/23/1096024423.db2.gz HYEXJRUPTHJZKM-UHFFFAOYSA-N 0 3 340.339 2.569 20 5 EFBDHN C[C@@H]1CC[C@H]([NH2+]Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])[C@H](C)C1 ZINC001603883161 1096655078 /nfs/dbraw/zinc/65/50/78/1096655078.db2.gz XSCXSOAJGYHWMA-GYSYKLTISA-N 0 3 330.392 2.689 20 5 EFBDHN C[C@@H]1CC[C@H]([NH2+]Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])[C@H](C)C1 ZINC001603883161 1096655082 /nfs/dbraw/zinc/65/50/82/1096655082.db2.gz XSCXSOAJGYHWMA-GYSYKLTISA-N 0 3 330.392 2.689 20 5 EFBDHN C[C@@H]1CC[C@@H]([NH2+]Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])[C@H](C)C1 ZINC001603883163 1096655332 /nfs/dbraw/zinc/65/53/32/1096655332.db2.gz XSCXSOAJGYHWMA-JTNHKYCSSA-N 0 3 330.392 2.689 20 5 EFBDHN C[C@@H]1CC[C@@H]([NH2+]Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])[C@H](C)C1 ZINC001603883163 1096655335 /nfs/dbraw/zinc/65/53/35/1096655335.db2.gz XSCXSOAJGYHWMA-JTNHKYCSSA-N 0 3 330.392 2.689 20 5 EFBDHN CC[C@@H]([NH2+]Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])[C@H]1CC1(C)C ZINC001604063232 1096716297 /nfs/dbraw/zinc/71/62/97/1096716297.db2.gz XCFXAYLMSDCZRY-CHWSQXEVSA-N 0 3 330.392 2.689 20 5 EFBDHN CC[C@@H]([NH2+]Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])[C@H]1CC1(C)C ZINC001604063232 1096716304 /nfs/dbraw/zinc/71/63/04/1096716304.db2.gz XCFXAYLMSDCZRY-CHWSQXEVSA-N 0 3 330.392 2.689 20 5 EFBDHN C[C@@H]([NH2+]Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])C1CCCCC1 ZINC001609124521 1098158206 /nfs/dbraw/zinc/15/82/06/1098158206.db2.gz CKHIRRMRTFZALY-LLVKDONJSA-N 0 3 330.392 2.833 20 5 EFBDHN C[C@@H]([NH2+]Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])C1CCCCC1 ZINC001609124521 1098158211 /nfs/dbraw/zinc/15/82/11/1098158211.db2.gz CKHIRRMRTFZALY-LLVKDONJSA-N 0 3 330.392 2.833 20 5 EFBDHN C[C@@H]1C[C@H](C)[C@@H](C)[N@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001609153919 1098171693 /nfs/dbraw/zinc/17/16/93/1098171693.db2.gz FWBJFHFMMJIQOO-GRYCIOLGSA-N 0 3 330.392 2.641 20 5 EFBDHN C[C@@H]1C[C@H](C)[C@@H](C)[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001609153919 1098171695 /nfs/dbraw/zinc/17/16/95/1098171695.db2.gz FWBJFHFMMJIQOO-GRYCIOLGSA-N 0 3 330.392 2.641 20 5 EFBDHN C[C@@H]1C[C@H](C)[C@@H](C)[N@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001609153919 1098171699 /nfs/dbraw/zinc/17/16/99/1098171699.db2.gz FWBJFHFMMJIQOO-GRYCIOLGSA-N 0 3 330.392 2.641 20 5 EFBDHN C[C@@H]1C[C@H](C)[C@@H](C)[N@@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001609153919 1098171702 /nfs/dbraw/zinc/17/17/02/1098171702.db2.gz FWBJFHFMMJIQOO-GRYCIOLGSA-N 0 3 330.392 2.641 20 5 EFBDHN C[C@H]1CCC[C@H](C)[N@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001609162711 1098176077 /nfs/dbraw/zinc/17/60/77/1098176077.db2.gz IJSQQQNKDFWBKZ-RYUDHWBXSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@H]1CCC[C@H](C)[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001609162711 1098176081 /nfs/dbraw/zinc/17/60/81/1098176081.db2.gz IJSQQQNKDFWBKZ-RYUDHWBXSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@H]1CCC[C@H](C)[N@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001609162711 1098176085 /nfs/dbraw/zinc/17/60/85/1098176085.db2.gz IJSQQQNKDFWBKZ-RYUDHWBXSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@H]1CCC[C@H](C)[N@@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001609162711 1098176090 /nfs/dbraw/zinc/17/60/90/1098176090.db2.gz IJSQQQNKDFWBKZ-RYUDHWBXSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@H]1CCC[C@H]([N@H+](C)Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001609163424 1098178289 /nfs/dbraw/zinc/17/82/89/1098178289.db2.gz ZMZCRPLMLLXJFA-FZMZJTMJSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@H]1CCC[C@H]([N@@H+](C)Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001609163424 1098178290 /nfs/dbraw/zinc/17/82/90/1098178290.db2.gz ZMZCRPLMLLXJFA-FZMZJTMJSA-N 0 3 330.392 2.785 20 5 EFBDHN CN1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc2nc3ccccc3nc21 ZINC001269504681 1098197876 /nfs/dbraw/zinc/19/78/76/1098197876.db2.gz KMSJEJMEUYHHFF-ROUUACIJSA-N 0 3 332.407 2.702 20 5 EFBDHN C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc(-c2nnn[n-]2)cs1 ZINC001609276316 1098233555 /nfs/dbraw/zinc/23/35/55/1098233555.db2.gz CQFXTTUQEVXVBZ-UHFFFAOYSA-N 0 3 344.400 2.511 20 5 EFBDHN C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc(-c2nnn[n-]2)cs1 ZINC001609276316 1098233558 /nfs/dbraw/zinc/23/35/58/1098233558.db2.gz CQFXTTUQEVXVBZ-UHFFFAOYSA-N 0 3 344.400 2.511 20 5 EFBDHN CN1CC2(C1)CCN(C(=O)c1cc3cccnc3c3ncccc13)CC2 ZINC001271060769 1100433047 /nfs/dbraw/zinc/43/30/47/1100433047.db2.gz AGTNOAADTIAEDM-UHFFFAOYSA-N 0 3 346.434 2.951 20 5 EFBDHN O=C(NCCCNCc1ccccc1[N+](=O)[O-])C1(C(F)(F)F)CC1 ZINC001167238723 1102118654 /nfs/dbraw/zinc/11/86/54/1102118654.db2.gz KIINUCFQJPBQMQ-UHFFFAOYSA-N 0 3 345.321 2.533 20 5 EFBDHN O=C([C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1)N1CCNC2(CCCCC2)C1 ZINC000906635583 1104387668 /nfs/dbraw/zinc/38/76/68/1104387668.db2.gz ZRTUVRSQDBXJRS-SJORKVTESA-N 0 3 343.427 2.833 20 5 EFBDHN CCN1CCN([C@H](C)CNc2nc3ccc([N+](=O)[O-])cc3s2)CC1 ZINC000729632336 1104632527 /nfs/dbraw/zinc/63/25/27/1104632527.db2.gz IGBAWXPEFQTANU-GFCCVEGCSA-N 0 3 349.460 2.642 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCN(C3CC3)C[C@H](C)C2)c1C ZINC000897866348 1106122756 /nfs/dbraw/zinc/12/27/56/1106122756.db2.gz XBSWCUWVHBDBFL-LBPRGKRZSA-N 0 3 331.416 2.768 20 5 EFBDHN CCN(CCNc1ccc([N+](=O)[O-])c(C)c1)C(=O)C1(N(C)C)CCC1 ZINC001106873857 1111939104 /nfs/dbraw/zinc/93/91/04/1111939104.db2.gz GACBPKCZFZWREU-UHFFFAOYSA-N 0 3 348.447 2.648 20 5 EFBDHN CCN(CCNc1ccc(C)cc1[N+](=O)[O-])C(=O)C1(N(C)C)CCC1 ZINC001106874225 1111939504 /nfs/dbraw/zinc/93/95/04/1111939504.db2.gz XMOJIOVGNWZPGF-UHFFFAOYSA-N 0 3 348.447 2.648 20 5 EFBDHN CCN(CCNc1ccc([N+](=O)[O-])cc1)C(=O)CN1CCC(C)(C)C1 ZINC001106951375 1118680300 /nfs/dbraw/zinc/68/03/00/1118680300.db2.gz GWDCMGCATQMLMG-UHFFFAOYSA-N 0 3 348.447 2.587 20 5 EFBDHN Cc1nn(C)c(N2CCN(Cc3ccccc3)C[C@@H](C)C2)c1[N+](=O)[O-] ZINC000450808775 282270477 /nfs/dbraw/zinc/27/04/77/282270477.db2.gz JDIWXXJNFZOADY-CQSZACIVSA-N 0 3 343.431 2.595 20 5 EFBDHN CN1CC[C@@H]2[C@H](CCCN2C(=O)c2cccc(Cl)c2[N+](=O)[O-])C1 ZINC000164255486 529799206 /nfs/dbraw/zinc/79/92/06/529799206.db2.gz NAXRQTYSIPUYLE-BXUZGUMPSA-N 0 3 337.807 2.805 20 5 EFBDHN CN(C[C@H]1CCCN(C)C1)C(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000155209197 529965720 /nfs/dbraw/zinc/96/57/20/529965720.db2.gz IUGQZJKBUGPAFN-ZDUSSCGKSA-N 0 3 342.399 2.557 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCN1CCN([C@@H]2C[C@H]3CC[C@@H]2C3)CC1 ZINC000177923798 232034170 /nfs/dbraw/zinc/03/41/70/232034170.db2.gz RUZBNMLMRKYMLN-LZLYRXPVSA-N 0 3 345.443 2.780 20 5 EFBDHN CCCC(=O)NC[C@@H]1CCCN(CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000101912166 219172079 /nfs/dbraw/zinc/17/20/79/219172079.db2.gz XWTLFPIQQXGFGD-HNNXBMFYSA-N 0 3 349.431 2.602 20 5 EFBDHN CCCC(=O)NC[C@H]1CCCN(CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000101912605 219172287 /nfs/dbraw/zinc/17/22/87/219172287.db2.gz FHLNPUQIEJNIMZ-OAHLLOKOSA-N 0 3 349.431 2.602 20 5 EFBDHN COc1cc(CN[C@H](C)CO)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000067223913 215124807 /nfs/dbraw/zinc/12/48/07/215124807.db2.gz UWAZZVXBOZRIIU-CYBMUJFWSA-N 0 3 346.383 2.653 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2ccc(CN3CCC[C@@H](OCCO)C3)o2)c1 ZINC000179576541 233184293 /nfs/dbraw/zinc/18/42/93/233184293.db2.gz FHZJKABQUUBGDI-MRXNPFEDSA-N 0 3 346.383 2.828 20 5 EFBDHN Cc1cc(NCC2(CO)CCOCC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000181532808 234221692 /nfs/dbraw/zinc/22/16/92/234221692.db2.gz QOWWZLDIZZQEDY-UHFFFAOYSA-N 0 3 331.372 2.652 20 5 EFBDHN Cc1c(NC(=O)CCN[C@H](C)c2ccccn2)cccc1[N+](=O)[O-] ZINC000181773238 234317659 /nfs/dbraw/zinc/31/76/59/234317659.db2.gz VNZRCTDCUXYCQR-CYBMUJFWSA-N 0 3 328.372 2.978 20 5 EFBDHN CN(CCOc1cccc([N+](=O)[O-])c1)Cc1ccc2c(c1)OCO2 ZINC000040105796 213266144 /nfs/dbraw/zinc/26/61/44/213266144.db2.gz JFOMMWWFWCWQRW-UHFFFAOYSA-N 0 3 330.340 2.834 20 5 EFBDHN COC[C@@H](N[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)C1CC1 ZINC000183473836 235098077 /nfs/dbraw/zinc/09/80/77/235098077.db2.gz WRYBFYPZYLCKIQ-YMTOWFKASA-N 0 3 341.795 2.590 20 5 EFBDHN CN1CC[C@@H]2[C@@H](CCCN2C(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000246261824 283093576 /nfs/dbraw/zinc/09/35/76/283093576.db2.gz LBUZLMRJUXIPHA-WCQYABFASA-N 0 3 337.807 2.805 20 5 EFBDHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1csc([N+](=O)[O-])c1 ZINC000184077197 235300336 /nfs/dbraw/zinc/30/03/36/235300336.db2.gz OVLHJMLXIFAOOS-WFASDCNBSA-N 0 3 345.424 2.907 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)CCN(C)C1CC1 ZINC000186752818 236008159 /nfs/dbraw/zinc/00/81/59/236008159.db2.gz JPNAYWDZGFVTRX-LBPRGKRZSA-N 0 3 337.445 2.628 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCN1CCSC2(CCOCC2)C1 ZINC000186849975 236042753 /nfs/dbraw/zinc/04/27/53/236042753.db2.gz UHMYDHIXSPHURU-UHFFFAOYSA-N 0 3 338.429 2.572 20 5 EFBDHN C[C@H](NC(=O)Cc1ccccc1[N+](=O)[O-])[C@H](c1ccccc1)N(C)C ZINC000187180888 236139485 /nfs/dbraw/zinc/13/94/85/236139485.db2.gz JXBGKTMZCLWULU-IFXJQAMLSA-N 0 3 341.411 2.945 20 5 EFBDHN C[C@@H]1CN(Cc2cc([N+](=O)[O-])ccc2Cl)CCN1CC(C)(C)O ZINC000189893979 237366265 /nfs/dbraw/zinc/36/62/65/237366265.db2.gz YTKIIEMCASXRFG-GFCCVEGCSA-N 0 3 341.839 2.525 20 5 EFBDHN C[C@H]1[C@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CCC[C@@H]1C ZINC000129244135 223035258 /nfs/dbraw/zinc/03/52/58/223035258.db2.gz JRBJHKFHOJKZIW-WOSRLPQWSA-N 0 3 340.445 2.783 20 5 EFBDHN C[C@H]1C[C@@H](Nc2ncc(Br)cc2[N+](=O)[O-])CN1C1CC1 ZINC000131310361 223221709 /nfs/dbraw/zinc/22/17/09/223221709.db2.gz JUBZCYXPDBBQOE-WCBMZHEXSA-N 0 3 341.209 2.789 20 5 EFBDHN CC(C)[C@@H]1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CCS1 ZINC000072837236 216314192 /nfs/dbraw/zinc/31/41/92/216314192.db2.gz FFXHUOJCKYOULL-HNNXBMFYSA-N 0 3 337.445 2.997 20 5 EFBDHN Nc1ccc([N+](=O)[O-])c(NCC2CCN(c3ccncc3)CC2)c1 ZINC000193493005 240187424 /nfs/dbraw/zinc/18/74/24/240187424.db2.gz GDDSNVIQMZPKQJ-UHFFFAOYSA-N 0 3 327.388 2.901 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@H](C)Cn1ccnc1C ZINC000236850092 242383153 /nfs/dbraw/zinc/38/31/53/242383153.db2.gz BPWPCYKOGKRGAK-ZDUSSCGKSA-N 0 3 332.404 2.924 20 5 EFBDHN Cc1c(CN2CCC[C@@H](N3CCCC3=O)CC2)cccc1[N+](=O)[O-] ZINC000412060421 243108705 /nfs/dbraw/zinc/10/87/05/243108705.db2.gz ZUXGCUWAWKWVGR-MRXNPFEDSA-N 0 3 331.416 2.880 20 5 EFBDHN C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CCN(C2CC2)C1 ZINC000412364835 243290975 /nfs/dbraw/zinc/29/09/75/243290975.db2.gz JOXPGZSEWSPJHX-DOPJRALCSA-N 0 3 343.427 2.641 20 5 EFBDHN C[C@H]1C[C@H](N2CCCC2)CN1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412338155 243275003 /nfs/dbraw/zinc/27/50/03/243275003.db2.gz NJYYZIDBEYGQIE-XDKFSHSGSA-N 0 3 343.427 2.784 20 5 EFBDHN CC[C@H](NC(=O)N1CCN2CCC[C@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000247031178 243355969 /nfs/dbraw/zinc/35/59/69/243355969.db2.gz MJOLBCWXQWBXRT-HOTGVXAUSA-N 0 3 332.404 2.536 20 5 EFBDHN CO[C@@H]([C@@H](C)N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C)C1CC1 ZINC000414163019 244027531 /nfs/dbraw/zinc/02/75/31/244027531.db2.gz FLCZCBWDPNOMLL-WQGACYEGSA-N 0 3 335.404 2.633 20 5 EFBDHN Cc1c(NC(=O)N2C[C@@H](c3ccccc3)[C@H](N)C2)cccc1[N+](=O)[O-] ZINC000414716108 244302825 /nfs/dbraw/zinc/30/28/25/244302825.db2.gz WVAXCWGMOQVVJW-LSDHHAIUSA-N 0 3 340.383 2.862 20 5 EFBDHN C[C@]1(F)CNCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000414765785 244334173 /nfs/dbraw/zinc/33/41/73/244334173.db2.gz GEKVGLMDODSQKK-KRWDZBQOSA-N 0 3 333.363 2.988 20 5 EFBDHN CC(C)c1ccc([C@H](N)CNC(=O)c2cc([N+](=O)[O-])ccc2N)cc1 ZINC000262012044 244760941 /nfs/dbraw/zinc/76/09/41/244760941.db2.gz UNKSEZPZSKOPIE-QGZVFWFLSA-N 0 3 342.399 2.730 20 5 EFBDHN O=C(CCN1CCC(OC2CCC2)CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000419296518 245371542 /nfs/dbraw/zinc/37/15/42/245371542.db2.gz DJXQRPKNCQDTIB-UHFFFAOYSA-N 0 3 347.415 2.957 20 5 EFBDHN CC[C@@H](NCC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)[C@H]1CC1(C)C ZINC000419316898 245378494 /nfs/dbraw/zinc/37/84/94/245378494.db2.gz MEVZYCHSGUISJU-GHMZBOCLSA-N 0 3 349.387 2.676 20 5 EFBDHN C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])s1)N(C)Cc1ccccc1 ZINC000110356897 220033033 /nfs/dbraw/zinc/03/30/33/220033033.db2.gz NZAVYZSFSFVZQJ-LBPRGKRZSA-N 0 3 333.413 2.907 20 5 EFBDHN COc1cc(CNC[C@H](C)O)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000078410276 217049695 /nfs/dbraw/zinc/04/96/95/217049695.db2.gz LGUKIXFXYCRUBW-ZDUSSCGKSA-N 0 3 346.383 2.653 20 5 EFBDHN CN(CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CCn1cccn1 ZINC000111283543 220133080 /nfs/dbraw/zinc/13/30/80/220133080.db2.gz JJCUSRLZRQPYKN-UHFFFAOYSA-N 0 3 341.371 2.621 20 5 EFBDHN COc1ccc(CNC(=O)[C@@H](C(C)C)N2CCCCC2)cc1[N+](=O)[O-] ZINC000264109672 246074437 /nfs/dbraw/zinc/07/44/37/246074437.db2.gz BEMVKMBQVTYQNX-QGZVFWFLSA-N 0 3 349.431 2.730 20 5 EFBDHN CN(C[C@@H]1CCCN1C)C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000421712038 246078618 /nfs/dbraw/zinc/07/86/18/246078618.db2.gz PPQGIKUGQPETOE-NSHDSACASA-N 0 3 345.321 2.780 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@H]1CCN(C2CCCC2)C1 ZINC000421766411 246106770 /nfs/dbraw/zinc/10/67/70/246106770.db2.gz FCMLHMMXRPOHRN-AWEZNQCLSA-N 0 3 331.416 2.958 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[C@@H](N2CCCCC2)C1 ZINC000421769500 246107630 /nfs/dbraw/zinc/10/76/30/246107630.db2.gz SBNCWSFENCMREO-OAHLLOKOSA-N 0 3 331.416 2.912 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[C@H](N2CCCCC2)C1 ZINC000421769499 246108414 /nfs/dbraw/zinc/10/84/14/246108414.db2.gz SBNCWSFENCMREO-HNNXBMFYSA-N 0 3 331.416 2.912 20 5 EFBDHN O=[N+]([O-])c1cccnc1NCc1ccc(CN2CCC(O)CC2)cc1 ZINC000264215308 246194922 /nfs/dbraw/zinc/19/49/22/246194922.db2.gz GJJFFMJOOLDCQE-UHFFFAOYSA-N 0 3 342.399 2.559 20 5 EFBDHN O=[N+]([O-])c1ccc(NCc2ccc(CN3CCC(O)CC3)cc2)nc1 ZINC000264331245 246361240 /nfs/dbraw/zinc/36/12/40/246361240.db2.gz XAIRWJVTOUUQOO-UHFFFAOYSA-N 0 3 342.399 2.559 20 5 EFBDHN COCC(C)(C)N1CCN(C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000425353233 247055664 /nfs/dbraw/zinc/05/56/64/247055664.db2.gz PUEUVMIXUNAVLR-SOFGYWHQSA-N 0 3 333.432 2.651 20 5 EFBDHN C[C@@]1(CO)CCC[C@H]1NCc1ccc(Br)cc1[N+](=O)[O-] ZINC000425444130 247088166 /nfs/dbraw/zinc/08/81/66/247088166.db2.gz LVDDHNQQWCVKDO-KGLIPLIRSA-N 0 3 343.221 2.998 20 5 EFBDHN C[C@@H]1[C@H](C)N(C)CCN1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425454866 247091247 /nfs/dbraw/zinc/09/12/47/247091247.db2.gz GYANVPRAJZIJHH-WDEREUQCSA-N 0 3 342.237 2.882 20 5 EFBDHN COC1CCC(N(C)Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000265197361 247289031 /nfs/dbraw/zinc/28/90/31/247289031.db2.gz IVPJWHJNKHDATP-UHFFFAOYSA-N 0 3 336.388 2.851 20 5 EFBDHN CC(C)[C@@H]1N(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC12CCC2 ZINC000427179958 247328159 /nfs/dbraw/zinc/32/81/59/247328159.db2.gz WSRYNNQVBWYQGV-WBVHZDCISA-N 0 3 334.416 2.845 20 5 EFBDHN O=C(Cc1cccc([N+](=O)[O-])c1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000265993175 248005364 /nfs/dbraw/zinc/00/53/64/248005364.db2.gz IXYIKEMQDUATDU-QGZVFWFLSA-N 0 3 339.395 2.528 20 5 EFBDHN CCc1ccc([C@H]2CCN(CCn3cc([N+](=O)[O-])ccc3=O)C2)cc1 ZINC000433075176 248013559 /nfs/dbraw/zinc/01/35/59/248013559.db2.gz JVWPUIPZBUVLDX-KRWDZBQOSA-N 0 3 341.411 2.808 20 5 EFBDHN CCO[C@@H]1C[C@@H](O)C12CCN(Cc1cccc([N+](=O)[O-])c1C)CC2 ZINC000266019954 248035032 /nfs/dbraw/zinc/03/50/32/248035032.db2.gz RAJZTHWTZPFRSC-IAGOWNOFSA-N 0 3 334.416 2.655 20 5 EFBDHN O=C(NC[C@@H]1CCCCN1C1CC1)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000434427303 248152237 /nfs/dbraw/zinc/15/22/37/248152237.db2.gz ZWGCUSSNFSBJDO-ZDUSSCGKSA-N 0 3 342.399 2.823 20 5 EFBDHN O=C(CCNc1ccccc1[N+](=O)[O-])NC[C@H]1CCCCN1C1CC1 ZINC000434423328 248152407 /nfs/dbraw/zinc/15/24/07/248152407.db2.gz DWKQMTLXDOWADE-OAHLLOKOSA-N 0 3 346.431 2.530 20 5 EFBDHN C[C@H](NCCn1cc([N+](=O)[O-])cn1)c1ccccc1OC(F)F ZINC000090538094 217937164 /nfs/dbraw/zinc/93/71/64/217937164.db2.gz NTYINVSODXQPLV-JTQLQIEISA-N 0 3 326.303 2.744 20 5 EFBDHN CO[C@H]1CCCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000091772229 218063659 /nfs/dbraw/zinc/06/36/59/218063659.db2.gz QEJVXORQTOUWJH-INIZCTEOSA-N 0 3 330.388 2.606 20 5 EFBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC(c2ccnn2CCO)CC1 ZINC000441543556 250041068 /nfs/dbraw/zinc/04/10/68/250041068.db2.gz RHKXCUHSZDWYBD-AWEZNQCLSA-N 0 3 344.415 2.724 20 5 EFBDHN C[C@@H]1C[C@@H](NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CCN1C ZINC000444077665 250256325 /nfs/dbraw/zinc/25/63/25/250256325.db2.gz UISPJOONVUZXBB-HIFRSBDPSA-N 0 3 349.434 2.894 20 5 EFBDHN C[C@@H]1CN(Cc2c(Cl)cccc2[N+](=O)[O-])CCN1CC(C)(C)O ZINC000444764537 250342723 /nfs/dbraw/zinc/34/27/23/250342723.db2.gz YPKJTELCRSSMET-GFCCVEGCSA-N 0 3 341.839 2.525 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN[C@@H](CCO)C3CCCCC3)nc2c1 ZINC000444684594 250328764 /nfs/dbraw/zinc/32/87/64/250328764.db2.gz NGFHBRJIIVTKFI-AWEZNQCLSA-N 0 3 332.404 2.892 20 5 EFBDHN COC[C@]1(C(=O)OC)CCN(C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000449458641 251033352 /nfs/dbraw/zinc/03/33/52/251033352.db2.gz WLRNTXNVDTTXPH-WAFIBAPDSA-N 0 3 348.399 2.510 20 5 EFBDHN COc1cc(C[NH2+]C[C@H]2CCOC3(CCC3)C2)c([N+](=O)[O-])cc1[O-] ZINC000449473957 251037879 /nfs/dbraw/zinc/03/78/79/251037879.db2.gz IRAOBNCVTHYMFO-LBPRGKRZSA-N 0 3 336.388 2.748 20 5 EFBDHN Cc1ccncc1CN[C@@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000449526514 251053370 /nfs/dbraw/zinc/05/33/70/251053370.db2.gz WDSYNHDTIAXQLN-ZDUSSCGKSA-N 0 3 328.372 2.805 20 5 EFBDHN COc1cc(C[NH2+][C@@H](C(C)C)[C@@H](CO)C(C)C)c([N+](=O)[O-])cc1[O-] ZINC000449508387 251046412 /nfs/dbraw/zinc/04/64/12/251046412.db2.gz HDYLYADBYDVHBV-GUYCJALGSA-N 0 3 340.420 2.688 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@@H]([C@H](CO)C1CC1)C1CC1 ZINC000449510831 251046591 /nfs/dbraw/zinc/04/65/91/251046591.db2.gz QQEDSODEQUUZOF-SJLPKXTDSA-N 0 3 334.416 2.880 20 5 EFBDHN C[C@@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)CCN1Cc1ccccc1 ZINC000267459487 251076280 /nfs/dbraw/zinc/07/62/80/251076280.db2.gz RFGQTSWFDPPBLC-UKRRQHHQSA-N 0 3 342.399 2.706 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000267481246 251097942 /nfs/dbraw/zinc/09/79/42/251097942.db2.gz VASBKSBCXZZFRZ-UKRRQHHQSA-N 0 3 342.399 2.563 20 5 EFBDHN C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000267481249 251098086 /nfs/dbraw/zinc/09/80/86/251098086.db2.gz VASBKSBCXZZFRZ-ZFWWWQNUSA-N 0 3 342.399 2.563 20 5 EFBDHN COC(=O)[C@@H]1CN(Cc2ccccc2[N+](=O)[O-])C[C@@H]1c1ccccc1 ZINC000449755817 251142233 /nfs/dbraw/zinc/14/22/33/251142233.db2.gz PCODKBHPIURJIR-IAGOWNOFSA-N 0 3 340.379 2.983 20 5 EFBDHN COC(=O)[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2)C[C@@H]1c1ccccc1 ZINC000449757315 251142743 /nfs/dbraw/zinc/14/27/43/251142743.db2.gz SDNSXOFQOUDOPV-QZTJIDSGSA-N 0 3 340.379 2.983 20 5 EFBDHN COC(=O)[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2)C[C@H]1c1ccccc1 ZINC000449757317 251143133 /nfs/dbraw/zinc/14/31/33/251143133.db2.gz SDNSXOFQOUDOPV-ZWKOTPCHSA-N 0 3 340.379 2.983 20 5 EFBDHN Cn1cc(CN2CC[C@H](CCCO)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000449794114 251158024 /nfs/dbraw/zinc/15/80/24/251158024.db2.gz ZTOAXYCJDOFDBS-AWEZNQCLSA-N 0 3 344.415 2.590 20 5 EFBDHN Cc1nc(NC[C@@H]2CCCCN2Cc2ccccc2)ncc1[N+](=O)[O-] ZINC000450291694 251331277 /nfs/dbraw/zinc/33/12/77/251331277.db2.gz YIJLTMVBXFASIY-INIZCTEOSA-N 0 3 341.415 2.582 20 5 EFBDHN CCN1CCC(NC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000267734318 251296838 /nfs/dbraw/zinc/29/68/38/251296838.db2.gz AGLLBMSAYZKSAX-CYBMUJFWSA-N 0 3 334.420 2.748 20 5 EFBDHN CCN1CCC(NC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000267734320 251297833 /nfs/dbraw/zinc/29/78/33/251297833.db2.gz AGLLBMSAYZKSAX-ZDUSSCGKSA-N 0 3 334.420 2.748 20 5 EFBDHN CCO[C@@H]1C[C@@H](NCC(=O)Nc2c(C)cccc2[N+](=O)[O-])C12CCC2 ZINC000451478617 251577985 /nfs/dbraw/zinc/57/79/85/251577985.db2.gz JXOPERBCNJTFFV-HUUCEWRRSA-N 0 3 347.415 2.779 20 5 EFBDHN C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000268129938 251642007 /nfs/dbraw/zinc/64/20/07/251642007.db2.gz PGIAYDKXCLOTKJ-XPTSAGLGSA-N 0 3 338.795 2.852 20 5 EFBDHN CC(C)C[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1Cl)N(C)C ZINC000112560662 220350901 /nfs/dbraw/zinc/35/09/01/220350901.db2.gz BGTBXSUBCKWEJD-GFCCVEGCSA-N 0 3 327.812 2.954 20 5 EFBDHN O=[N+]([O-])c1cnc(C(F)(F)F)cc1N1CC[C@@H](N2CCCC2)C1 ZINC000364610760 285170656 /nfs/dbraw/zinc/17/06/56/285170656.db2.gz FBAWFYASCMZBTC-SNVBAGLBSA-N 0 3 330.310 2.683 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@@H](C)CO[C@@H]2CCOC2)cc1[N+](=O)[O-] ZINC000154192672 224217583 /nfs/dbraw/zinc/21/75/83/224217583.db2.gz PTGLQQYDUBDHBO-KCQAQPDRSA-N 0 3 338.404 2.838 20 5 EFBDHN C[C@H](CN1CCCCC1)NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000117754822 221086633 /nfs/dbraw/zinc/08/66/33/221086633.db2.gz ZOTKQWPPUNIJFL-GFCCVEGCSA-N 0 3 339.823 2.781 20 5 EFBDHN COc1cc(CNCC2(O)CCCCCC2)c([N+](=O)[O-])cc1OC ZINC000117947099 221102186 /nfs/dbraw/zinc/10/21/86/221102186.db2.gz VPXLTJVXEMTSRO-UHFFFAOYSA-N 0 3 338.404 2.787 20 5 EFBDHN O=[N+]([O-])c1cccc(CN2CCC(CCCN3CCOCC3)CC2)c1 ZINC000182962138 141377828 /nfs/dbraw/zinc/37/78/28/141377828.db2.gz SMIQQIYHPAAHGO-UHFFFAOYSA-N 0 3 347.459 2.919 20 5 EFBDHN O=C(C1CCC1)N(CCCNCc1ccccc1[N+](=O)[O-])C1CC1 ZINC000343536552 142014345 /nfs/dbraw/zinc/01/43/45/142014345.db2.gz UFVNYWJVWQVXRT-UHFFFAOYSA-N 0 3 331.416 2.866 20 5 EFBDHN Cc1c(CC(=O)N2CCN(C3CCC3)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000344770930 142075408 /nfs/dbraw/zinc/07/54/08/142075408.db2.gz JFAVCQBZNAHOJV-AWEZNQCLSA-N 0 3 345.443 2.779 20 5 EFBDHN Cc1c(CC(=O)N2CCN(C3CCC3)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000344770931 142075498 /nfs/dbraw/zinc/07/54/98/142075498.db2.gz JFAVCQBZNAHOJV-CQSZACIVSA-N 0 3 345.443 2.779 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CNC[C@@H]1CCCCS1(=O)=O ZINC000344827228 142084832 /nfs/dbraw/zinc/08/48/32/142084832.db2.gz ZDYKKAFTYDVTHO-OVHOFWQVSA-N 0 3 338.429 2.555 20 5 EFBDHN Cn1cnc(CCNCc2ccc(-c3ccccc3[N+](=O)[O-])s2)n1 ZINC000344909820 142096110 /nfs/dbraw/zinc/09/61/10/142096110.db2.gz UDWOOQHBECGJPK-UHFFFAOYSA-N 0 3 343.412 2.784 20 5 EFBDHN Cc1c(C(=O)N2CCN([C@@H]3C[C@H]3C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000346136839 142152839 /nfs/dbraw/zinc/15/28/39/142152839.db2.gz LRTYMUBYZNJCBH-OGHNNQOOSA-N 0 3 331.416 2.706 20 5 EFBDHN C[C@@H]1C[C@H]1N1CCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000346151579 142155812 /nfs/dbraw/zinc/15/58/12/142155812.db2.gz ZEVFWSMVBNRACT-YWPYICTPSA-N 0 3 335.379 2.536 20 5 EFBDHN Cc1cc(C(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@H](C)C2)cc([N+](=O)[O-])c1 ZINC000346242188 142174797 /nfs/dbraw/zinc/17/47/97/142174797.db2.gz RTSLTGMXTNXODY-GRDNDAEWSA-N 0 3 331.416 2.706 20 5 EFBDHN CN(C)CCN(CCCc1ccccc1)C(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000347866923 142284466 /nfs/dbraw/zinc/28/44/66/142284466.db2.gz MIOOAMAGWBYABS-UHFFFAOYSA-N 0 3 344.415 2.560 20 5 EFBDHN CC[C@@H]1CCC[C@@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000349660569 142344505 /nfs/dbraw/zinc/34/45/05/142344505.db2.gz CNPXUGPNXDHHLF-ZIAGYGMSSA-N 0 3 340.445 2.927 20 5 EFBDHN CCOc1ccc([C@H](C)NCCn2ccc([N+](=O)[O-])n2)cc1OC ZINC000341435469 145051577 /nfs/dbraw/zinc/05/15/77/145051577.db2.gz SCGAXHWOKAFITE-LBPRGKRZSA-N 0 3 334.376 2.549 20 5 EFBDHN COC(=O)[C@]12CN(Cc3ccc(OC)c([N+](=O)[O-])c3)C[C@H]1CCCC2 ZINC000342128080 145067005 /nfs/dbraw/zinc/06/70/05/145067005.db2.gz RLLDRNGXKOABBL-RDTXWAMCSA-N 0 3 348.399 2.769 20 5 EFBDHN Cn1nnc2cc(CNC(C)(C)c3ccc([N+](=O)[O-])cc3)ccc21 ZINC000342220650 145082854 /nfs/dbraw/zinc/08/28/54/145082854.db2.gz CMCLEFDBYWXPKL-UHFFFAOYSA-N 0 3 325.372 2.901 20 5 EFBDHN C[C@@H](CNc1cccc(C(N)=O)c1[N+](=O)[O-])N(C)Cc1ccccc1 ZINC000342232288 145084565 /nfs/dbraw/zinc/08/45/65/145084565.db2.gz XUFYQSOGKPCCNT-ZDUSSCGKSA-N 0 3 342.399 2.626 20 5 EFBDHN C[C@H]1CCCC[C@@H]1CNCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000342350434 145106826 /nfs/dbraw/zinc/10/68/26/145106826.db2.gz YGTAXCXHLQLMBE-UONOGXRCSA-N 0 3 340.445 2.784 20 5 EFBDHN CCN(Cc1cccc(F)c1)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000342354409 145107726 /nfs/dbraw/zinc/10/77/26/145107726.db2.gz IYSPXOQTXYENGY-MRXNPFEDSA-N 0 3 348.374 2.996 20 5 EFBDHN C[C@H]1[C@@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CCCN1C ZINC000342361293 145108680 /nfs/dbraw/zinc/10/86/80/145108680.db2.gz SQMICFZXYADXBG-CABZTGNLSA-N 0 3 326.784 2.852 20 5 EFBDHN CC1(C)C[C@H](N[C@H]2CCC(=O)N[C@@H]2C2CC2)c2cc([N+](=O)[O-])ccc21 ZINC000342808262 145198446 /nfs/dbraw/zinc/19/84/46/145198446.db2.gz AVGQXJCLJGYNJF-XYJFISCASA-N 0 3 343.427 2.964 20 5 EFBDHN O=C(NCCN1CCCCCC1)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000342912269 145220272 /nfs/dbraw/zinc/22/02/72/145220272.db2.gz BMRRGSJLMLHWAE-UHFFFAOYSA-N 0 3 330.388 2.682 20 5 EFBDHN C[C@@H](NC(C)(C)CNC(=O)c1cc([N+](=O)[O-])c[nH]1)c1ccccc1 ZINC000343721076 145279240 /nfs/dbraw/zinc/27/92/40/145279240.db2.gz WFGGWRRTSWACRR-GFCCVEGCSA-N 0 3 330.388 2.782 20 5 EFBDHN CN(C)CCOc1ccc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)cc1 ZINC000344220817 145395025 /nfs/dbraw/zinc/39/50/25/145395025.db2.gz OYDFPPNSSKRIBE-UHFFFAOYSA-N 0 3 347.346 2.927 20 5 EFBDHN O=C(NCCN1CCCCCC1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000351596141 146154909 /nfs/dbraw/zinc/15/49/09/146154909.db2.gz SXUPROYUAWBGKB-UHFFFAOYSA-N 0 3 346.431 2.775 20 5 EFBDHN CCCN(CCN(C)C)C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000351963405 146250280 /nfs/dbraw/zinc/25/02/80/146250280.db2.gz HBQLGOQUVFWBQL-UHFFFAOYSA-N 0 3 345.346 2.610 20 5 EFBDHN C[C@@H]1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CCC1(F)F ZINC000352010191 146263812 /nfs/dbraw/zinc/26/38/12/146263812.db2.gz ZTAVCKUVVZRYJN-LLVKDONJSA-N 0 3 327.331 2.901 20 5 EFBDHN COC(=O)COc1ccc(CN(CC(C)C)C2CC2)cc1[N+](=O)[O-] ZINC000355577887 147001257 /nfs/dbraw/zinc/00/12/57/147001257.db2.gz CDGVAXINJPAEPM-UHFFFAOYSA-N 0 3 336.388 2.767 20 5 EFBDHN CCn1ncnc1CN[C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000355578751 147002441 /nfs/dbraw/zinc/00/24/41/147002441.db2.gz FVQWBMFSDUJFPI-ZFWWWQNUSA-N 0 3 329.404 2.707 20 5 EFBDHN COC(=O)COc1ccc(CN(C)CC2CCCC2)cc1[N+](=O)[O-] ZINC000355749394 147053069 /nfs/dbraw/zinc/05/30/69/147053069.db2.gz RZNDNYPGSSULLU-UHFFFAOYSA-N 0 3 336.388 2.769 20 5 EFBDHN CN1CCC[C@]2(CCN(C(=O)C(C)(C)c3ccccc3[N+](=O)[O-])C2)C1 ZINC000356265708 147193896 /nfs/dbraw/zinc/19/38/96/147193896.db2.gz XUFFNBSIZMZWJD-IBGZPJMESA-N 0 3 345.443 2.817 20 5 EFBDHN CCNc1ccc(C(=O)N2C[C@H](N3CCCC3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000356285922 147200892 /nfs/dbraw/zinc/20/08/92/147200892.db2.gz VOBXRFQUMBEPOR-DZGCQCFKSA-N 0 3 346.431 2.725 20 5 EFBDHN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCN1C ZINC000356396943 147234320 /nfs/dbraw/zinc/23/43/20/147234320.db2.gz VJVMIQXGPKLAGC-CYBMUJFWSA-N 0 3 337.445 2.921 20 5 EFBDHN COc1c(C(=O)Nc2ccccc2CCN(C)C)cccc1[N+](=O)[O-] ZINC000356960136 147385273 /nfs/dbraw/zinc/38/52/73/147385273.db2.gz RAZKAMMLICWGMA-UHFFFAOYSA-N 0 3 343.383 2.960 20 5 EFBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCN(C2CC2)C1 ZINC000359218128 148026204 /nfs/dbraw/zinc/02/62/04/148026204.db2.gz CPTHMIABSUXYHV-OAHLLOKOSA-N 0 3 346.431 2.752 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2ccc(CN[C@H](CO)C3CCOCC3)o2)c1 ZINC000359949450 148232267 /nfs/dbraw/zinc/23/22/67/148232267.db2.gz LZKXHWDNJRNDAU-QGZVFWFLSA-N 0 3 346.383 2.732 20 5 EFBDHN CS[C@H]1CN(Cc2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1N(C)C ZINC000360200387 148297015 /nfs/dbraw/zinc/29/70/15/148297015.db2.gz RDEDECWGPAVTMM-KBPBESRZSA-N 0 3 329.853 2.726 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@@H]2CCN(CCCc3ccncc3)C2)nc1 ZINC000360490353 148374005 /nfs/dbraw/zinc/37/40/05/148374005.db2.gz JYBBUZFUFNEMPH-OAHLLOKOSA-N 0 3 327.388 2.504 20 5 EFBDHN O=[N+]([O-])c1ccc(S(=O)(=O)CCNC2CCC3(CC3)CC2)cc1 ZINC000362912007 148905769 /nfs/dbraw/zinc/90/57/69/148905769.db2.gz DRLJSZWBJYUPIB-UHFFFAOYSA-N 0 3 338.429 2.681 20 5 EFBDHN O=C(CCN1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccc(F)cc1 ZINC000365127263 149323597 /nfs/dbraw/zinc/32/35/97/149323597.db2.gz VOGAVUUGPGRFBH-UHFFFAOYSA-N 0 3 346.362 2.840 20 5 EFBDHN O=C(CCN1CCC[C@@H](OCC2CC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000368412224 150112766 /nfs/dbraw/zinc/11/27/66/150112766.db2.gz RFDRNTNOOZMOPA-OAHLLOKOSA-N 0 3 347.415 2.814 20 5 EFBDHN CCO[C@@H]1CCCC[C@H]1N[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000452038838 286206052 /nfs/dbraw/zinc/20/60/52/286206052.db2.gz YTTOYTGKFXFFLG-JGGQBBKZSA-N 0 3 335.404 2.859 20 5 EFBDHN O=[N+]([O-])c1ccc(CCN2CCCN(c3ncccc3F)CC2)cc1 ZINC000372611666 151037967 /nfs/dbraw/zinc/03/79/67/151037967.db2.gz REZXPUDBACIKNP-UHFFFAOYSA-N 0 3 344.390 2.884 20 5 EFBDHN Cc1ccc([C@H](C)N[C@H]2CCN(c3cnn(C)c3)C2)cc1[N+](=O)[O-] ZINC000372785903 151062503 /nfs/dbraw/zinc/06/25/03/151062503.db2.gz VYAQLYNHSYYISK-ZFWWWQNUSA-N 0 3 329.404 2.566 20 5 EFBDHN COc1ccc(CNC[C@H]2CCCn3cc(C)nc32)cc1[N+](=O)[O-] ZINC000374146009 151290958 /nfs/dbraw/zinc/29/09/58/151290958.db2.gz VKDFGGGEYBIVQE-CQSZACIVSA-N 0 3 330.388 2.776 20 5 EFBDHN C[C@H](NC(=O)N1CCCC12CCN(C)CC2)c1cccc([N+](=O)[O-])c1 ZINC000408072379 152149368 /nfs/dbraw/zinc/14/93/68/152149368.db2.gz RWVZGNJQJNIBEW-AWEZNQCLSA-N 0 3 346.431 2.926 20 5 EFBDHN C[C@H](C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)N1[C@H](C)CC[C@H]1C ZINC000408438623 152191816 /nfs/dbraw/zinc/19/18/16/152191816.db2.gz JNQUAFJHYAPHJC-MGPQQGTHSA-N 0 3 331.416 2.741 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N(CCN(C)C)C(C)C)cc1[N+](=O)[O-] ZINC000159462186 225222645 /nfs/dbraw/zinc/22/26/45/225222645.db2.gz GJGFTIJHIBIJDU-AWEZNQCLSA-N 0 3 336.436 2.946 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2cnc(CCN3CCCC[C@@H]3CO)o2)c1 ZINC000159989096 225314938 /nfs/dbraw/zinc/31/49/38/225314938.db2.gz GCEFWIBIGSBADO-OAHLLOKOSA-N 0 3 331.372 2.639 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000122835864 222169075 /nfs/dbraw/zinc/16/90/75/222169075.db2.gz ONCALNLYTPYBLO-OCCSQVGLSA-N 0 3 348.403 2.694 20 5 EFBDHN CC(=O)N1CCC[C@H](CNCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000279781630 273252844 /nfs/dbraw/zinc/25/28/44/273252844.db2.gz LIMAVSAJMVEFKR-GFCCVEGCSA-N 0 3 325.796 2.596 20 5 EFBDHN COC(=O)N1CCC([C@H](C)NCc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000186418788 265065866 /nfs/dbraw/zinc/06/58/66/265065866.db2.gz QROAMCQDLPIQJR-NSHDSACASA-N 0 3 339.367 2.690 20 5 EFBDHN CCOC(=O)N1CCC([C@H](C)NCc2ccccc2[N+](=O)[O-])CC1 ZINC000186422002 265067483 /nfs/dbraw/zinc/06/74/83/265067483.db2.gz XNNCGYGFLGYJRS-ZDUSSCGKSA-N 0 3 335.404 2.941 20 5 EFBDHN CC(C)c1ccc(C(=O)Nc2ccn(CCN(C)C)n2)cc1[N+](=O)[O-] ZINC000187510103 265106907 /nfs/dbraw/zinc/10/69/07/265106907.db2.gz YHIKBNVVICUUPT-UHFFFAOYSA-N 0 3 345.403 2.729 20 5 EFBDHN C[C@H](NCCN1CCc2ccccc2C1=O)c1ccc([N+](=O)[O-])cc1 ZINC000188682971 265146855 /nfs/dbraw/zinc/14/68/55/265146855.db2.gz VZGMCWSGMCVPCQ-AWEZNQCLSA-N 0 3 339.395 2.944 20 5 EFBDHN COc1ccc([C@@H](CNc2ccc([N+](=O)[O-])cn2)N(C)C)cc1OC ZINC000194905797 265396688 /nfs/dbraw/zinc/39/66/88/265396688.db2.gz JQGDZDOHEKTOAB-CQSZACIVSA-N 0 3 346.387 2.722 20 5 EFBDHN C[C@H](N[C@@H](CO)C[C@@H](O)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000271476114 265988887 /nfs/dbraw/zinc/98/88/87/265988887.db2.gz IBRZFNMWMJTFLD-FDQGKXFDSA-N 0 3 330.384 2.730 20 5 EFBDHN COc1cc(CN[C@H]2CCO[C@@H](C(C)C)C2)c([N+](=O)[O-])cc1OC ZINC000271535665 266003120 /nfs/dbraw/zinc/00/31/20/266003120.db2.gz OURYBBPPYSTCIT-DZGCQCFKSA-N 0 3 338.404 2.905 20 5 EFBDHN Cc1ccc([C@H](C)N[C@@H]2CCC[C@H](S(C)(=O)=O)C2)cc1[N+](=O)[O-] ZINC000271559434 266007033 /nfs/dbraw/zinc/00/70/33/266007033.db2.gz XHVPADQUTLYDKS-CFVMTHIKSA-N 0 3 340.445 2.910 20 5 EFBDHN COc1cccc(C2(NC[C@@H](O)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000271665995 266036808 /nfs/dbraw/zinc/03/68/08/266036808.db2.gz BPWZYHKNWPIKSZ-QGZVFWFLSA-N 0 3 328.368 2.916 20 5 EFBDHN COC(=O)[C@@H]1CCCC[C@]1(C)NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000271992871 266117819 /nfs/dbraw/zinc/11/78/19/266117819.db2.gz GNNJFJLWTQUODC-GUYCJALGSA-N 0 3 336.388 2.815 20 5 EFBDHN CN1CC[C@@H]2CCN(c3ccc([N+](=O)[O-])c(OC(F)F)c3)[C@@H]2C1 ZINC000272259800 266207443 /nfs/dbraw/zinc/20/74/43/266207443.db2.gz ZUYLTJIGWKKGEQ-ZWNOBZJWSA-N 0 3 327.331 2.727 20 5 EFBDHN CN1CC[C@H]2CCN(C(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)[C@H]2C1 ZINC000272305351 266223512 /nfs/dbraw/zinc/22/35/12/266223512.db2.gz QNPJSOCNJABARY-HZMBPMFUSA-N 0 3 338.795 2.806 20 5 EFBDHN COc1cc(CNCC[C@H](C)OC)c([N+](=O)[O-])cc1OCC(F)F ZINC000272371140 266243960 /nfs/dbraw/zinc/24/39/60/266243960.db2.gz GOAQDTPZMSOGTR-JTQLQIEISA-N 0 3 348.346 2.762 20 5 EFBDHN CN1CC[C@H]2CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)[C@H]2C1 ZINC000272370884 266244820 /nfs/dbraw/zinc/24/48/20/266244820.db2.gz GQYPJPQBYQHFRY-HZMBPMFUSA-N 0 3 338.795 2.806 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[C@@H]2CCN(C)C[C@H]21 ZINC000272413091 266257557 /nfs/dbraw/zinc/25/75/57/266257557.db2.gz LDVACMUYANMAAF-DZGCQCFKSA-N 0 3 332.404 2.770 20 5 EFBDHN C[C@@H](CCC1CC1)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000274418309 266646226 /nfs/dbraw/zinc/64/62/26/266646226.db2.gz HTWGAEPEFRMTGW-LBPRGKRZSA-N 0 3 326.418 2.537 20 5 EFBDHN CN(C)CCc1ccccc1NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000275865847 266888177 /nfs/dbraw/zinc/88/81/77/266888177.db2.gz PHWNOLZAZOSEAF-UHFFFAOYSA-N 0 3 343.383 2.716 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CCCN(C)C1 ZINC000108329807 273009131 /nfs/dbraw/zinc/00/91/31/273009131.db2.gz XXFDMQBVUKWRDC-STQMWFEESA-N 0 3 337.445 2.533 20 5 EFBDHN O=C(NC[C@H]1CCCCN1C1CC1)c1ccc([N+](=O)[O-])cc1Cl ZINC000277434464 267180157 /nfs/dbraw/zinc/18/01/57/267180157.db2.gz DYGZTMZSEXJEHL-CYBMUJFWSA-N 0 3 337.807 2.995 20 5 EFBDHN O=C(CSc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CCCCN1C1CC1 ZINC000277637672 267218727 /nfs/dbraw/zinc/21/87/27/267218727.db2.gz XSHKPHGYTVKYGT-HNNXBMFYSA-N 0 3 349.456 2.820 20 5 EFBDHN CN(C)CCN(C)c1cc(C(F)(F)C(F)(F)F)ncc1[N+](=O)[O-] ZINC000278162938 267356934 /nfs/dbraw/zinc/35/69/34/267356934.db2.gz AOOMQSCTZRSSDS-UHFFFAOYSA-N 0 3 342.268 2.642 20 5 EFBDHN C[C@@H](N[C@H]1CCCN(c2ccnn2C)C1)c1cccc([N+](=O)[O-])c1 ZINC000278537011 267474493 /nfs/dbraw/zinc/47/44/93/267474493.db2.gz URNMZADBGOOWSY-HIFRSBDPSA-N 0 3 329.404 2.648 20 5 EFBDHN Cc1ccc(CNCCN2CCc3ccccc3C2=O)cc1[N+](=O)[O-] ZINC000189043205 273058936 /nfs/dbraw/zinc/05/89/36/273058936.db2.gz WEDLUVKAXHCSIS-UHFFFAOYSA-N 0 3 339.395 2.691 20 5 EFBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])N[C@H]1CCCCNC1=O ZINC000271116603 273098890 /nfs/dbraw/zinc/09/88/90/273098890.db2.gz INWNOZIUFGRVEJ-STQMWFEESA-N 0 3 337.445 2.724 20 5 EFBDHN CC(C)(C(=O)NC1CCN(C2CC2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000273967950 273121333 /nfs/dbraw/zinc/12/13/33/273121333.db2.gz QNEYTMCLISQRTO-UHFFFAOYSA-N 0 3 349.406 2.755 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[C@@H]2CCN(C)C[C@H]21 ZINC000274268712 273128679 /nfs/dbraw/zinc/12/86/79/273128679.db2.gz MEGDPUDSHFDLIF-XJKSGUPXSA-N 0 3 332.404 2.770 20 5 EFBDHN C[C@@H]1CC[C@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000274304996 273131289 /nfs/dbraw/zinc/13/12/89/273131289.db2.gz OTPKGHPEFNRMKB-RDBSUJKOSA-N 0 3 340.445 2.783 20 5 EFBDHN CN(C)C1(CN(C)C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000275585796 273137666 /nfs/dbraw/zinc/13/76/66/273137666.db2.gz FJPFQRWNFKUQDO-UHFFFAOYSA-N 0 3 341.358 2.629 20 5 EFBDHN CC1(C)C[C@H](NCCCN2CCOCC2)c2cc([N+](=O)[O-])ccc21 ZINC000279020614 273167359 /nfs/dbraw/zinc/16/73/59/273167359.db2.gz HOKBPZWTZYCHRO-KRWDZBQOSA-N 0 3 333.432 2.629 20 5 EFBDHN Cc1nc2n(n1)C[C@@H](N[C@@H]1CC(C)(C)c3ccc([N+](=O)[O-])cc31)CC2 ZINC000279044382 273169890 /nfs/dbraw/zinc/16/98/90/273169890.db2.gz JPDFBJCVTBLJPF-BLLLJJGKSA-N 0 3 341.415 2.822 20 5 EFBDHN O=C(NCc1cc([N+](=O)[O-])ccc1Cl)C1CCN(C2CC2)CC1 ZINC000279096360 273176209 /nfs/dbraw/zinc/17/62/09/273176209.db2.gz WUMBNVUOBRLFCN-UHFFFAOYSA-N 0 3 337.807 2.739 20 5 EFBDHN CC1(C)C[C@H](N[C@@H]2CC(=O)N(C3CC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000279126095 273179540 /nfs/dbraw/zinc/17/95/40/273179540.db2.gz QPXKKKWPHSZZFB-BZNIZROVSA-N 0 3 329.400 2.670 20 5 EFBDHN CC1(C)C[C@H](NCCNC(=O)c2ccco2)c2cc([N+](=O)[O-])ccc21 ZINC000279201056 273187701 /nfs/dbraw/zinc/18/77/01/273187701.db2.gz XJLPMTMAPMUUET-HNNXBMFYSA-N 0 3 343.383 2.930 20 5 EFBDHN CC1(C)C[C@@H](NCCNC(=O)c2ccco2)c2cc([N+](=O)[O-])ccc21 ZINC000279201058 273187743 /nfs/dbraw/zinc/18/77/43/273187743.db2.gz XJLPMTMAPMUUET-OAHLLOKOSA-N 0 3 343.383 2.930 20 5 EFBDHN CCN(CC)CC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000279361783 273206778 /nfs/dbraw/zinc/20/67/78/273206778.db2.gz VMBPPTCOZWAYNI-UHFFFAOYSA-N 0 3 333.310 2.572 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1NC1CCN(C)CC1 ZINC000279501497 273222131 /nfs/dbraw/zinc/22/21/31/273222131.db2.gz NWDKMPGDJPDKRY-UHFFFAOYSA-N 0 3 327.768 2.541 20 5 EFBDHN CCOc1cc(N2CCN(CC[C@H]3CCCO3)CC2)ccc1[N+](=O)[O-] ZINC000280295401 273312570 /nfs/dbraw/zinc/31/25/70/273312570.db2.gz UZJSZRDWMRZDOO-MRXNPFEDSA-N 0 3 349.431 2.685 20 5 EFBDHN Cc1cc(NCC2(S(C)(=O)=O)CCC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000280480490 273332560 /nfs/dbraw/zinc/33/25/60/273332560.db2.gz NQMARYYZXLWWDQ-UHFFFAOYSA-N 0 3 349.412 2.831 20 5 EFBDHN COC[C@@H](CO)N[C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000280935543 273383127 /nfs/dbraw/zinc/38/31/27/273383127.db2.gz IMBIKNBBUHFASJ-VXGBXAGGSA-N 0 3 336.413 2.981 20 5 EFBDHN CN(C)CC1(NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCC1 ZINC000281025701 273392983 /nfs/dbraw/zinc/39/29/83/273392983.db2.gz HHAIAPVPOSUVNV-UHFFFAOYSA-N 0 3 345.321 2.828 20 5 EFBDHN COC(=O)CC1(CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC000281535208 273444367 /nfs/dbraw/zinc/44/43/67/273444367.db2.gz WMNLDZJWGVAAFT-UHFFFAOYSA-N 0 3 348.399 2.781 20 5 EFBDHN CC(C)C[C@@H](CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)N(C)C ZINC000344364979 273516524 /nfs/dbraw/zinc/51/65/24/273516524.db2.gz XIZPBFKMTYOYGQ-ZDUSSCGKSA-N 0 3 332.404 2.782 20 5 EFBDHN COCC[C@H](CO)NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000282301847 273543074 /nfs/dbraw/zinc/54/30/74/273543074.db2.gz RWEKYOIEQDALFW-GFCCVEGCSA-N 0 3 336.413 2.810 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NC2CCN(C(C)C)CC2)c1 ZINC000283348889 273704332 /nfs/dbraw/zinc/70/43/32/273704332.db2.gz CHOBTKYOCOISHA-UHFFFAOYSA-N 0 3 335.404 2.596 20 5 EFBDHN O=C(Nc1cccc([N+](=O)[O-])c1Cl)NC1CCN(C2CC2)CC1 ZINC000284219276 273811608 /nfs/dbraw/zinc/81/16/08/273811608.db2.gz ZSOMPKHOGXPOLK-UHFFFAOYSA-N 0 3 338.795 2.997 20 5 EFBDHN C[C@@H](NCCn1cc(Br)cn1)c1ccc([N+](=O)[O-])cc1 ZINC000285097221 273941430 /nfs/dbraw/zinc/94/14/30/273941430.db2.gz LPORTGAWJANOLL-SNVBAGLBSA-N 0 3 339.193 2.905 20 5 EFBDHN COc1ccc(CN[C@H]2CCO[C@@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000285175758 273955581 /nfs/dbraw/zinc/95/55/81/273955581.db2.gz VELRRAVSHXZSTF-WMLDXEAASA-N 0 3 329.356 2.618 20 5 EFBDHN Cc1ccc(C(=O)NCCN[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000285405022 273993561 /nfs/dbraw/zinc/99/35/61/273993561.db2.gz XLMMBBBJIHHDAX-CYBMUJFWSA-N 0 3 342.399 2.566 20 5 EFBDHN COCCN(C)CCNc1cc(C)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000338661905 274023846 /nfs/dbraw/zinc/02/38/46/274023846.db2.gz BICZOYFSEGYZFV-UHFFFAOYSA-N 0 3 335.326 2.912 20 5 EFBDHN CC(C)(C)[C@@H]1NC(=O)CC[C@H]1NC/C=C/c1ccccc1[N+](=O)[O-] ZINC000285630477 274041633 /nfs/dbraw/zinc/04/16/33/274041633.db2.gz YQXSVXLKEORFMY-HTFDGFGYSA-N 0 3 331.416 2.891 20 5 EFBDHN CC[C@@H](NCC1(S(C)(=O)=O)CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000285756366 274067882 /nfs/dbraw/zinc/06/78/82/274067882.db2.gz SJFXUMKPEOQMTJ-OAHLLOKOSA-N 0 3 340.445 2.993 20 5 EFBDHN COc1ccc([C@@H](CN(C)C)NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000285890779 274095093 /nfs/dbraw/zinc/09/50/93/274095093.db2.gz CLCKVVBFNLCFFQ-QGZVFWFLSA-N 0 3 343.383 2.636 20 5 EFBDHN C[C@H]1C[C@H](N2CCCC2)CN1C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000285985164 274112322 /nfs/dbraw/zinc/11/23/22/274112322.db2.gz XKQAOISHKHXRNW-ZFWWWQNUSA-N 0 3 349.456 2.772 20 5 EFBDHN CC(=O)c1cc(NC2CCN(C[C@@H]3CCOC3)CC2)ccc1[N+](=O)[O-] ZINC000286021301 274118865 /nfs/dbraw/zinc/11/88/65/274118865.db2.gz ANVQQNAYIHHVSK-AWEZNQCLSA-N 0 3 347.415 2.710 20 5 EFBDHN CCS[C@H]1CCC[C@H]1NCC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000286190526 274150642 /nfs/dbraw/zinc/15/06/42/274150642.db2.gz PQCVAUCXEJOZAC-CABCVRRESA-N 0 3 337.445 2.821 20 5 EFBDHN CS[C@@H]1CN(c2ccc3cc([N+](=O)[O-])ccc3n2)C[C@H]1N(C)C ZINC000340733973 274182433 /nfs/dbraw/zinc/18/24/33/274182433.db2.gz BUGCZPRRWBVHBC-HUUCEWRRSA-N 0 3 332.429 2.625 20 5 EFBDHN CN(Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C1CCC(F)(F)CC1 ZINC000286726874 274260420 /nfs/dbraw/zinc/26/04/20/274260420.db2.gz GVPALQHQJQJWHV-UHFFFAOYSA-N 0 3 327.331 2.703 20 5 EFBDHN O=[N+]([O-])c1ccc(CCN2CC[C@@H](C(F)(F)F)[C@H](CO)C2)cc1 ZINC000286765829 274268950 /nfs/dbraw/zinc/26/89/50/274268950.db2.gz ZMMKZDGVOFMKQV-GXTWGEPZSA-N 0 3 332.322 2.630 20 5 EFBDHN O=[N+]([O-])c1ccc(CCN2CC[C@H](C(F)(F)F)[C@H](CO)C2)cc1 ZINC000286765832 274269038 /nfs/dbraw/zinc/26/90/38/274269038.db2.gz ZMMKZDGVOFMKQV-JSGCOSHPSA-N 0 3 332.322 2.630 20 5 EFBDHN CN(C)CC1(CNc2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)CCCC1 ZINC000286778146 274271517 /nfs/dbraw/zinc/27/15/17/274271517.db2.gz ISRBQLUKVPCFNC-UHFFFAOYSA-N 0 3 345.403 2.778 20 5 EFBDHN CS[C@@H]1CN(c2ccc([N+](=O)[O-])cc2C(C)=O)C[C@@H]1N1CCCC1 ZINC000286904886 274297387 /nfs/dbraw/zinc/29/73/87/274297387.db2.gz PGSZNLGYXMXQEO-DLBZAZTESA-N 0 3 349.456 2.813 20 5 EFBDHN Cc1cc(NC(=O)N2C[C@@H](N3CCCC3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000286985209 274315357 /nfs/dbraw/zinc/31/53/57/274315357.db2.gz DMUZUKAUJUQPAI-ZFWWWQNUSA-N 0 3 332.404 2.994 20 5 EFBDHN CCC[C@@H](NC[C@H]1CCCS(=O)(=O)C1)c1cccc([N+](=O)[O-])c1 ZINC000287149218 274354390 /nfs/dbraw/zinc/35/43/90/274354390.db2.gz SQXUQCYHTNJIPH-CZUORRHYSA-N 0 3 340.445 2.850 20 5 EFBDHN C[C@H]1[C@H](N2CCCC2)CCN1C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000287173764 274360164 /nfs/dbraw/zinc/36/01/64/274360164.db2.gz OHWYGGBJJJOBEI-XHDPSFHLSA-N 0 3 337.807 2.947 20 5 EFBDHN CCCN(CCN1CCCCC1)C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000287199209 274366138 /nfs/dbraw/zinc/36/61/38/274366138.db2.gz TZUOPWGGIOQOAZ-UHFFFAOYSA-N 0 3 335.408 2.720 20 5 EFBDHN CCOc1ccc([C@@H](C)NCCC2(O)CCOCC2)cc1[N+](=O)[O-] ZINC000287654643 274465576 /nfs/dbraw/zinc/46/55/76/274465576.db2.gz VEDCRPAQNQDHSF-CYBMUJFWSA-N 0 3 338.404 2.576 20 5 EFBDHN CCN(CC)CCN(CCOC)c1ccc([N+](=O)[O-])c(C(C)=O)c1 ZINC000287668811 274468105 /nfs/dbraw/zinc/46/81/05/274468105.db2.gz BVZFSULRHKZTBQ-UHFFFAOYSA-N 0 3 337.420 2.592 20 5 EFBDHN COc1ccc(CN[C@H]2CCO[C@H](C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000287826256 274491616 /nfs/dbraw/zinc/49/16/16/274491616.db2.gz VKZHIVWXNSAPMJ-GWCFXTLKSA-N 0 3 334.294 2.803 20 5 EFBDHN C[C@H](NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CCCOC1 ZINC000348146035 274510912 /nfs/dbraw/zinc/51/09/12/274510912.db2.gz MOKGWKFFAUAKCJ-QWRGUYRKSA-N 0 3 341.795 2.591 20 5 EFBDHN CCn1c(C)nc([N+](=O)[O-])c1N(CCN(C)C)Cc1ccc(F)cc1 ZINC000288324651 274570700 /nfs/dbraw/zinc/57/07/00/274570700.db2.gz DKWBNDJFELBKEK-UHFFFAOYSA-N 0 3 349.410 2.827 20 5 EFBDHN O=[N+]([O-])c1cc(CNCCCn2cc(Br)cn2)cs1 ZINC000288434667 274592459 /nfs/dbraw/zinc/59/24/59/274592459.db2.gz LHZFMPRRPOQAMK-UHFFFAOYSA-N 0 3 345.222 2.795 20 5 EFBDHN C[C@H]1C[C@H](N2CCCC2)CN1C(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000288564637 274619227 /nfs/dbraw/zinc/61/92/27/274619227.db2.gz WKTIYMYXCIBRBI-RYUDHWBXSA-N 0 3 337.807 2.947 20 5 EFBDHN C[C@H]1C[C@H](N2CCCC2)CN1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000289588421 274787067 /nfs/dbraw/zinc/78/70/67/274787067.db2.gz IFORYXVDERPTIE-AAEUAGOBSA-N 0 3 337.807 2.947 20 5 EFBDHN C[C@H]1C[C@H](N2CCCC2)CN1C(=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000289695557 274805416 /nfs/dbraw/zinc/80/54/16/274805416.db2.gz NNKVYICOZUMZIS-QWRGUYRKSA-N 0 3 339.342 2.572 20 5 EFBDHN O=[N+]([O-])c1cc(Br)cnc1NC1CCN(C2CC2)CC1 ZINC000268458515 275032940 /nfs/dbraw/zinc/03/29/40/275032940.db2.gz CZFJFLKKTCHFOL-UHFFFAOYSA-N 0 3 341.209 2.791 20 5 EFBDHN O=[N+]([O-])c1cc(Br)ccc1CNC1(CO)CCCC1 ZINC000162168888 275032969 /nfs/dbraw/zinc/03/29/69/275032969.db2.gz KQJXCIHLWJVRIQ-UHFFFAOYSA-N 0 3 329.194 2.752 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)ccc1N1CCN(CC2CCOCC2)CC1 ZINC000264844895 275033293 /nfs/dbraw/zinc/03/32/93/275033293.db2.gz FRYFHPCPGJHSQT-UHFFFAOYSA-N 0 3 339.823 2.797 20 5 EFBDHN O=[N+]([O-])c1ccc(NCCN2CCCC2)nc1-c1ccc(F)cc1 ZINC000362348666 275034959 /nfs/dbraw/zinc/03/49/59/275034959.db2.gz LUPKBLGWOINSBL-UHFFFAOYSA-N 0 3 330.363 2.726 20 5 EFBDHN O=[N+]([O-])c1cccc2ncnc(N3CCN(C4CCCCC4)CC3)c21 ZINC000347411691 275039557 /nfs/dbraw/zinc/03/95/57/275039557.db2.gz RJUDRNDEGREDNP-UHFFFAOYSA-N 0 3 341.415 2.993 20 5 EFBDHN CC1(C)CN(CCN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CCO1 ZINC000192831875 275845467 /nfs/dbraw/zinc/84/54/67/275845467.db2.gz DVTNVPXFRNUZBO-QGZVFWFLSA-N 0 3 333.432 2.673 20 5 EFBDHN CCO[C@@H]1COCC[C@@H]1NCc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339089993 276340331 /nfs/dbraw/zinc/34/03/31/276340331.db2.gz FHKYAANKFBKKJN-UONOGXRCSA-N 0 3 348.321 2.897 20 5 EFBDHN CN1CCC2(CCCN2C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CC1 ZINC000372433803 277037745 /nfs/dbraw/zinc/03/77/45/277037745.db2.gz PRNFFJKDDQHUGI-UHFFFAOYSA-N 0 3 337.807 2.949 20 5 EFBDHN COC1([C@@H](C)NCc2ccc(Cl)cc2[N+](=O)[O-])CCOCC1 ZINC000421022604 277190239 /nfs/dbraw/zinc/19/02/39/277190239.db2.gz AKLLMMMCQUDIRL-LLVKDONJSA-N 0 3 328.796 2.922 20 5 EFBDHN C[C@@H]1[C@H](Nc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CCCN1C ZINC000343451719 278100957 /nfs/dbraw/zinc/10/09/57/278100957.db2.gz GDIJWKNILMVXEB-UKRRQHHQSA-N 0 3 326.400 2.973 20 5 EFBDHN CC(C)(C(=O)NCCN1CCCC1(C)C)c1ccccc1[N+](=O)[O-] ZINC000457051330 278272468 /nfs/dbraw/zinc/27/24/68/278272468.db2.gz HUZLZISSQANGFH-UHFFFAOYSA-N 0 3 333.432 2.863 20 5 EFBDHN C[C@@H](N[C@H]1CCCN(c2ccnn2C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000365736736 278381858 /nfs/dbraw/zinc/38/18/58/278381858.db2.gz UPPHLHLHTCAKDV-HIFRSBDPSA-N 0 3 329.404 2.648 20 5 EFBDHN C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000265933197 288075283 /nfs/dbraw/zinc/07/52/83/288075283.db2.gz DZGFRIUWEMWEBG-MFKMUULPSA-N 0 3 325.796 2.660 20 5 EFBDHN C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000265933199 288079174 /nfs/dbraw/zinc/07/91/74/288079174.db2.gz DZGFRIUWEMWEBG-ZWNOBZJWSA-N 0 3 325.796 2.660 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)c1cccc(SC)c1[N+](=O)[O-] ZINC000188153325 279274767 /nfs/dbraw/zinc/27/47/67/279274767.db2.gz LJCJGECVGBIHTN-GFCCVEGCSA-N 0 3 337.445 2.921 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@@H]2CCC[C@@H]2C(=O)NC)cc1[N+](=O)[O-] ZINC000358231724 279964883 /nfs/dbraw/zinc/96/48/83/279964883.db2.gz ASKYEOBLFAVDHI-FPMFFAJLSA-N 0 3 335.404 2.559 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC[C@H](N2CCCC2)C1 ZINC000421765877 280400242 /nfs/dbraw/zinc/40/02/42/280400242.db2.gz AUGBTBMIZRFLAA-HNNXBMFYSA-N 0 3 331.416 2.912 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@H](CN2CCOCC2)C1 ZINC000182809983 281022021 /nfs/dbraw/zinc/02/20/21/281022021.db2.gz GWEQRNSGQZEIMN-JKSUJKDBSA-N 0 3 333.432 2.618 20 5 EFBDHN Cc1cccc(C(=O)NC[C@@H]2NCCc3ccccc32)c1[N+](=O)[O-] ZINC000261667523 281194071 /nfs/dbraw/zinc/19/40/71/281194071.db2.gz LIUIQWGDQXYWDI-INIZCTEOSA-N 0 3 325.368 2.520 20 5 EFBDHN C[C@H](CNC(=O)NCc1ccc([N+](=O)[O-])cc1)N1CCC(C)CC1 ZINC000067706602 292698481 /nfs/dbraw/zinc/69/84/81/292698481.db2.gz RLFJDGIFNOJLHD-CQSZACIVSA-N 0 3 334.420 2.514 20 5 EFBDHN CC(C)[C@H](C(=O)NCCc1cccc([N+](=O)[O-])c1)N1CCCCC1 ZINC000089302723 292831336 /nfs/dbraw/zinc/83/13/36/292831336.db2.gz ADGHDBCWCPWYCG-QGZVFWFLSA-N 0 3 333.432 2.764 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H](C(C)C)N1CCOCC1 ZINC000120093077 292920718 /nfs/dbraw/zinc/92/07/18/292920718.db2.gz JMHVACQSORKCQO-CRAIPNDOSA-N 0 3 335.448 2.911 20 5 EFBDHN CCCCN1CCCC[C@H]1CNC(=O)c1cc(OC)ccc1[N+](=O)[O-] ZINC000126300630 293034227 /nfs/dbraw/zinc/03/42/27/293034227.db2.gz WXXMVVFNOPOMNF-AWEZNQCLSA-N 0 3 349.431 2.988 20 5 EFBDHN CCOc1ccc([C@@H](C)N[C@H](CCO)CSC)cc1[N+](=O)[O-] ZINC000153940713 293401978 /nfs/dbraw/zinc/40/19/78/293401978.db2.gz WAWKJYWDRKUKDI-DGCLKSJQSA-N 0 3 328.434 2.758 20 5 EFBDHN CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)NCCN(C)C ZINC000154218203 293415009 /nfs/dbraw/zinc/41/50/09/293415009.db2.gz LAMKHSFLNBAWTC-UHFFFAOYSA-N 0 3 325.434 2.634 20 5 EFBDHN CCCN(CC)C[C@@H](C)Nc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000290799173 294188715 /nfs/dbraw/zinc/18/87/15/294188715.db2.gz OYCOZCJPAAZFJM-LLVKDONJSA-N 0 3 333.392 2.776 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CN1CC2(CCC2)[C@H]1C1CC1 ZINC000290851334 294203166 /nfs/dbraw/zinc/20/31/66/294203166.db2.gz XJMBZEUBIYFJAT-RHSMWYFYSA-N 0 3 332.400 2.599 20 5 EFBDHN CN(C[C@H](O)COc1c(Cl)cc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000290866089 294206635 /nfs/dbraw/zinc/20/66/35/294206635.db2.gz ZFTPBTLLORULEC-JTQLQIEISA-N 0 3 335.187 2.736 20 5 EFBDHN CCN1CCN(C[C@H](C)CNc2cc(C)c([N+](=O)[O-])cc2F)CC1 ZINC000290867888 294207544 /nfs/dbraw/zinc/20/75/44/294207544.db2.gz ARHUBULQVYSEAP-CYBMUJFWSA-N 0 3 338.427 2.728 20 5 EFBDHN O=C1OCCN1CCCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000290896890 294214487 /nfs/dbraw/zinc/21/44/87/294214487.db2.gz NMGNHLCBKLCZRT-UHFFFAOYSA-N 0 3 348.186 2.834 20 5 EFBDHN Cc1cc(N2CCC(CN3CCOCC3)CC2)c(F)cc1[N+](=O)[O-] ZINC000291018725 294248654 /nfs/dbraw/zinc/24/86/54/294248654.db2.gz VUIKBORDYDREPQ-UHFFFAOYSA-N 0 3 337.395 2.591 20 5 EFBDHN Cc1sc(C(=O)Nc2ccc3c(c2)CNCCO3)cc1[N+](=O)[O-] ZINC000291084323 294270208 /nfs/dbraw/zinc/27/02/08/294270208.db2.gz OWOMXTKBNIBHAV-UHFFFAOYSA-N 0 3 333.369 2.699 20 5 EFBDHN CN1CCC(NC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000291409849 294374148 /nfs/dbraw/zinc/37/41/48/294374148.db2.gz GFYGBSMZXKYZII-UHFFFAOYSA-N 0 3 332.187 2.726 20 5 EFBDHN CCOC1CC(O)(CNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000291460863 294387425 /nfs/dbraw/zinc/38/74/25/294387425.db2.gz DDLFCIXLJWRYGN-UHFFFAOYSA-N 0 3 349.214 2.921 20 5 EFBDHN CCN1CCC(NC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])CC1 ZINC000291585346 294422568 /nfs/dbraw/zinc/42/25/68/294422568.db2.gz FRWMAMDCIVDCPD-UHFFFAOYSA-N 0 3 334.420 2.613 20 5 EFBDHN Cc1cc(NC(=O)CCNC(C)(C)c2ccccc2[N+](=O)[O-])no1 ZINC000292221063 294616784 /nfs/dbraw/zinc/61/67/84/294616784.db2.gz VAEGHIGEORYJOZ-UHFFFAOYSA-N 0 3 332.360 2.745 20 5 EFBDHN C[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1OCCc2sccc21 ZINC000292380785 294665269 /nfs/dbraw/zinc/66/52/69/294665269.db2.gz JRSDIJQUJBGNQG-XNJJOIOASA-N 0 3 348.424 2.982 20 5 EFBDHN C[C@H]1CN(C(=O)c2cc(F)ccc2[N+](=O)[O-])CCN(C2CCC2)C1 ZINC000293654996 295020607 /nfs/dbraw/zinc/02/06/07/295020607.db2.gz IQIAZEPCUQHRLK-GFCCVEGCSA-N 0 3 335.379 2.680 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCN(C2CCC2)C[C@H](C)C1 ZINC000293710052 295033302 /nfs/dbraw/zinc/03/33/02/295033302.db2.gz OFYHAUWQXYILRH-ZDUSSCGKSA-N 0 3 331.416 2.850 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@@]2(C1)CCCN(C)C2 ZINC000294229059 295131665 /nfs/dbraw/zinc/13/16/65/295131665.db2.gz RKPDEPRULWHFAS-SFHVURJKSA-N 0 3 347.415 2.551 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@]2(C1)CCCN(C)C2 ZINC000294229057 295131766 /nfs/dbraw/zinc/13/17/66/295131766.db2.gz RKPDEPRULWHFAS-GOSISDBHSA-N 0 3 347.415 2.551 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@]3(C2)CCCN(C)C3)c1 ZINC000294380759 295157494 /nfs/dbraw/zinc/15/74/94/295157494.db2.gz ZYUKYMOXKGBIFX-SFHVURJKSA-N 0 3 347.415 2.551 20 5 EFBDHN CN(Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)CC1(O)CCOCC1 ZINC000294542117 295183552 /nfs/dbraw/zinc/18/35/52/295183552.db2.gz KJIDDIKBMTYBCT-UHFFFAOYSA-N 0 3 348.321 2.587 20 5 EFBDHN C[C@@H](CCN1CCN(C)CC1)Nc1nccc2cc([N+](=O)[O-])ccc21 ZINC000294843302 295235743 /nfs/dbraw/zinc/23/57/43/295235743.db2.gz BRAWXSABFOWPMI-AWEZNQCLSA-N 0 3 343.431 2.581 20 5 EFBDHN Cc1nc(N[C@H]2CN(Cc3ccccc3)C[C@H]2C)ncc1[N+](=O)[O-] ZINC000294939228 295248456 /nfs/dbraw/zinc/24/84/56/295248456.db2.gz JOKLWZUOESBHAP-DOMZBBRYSA-N 0 3 327.388 2.626 20 5 EFBDHN Cc1cccc2c1CC(C)(C)N(CCn1cc([N+](=O)[O-])ccc1=O)C2 ZINC000295131591 295272045 /nfs/dbraw/zinc/27/20/45/295272045.db2.gz AYVGUKJIJUXKJT-UHFFFAOYSA-N 0 3 341.411 2.902 20 5 EFBDHN CCN(CCNC(=O)c1cc([N+](=O)[O-])c(C)cc1Cl)C1CC1 ZINC000295285585 295293511 /nfs/dbraw/zinc/29/35/11/295293511.db2.gz PUGMZSHGDWDVLP-UHFFFAOYSA-N 0 3 325.796 2.771 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](CC(C)C)CN2CCCC2)c1 ZINC000295442356 295321043 /nfs/dbraw/zinc/32/10/43/295321043.db2.gz LMFBAZPDCCGSRK-AWEZNQCLSA-N 0 3 349.431 2.844 20 5 EFBDHN CN(CCn1cc(Br)c([N+](=O)[O-])n1)Cc1ccccc1 ZINC000295636154 295352821 /nfs/dbraw/zinc/35/28/21/295352821.db2.gz BRXWGFOLSXXTCY-UHFFFAOYSA-N 0 3 339.193 2.686 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@@H]2[C@H]3CCO[C@H]3C23CCC3)c([N+](=O)[O-])c1 ZINC000295908124 295395104 /nfs/dbraw/zinc/39/51/04/295395104.db2.gz HHGLSPHGRFDDPT-BPLDGKMQSA-N 0 3 333.344 2.550 20 5 EFBDHN CCO[C@@H]1C[C@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C12CCC2 ZINC000296052108 295417605 /nfs/dbraw/zinc/41/76/05/295417605.db2.gz FTSVUXPECKHHED-JKSUJKDBSA-N 0 3 347.415 2.779 20 5 EFBDHN C[C@H](CNC(=O)CCNc1ccccc1[N+](=O)[O-])N1CCC(C)CC1 ZINC000343327113 298686963 /nfs/dbraw/zinc/68/69/63/298686963.db2.gz ALFJNOAHEVAAFX-OAHLLOKOSA-N 0 3 348.447 2.633 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1C(=O)NCCN(C)Cc1ccccc1 ZINC000194480478 302039360 /nfs/dbraw/zinc/03/93/60/302039360.db2.gz QAKPCQNYONYACS-UHFFFAOYSA-N 0 3 327.384 2.765 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H](C)CN1C[C@@H](C)C[C@H](C)C1 ZINC000194484746 302039678 /nfs/dbraw/zinc/03/96/78/302039678.db2.gz IJCKOFFLEZHQRO-KCQAQPDRSA-N 0 3 333.432 2.999 20 5 EFBDHN CN(C)Cc1ccc(CNC(=O)c2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000135627346 310657705 /nfs/dbraw/zinc/65/77/05/310657705.db2.gz HLWBRBHZAKRCHF-UHFFFAOYSA-N 0 3 331.347 2.726 20 5 EFBDHN CS[C@H]1CN(c2nccc3cc([N+](=O)[O-])ccc32)C[C@H]1N(C)C ZINC000297557675 310908203 /nfs/dbraw/zinc/90/82/03/310908203.db2.gz RIYJGWXXJIPCBC-CABCVRRESA-N 0 3 332.429 2.625 20 5 EFBDHN COc1ccc2c(c1)C[C@H](NCc1ccc(OC)c([N+](=O)[O-])c1)CO2 ZINC000297646303 310917354 /nfs/dbraw/zinc/91/73/54/310917354.db2.gz JZRBVBOYWUJNHM-AWEZNQCLSA-N 0 3 344.367 2.705 20 5 EFBDHN C[C@H]1CCCN(CCNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000298699687 311015484 /nfs/dbraw/zinc/01/54/84/311015484.db2.gz BPIGGDIPWHFYHH-LBPRGKRZSA-N 0 3 331.372 2.803 20 5 EFBDHN Cc1ccc2c(c1)[C@H]1CN(C)CC[C@H]1N2C(=O)CCC(C)(C)[N+](=O)[O-] ZINC000298828221 311026782 /nfs/dbraw/zinc/02/67/82/311026782.db2.gz ZNPQVRXSDOJXEO-NVXWUHKLSA-N 0 3 345.443 2.965 20 5 EFBDHN Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@@H]1N2C(=O)CCC(C)(C)[N+](=O)[O-] ZINC000298828225 311026789 /nfs/dbraw/zinc/02/67/89/311026789.db2.gz ZNPQVRXSDOJXEO-RDJZCZTQSA-N 0 3 345.443 2.965 20 5 EFBDHN C[C@@H]1CCCN(C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000299125093 311053909 /nfs/dbraw/zinc/05/39/09/311053909.db2.gz WUUYURIMHWCFCN-LLVKDONJSA-N 0 3 325.434 2.897 20 5 EFBDHN C[C@H](CN1CCCCC1)NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000299175414 311059092 /nfs/dbraw/zinc/05/90/92/311059092.db2.gz WXVXDWDXTDZTSM-GFCCVEGCSA-N 0 3 330.388 2.680 20 5 EFBDHN C[C@H](CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)N1CCC[C@@H](C)C1 ZINC000299293919 311069825 /nfs/dbraw/zinc/06/98/25/311069825.db2.gz QRTCPZYGDUGHDH-CHWSQXEVSA-N 0 3 344.415 2.926 20 5 EFBDHN Cc1cc(NC2CCN(C)CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000299397454 311080548 /nfs/dbraw/zinc/08/05/48/311080548.db2.gz WAQBHGJJTFWRFB-UHFFFAOYSA-N 0 3 327.388 2.866 20 5 EFBDHN O=C(NC[C@H]1CCCN(Cc2cccs2)C1)c1ccc([N+](=O)[O-])[nH]1 ZINC000299440328 311085316 /nfs/dbraw/zinc/08/53/16/311085316.db2.gz JKYIJVMIDWBGFF-GFCCVEGCSA-N 0 3 348.428 2.626 20 5 EFBDHN CCN(CCc1cccs1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000299446492 311085606 /nfs/dbraw/zinc/08/56/06/311085606.db2.gz YBGFFMMOZOVUOL-UHFFFAOYSA-N 0 3 333.413 2.820 20 5 EFBDHN O=C(CCN(Cc1cccnc1)C1CC1)Nc1ccccc1[N+](=O)[O-] ZINC000299652819 311107465 /nfs/dbraw/zinc/10/74/65/311107465.db2.gz LCDKLHWDABRGHL-UHFFFAOYSA-N 0 3 340.383 2.983 20 5 EFBDHN CCc1nn(C)c(N[C@H]2CCCN(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000301349899 311133053 /nfs/dbraw/zinc/13/30/53/311133053.db2.gz JKHLKGTXEILFKB-HNNXBMFYSA-N 0 3 343.431 2.967 20 5 EFBDHN CCN1CCN([C@H](C)CNc2ccc([N+](=O)[O-])c3cccnc23)CC1 ZINC000301503490 311141344 /nfs/dbraw/zinc/14/13/44/311141344.db2.gz FXSBACYKWOZWBT-CQSZACIVSA-N 0 3 343.431 2.581 20 5 EFBDHN CN(C[C@H]1CCCN(C)C1)c1c(Br)cncc1[N+](=O)[O-] ZINC000301860936 311163140 /nfs/dbraw/zinc/16/31/40/311163140.db2.gz DOGWUUDHNRFQFF-JTQLQIEISA-N 0 3 343.225 2.530 20 5 EFBDHN CN(C[C@H]1CCCN(C)C1)c1ccc([N+](=O)[O-])cc1OC(F)F ZINC000302138185 311179814 /nfs/dbraw/zinc/17/98/14/311179814.db2.gz CFLUEYVCGADTOT-NSHDSACASA-N 0 3 329.347 2.974 20 5 EFBDHN CC(C)[C@H](CNc1ncc([N+](=O)[O-])cn1)N1CCc2ccccc2C1 ZINC000302151348 311180833 /nfs/dbraw/zinc/18/08/33/311180833.db2.gz KPLUENMMTSVTOV-KRWDZBQOSA-N 0 3 341.415 2.880 20 5 EFBDHN C[C@@H]1CN(CCCCNc2c3c(ccc2[N+](=O)[O-])NCC3)C[C@@H](C)O1 ZINC000302458941 311190399 /nfs/dbraw/zinc/19/03/99/311190399.db2.gz QYQVNRNOQZNEFQ-ZIAGYGMSSA-N 0 3 348.447 2.864 20 5 EFBDHN CCN1CCN(C[C@H](C)CNc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000302665264 311195793 /nfs/dbraw/zinc/19/57/93/311195793.db2.gz MKPQWQVQOJSIQC-CYBMUJFWSA-N 0 3 340.855 2.934 20 5 EFBDHN COc1ccc(CN2CCNC[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000313375673 311232247 /nfs/dbraw/zinc/23/22/47/311232247.db2.gz XMURVHIJLPFJLA-QGZVFWFLSA-N 0 3 327.384 2.750 20 5 EFBDHN Cc1cc(C)cc(OC[C@@H](O)CNCc2cccc([N+](=O)[O-])c2)c1 ZINC000324626009 311242169 /nfs/dbraw/zinc/24/21/69/311242169.db2.gz RBPOXAFIOPDMBK-KRWDZBQOSA-N 0 3 330.384 2.741 20 5 EFBDHN Cc1c(CNC[C@H](O)COCc2ccccc2F)cccc1[N+](=O)[O-] ZINC000327501458 311245224 /nfs/dbraw/zinc/24/52/24/311245224.db2.gz GQGWMKUPTZYTRA-INIZCTEOSA-N 0 3 348.374 2.710 20 5 EFBDHN Cc1c(CN2CCC[C@H](CNC(=O)C(C)C)C2)cccc1[N+](=O)[O-] ZINC000330447538 311318194 /nfs/dbraw/zinc/31/81/94/311318194.db2.gz WCQSODFMHRIGCW-OAHLLOKOSA-N 0 3 333.432 2.887 20 5 EFBDHN CCN1C[C@@H](C)N(Cc2cc(OC)c(F)cc2[N+](=O)[O-])C[C@H]1C ZINC000330988226 311347256 /nfs/dbraw/zinc/34/72/56/311347256.db2.gz RBGVBVCOUPRSSB-VXGBXAGGSA-N 0 3 325.384 2.657 20 5 EFBDHN CCN1C[C@@H](C)N(Cc2cc(OC)c(F)cc2[N+](=O)[O-])C[C@@H]1C ZINC000330988222 311347307 /nfs/dbraw/zinc/34/73/07/311347307.db2.gz RBGVBVCOUPRSSB-NWDGAFQWSA-N 0 3 325.384 2.657 20 5 EFBDHN CN1CCC(C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000331614577 311397218 /nfs/dbraw/zinc/39/72/18/311397218.db2.gz WODPFYHMNCAXBG-MRXNPFEDSA-N 0 3 331.416 2.643 20 5 EFBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@@H](c2ccnc(N)n2)C1 ZINC000331623406 311398580 /nfs/dbraw/zinc/39/85/80/311398580.db2.gz YCQJIIGNWQXEIU-TZMCWYRMSA-N 0 3 327.388 2.738 20 5 EFBDHN CC(C)c1nc2n(n1)C[C@@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000332644783 311530259 /nfs/dbraw/zinc/53/02/59/311530259.db2.gz MBJDVLLJUUKQBB-STQMWFEESA-N 0 3 329.404 2.975 20 5 EFBDHN C[C@@H](CN1CCCCC1)NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000342924286 311726872 /nfs/dbraw/zinc/72/68/72/311726872.db2.gz HUOCYDCZVCUATM-LBPRGKRZSA-N 0 3 330.388 2.680 20 5 EFBDHN Cc1ccc(CN2CCC[C@H](N3CCCC3=O)CC2)cc1[N+](=O)[O-] ZINC000414558419 312051032 /nfs/dbraw/zinc/05/10/32/312051032.db2.gz YVQWLXULLWRVTD-INIZCTEOSA-N 0 3 331.416 2.880 20 5 EFBDHN CCC(=O)N1CC[C@H](N[C@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417308223 312206772 /nfs/dbraw/zinc/20/67/72/312206772.db2.gz HQRHPKASBJVJDE-YOEHRIQHSA-N 0 3 331.416 2.963 20 5 EFBDHN Cc1nc2n(n1)C[C@H](N[C@@H]1CCCCc3ccc([N+](=O)[O-])cc31)CC2 ZINC000417311998 312207226 /nfs/dbraw/zinc/20/72/26/312207226.db2.gz MYJNQDFTEREIOJ-RHSMWYFYSA-N 0 3 341.415 2.867 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](NC[C@H](O)C1CCOCC1)CCCC2 ZINC000417314190 312207652 /nfs/dbraw/zinc/20/76/52/312207652.db2.gz YHVYWWQIPRSNTB-MSOLQXFVSA-N 0 3 334.416 2.739 20 5 EFBDHN CC(C)COC[C@@H](O)CN[C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417335807 312210704 /nfs/dbraw/zinc/21/07/04/312210704.db2.gz GSIJSWLCDBEXKM-WMZOPIPTSA-N 0 3 336.432 2.985 20 5 EFBDHN Cc1c(CNC(=O)NCc2ccc3c(c2)CNC3)cccc1[N+](=O)[O-] ZINC000418083204 312322725 /nfs/dbraw/zinc/32/27/25/312322725.db2.gz RQTFCYGHQWXCDN-UHFFFAOYSA-N 0 3 340.383 2.506 20 5 EFBDHN CCN(CC)[C@@H](CNc1c(C(N)=O)cccc1[N+](=O)[O-])c1ccco1 ZINC000420579469 312373277 /nfs/dbraw/zinc/37/32/77/312373277.db2.gz CSRVYSSRVGULMS-AWEZNQCLSA-N 0 3 346.387 2.782 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)N(C)C[C@H]2CCCN2C)cc1[N+](=O)[O-] ZINC000420811170 312395148 /nfs/dbraw/zinc/39/51/48/312395148.db2.gz SUUTYXSCZURLRX-UKRRQHHQSA-N 0 3 334.420 2.700 20 5 EFBDHN CCc1ccccc1[C@@H](N)CNC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000423976642 312493517 /nfs/dbraw/zinc/49/35/17/312493517.db2.gz MWGCICZIMPKUCO-KRWDZBQOSA-N 0 3 327.384 2.516 20 5 EFBDHN CN(C)CCOC1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000432339277 312557898 /nfs/dbraw/zinc/55/78/98/312557898.db2.gz SGNGPRPNLXKGIM-UHFFFAOYSA-N 0 3 327.812 2.795 20 5 EFBDHN CCn1cccc(CNC/C(C)=C/c2cccc([N+](=O)[O-])c2)c1=O ZINC000433175129 312597843 /nfs/dbraw/zinc/59/78/43/312597843.db2.gz NEOMTFFZTRYGNR-GXDHUFHOSA-N 0 3 327.384 2.970 20 5 EFBDHN Cc1ncccc1NC(=O)[C@H](C)N[C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000453426441 312902942 /nfs/dbraw/zinc/90/29/42/312902942.db2.gz HFFGHBUOKICWJF-JSGCOSHPSA-N 0 3 342.399 2.846 20 5 EFBDHN COC(=O)[C@@](C)(CNCc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000470139196 313129164 /nfs/dbraw/zinc/12/91/64/313129164.db2.gz ZHIQFBUKXNELPJ-SFHVURJKSA-N 0 3 346.358 2.954 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC[C@@H](CN2CCOCC2)C1 ZINC000470169858 313129582 /nfs/dbraw/zinc/12/95/82/313129582.db2.gz LAMXVWRFJAZKDO-QMJOVRGKSA-N 0 3 345.443 2.652 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCN(C[C@@H]2CCOC2)CC1 ZINC000470184817 313130590 /nfs/dbraw/zinc/13/05/90/313130590.db2.gz XRBJDRWRDXFOLF-FYXHJSOBSA-N 0 3 345.443 2.652 20 5 EFBDHN CC(=O)N1CCC(NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1 ZINC000487199805 313375822 /nfs/dbraw/zinc/37/58/22/313375822.db2.gz NOAGHDOYPZJPPP-UHFFFAOYSA-N 0 3 345.321 2.714 20 5 EFBDHN CN1CCC(CC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000487202433 313376678 /nfs/dbraw/zinc/37/66/78/313376678.db2.gz MHFOKHQFTIFUEY-UHFFFAOYSA-N 0 3 325.796 2.596 20 5 EFBDHN CS[C@H]1CN(Cc2c(Cl)cccc2[N+](=O)[O-])C[C@H]1N(C)C ZINC000492262588 313928240 /nfs/dbraw/zinc/92/82/40/313928240.db2.gz XMAQMIDWXOPWSW-KGLIPLIRSA-N 0 3 329.853 2.726 20 5 EFBDHN CC1=CCN(CCNC(=O)/C=C\c2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000492626124 314063430 /nfs/dbraw/zinc/06/34/30/314063430.db2.gz RLRRGRIFPASJRR-HYXAFXHYSA-N 0 3 333.363 2.515 20 5 EFBDHN C[C@@H]1C[C@H]1N1CCN(C(=O)/C=C\c2cccc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000492797562 314128828 /nfs/dbraw/zinc/12/88/28/314128828.db2.gz JGQBISKUDHZITL-LVQKAXJZSA-N 0 3 343.427 2.797 20 5 EFBDHN CN1CCC[C@]2(CCN(C(=O)/C=C/c3cccc([N+](=O)[O-])c3)C2)C1 ZINC000493487199 314374111 /nfs/dbraw/zinc/37/41/11/314374111.db2.gz MHTFAJDYZSOVMU-DKFQHHCZSA-N 0 3 329.400 2.552 20 5 EFBDHN CCCN(CCN1CCCCCC1)C(=O)c1cccc([N+](=O)[O-])c1N ZINC000494837554 314640300 /nfs/dbraw/zinc/64/03/00/314640300.db2.gz MJSZUTGXAVBDDO-UHFFFAOYSA-N 0 3 348.447 2.905 20 5 EFBDHN COC(=O)N1CCC[C@@H]([C@@H](C)NCc2csc([N+](=O)[O-])c2)C1 ZINC000495479705 314729184 /nfs/dbraw/zinc/72/91/84/314729184.db2.gz JAASHGRJLIHBOM-ZYHUDNBSSA-N 0 3 327.406 2.613 20 5 EFBDHN COC(=O)N1CCC[C@@H]([C@@H](C)NCc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000495480932 314729310 /nfs/dbraw/zinc/72/93/10/314729310.db2.gz ODOIYLNIHCAUIS-VXGBXAGGSA-N 0 3 339.367 2.690 20 5 EFBDHN CC(C)(C)OC(=O)N1C[C@@H]2C[C@]2(CNCc2ccc([N+](=O)[O-])cc2)C1 ZINC000495866058 314857186 /nfs/dbraw/zinc/85/71/86/314857186.db2.gz MPVLYRXPTOXOGV-KSSFIOAISA-N 0 3 347.415 2.941 20 5 EFBDHN C[C@@H](C(=O)N(C)[C@H](C)C1CCN(C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000515115632 315593289 /nfs/dbraw/zinc/59/32/89/315593289.db2.gz ARMHUXXESXBWIG-ZIAGYGMSSA-N 0 3 333.432 2.887 20 5 EFBDHN CCCCN1CCCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1OC ZINC000522186003 316077967 /nfs/dbraw/zinc/07/79/67/316077967.db2.gz DLTVSKANJQLZLG-HNNXBMFYSA-N 0 3 349.431 2.988 20 5 EFBDHN CC(C)(C)CCN1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)CC1 ZINC000523435788 316123296 /nfs/dbraw/zinc/12/32/96/316123296.db2.gz NQLIMCOHGYRHCB-UHFFFAOYSA-N 0 3 348.447 2.858 20 5 EFBDHN C[C@H](O)CN(CCOc1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000525486705 316217735 /nfs/dbraw/zinc/21/77/35/316217735.db2.gz DPBCCKUOSPGJLS-HNNXBMFYSA-N 0 3 330.384 2.857 20 5 EFBDHN CC(C)N1CCN([C@H]2CCN([C@H](C)c3ccccc3[N+](=O)[O-])C2)CC1 ZINC000525686489 316226958 /nfs/dbraw/zinc/22/69/58/316226958.db2.gz SGAIVWWXRSCFKW-SJORKVTESA-N 0 3 346.475 2.756 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CCC(OCC3CCCCC3)CC2)n1 ZINC000531143669 317225605 /nfs/dbraw/zinc/22/56/05/317225605.db2.gz OLPADQMMVWWPGD-UHFFFAOYSA-N 0 3 336.436 2.853 20 5 EFBDHN O=[N+]([O-])c1ccc(CNC2CCN(c3cnccn3)CC2)c(Cl)c1 ZINC000545951644 317943308 /nfs/dbraw/zinc/94/33/08/317943308.db2.gz GXIWXLBVNMUDJW-UHFFFAOYSA-N 0 3 347.806 2.797 20 5 EFBDHN CC(C)=CCN1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000547832562 318046739 /nfs/dbraw/zinc/04/67/39/318046739.db2.gz HJGFADLWJILBHM-UHFFFAOYSA-N 0 3 329.404 2.949 20 5 EFBDHN C[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F)N1CCCC1 ZINC000550737866 318196744 /nfs/dbraw/zinc/19/67/44/318196744.db2.gz RNYNQZROTUDFPD-JTQLQIEISA-N 0 3 345.321 2.828 20 5 EFBDHN O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2NCc2cnc3n2CCCC3)n1 ZINC000551573078 318210138 /nfs/dbraw/zinc/21/01/38/318210138.db2.gz ZRGUJSYMQCQWMR-CABCVRRESA-N 0 3 344.419 2.598 20 5 EFBDHN Cc1ccc(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000554720316 318334235 /nfs/dbraw/zinc/33/42/35/318334235.db2.gz MPYFCBLNPZMEOK-MRXNPFEDSA-N 0 3 330.384 2.741 20 5 EFBDHN CN(C)c1cccc(CNCCC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000566108443 319033870 /nfs/dbraw/zinc/03/38/70/319033870.db2.gz AUKVTJCUZYJOFY-UHFFFAOYSA-N 0 3 342.399 2.779 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@@H]2C[C@H]2c2ccc(F)cc2)c1 ZINC000566125072 319036556 /nfs/dbraw/zinc/03/65/56/319036556.db2.gz OQJOHISTKCYNDM-BPQIPLTHSA-N 0 3 346.358 2.619 20 5 EFBDHN Cc1nc(C)c(CNCCC(=O)Nc2ccccc2[N+](=O)[O-])s1 ZINC000566851189 319116016 /nfs/dbraw/zinc/11/60/16/319116016.db2.gz OGRBOMJZZYFTOI-UHFFFAOYSA-N 0 3 334.401 2.787 20 5 EFBDHN CC[C@@H](CC(F)(F)F)NC[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000567710596 319201645 /nfs/dbraw/zinc/20/16/45/319201645.db2.gz NOVQZUGVAAYVFF-WDEREUQCSA-N 0 3 336.310 2.655 20 5 EFBDHN CC[C@H](CC(F)(F)F)NC[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000567710593 319201686 /nfs/dbraw/zinc/20/16/86/319201686.db2.gz NOVQZUGVAAYVFF-GHMZBOCLSA-N 0 3 336.310 2.655 20 5 EFBDHN CC(C)C[C@H](CN[C@H]1CCc2c1cccc2[N+](=O)[O-])N1CCOCC1 ZINC000568780305 319318748 /nfs/dbraw/zinc/31/87/48/319318748.db2.gz WIKLXTFATWPLRJ-QAPCUYQASA-N 0 3 347.459 2.919 20 5 EFBDHN CNc1ccc(C(=O)N(CC(C)C)C2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000572871183 319712849 /nfs/dbraw/zinc/71/28/49/319712849.db2.gz JYAQTTVFQIGURR-UHFFFAOYSA-N 0 3 348.447 2.829 20 5 EFBDHN C[C@H](CCc1ccccc1[N+](=O)[O-])N[C@H]1CCN(C(C)(C)C)C1=O ZINC000573844805 319804369 /nfs/dbraw/zinc/80/43/69/319804369.db2.gz LQJZGWGRVFHAAG-HIFRSBDPSA-N 0 3 333.432 2.905 20 5 EFBDHN Cc1cc(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])ccc1F ZINC000576665101 320036951 /nfs/dbraw/zinc/03/69/51/320036951.db2.gz MJWWUPCEEYZUTJ-CQSZACIVSA-N 0 3 334.347 2.572 20 5 EFBDHN Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1[C@@H]2CC[C@H]1CCN(C)C2 ZINC000578764524 320237941 /nfs/dbraw/zinc/23/79/41/320237941.db2.gz LNZASAOQCGMINM-QWHCGFSZSA-N 0 3 337.807 2.865 20 5 EFBDHN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCN1C ZINC000181352673 323232712 /nfs/dbraw/zinc/23/27/12/323232712.db2.gz ZWRBTZKXKYPBSP-CYBMUJFWSA-N 0 3 337.445 2.919 20 5 EFBDHN CCC1(CC)[C@@H](NCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1OC ZINC000181844292 323253053 /nfs/dbraw/zinc/25/30/53/323253053.db2.gz MRFBITYODCYOJA-GJZGRUSLSA-N 0 3 335.404 2.717 20 5 EFBDHN CC[C@@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCCO1 ZINC000182251023 323272806 /nfs/dbraw/zinc/27/28/06/323272806.db2.gz XPKOZHXVEQHYQP-TZMCWYRMSA-N 0 3 341.795 2.734 20 5 EFBDHN CC[C@@H](NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCCO1 ZINC000182367221 323279828 /nfs/dbraw/zinc/27/98/28/323279828.db2.gz JBXSDEGMBBMWMN-RISCZKNCSA-N 0 3 341.795 2.734 20 5 EFBDHN CC[C@H](NC[C@H](O)COc1ccccc1[N+](=O)[O-])c1c(C)noc1C ZINC000182519235 323287079 /nfs/dbraw/zinc/28/70/79/323287079.db2.gz ZLNYUYOJLIITOT-KBPBESRZSA-N 0 3 349.387 2.680 20 5 EFBDHN C[C@@H](CN1CCCCC1)NC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000184923690 323378059 /nfs/dbraw/zinc/37/80/59/323378059.db2.gz ZLSGLFHMKIBZJB-STQMWFEESA-N 0 3 337.395 2.828 20 5 EFBDHN O=[N+]([O-])c1cc(Br)ccc1CN[C@@H](CO)C1CCCC1 ZINC000386143263 323759635 /nfs/dbraw/zinc/75/96/35/323759635.db2.gz RHWLCUKJXXGKLI-ZDUSSCGKSA-N 0 3 343.221 2.998 20 5 EFBDHN COCc1cccc(CNCCC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000579686769 324011756 /nfs/dbraw/zinc/01/17/56/324011756.db2.gz MZIHYZPVQNIROE-UHFFFAOYSA-N 0 3 343.383 2.860 20 5 EFBDHN CCc1ccccc1CNC[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000581007377 324285921 /nfs/dbraw/zinc/28/59/21/324285921.db2.gz NMRDRWDAOMMUMN-INIZCTEOSA-N 0 3 330.384 2.687 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2N[C@@H](CO)Cc1ccc(F)cc1 ZINC000581200508 324327442 /nfs/dbraw/zinc/32/74/42/324327442.db2.gz QTNHRLDZGWNOFK-PBHICJAKSA-N 0 3 330.359 2.914 20 5 EFBDHN CCC(O)(CC)C(C)(C)C[NH2+]Cc1cc(OC)c([O-])cc1[N+](=O)[O-] ZINC000581381062 324365695 /nfs/dbraw/zinc/36/56/95/324365695.db2.gz OIOIOZBMKLFCCS-UHFFFAOYSA-N 0 3 340.420 2.976 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H](C)N1CCCC1 ZINC000581462527 324381988 /nfs/dbraw/zinc/38/19/88/324381988.db2.gz IRQVPSCYUBTHGZ-GDBMZVCRSA-N 0 3 333.432 2.764 20 5 EFBDHN C[C@H](NC(=O)C[C@@H](N)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000582354738 324575050 /nfs/dbraw/zinc/57/50/50/324575050.db2.gz FAEXAINHTONHSH-BBRMVZONSA-N 0 3 327.384 2.732 20 5 EFBDHN C[C@H](NC(=O)C[C@H](N)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000582354741 324575100 /nfs/dbraw/zinc/57/51/00/324575100.db2.gz FAEXAINHTONHSH-XJKSGUPXSA-N 0 3 327.384 2.732 20 5 EFBDHN CCC(CC)Nc1ccncc1NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000583053073 324726868 /nfs/dbraw/zinc/72/68/68/324726868.db2.gz UYJYJVOXGFSBEL-UHFFFAOYSA-N 0 3 343.387 2.847 20 5 EFBDHN CNC(=O)[C@@H](C)CN(C)Cc1cc(=O)oc2ccc3ccccc3c12 ZINC000081529549 473216094 /nfs/dbraw/zinc/21/60/94/473216094.db2.gz JDDDNENHMHVRPR-ZDUSSCGKSA-N 0 3 338.407 2.760 20 5 EFBDHN C[C@H](C(=O)N(C)Cc1ccccc1[N+](=O)[O-])[C@@H](N)c1ccccc1 ZINC000095965557 473232693 /nfs/dbraw/zinc/23/26/93/473232693.db2.gz OHLRARAZESRZDZ-SUMWQHHRSA-N 0 3 327.384 2.889 20 5 EFBDHN CC1CCN(C[C@@H](O)CNc2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000112080966 473241280 /nfs/dbraw/zinc/24/12/80/473241280.db2.gz YSWCYSJSBQMMEE-AWEZNQCLSA-N 0 3 344.415 2.648 20 5 EFBDHN CCN1CCN([C@@H](C)CNc2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000112074315 473241870 /nfs/dbraw/zinc/24/18/70/473241870.db2.gz XFIMBSFFRMABIP-AWEZNQCLSA-N 0 3 343.431 2.581 20 5 EFBDHN O=[N+]([O-])c1cnc(N[C@@H]2CCN3CCCC[C@H]23)c(Br)c1 ZINC000081941351 473276362 /nfs/dbraw/zinc/27/63/62/473276362.db2.gz GUZWNNRFQLMBRR-VXGBXAGGSA-N 0 3 341.209 2.791 20 5 EFBDHN Cc1ccc([C@H](CNC(=O)Nc2ccncc2[N+](=O)[O-])N(C)C)cc1 ZINC000124697119 473287938 /nfs/dbraw/zinc/28/79/38/473287938.db2.gz KNRKQIGCIRMSNZ-HNNXBMFYSA-N 0 3 343.387 2.723 20 5 EFBDHN COCCN(C)CCNC(=O)c1cc2ccccc2c2cccnc12 ZINC000171128235 473294388 /nfs/dbraw/zinc/29/43/88/473294388.db2.gz NRGJGIXLWVTCCF-UHFFFAOYSA-N 0 3 337.423 2.696 20 5 EFBDHN CC1(C)CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])C(C)(C)CO1 ZINC000619718039 479865494 /nfs/dbraw/zinc/86/54/94/479865494.db2.gz PXASSAYNHIZQJO-UHFFFAOYSA-N 0 3 335.404 2.813 20 5 EFBDHN CSc1ccc(C(=O)N[C@@H]2C[C@@H](C)N(C3CC3)C2)cc1[N+](=O)[O-] ZINC000177134499 473312934 /nfs/dbraw/zinc/31/29/34/473312934.db2.gz OWEORFDEALYLPJ-ZYHUDNBSSA-N 0 3 335.429 2.672 20 5 EFBDHN C[C@@H](CNC(=O)NCc1cccc([N+](=O)[O-])c1)N1CCC(C)CC1 ZINC000171201877 473319851 /nfs/dbraw/zinc/31/98/51/473319851.db2.gz INUHJTKCBHZAAV-AWEZNQCLSA-N 0 3 334.420 2.514 20 5 EFBDHN CC(C)[C@@H](CCO)N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000162259393 473322462 /nfs/dbraw/zinc/32/24/62/473322462.db2.gz NUWRHZSXVPYYMR-GXFFZTMASA-N 0 3 343.811 2.572 20 5 EFBDHN C[C@@H]1C[C@H](NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)CN1C1CC1 ZINC000177206211 473331464 /nfs/dbraw/zinc/33/14/64/473331464.db2.gz QQBPUMHFFXVEBA-HIFRSBDPSA-N 0 3 346.431 2.528 20 5 EFBDHN CCC[C@H]1CN(c2ccc([N+](=O)[O-])c(OC)c2)CCN1CCOC ZINC000162489682 473346184 /nfs/dbraw/zinc/34/61/84/473346184.db2.gz ZEMMVDMQMWNEHF-HNNXBMFYSA-N 0 3 337.420 2.541 20 5 EFBDHN COC1CCN(CCNc2nc3ccccc3cc2[N+](=O)[O-])CC1 ZINC000616060820 469360329 /nfs/dbraw/zinc/36/03/29/469360329.db2.gz WDSARERMZNJYBQ-UHFFFAOYSA-N 0 3 330.388 2.666 20 5 EFBDHN CC1(O)CCN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000177302826 473350419 /nfs/dbraw/zinc/35/04/19/473350419.db2.gz VJOPESDCLVROKU-UHFFFAOYSA-N 0 3 331.372 2.639 20 5 EFBDHN C[C@H](C(=O)N1CC[C@@H](N2CCCC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000185170817 473350723 /nfs/dbraw/zinc/35/07/23/473350723.db2.gz FEWKSDJUTQJXHE-GXTWGEPZSA-N 0 3 335.379 2.534 20 5 EFBDHN CS(=O)(=O)CCCCCNCc1ccc([N+](=O)[O-])cc1Cl ZINC000185213790 473363676 /nfs/dbraw/zinc/36/36/76/473363676.db2.gz IBQJYIATBFNADK-UHFFFAOYSA-N 0 3 334.825 2.553 20 5 EFBDHN C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000126199895 473498050 /nfs/dbraw/zinc/49/80/50/473498050.db2.gz YXSOEODJVIRDTO-MFKMUULPSA-N 0 3 325.796 2.660 20 5 EFBDHN CC[C@@H](CN1CCCC1)NC(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000616347364 479886070 /nfs/dbraw/zinc/88/60/70/479886070.db2.gz FFZMQBFNCRRPME-AWEZNQCLSA-N 0 3 335.404 2.516 20 5 EFBDHN CO[C@@H](CN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000338545722 475999939 /nfs/dbraw/zinc/99/99/39/475999939.db2.gz IXMFQDVAKXYRSU-RDJZCZTQSA-N 0 3 342.399 2.864 20 5 EFBDHN O=[N+]([O-])c1ccn(C2CCN(Cc3ccc4nccnc4c3)CC2)n1 ZINC000602637982 479440791 /nfs/dbraw/zinc/44/07/91/479440791.db2.gz PTIMOAYJGLSKAN-UHFFFAOYSA-N 0 3 338.371 2.572 20 5 EFBDHN CN1CCCC(C)(C)[C@@H]1CNCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602643877 479444518 /nfs/dbraw/zinc/44/45/18/479444518.db2.gz NUVFXZLXQVPSJV-HNNXBMFYSA-N 0 3 332.404 2.946 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCN(CC2CC2)C1 ZINC000613233638 479930776 /nfs/dbraw/zinc/93/07/76/479930776.db2.gz ACZWAUMSGCOMJN-DLBZAZTESA-N 0 3 345.443 2.764 20 5 EFBDHN Cc1ccc([C@@H](CNC(=O)c2ccc([N+](=O)[O-])cc2)N(C)C)cc1 ZINC000010017892 471725778 /nfs/dbraw/zinc/72/57/78/471725778.db2.gz WZKLTJFGZBITMP-QGZVFWFLSA-N 0 3 327.384 2.936 20 5 EFBDHN O=C(NC1CCN(C2CC2)CC1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000014528219 471873688 /nfs/dbraw/zinc/87/36/88/471873688.db2.gz AUHOUKGETPEIGG-UHFFFAOYSA-N 0 3 344.415 2.526 20 5 EFBDHN CC[C@@H](CN1CCCC1)NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000609833656 480210840 /nfs/dbraw/zinc/21/08/40/480210840.db2.gz RMHGYFIHDXRXMJ-NSHDSACASA-N 0 3 325.796 2.852 20 5 EFBDHN CN(C)[C@H](CNC(=O)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000016599425 471942925 /nfs/dbraw/zinc/94/29/25/471942925.db2.gz OJNSMUKOUHGJPS-QGZVFWFLSA-N 0 3 327.384 2.556 20 5 EFBDHN O=C(Nc1cccc([N+](=O)[O-])c1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000018180508 471971546 /nfs/dbraw/zinc/97/15/46/471971546.db2.gz YEAINNJVKJQAAP-INIZCTEOSA-N 0 3 340.383 2.991 20 5 EFBDHN CC(C)NC(=O)c1ccc(NC2CCN(C3CC3)CC2)c([N+](=O)[O-])c1 ZINC000022138027 472010316 /nfs/dbraw/zinc/01/03/16/472010316.db2.gz XUJCJHCWJQNJIV-UHFFFAOYSA-N 0 3 346.431 2.772 20 5 EFBDHN CNC(=O)c1ccc(NC[C@H](c2cccs2)N(C)C)c([N+](=O)[O-])c1 ZINC000053550039 472018608 /nfs/dbraw/zinc/01/86/08/472018608.db2.gz PGVJUMUDITVPIT-CQSZACIVSA-N 0 3 348.428 2.731 20 5 EFBDHN CN(CCNC(=O)Nc1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000053751071 472034415 /nfs/dbraw/zinc/03/44/15/472034415.db2.gz OMTJBNQEOYYOBS-UHFFFAOYSA-N 0 3 328.372 2.848 20 5 EFBDHN CN(C)Cc1ccccc1CNC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000054130684 472060037 /nfs/dbraw/zinc/06/00/37/472060037.db2.gz JHMZSHUDJWPAFA-UHFFFAOYSA-N 0 3 331.347 2.726 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)NCC(C)(C)N1CCC[C@H](C)C1 ZINC000054286728 472073361 /nfs/dbraw/zinc/07/33/61/472073361.db2.gz UUXUFNVKVBGFKW-ZDUSSCGKSA-N 0 3 349.431 2.844 20 5 EFBDHN C[C@@H]1CCCN(C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000054287803 472073973 /nfs/dbraw/zinc/07/39/73/472073973.db2.gz KKROCFYWNWAYHN-GFCCVEGCSA-N 0 3 337.395 2.974 20 5 EFBDHN C[C@@H](CNC(=O)NCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](C)C1 ZINC000067724766 472079089 /nfs/dbraw/zinc/07/90/89/472079089.db2.gz DZBCVDRMUOIHDV-KGLIPLIRSA-N 0 3 334.420 2.514 20 5 EFBDHN C[C@@H](CNC(=O)NCc1cccc([N+](=O)[O-])c1)N1CCCC[C@@H]1C ZINC000067725686 472079926 /nfs/dbraw/zinc/07/99/26/472079926.db2.gz ZOYJFLWPFKSQQZ-KBPBESRZSA-N 0 3 334.420 2.657 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CN(Cc2ccccc2)C2CC2)c1 ZINC000025259864 472087523 /nfs/dbraw/zinc/08/75/23/472087523.db2.gz LXJMJBGHWNZUHQ-SFHVURJKSA-N 0 3 342.395 2.999 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)CN2C[C@@H](C)C[C@H](C)C2)c1 ZINC000067806625 472091372 /nfs/dbraw/zinc/09/13/72/472091372.db2.gz ULZMMYUERSUDCY-MELADBBJSA-N 0 3 349.431 2.700 20 5 EFBDHN CN(CCNC(=O)NCc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000054777782 472115458 /nfs/dbraw/zinc/11/54/58/472115458.db2.gz XOTLAJUYWLPIFS-UHFFFAOYSA-N 0 3 342.399 2.526 20 5 EFBDHN CN(CCCNC(=O)Cc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000026304434 472130408 /nfs/dbraw/zinc/13/04/08/472130408.db2.gz HXVCYGDUFBGUTF-UHFFFAOYSA-N 0 3 341.411 2.776 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC1CCN(C2CC2)CC1 ZINC000026711787 472145333 /nfs/dbraw/zinc/14/53/33/472145333.db2.gz WMARJBBVXZRIAH-GFCCVEGCSA-N 0 3 349.456 2.818 20 5 EFBDHN CN(Cc1cccc(F)c1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000026712818 472145893 /nfs/dbraw/zinc/14/58/93/472145893.db2.gz LEOOWEJTNCJAMF-MRXNPFEDSA-N 0 3 334.347 2.606 20 5 EFBDHN CNc1ccc(C(=O)NCC(C)(C)N2CCCCC2)cc1[N+](=O)[O-] ZINC000027412663 472177112 /nfs/dbraw/zinc/17/71/12/472177112.db2.gz ZBKZOMMEALHRLD-UHFFFAOYSA-N 0 3 334.420 2.631 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)CN2CCCCC2)c1 ZINC000027757643 472193827 /nfs/dbraw/zinc/19/38/27/472193827.db2.gz TXENMHHVBBEUBJ-LBPRGKRZSA-N 0 3 337.445 2.921 20 5 EFBDHN CSc1ccc(C(=O)N[C@H](C)CN2CCCCC2)cc1[N+](=O)[O-] ZINC000027744857 472194254 /nfs/dbraw/zinc/19/42/54/472194254.db2.gz CWBWONWFJROXSX-GFCCVEGCSA-N 0 3 337.445 2.921 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCN(CCCCCn3cccn3)CC2)cc1 ZINC000068455387 472194386 /nfs/dbraw/zinc/19/43/86/472194386.db2.gz JQKXBOPLEXPCIL-UHFFFAOYSA-N 0 3 343.431 2.784 20 5 EFBDHN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)NC1CCN(C2CC2)CC1 ZINC000043342457 472225085 /nfs/dbraw/zinc/22/50/85/472225085.db2.gz FHQSBBNXQQNLSV-UHFFFAOYSA-N 0 3 338.795 2.997 20 5 EFBDHN CC(C)N1CCCN(C(=O)/C=C/c2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000068777599 472240631 /nfs/dbraw/zinc/24/06/31/472240631.db2.gz OLXXLYDQVXLOKG-FNORWQNLSA-N 0 3 335.379 2.690 20 5 EFBDHN CC(C)N1CCCN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)CC1 ZINC000068799017 472245661 /nfs/dbraw/zinc/24/56/61/472245661.db2.gz CTUWQFMKXQDURX-UHFFFAOYSA-N 0 3 348.447 2.730 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)NC2CCN(C3CC3)CC2)c1 ZINC000029093554 472249865 /nfs/dbraw/zinc/24/98/65/472249865.db2.gz JCAQPEPNLXMJFG-UHFFFAOYSA-N 0 3 335.429 2.673 20 5 EFBDHN CN(CCN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000085820369 472268535 /nfs/dbraw/zinc/26/85/35/472268535.db2.gz TZCFZXKFZZFFSE-HNNXBMFYSA-N 0 3 341.415 2.612 20 5 EFBDHN O=C(NCC1(N2CCSCC2)CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000029371884 472270850 /nfs/dbraw/zinc/27/08/50/472270850.db2.gz YRJQNGLRTAGTMT-UHFFFAOYSA-N 0 3 349.456 2.686 20 5 EFBDHN CC(C)CN(CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)C(C)C ZINC000029724254 472291827 /nfs/dbraw/zinc/29/18/27/472291827.db2.gz RFJVMCVPYGAQQW-UHFFFAOYSA-N 0 3 337.376 2.628 20 5 EFBDHN O=C(NCCCN1CCc2ccccc2C1)c1csc([N+](=O)[O-])c1 ZINC000044490680 472311407 /nfs/dbraw/zinc/31/14/07/472311407.db2.gz ABHHNZRRDLLANV-UHFFFAOYSA-N 0 3 345.424 2.835 20 5 EFBDHN CCn1ccc(CN(C)CCC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000616786202 479977089 /nfs/dbraw/zinc/97/70/89/479977089.db2.gz ONPSDSPFQFFPBF-UHFFFAOYSA-N 0 3 330.388 2.877 20 5 EFBDHN CN(C)Cc1ccc(C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000088251932 472352244 /nfs/dbraw/zinc/35/22/44/472352244.db2.gz BNUDHFYVKRGHIK-UHFFFAOYSA-N 0 3 339.395 2.855 20 5 EFBDHN COc1cc(C(=O)NC[C@@H]2CCCCN2CC(C)C)ccc1[N+](=O)[O-] ZINC000154194584 472400512 /nfs/dbraw/zinc/40/05/12/472400512.db2.gz CBUXTMMKQIJFFQ-HNNXBMFYSA-N 0 3 349.431 2.844 20 5 EFBDHN CC(C)CN1CCCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000154221229 472405328 /nfs/dbraw/zinc/40/53/28/472405328.db2.gz LSHHAGOCOHSIQB-AWEZNQCLSA-N 0 3 337.395 2.974 20 5 EFBDHN O=C1C[C@@H]([C@H]2CCCCN2Cc2ccc([N+](=O)[O-])cc2Cl)CN1 ZINC000097082869 472436221 /nfs/dbraw/zinc/43/62/21/472436221.db2.gz IOAVQWGANKJWFZ-IUODEOHRSA-N 0 3 337.807 2.739 20 5 EFBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@H](CN2CCOCC2)C1 ZINC000069857604 472452954 /nfs/dbraw/zinc/45/29/54/472452954.db2.gz JLWIXUJBZFQBPH-HZPDHXFCSA-N 0 3 333.432 2.700 20 5 EFBDHN Cc1cc(NC[C@@H]2C[C@H](O)CN2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000089643938 472475770 /nfs/dbraw/zinc/47/57/70/472475770.db2.gz WBTOLJKUSYJWFF-ROUUACIJSA-N 0 3 341.411 2.951 20 5 EFBDHN C[C@H](CNC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1)N(C)C ZINC000033093094 472496007 /nfs/dbraw/zinc/49/60/07/472496007.db2.gz LLYLOJBBZFIRAC-CQSZACIVSA-N 0 3 348.447 2.511 20 5 EFBDHN CCCCNC(=O)C1CCN(CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000046037318 472500876 /nfs/dbraw/zinc/50/08/76/472500876.db2.gz AOBJSZJIYLUQIO-UHFFFAOYSA-N 0 3 349.431 2.602 20 5 EFBDHN CN(C)CCN(C(=O)CNc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000058296909 472540253 /nfs/dbraw/zinc/54/02/53/472540253.db2.gz KPKGKYSTIMMFRZ-UHFFFAOYSA-N 0 3 342.399 2.602 20 5 EFBDHN CN1CCC(N(Cc2ccco2)C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000071838571 472580260 /nfs/dbraw/zinc/58/02/60/472580260.db2.gz OKECCWSBIYHMBX-UHFFFAOYSA-N 0 3 343.383 2.924 20 5 EFBDHN C[C@@H]1C[C@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CN1C1CC1 ZINC000119856122 472593201 /nfs/dbraw/zinc/59/32/01/472593201.db2.gz FUTXCVBDHOCOSE-ZJUUUORDSA-N 0 3 338.795 2.995 20 5 EFBDHN O=C(NCCN1CCCCCC1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000058857818 472605955 /nfs/dbraw/zinc/60/59/55/472605955.db2.gz UTVSTQWKSVOMDR-UHFFFAOYSA-N 0 3 330.388 2.682 20 5 EFBDHN CC(C)CN(CCN(C)C)C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000058883584 472609605 /nfs/dbraw/zinc/60/96/05/472609605.db2.gz BQWPYIMBZPWNDY-UHFFFAOYSA-N 0 3 332.404 2.736 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)CCN1CCCC1 ZINC000103119572 472611985 /nfs/dbraw/zinc/61/19/85/472611985.db2.gz DHXYZIHIOWTBFZ-ZDUSSCGKSA-N 0 3 337.445 2.630 20 5 EFBDHN C[C@@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(-n2cnnn2)cc1 ZINC000155814953 472620807 /nfs/dbraw/zinc/62/08/07/472620807.db2.gz BPECKVZBIKQZGS-CHWSQXEVSA-N 0 3 338.371 2.982 20 5 EFBDHN C[C@@H]1C[C@@H](c2ccccc2F)N(CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000090550921 472633674 /nfs/dbraw/zinc/63/36/74/472633674.db2.gz PZEPUYSTNRGARA-DYVFJYSZSA-N 0 3 345.374 2.979 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCN(C1CC1)[C@H]1CCc2ccccc21 ZINC000090553265 472634544 /nfs/dbraw/zinc/63/45/44/472634544.db2.gz ZHIQQVXFHLRNFB-SFHVURJKSA-N 0 3 339.395 2.908 20 5 EFBDHN CCOc1ccc([C@@H](C)NCC2(OC)CCOCC2)cc1[N+](=O)[O-] ZINC000090651413 472647512 /nfs/dbraw/zinc/64/75/12/472647512.db2.gz ACTXIBHIPUXOEU-CYBMUJFWSA-N 0 3 338.404 2.840 20 5 EFBDHN O=[N+]([O-])c1ccc(Cl)c(CNCCCOC[C@H]2CCCO2)c1 ZINC000060774032 472677386 /nfs/dbraw/zinc/67/73/86/472677386.db2.gz DXROBXSQOBEEQS-CQSZACIVSA-N 0 3 328.796 2.924 20 5 EFBDHN CC(C)c1ccc(CNCCn2cnnc2C2CC2)cc1[N+](=O)[O-] ZINC000156244253 472681622 /nfs/dbraw/zinc/68/16/22/472681622.db2.gz PWZSAZNJEFMWQK-UHFFFAOYSA-N 0 3 329.404 2.977 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@@H]2CCN(CCCCCn3cccn3)C2)nc1 ZINC000072665221 472696760 /nfs/dbraw/zinc/69/67/60/472696760.db2.gz ZRJNQMXOKFLOEF-OAHLLOKOSA-N 0 3 344.419 2.543 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCN2CC[C@@H](Oc3ccncc3)C2)cc1 ZINC000131888727 472699013 /nfs/dbraw/zinc/69/90/13/472699013.db2.gz YFNWSUJBSZQKBF-QGZVFWFLSA-N 0 3 329.356 2.522 20 5 EFBDHN CN(C)Cc1cccc(NC(=O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000047454201 472715966 /nfs/dbraw/zinc/71/59/66/472715966.db2.gz VZBKOIJPYIBBBN-UHFFFAOYSA-N 0 3 329.356 2.674 20 5 EFBDHN CO[C@]1(C)C[C@@H](NCc2cc3c(cc2[N+](=O)[O-])OCCO3)C1(C)C ZINC000072926538 472741677 /nfs/dbraw/zinc/74/16/77/472741677.db2.gz PPNIIEZAFCCXQP-NVXWUHKLSA-N 0 3 336.388 2.659 20 5 EFBDHN CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1NC[C@@H]1CCCN(C)C1 ZINC000091483094 472772682 /nfs/dbraw/zinc/77/26/82/472772682.db2.gz KGRLZVUAJFBLIN-NSHDSACASA-N 0 3 339.367 2.664 20 5 EFBDHN Cc1c(CN2CCC[C@H](C(=O)NCC3CC3)C2)cccc1[N+](=O)[O-] ZINC000047978894 472793230 /nfs/dbraw/zinc/79/32/30/472793230.db2.gz WGTKYDDRFXKYDX-INIZCTEOSA-N 0 3 331.416 2.641 20 5 EFBDHN CN1CC[C@H]2[C@H](CCCN2C(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000157204925 472795563 /nfs/dbraw/zinc/79/55/63/472795563.db2.gz ADOYLCFBNZVWFD-CJNGLKHVSA-N 0 3 349.456 2.630 20 5 EFBDHN CN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000157247721 472800093 /nfs/dbraw/zinc/80/00/93/472800093.db2.gz IIWSUUNSSNDXOD-ABAIWWIYSA-N 0 3 337.807 2.805 20 5 EFBDHN C[C@@H]1C[C@H](Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)CN1C1CC1 ZINC000133520236 472812895 /nfs/dbraw/zinc/81/28/95/472812895.db2.gz FMYFHCFLFHOEIJ-PWSUYJOCSA-N 0 3 330.388 2.517 20 5 EFBDHN COc1ccc(OCCN(C)CCc2nccs2)c([N+](=O)[O-])c1 ZINC000157812634 472861164 /nfs/dbraw/zinc/86/11/64/472861164.db2.gz QPNXOTGOEHSYKS-UHFFFAOYSA-N 0 3 337.401 2.613 20 5 EFBDHN CNC(=O)c1ccc(NC[C@@H](C)N2CCCC[C@H]2C)c([N+](=O)[O-])c1 ZINC000064914226 472884713 /nfs/dbraw/zinc/88/47/13/472884713.db2.gz MCCSNDSDJJWQNC-CHWSQXEVSA-N 0 3 334.420 2.629 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN(Cc2ccccc2)CC2(O)CCCC2)n1 ZINC000134344643 472896557 /nfs/dbraw/zinc/89/65/57/472896557.db2.gz IPEKWIMEGZUAKR-UHFFFAOYSA-N 0 3 344.415 2.599 20 5 EFBDHN Cc1nn(C)c(NC2CCN(CCc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000079887117 472937423 /nfs/dbraw/zinc/93/74/23/472937423.db2.gz QYYXKJSHLVPMFK-UHFFFAOYSA-N 0 3 343.431 2.756 20 5 EFBDHN CCC[C@@H]1CN(CCc2ccc([N+](=O)[O-])cc2)CCN1CCOC ZINC000121956825 472954057 /nfs/dbraw/zinc/95/40/57/472954057.db2.gz LELAEKBIBWVBBR-GOSISDBHSA-N 0 3 335.448 2.570 20 5 EFBDHN NC(=O)CCN(C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000122084390 472973367 /nfs/dbraw/zinc/97/33/67/472973367.db2.gz AIOYAHSDZBNESF-UXBLZVDNSA-N 0 3 339.395 2.986 20 5 EFBDHN COc1ccc(-c2ccc(CN3CC[C@H](CO)C3)o2)c([N+](=O)[O-])c1 ZINC000092763998 472980156 /nfs/dbraw/zinc/98/01/56/472980156.db2.gz KAXODXMZKRPCKR-LBPRGKRZSA-N 0 3 332.356 2.678 20 5 EFBDHN CC(C)C[C@@H](CNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)N(C)C ZINC000134927203 472991595 /nfs/dbraw/zinc/99/15/95/472991595.db2.gz VDIXPXUSYIUSKH-AWEZNQCLSA-N 0 3 327.812 2.954 20 5 EFBDHN CCc1nn(C)c(NC[C@H](c2ccc(F)cc2)N(C)C)c1[N+](=O)[O-] ZINC000092828974 472995206 /nfs/dbraw/zinc/99/52/06/472995206.db2.gz GUIXZWJLTNSFDY-CQSZACIVSA-N 0 3 335.383 2.745 20 5 EFBDHN CN(C[C@@H]1CCCN(C)C1)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000134965557 472999578 /nfs/dbraw/zinc/99/95/78/472999578.db2.gz ZHMWIUPDUBUVBH-LLVKDONJSA-N 0 3 325.796 2.662 20 5 EFBDHN COC1CCN(CCNc2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000080250456 473004064 /nfs/dbraw/zinc/00/40/64/473004064.db2.gz WZXHRMBGOPFRIH-UHFFFAOYSA-N 0 3 330.388 2.666 20 5 EFBDHN CN(C)CCN(C(=O)Cc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000065746141 473005749 /nfs/dbraw/zinc/00/57/49/473005749.db2.gz WHALLVHTENUSKO-UHFFFAOYSA-N 0 3 333.432 2.860 20 5 EFBDHN COC1CCN(CCNc2ccc([N+](=O)[O-])c3cccnc23)CC1 ZINC000080267748 473006492 /nfs/dbraw/zinc/00/64/92/473006492.db2.gz GLEQPEGTKGNKBE-UHFFFAOYSA-N 0 3 330.388 2.666 20 5 EFBDHN CCc1ccc([C@H](CNc2c([N+](=O)[O-])c(C)nn2C)N(C)C)cc1 ZINC000051261797 473036559 /nfs/dbraw/zinc/03/65/59/473036559.db2.gz VMQFBEOZDVJCQF-HNNXBMFYSA-N 0 3 331.420 2.914 20 5 EFBDHN CC(C(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000074729867 473053196 /nfs/dbraw/zinc/05/31/96/473053196.db2.gz PAHXQRGESJCOOY-MRVPVSSYSA-N 0 3 328.250 2.917 20 5 EFBDHN CCc1ccc(CN(CCn2cc([N+](=O)[O-])ccc2=O)C2CC2)cc1 ZINC000159742213 473056532 /nfs/dbraw/zinc/05/65/32/473056532.db2.gz UCDNSBCHWMQOHL-UHFFFAOYSA-N 0 3 341.411 2.984 20 5 EFBDHN Cc1nn(C)c(N(C)[C@H]2CCCN(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000074775151 473062143 /nfs/dbraw/zinc/06/21/43/473062143.db2.gz OAOUJRUCJBMPHN-INIZCTEOSA-N 0 3 343.431 2.738 20 5 EFBDHN Cc1ccc(C[C@H]2CCCN2CCn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC000159826216 473064975 /nfs/dbraw/zinc/06/49/75/473064975.db2.gz UWMWZMWBKZRKQH-QGZVFWFLSA-N 0 3 341.411 2.772 20 5 EFBDHN CC(C)N1CCC(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000136157389 473139866 /nfs/dbraw/zinc/13/98/66/473139866.db2.gz YRNPRWFTCWNYFQ-UHFFFAOYSA-N 0 3 325.796 2.851 20 5 EFBDHN Cc1noc([C@H]2CCCN(CCCOc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000052863680 473156821 /nfs/dbraw/zinc/15/68/21/473156821.db2.gz RVFPSKFKQCGUNL-AWEZNQCLSA-N 0 3 346.387 2.935 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1ccn(CCN(C)C)n1 ZINC000094070143 473174270 /nfs/dbraw/zinc/17/42/70/473174270.db2.gz TWKRXAHWJAGZOG-UHFFFAOYSA-N 0 3 345.403 2.530 20 5 EFBDHN COCCN(Cc1ccccc1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136809192 473177791 /nfs/dbraw/zinc/17/77/91/473177791.db2.gz HMDCFOFZUWWRRL-GOSISDBHSA-N 0 3 330.384 2.777 20 5 EFBDHN CCc1nn(C)c(NCCCN2CCc3ccccc3C2)c1[N+](=O)[O-] ZINC000094134675 473179816 /nfs/dbraw/zinc/17/98/16/473179816.db2.gz AEJVSFOTBWZCKN-UHFFFAOYSA-N 0 3 343.431 2.751 20 5 EFBDHN O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CCC[C@@H]1CN1CCCC1 ZINC000066944115 473180406 /nfs/dbraw/zinc/18/04/06/473180406.db2.gz INYUBOPCKJJFHD-CQSZACIVSA-N 0 3 342.399 2.777 20 5 EFBDHN Cn1ccnc1C[C@@H]1CCCN(CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000123797876 473186225 /nfs/dbraw/zinc/18/62/25/473186225.db2.gz FJPQCVMRVXHTHF-HNNXBMFYSA-N 0 3 344.415 2.662 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCN2CCC(O)(c3ccccc3)CC2)c1 ZINC000185515385 473446383 /nfs/dbraw/zinc/44/63/83/473446383.db2.gz SYBGKCWMCRTDQM-UHFFFAOYSA-N 0 3 342.395 2.957 20 5 EFBDHN CCNc1ccc(C(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)cc1[N+](=O)[O-] ZINC000164068747 473477432 /nfs/dbraw/zinc/47/74/32/473477432.db2.gz WQXUAAOYSBKUNX-GDBMZVCRSA-N 0 3 346.431 2.583 20 5 EFBDHN CN1CC[C@@H]2[C@H](CCCN2C(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000164173855 473480960 /nfs/dbraw/zinc/48/09/60/473480960.db2.gz LBUZLMRJUXIPHA-DGCLKSJQSA-N 0 3 337.807 2.805 20 5 EFBDHN CC(C)N(CCN(C)C)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000151770880 473492679 /nfs/dbraw/zinc/49/26/79/473492679.db2.gz GQLYVVIQILJODJ-UHFFFAOYSA-N 0 3 334.420 2.581 20 5 EFBDHN Cc1c(Br)c(NC2CCN(C)CC2)ncc1[N+](=O)[O-] ZINC000165719419 473513680 /nfs/dbraw/zinc/51/36/80/473513680.db2.gz MLYOWXWPEYMVAF-UHFFFAOYSA-N 0 3 329.198 2.567 20 5 EFBDHN CC[C@@H]1CN(C)c2ccccc2CN1CCn1ccc([N+](=O)[O-])n1 ZINC000127433142 473613132 /nfs/dbraw/zinc/61/31/32/473613132.db2.gz SKSSWNMAYMLQQV-OAHLLOKOSA-N 0 3 329.404 2.522 20 5 EFBDHN O=C1C[C@H](CNCc2csc([N+](=O)[O-])c2)CN1Cc1ccccc1 ZINC000179056981 473619297 /nfs/dbraw/zinc/61/92/97/473619297.db2.gz GKCPBOFDJHFYNC-CQSZACIVSA-N 0 3 345.424 2.795 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H]1CCN(CC2CC2)C1 ZINC000127611552 473631907 /nfs/dbraw/zinc/63/19/07/473631907.db2.gz OSXIMYBXMJCVIZ-AWEZNQCLSA-N 0 3 332.404 2.817 20 5 EFBDHN CC(C)C[C@@H]1OCCC[C@@H]1NCC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000186305437 473643641 /nfs/dbraw/zinc/64/36/41/473643641.db2.gz RWKLMDAZOCBRIW-IRXDYDNUSA-N 0 3 349.431 2.741 20 5 EFBDHN CC(C)C[C@H]1OCCC[C@@H]1NCC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000186305420 473644233 /nfs/dbraw/zinc/64/42/33/473644233.db2.gz RWKLMDAZOCBRIW-DLBZAZTESA-N 0 3 349.431 2.741 20 5 EFBDHN C[C@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)[C@@H](c1ccccc1)N(C)C ZINC000186496814 473682193 /nfs/dbraw/zinc/68/21/93/473682193.db2.gz QCFCJODTXAVOMO-SJCJKPOMSA-N 0 3 342.399 2.598 20 5 EFBDHN CCOc1ccc([C@@H](C)N[C@@H](C)CN2CCCC2=O)cc1[N+](=O)[O-] ZINC000179405553 473684833 /nfs/dbraw/zinc/68/48/33/473684833.db2.gz KTWXVBLNKYTNDL-QWHCGFSZSA-N 0 3 335.404 2.655 20 5 EFBDHN CCn1nc(C)c([N+](=O)[O-])c1NCc1ccccc1OCCN(C)C ZINC000192543690 473690847 /nfs/dbraw/zinc/69/08/47/473690847.db2.gz WTPYXFQNGKEEBJ-UHFFFAOYSA-N 0 3 347.419 2.672 20 5 EFBDHN CCn1nc(C)c([N+](=O)[O-])c1NCCN(C)Cc1ccc(F)cc1 ZINC000192649012 473700607 /nfs/dbraw/zinc/70/06/07/473700607.db2.gz QTYKYXKQDCFNTI-UHFFFAOYSA-N 0 3 335.383 2.803 20 5 EFBDHN Cc1[n-]nc(C(=O)Nc2cc(C[NH+]3CCCC3)ccc2C)c1[N+](=O)[O-] ZINC000269146482 473709408 /nfs/dbraw/zinc/70/94/08/473709408.db2.gz OFPFMJDOVYNTHE-UHFFFAOYSA-N 0 3 343.387 2.783 20 5 EFBDHN CCN1CCN([C@@H]2CCN([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)CC1 ZINC000245535417 473716039 /nfs/dbraw/zinc/71/60/39/473716039.db2.gz WPUMLRQKTOHLLY-SJLPKXTDSA-N 0 3 346.475 2.676 20 5 EFBDHN Cc1nn(C)c(N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000274060806 473721735 /nfs/dbraw/zinc/72/17/35/473721735.db2.gz AHOHGDKISVCTMP-IUODEOHRSA-N 0 3 329.404 2.569 20 5 EFBDHN Nc1ccc([N+](=O)[O-])c(N2CCCN(Cc3ccccc3)CC2)c1 ZINC000192769170 473722227 /nfs/dbraw/zinc/72/22/27/473722227.db2.gz YGGNPWRKLWDGOE-UHFFFAOYSA-N 0 3 326.400 2.889 20 5 EFBDHN CC1(C)COCCN1CCN[C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192816576 473731662 /nfs/dbraw/zinc/73/16/62/473731662.db2.gz VCBGCDMSYJNSNN-QGZVFWFLSA-N 0 3 333.432 2.673 20 5 EFBDHN C[C@@H](NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCOCC1 ZINC000179842005 473739311 /nfs/dbraw/zinc/73/93/11/473739311.db2.gz BYGNMCMBZNXJIK-LLVKDONJSA-N 0 3 332.360 2.550 20 5 EFBDHN C[C@@H](NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CCOCC1 ZINC000179870495 473744830 /nfs/dbraw/zinc/74/48/30/473744830.db2.gz KTKZHOPTSICRER-LLVKDONJSA-N 0 3 332.360 2.550 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C\CN1CCOC2(CCOCC2)CC1 ZINC000613620826 480059292 /nfs/dbraw/zinc/05/92/92/480059292.db2.gz KTUBAWKISFVWLL-HYXAFXHYSA-N 0 3 332.400 2.880 20 5 EFBDHN COc1ccc(CN[C@@H]2CCO[C@@H](C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000287826270 473771985 /nfs/dbraw/zinc/77/19/85/473771985.db2.gz VKZHIVWXNSAPMJ-ZWNOBZJWSA-N 0 3 334.294 2.803 20 5 EFBDHN CC[C@@H](NC[C@H]1COC2(CCOCC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000179998504 473774358 /nfs/dbraw/zinc/77/43/58/473774358.db2.gz HLCZKWNSORJGJI-JKSUJKDBSA-N 0 3 336.388 2.558 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCN(CC3CCCC3)C2)c1 ZINC000173259523 473783760 /nfs/dbraw/zinc/78/37/60/473783760.db2.gz IRJYGIDGAVTZMR-OAHLLOKOSA-N 0 3 331.416 2.898 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H]2CCCN(C(C)C)C2)c1 ZINC000281664238 473799917 /nfs/dbraw/zinc/79/99/17/473799917.db2.gz STEMOESSGCCHDK-HNNXBMFYSA-N 0 3 349.431 2.661 20 5 EFBDHN C[C@@H](NCCC(=O)NCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000173366977 473817168 /nfs/dbraw/zinc/81/71/68/473817168.db2.gz IAOKQLCQLLNXIO-CQSZACIVSA-N 0 3 327.384 2.952 20 5 EFBDHN COc1ccc(OCCN2CCC(n3ccnc3)CC2)c([N+](=O)[O-])c1 ZINC000173370045 473817586 /nfs/dbraw/zinc/81/75/86/473817586.db2.gz WLYNUFMCZFELBD-UHFFFAOYSA-N 0 3 346.387 2.516 20 5 EFBDHN CCn1c(C)nc([N+](=O)[O-])c1N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000288041662 473831097 /nfs/dbraw/zinc/83/10/97/473831097.db2.gz DLQMMJWXINAXPR-OAHLLOKOSA-N 0 3 329.404 2.806 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)C1CCN(C)CC1 ZINC000194118522 473845691 /nfs/dbraw/zinc/84/56/91/473845691.db2.gz JVGOFCVHWIUYMC-GFCCVEGCSA-N 0 3 337.445 2.628 20 5 EFBDHN CNC(=O)[C@@H](C)CN(C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000180292499 473847436 /nfs/dbraw/zinc/84/74/36/473847436.db2.gz GYMGRPZRSZNBKO-LBPRGKRZSA-N 0 3 331.372 2.669 20 5 EFBDHN CNC(=O)[C@@H](C)CN(C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000180294202 473848814 /nfs/dbraw/zinc/84/88/14/473848814.db2.gz QUADXJGQGRGTIZ-LBPRGKRZSA-N 0 3 331.372 2.669 20 5 EFBDHN Cc1c(CC(=O)N2CC[C@H](N3CCCCC3)C2)cccc1[N+](=O)[O-] ZINC000269648551 473850081 /nfs/dbraw/zinc/85/00/81/473850081.db2.gz CWXLELPPSQMCAV-INIZCTEOSA-N 0 3 331.416 2.533 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CCC[C@@H]2C[C@H](O)c2ccc(F)cc2)c1 ZINC000269704759 473868922 /nfs/dbraw/zinc/86/89/22/473868922.db2.gz ZGLQEJNRDHJYRI-WBVHZDCISA-N 0 3 348.378 2.519 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1C(=O)NCc1cccc(CN(C)C)c1 ZINC000194384990 473889897 /nfs/dbraw/zinc/88/98/97/473889897.db2.gz KGFSWPSYPIBXEI-UHFFFAOYSA-N 0 3 327.384 2.895 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000281936839 473891163 /nfs/dbraw/zinc/89/11/63/473891163.db2.gz LAFUGHRRJIVCGW-GFCCVEGCSA-N 0 3 348.403 2.765 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H](C)CN1C[C@H](C)C[C@H](C)C1 ZINC000194484706 473905586 /nfs/dbraw/zinc/90/55/86/473905586.db2.gz IJCKOFFLEZHQRO-GUTXKFCHSA-N 0 3 333.432 2.999 20 5 EFBDHN C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)c1cc(F)c([N+](=O)[O-])cc1F ZINC000288360221 473919951 /nfs/dbraw/zinc/91/99/51/473919951.db2.gz KOTXAZNREBNRGA-MNOVXSKESA-N 0 3 339.342 2.572 20 5 EFBDHN CCn1c(C)nc([N+](=O)[O-])c1N(C)CCCN(C)Cc1ccco1 ZINC000288377437 473925710 /nfs/dbraw/zinc/92/57/10/473925710.db2.gz IKVYZTNKBMRJCA-UHFFFAOYSA-N 0 3 335.408 2.671 20 5 EFBDHN CSc1ccccc1[C@@H](C)NCCn1cc([N+](=O)[O-])ccc1=O ZINC000282083959 473940778 /nfs/dbraw/zinc/94/07/78/473940778.db2.gz OGFSAJRJLMDBAX-GFCCVEGCSA-N 0 3 333.413 2.829 20 5 EFBDHN Cc1ccc([C@@H](CNC(=O)c2c(N)cccc2[N+](=O)[O-])N(C)C)cc1 ZINC000180714417 473949635 /nfs/dbraw/zinc/94/96/35/473949635.db2.gz AYKBUHIOVXYEHP-MRXNPFEDSA-N 0 3 342.399 2.518 20 5 EFBDHN C[C@@H](N[C@H]1CCCC12CCOCC2)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000282146491 473960428 /nfs/dbraw/zinc/96/04/28/473960428.db2.gz SHIKMFFGTSXLSZ-CJNGLKHVSA-N 0 3 347.415 2.861 20 5 EFBDHN COc1ccc(CNC[C@H](CO)Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000264377569 473967814 /nfs/dbraw/zinc/96/78/14/473967814.db2.gz WNOOQYSBWTUFNK-OAHLLOKOSA-N 0 3 348.374 2.683 20 5 EFBDHN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCN(C)C1 ZINC000180811999 473970146 /nfs/dbraw/zinc/97/01/46/473970146.db2.gz RTTNVGYEZPNHAQ-GFCCVEGCSA-N 0 3 337.445 2.777 20 5 EFBDHN CSc1cccc(C(=O)N2CC[C@@H](N3CCCC3)C2)c1[N+](=O)[O-] ZINC000188119232 473990602 /nfs/dbraw/zinc/99/06/02/473990602.db2.gz XXKGUNCNEUETTP-GFCCVEGCSA-N 0 3 335.429 2.627 20 5 EFBDHN CCOCC(C)(C)CNCc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000288619771 474002272 /nfs/dbraw/zinc/00/22/72/474002272.db2.gz RNCNRZHQEPSWOC-UHFFFAOYSA-N 0 3 326.393 2.764 20 5 EFBDHN CCCCN(C)C[C@H](C)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000288692306 474023700 /nfs/dbraw/zinc/02/37/00/474023700.db2.gz BIZWESPBGVBFDO-LBPRGKRZSA-N 0 3 343.449 2.531 20 5 EFBDHN C[C@H](NC(C)(C)CNC(=O)c1ccc([N+](=O)[O-])[nH]1)c1ccccc1 ZINC000264532342 474026426 /nfs/dbraw/zinc/02/64/26/474026426.db2.gz FUNNWBPGNZZJDZ-LBPRGKRZSA-N 0 3 330.388 2.782 20 5 EFBDHN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CC[C@H](N2CCCCC2)C1 ZINC000264543458 474030951 /nfs/dbraw/zinc/03/09/51/474030951.db2.gz BFLWSXRWXTYCTI-ZDUSSCGKSA-N 0 3 337.807 2.949 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)NCCN2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000247009227 474032665 /nfs/dbraw/zinc/03/26/65/474032665.db2.gz LFYWCEAAMBALCY-UKRRQHHQSA-N 0 3 348.447 2.995 20 5 EFBDHN CN(C)Cc1cccc(NC(=O)NCc2cccc([N+](=O)[O-])c2)c1 ZINC000195257088 474040730 /nfs/dbraw/zinc/04/07/30/474040730.db2.gz LEUYZDXBECVFPR-UHFFFAOYSA-N 0 3 328.372 2.978 20 5 EFBDHN C[C@@H]1NC(=O)CC[C@@H]1NCc1cc(=O)oc2ccc3ccccc3c12 ZINC000282415341 474057054 /nfs/dbraw/zinc/05/70/54/474057054.db2.gz QMVNFNASCDUXIH-LRDDRELGSA-N 0 3 336.391 2.703 20 5 EFBDHN C[C@@H]1NC(=O)CC[C@H]1NCc1cc(=O)oc2ccc3ccccc3c12 ZINC000282415340 474057101 /nfs/dbraw/zinc/05/71/01/474057101.db2.gz QMVNFNASCDUXIH-BLLLJJGKSA-N 0 3 336.391 2.703 20 5 EFBDHN CN(C)Cc1cccc(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)c1 ZINC000174534416 474057658 /nfs/dbraw/zinc/05/76/58/474057658.db2.gz CPYLAIIXGQBQDC-UHFFFAOYSA-N 0 3 325.368 2.859 20 5 EFBDHN CN1CCN(CCCNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000270287735 474059851 /nfs/dbraw/zinc/05/98/51/474059851.db2.gz ZDQUSXUDLKNHAP-UHFFFAOYSA-N 0 3 346.353 2.663 20 5 EFBDHN C[S@@](=O)C1(CNCc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000282431132 474063547 /nfs/dbraw/zinc/06/35/47/474063547.db2.gz RHOZJDGCRRGFPQ-HSZRJFAPSA-N 0 3 334.397 2.856 20 5 EFBDHN COCCN1CC[C@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000264619657 474063534 /nfs/dbraw/zinc/06/35/34/474063534.db2.gz RIFNSUYIDKRQBQ-HNNXBMFYSA-N 0 3 345.399 2.665 20 5 EFBDHN C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)C1CCN(C2CC2)CC1 ZINC000195347221 474063781 /nfs/dbraw/zinc/06/37/81/474063781.db2.gz XASBUZPIFDAKEZ-LBPRGKRZSA-N 0 3 329.400 2.747 20 5 EFBDHN O=C(c1c[nH]c2cc([N+](=O)[O-])ccc12)N1CC[C@@H](N2CCCCC2)C1 ZINC000264623459 474065442 /nfs/dbraw/zinc/06/54/42/474065442.db2.gz SCMIGOGDZBWYMU-CQSZACIVSA-N 0 3 342.399 2.777 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1ccc(CN(C)C)cc1 ZINC000195484042 474082462 /nfs/dbraw/zinc/08/24/62/474082462.db2.gz DOYQCENFPDOPRP-UHFFFAOYSA-N 0 3 343.383 2.595 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@H](C(=O)NCC(F)(F)F)C1 ZINC000275141881 474082631 /nfs/dbraw/zinc/08/26/31/474082631.db2.gz VLXKHNFUHITFRM-MNOVXSKESA-N 0 3 345.321 2.656 20 5 EFBDHN CS[C@H]1CN(C(=O)c2cc(C)cc([N+](=O)[O-])c2)C[C@@H]1N1CCCC1 ZINC000275164901 474091035 /nfs/dbraw/zinc/09/10/35/474091035.db2.gz VKRHCKJJMKJKEF-HOTGVXAUSA-N 0 3 349.456 2.555 20 5 EFBDHN CS[C@@H]1CN(c2ccc([N+](=O)[O-])c3cnccc32)C[C@@H]1N(C)C ZINC000270399463 474105577 /nfs/dbraw/zinc/10/55/77/474105577.db2.gz UZVQLSFOQYKCME-JKSUJKDBSA-N 0 3 332.429 2.625 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)NCC(C)(C)N1CCCCC1 ZINC000198360713 474110522 /nfs/dbraw/zinc/11/05/22/474110522.db2.gz ZMPAVSIFEVDUGE-UHFFFAOYSA-N 0 3 335.404 2.598 20 5 EFBDHN CN(C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@@H]1CCc2ccccc21 ZINC000182201182 474121737 /nfs/dbraw/zinc/12/17/37/474121737.db2.gz VVDBITHFEITYEH-DOTOQJQBSA-N 0 3 342.395 2.954 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000264774862 474123184 /nfs/dbraw/zinc/12/31/84/474123184.db2.gz VSLRSAPPSIJHBR-LBPRGKRZSA-N 0 3 325.796 2.852 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCCN2CCS[C@H]3COCC[C@H]32)cc1 ZINC000247343864 474124147 /nfs/dbraw/zinc/12/41/47/474124147.db2.gz XRUKFWUCKWIURN-CVEARBPZSA-N 0 3 338.429 2.570 20 5 EFBDHN COc1cc(C(=O)N[C@@H](C)CN2CCCCC2)cc([N+](=O)[O-])c1C ZINC000188589960 474135896 /nfs/dbraw/zinc/13/58/96/474135896.db2.gz RDCICGIIRADOMP-LBPRGKRZSA-N 0 3 335.404 2.516 20 5 EFBDHN Cc1ccc(CN[C@H]2CCCO[C@@H]2c2nccn2C)cc1[N+](=O)[O-] ZINC000275359229 474157248 /nfs/dbraw/zinc/15/72/48/474157248.db2.gz AUSVGVQBOJGWOU-HOCLYGCPSA-N 0 3 330.388 2.647 20 5 EFBDHN CCc1ccc(C(=O)NCc2ccc3c(c2)CNC3)cc1[N+](=O)[O-] ZINC000188670161 474159801 /nfs/dbraw/zinc/15/98/01/474159801.db2.gz JBZQTJAKWKXUEW-UHFFFAOYSA-N 0 3 325.368 2.690 20 5 EFBDHN COC(=O)C1(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000188680721 474165138 /nfs/dbraw/zinc/16/51/38/474165138.db2.gz VIRUTBGVPPXBJD-UHFFFAOYSA-N 0 3 330.340 2.898 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2noc([C@H]3CCCN3C3CCOCC3)n2)c1 ZINC000275442446 474185861 /nfs/dbraw/zinc/18/58/61/474185861.db2.gz KMPSVKDJOMOJKH-OAHLLOKOSA-N 0 3 344.371 2.961 20 5 EFBDHN COc1cc(C[NH2+][C@H]2CCO[C@H](C(C)(C)C)C2)c([N+](=O)[O-])cc1[O-] ZINC000270601113 474186475 /nfs/dbraw/zinc/18/64/75/474186475.db2.gz ARVNIZFQUSCLNG-LRDDRELGSA-N 0 3 338.404 2.992 20 5 EFBDHN C[C@H]1CCN(CCOc2cccc([N+](=O)[O-])c2)C[C@H]1n1ccnc1 ZINC000247591509 474187103 /nfs/dbraw/zinc/18/71/03/474187103.db2.gz MNUJDIUFHUCQNK-WMLDXEAASA-N 0 3 330.388 2.753 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)NCC2(N(C)C)CCC2)cc1[N+](=O)[O-] ZINC000275496737 474209182 /nfs/dbraw/zinc/20/91/82/474209182.db2.gz QFZMGKACQQIILQ-CYBMUJFWSA-N 0 3 334.420 2.748 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)NCC2(N(C)C)CCC2)cc1[N+](=O)[O-] ZINC000275496743 474210629 /nfs/dbraw/zinc/21/06/29/474210629.db2.gz QFZMGKACQQIILQ-ZDUSSCGKSA-N 0 3 334.420 2.748 20 5 EFBDHN CC(C)Oc1ccc([C@H](C)NCCn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC000182626891 474221430 /nfs/dbraw/zinc/22/14/30/474221430.db2.gz HBVQOMJWJVZURQ-AWEZNQCLSA-N 0 3 345.399 2.895 20 5 EFBDHN CN(C[C@@H](O)COc1cccc([N+](=O)[O-])c1)[C@H]1CCc2ccccc21 ZINC000247971047 474235017 /nfs/dbraw/zinc/23/50/17/474235017.db2.gz HQIKAGHFDVKPHB-APWZRJJASA-N 0 3 342.395 2.954 20 5 EFBDHN CN(C)CCOc1cc(CNc2ccc([N+](=O)[O-])cc2F)ccn1 ZINC000270718879 474235301 /nfs/dbraw/zinc/23/53/01/474235301.db2.gz NHEQJQGYDBSVFS-UHFFFAOYSA-N 0 3 334.351 2.681 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@H]3CN(C)CC[C@H]32)c1 ZINC000282947043 474250416 /nfs/dbraw/zinc/25/04/16/474250416.db2.gz YWJLHNIZTJAAEL-XJKSGUPXSA-N 0 3 347.415 2.550 20 5 EFBDHN C[C@H]1C[C@H](Nc2c(Br)cncc2[N+](=O)[O-])CCN1C ZINC000231630168 474263801 /nfs/dbraw/zinc/26/38/01/474263801.db2.gz WFDCYOAPTHQXAZ-DTWKUNHWSA-N 0 3 329.198 2.647 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCN(C[C@H]2CCOC2)CC1 ZINC000182829764 474266811 /nfs/dbraw/zinc/26/68/11/474266811.db2.gz TZDOOWGPGFXGSR-JKSUJKDBSA-N 0 3 333.432 2.618 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000189068108 474280984 /nfs/dbraw/zinc/28/09/84/474280984.db2.gz YHQLMJSGAOCZQZ-CABCVRRESA-N 0 3 347.415 2.611 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN[C@@H](CO)c1ccccc1 ZINC000182924176 474289019 /nfs/dbraw/zinc/28/90/19/474289019.db2.gz BNWFSRMOWOCFEY-KRWDZBQOSA-N 0 3 343.383 2.555 20 5 EFBDHN C[C@@H]1CCC[C@@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@H]1C ZINC000248373546 474298155 /nfs/dbraw/zinc/29/81/55/474298155.db2.gz JRBJHKFHOJKZIW-DVOMOZLQSA-N 0 3 340.445 2.783 20 5 EFBDHN CC(C)N1CCN(C2CCN(Cc3ccccc3[N+](=O)[O-])CC2)CC1 ZINC000270879031 474304423 /nfs/dbraw/zinc/30/44/23/474304423.db2.gz KALWMRPFFRXLAH-UHFFFAOYSA-N 0 3 346.475 2.585 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@H]1CCN(C)C[C@H]1C ZINC000248399303 474306921 /nfs/dbraw/zinc/30/69/21/474306921.db2.gz VQRHKMFNJYJUNG-KYJSFNMBSA-N 0 3 347.459 2.962 20 5 EFBDHN C[C@@H]1CN(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)[C@@H]2CCCC[C@@H]21 ZINC000248417177 474316246 /nfs/dbraw/zinc/31/62/46/474316246.db2.gz JHPIIKDHHKWCBP-KBRIMQKVSA-N 0 3 343.427 2.994 20 5 EFBDHN CC[C@H]1CN(Cc2ccc([N+](=O)[O-])cc2Cl)CCN1C[C@H](C)O ZINC000248425158 474318463 /nfs/dbraw/zinc/31/84/63/474318463.db2.gz NUXNLHOSOXBIDF-JSGCOSHPSA-N 0 3 341.839 2.525 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CN1CC[C@@H](c2ccccc2)C1 ZINC000248437828 474323250 /nfs/dbraw/zinc/32/32/50/474323250.db2.gz BOOAMFKYYFRZGR-IAGOWNOFSA-N 0 3 342.395 2.824 20 5 EFBDHN O=[N+]([O-])c1ccccc1N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO ZINC000265753912 474323854 /nfs/dbraw/zinc/32/38/54/474323854.db2.gz DDKOIYGHFDWNQO-SJORKVTESA-N 0 3 341.411 2.890 20 5 EFBDHN COC[C@H](CCO)NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000265766868 474329016 /nfs/dbraw/zinc/32/90/16/474329016.db2.gz LEJBTZTVSZHLNV-LBPRGKRZSA-N 0 3 336.413 2.810 20 5 EFBDHN C[S@@](=O)C[C@H](NCCOc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000183120084 474332555 /nfs/dbraw/zinc/33/25/55/474332555.db2.gz KTUGMBCEDJSHMU-IZHWHUGBSA-N 0 3 348.424 2.683 20 5 EFBDHN C[S@@](=O)C[C@@H](NCCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000183120783 474332572 /nfs/dbraw/zinc/33/25/72/474332572.db2.gz OVDHFILXVKWQQR-UZUQRXQVSA-N 0 3 332.425 2.847 20 5 EFBDHN C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000289588423 474335794 /nfs/dbraw/zinc/33/57/94/474335794.db2.gz IFORYXVDERPTIE-DGCLKSJQSA-N 0 3 337.807 2.947 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000248566408 474360811 /nfs/dbraw/zinc/36/08/11/474360811.db2.gz KWWZNUAORRQJNR-OCCSQVGLSA-N 0 3 337.395 2.828 20 5 EFBDHN CC1(C)CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H]1[C@H]1CCCO1 ZINC000289667851 474370138 /nfs/dbraw/zinc/37/01/38/474370138.db2.gz GZQNOKSSPFAYOK-WBVHZDCISA-N 0 3 347.415 2.813 20 5 EFBDHN CCNC(=O)[C@H](C)N[C@H](CC)CSc1ccccc1[N+](=O)[O-] ZINC000271025866 474373210 /nfs/dbraw/zinc/37/32/10/474373210.db2.gz BDWHRVVFYUEJTQ-NWDGAFQWSA-N 0 3 325.434 2.580 20 5 EFBDHN COC1CCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000271035588 474377782 /nfs/dbraw/zinc/37/77/82/474377782.db2.gz IYRJKUDAPLQGPZ-UHFFFAOYSA-N 0 3 330.388 2.606 20 5 EFBDHN CN(C)CCN(CC1CCCCC1)C(=O)c1cccc([N+](=O)[O-])c1N ZINC000176131087 474389793 /nfs/dbraw/zinc/38/97/93/474389793.db2.gz UVHLPKSGOOHSKD-UHFFFAOYSA-N 0 3 348.447 2.761 20 5 EFBDHN Cc1c2ccccc2oc1[C@H](C)NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000183536370 474389894 /nfs/dbraw/zinc/38/98/94/474389894.db2.gz YHBJYQHLBNTRNR-GXTWGEPZSA-N 0 3 344.371 2.558 20 5 EFBDHN CCOc1ccc([C@@H](C)NCCN2CCSCC2)cc1[N+](=O)[O-] ZINC000271064011 474392567 /nfs/dbraw/zinc/39/25/67/474392567.db2.gz CPQJUFYYZXOHEN-CYBMUJFWSA-N 0 3 339.461 2.693 20 5 EFBDHN C[C@@H]1CN(CC(C)(C)O)CCN1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000189443444 474399806 /nfs/dbraw/zinc/39/98/06/474399806.db2.gz ZMDKNOQPZXRSSW-GFCCVEGCSA-N 0 3 341.839 2.525 20 5 EFBDHN C[C@H]1CN(CC(C)(C)O)CCN1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000189445883 474399848 /nfs/dbraw/zinc/39/98/48/474399848.db2.gz QHFGWYYSMDWMPS-LBPRGKRZSA-N 0 3 341.839 2.525 20 5 EFBDHN C[C@H]1CN(CC(C)(C)O)CCN1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000189443465 474400316 /nfs/dbraw/zinc/40/03/16/474400316.db2.gz ZMDKNOQPZXRSSW-LBPRGKRZSA-N 0 3 341.839 2.525 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)[C@H](N)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000237418851 474400408 /nfs/dbraw/zinc/40/04/08/474400408.db2.gz REZBNCIVEWLEAQ-CZUORRHYSA-N 0 3 327.384 2.650 20 5 EFBDHN CN(CCn1ccc([N+](=O)[O-])n1)Cc1ccccc1C(F)(F)F ZINC000176202578 474407670 /nfs/dbraw/zinc/40/76/70/474407670.db2.gz UWRHXOPMZGUSAN-UHFFFAOYSA-N 0 3 328.294 2.942 20 5 EFBDHN CCc1ccc([N+](=O)[O-])cc1NC(=O)N(C)C[C@H]1CCCN(C)C1 ZINC000289752195 474408893 /nfs/dbraw/zinc/40/88/93/474408893.db2.gz KAHDYSMBRAFPOR-ZDUSSCGKSA-N 0 3 334.420 2.963 20 5 EFBDHN CCc1nn(C)c(NC[C@H](c2cccc(OC)c2)N(C)C)c1[N+](=O)[O-] ZINC000271161267 474411680 /nfs/dbraw/zinc/41/16/80/474411680.db2.gz QINQIERKMKAXRT-OAHLLOKOSA-N 0 3 347.419 2.614 20 5 EFBDHN COc1cccc(CN(CCN(C)C)c2ccc([N+](=O)[O-])cn2)c1 ZINC000189627777 474450806 /nfs/dbraw/zinc/45/08/06/474450806.db2.gz GVNMPWXYTUTENB-UHFFFAOYSA-N 0 3 330.388 2.567 20 5 EFBDHN CCC1(CC)[C@H](NCc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@H](C)[C@H]1OC ZINC000248846363 474454546 /nfs/dbraw/zinc/45/45/46/474454546.db2.gz RXQLDXFTSITLAM-IUIKQTSFSA-N 0 3 349.431 2.623 20 5 EFBDHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000248920007 474483691 /nfs/dbraw/zinc/48/36/91/474483691.db2.gz WMKJOHFFBRWNDZ-KBXCAEBGSA-N 0 3 339.395 2.845 20 5 EFBDHN CC(C)C[C@@H](CNC(=O)c1cccc(Cl)c1[N+](=O)[O-])N(C)C ZINC000176483934 474485987 /nfs/dbraw/zinc/48/59/87/474485987.db2.gz DAWVNOCZFHHIPL-NSHDSACASA-N 0 3 327.812 2.954 20 5 EFBDHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000248941267 474487907 /nfs/dbraw/zinc/48/79/07/474487907.db2.gz YTURNJMEDXITEW-KBXCAEBGSA-N 0 3 339.395 2.845 20 5 EFBDHN C[C@H](NC[C@H](O)COc1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000266825319 474495669 /nfs/dbraw/zinc/49/56/69/474495669.db2.gz CTQYZJRZPIULMD-LRDDRELGSA-N 0 3 334.347 2.824 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCN(CC(C)(C)O)[C@H](C)C1 ZINC000189948204 474515504 /nfs/dbraw/zinc/51/55/04/474515504.db2.gz LRVSCAJQRGLQRT-HUUCEWRRSA-N 0 3 335.448 2.741 20 5 EFBDHN CC[C@H](NC(=O)N1CCN2CCC[C@@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000176687629 474517423 /nfs/dbraw/zinc/51/74/23/474517423.db2.gz MJOLBCWXQWBXRT-CVEARBPZSA-N 0 3 332.404 2.536 20 5 EFBDHN COc1ccc(CC(=O)NC[C@@H](C)N2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000609011272 480108977 /nfs/dbraw/zinc/10/89/77/480108977.db2.gz MNFTWVLAPPHGFX-UONOGXRCSA-N 0 3 349.431 2.525 20 5 EFBDHN CC[C@@H](NC(=O)N1CCC[C@@H](N(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000176706364 474519475 /nfs/dbraw/zinc/51/94/75/474519475.db2.gz QFIKUDVCQOVBST-HZPDHXFCSA-N 0 3 334.420 2.782 20 5 EFBDHN COc1cc(C(=O)N[C@@H](C)CN2CCC[C@H](C)C2)cc([N+](=O)[O-])c1C ZINC000189992099 474530008 /nfs/dbraw/zinc/53/00/08/474530008.db2.gz AQKIQGVULGVBQQ-STQMWFEESA-N 0 3 349.431 2.762 20 5 EFBDHN O=C(NCCNCc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1CC1 ZINC000238127587 474537009 /nfs/dbraw/zinc/53/70/09/474537009.db2.gz NSPNANDMAVVEML-UHFFFAOYSA-N 0 3 345.424 2.939 20 5 EFBDHN COc1ccc([C@H](O)CN[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000284018919 474550656 /nfs/dbraw/zinc/55/06/56/474550656.db2.gz IRNDSBIDWOHZHV-APPDUMDISA-N 0 3 331.372 2.570 20 5 EFBDHN COc1ccc([C@H](O)CN[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000284018925 474551083 /nfs/dbraw/zinc/55/10/83/474551083.db2.gz IRNDSBIDWOHZHV-PIGZYNQJSA-N 0 3 331.372 2.570 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CCCN1CC ZINC000184653901 474575357 /nfs/dbraw/zinc/57/53/57/474575357.db2.gz SLBGTQHAOHJDMF-RDJZCZTQSA-N 0 3 333.432 2.764 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCN(CC)C1CC1 ZINC000184755142 474601267 /nfs/dbraw/zinc/60/12/67/474601267.db2.gz VCOOFXQIDPBNAF-OAHLLOKOSA-N 0 3 333.432 2.764 20 5 EFBDHN Cc1cc(N(C)CCN(C)C2CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000184784503 474608097 /nfs/dbraw/zinc/60/80/97/474608097.db2.gz NKDLHQBMGBHOCU-UHFFFAOYSA-N 0 3 341.415 2.891 20 5 EFBDHN CC(C)C[C@]1(CO)CCCN1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000284282669 474610651 /nfs/dbraw/zinc/61/06/51/474610651.db2.gz YDIJUZKKOQIOPK-INIZCTEOSA-N 0 3 337.376 2.876 20 5 EFBDHN C[C@@H]1CCCN(CCNc2ccc([N+](=O)[O-])cc2N2CCOC2=O)C1 ZINC000267185903 474612098 /nfs/dbraw/zinc/61/20/98/474612098.db2.gz GKTOMICTWCQPEH-CYBMUJFWSA-N 0 3 348.403 2.695 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1Nc1c([N+](=O)[O-])ncn1C ZINC000267189700 474612851 /nfs/dbraw/zinc/61/28/51/474612851.db2.gz HCFGOLOOOUCEKC-HIFRSBDPSA-N 0 3 329.404 2.651 20 5 EFBDHN CS[C@H]1CN(c2c3c(ccc2[N+](=O)[O-])NCC3)C[C@@H]1N1CCCC1 ZINC000278348549 474616964 /nfs/dbraw/zinc/61/69/64/474616964.db2.gz JKYVTZDWPZBIJC-HOTGVXAUSA-N 0 3 348.472 2.579 20 5 EFBDHN CS[C@@H]1CN(c2c3c(ccc2[N+](=O)[O-])NCC3)C[C@H]1N1CCCC1 ZINC000278348552 474617388 /nfs/dbraw/zinc/61/73/88/474617388.db2.gz JKYVTZDWPZBIJC-HZPDHXFCSA-N 0 3 348.472 2.579 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1C[C@H](C)N(C2CC2)C1 ZINC000184846183 474618891 /nfs/dbraw/zinc/61/88/91/474618891.db2.gz BSTKBIWUBHPLFN-BPUTZDHNSA-N 0 3 345.443 2.905 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N[C@@H](C)C2=CCN(C)CC2)cc1[N+](=O)[O-] ZINC000272885034 474633980 /nfs/dbraw/zinc/63/39/80/474633980.db2.gz YMCQDPKVXMBLKQ-KBPBESRZSA-N 0 3 346.431 2.914 20 5 EFBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCCN1CCCOCC1 ZINC000291668921 474644790 /nfs/dbraw/zinc/64/47/90/474644790.db2.gz WDFDFSGITKNSPR-UHFFFAOYSA-N 0 3 348.230 2.714 20 5 EFBDHN CCOc1ccc([C@@H](C)NCC2(O)CC(OCC)C2)cc1[N+](=O)[O-] ZINC000278439876 474645057 /nfs/dbraw/zinc/64/50/57/474645057.db2.gz KGDDCBJUIYLYQX-RFSCMCKOSA-N 0 3 338.404 2.574 20 5 EFBDHN C[C@H](Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)C1=CCN(C)CC1 ZINC000272940533 474646349 /nfs/dbraw/zinc/64/63/49/474646349.db2.gz LWBAVBZUQMZXOT-NSHDSACASA-N 0 3 330.388 2.542 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000272949551 474648965 /nfs/dbraw/zinc/64/89/65/474648965.db2.gz MQGAMUDOHIOUDG-AWEZNQCLSA-N 0 3 331.416 2.900 20 5 EFBDHN CCN1CCC[C@H]1CNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-] ZINC000291747348 474667064 /nfs/dbraw/zinc/66/70/64/474667064.db2.gz NOPSUOMKCQDEDH-AWEZNQCLSA-N 0 3 334.420 2.629 20 5 EFBDHN Cc1cc(C2CCN(C[C@@H](O)c3cccc([N+](=O)[O-])c3)CC2)n[nH]1 ZINC000273019527 474674126 /nfs/dbraw/zinc/67/41/26/474674126.db2.gz RWFUMKIYLZWFBK-QGZVFWFLSA-N 0 3 330.388 2.539 20 5 EFBDHN Cc1cc(C2CCN(C[C@@H](O)c3cccc([N+](=O)[O-])c3)CC2)[nH]n1 ZINC000273019527 474674134 /nfs/dbraw/zinc/67/41/34/474674134.db2.gz RWFUMKIYLZWFBK-QGZVFWFLSA-N 0 3 330.388 2.539 20 5 EFBDHN CCN1CCC(NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000292853249 474677127 /nfs/dbraw/zinc/67/71/27/474677127.db2.gz SKHYBPQHSOVPEN-UHFFFAOYSA-N 0 3 345.321 2.828 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC1(c2ccccc2)CC1 ZINC000273094467 474711609 /nfs/dbraw/zinc/71/16/09/474711609.db2.gz CXYNIZBZPZVKMK-HNNXBMFYSA-N 0 3 328.368 2.613 20 5 EFBDHN COc1ccc(OCCN2CCC[C@@H]2[C@H]2CCCO2)c([N+](=O)[O-])c1 ZINC000284663328 474713012 /nfs/dbraw/zinc/71/30/12/474713012.db2.gz GOHMJIIVAACFBR-GDBMZVCRSA-N 0 3 336.388 2.626 20 5 EFBDHN COc1cc(C(=O)NC[C@@H](C)N2CCC[C@@H](C)C2)cc([N+](=O)[O-])c1C ZINC000253282448 474719601 /nfs/dbraw/zinc/71/96/01/474719601.db2.gz ZLCYDHMTHXIKDR-CHWSQXEVSA-N 0 3 349.431 2.762 20 5 EFBDHN CCOC1CC(O)(CN[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000278594623 474725621 /nfs/dbraw/zinc/72/56/21/474725621.db2.gz AHPRQNUJDWIZJJ-CRPOECCBSA-N 0 3 334.416 2.837 20 5 EFBDHN CN1CCC[C@@H]1CNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000273173702 474759557 /nfs/dbraw/zinc/75/95/57/474759557.db2.gz ICZBTIFNEASNMX-LLVKDONJSA-N 0 3 343.836 2.551 20 5 EFBDHN CC(C)(O)[C@H]1CCCN1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000305753029 474766775 /nfs/dbraw/zinc/76/67/75/474766775.db2.gz UCSVPGBWABWFTQ-OAHLLOKOSA-N 0 3 331.372 2.985 20 5 EFBDHN CN(C)C[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000291977284 474783104 /nfs/dbraw/zinc/78/31/04/474783104.db2.gz WQSXDXRCWNMIKH-QGZVFWFLSA-N 0 3 345.374 2.696 20 5 EFBDHN CC(C)n1nccc1[C@H]1OCC[C@@H]1NCc1ccc([N+](=O)[O-])cc1 ZINC000284821043 474785518 /nfs/dbraw/zinc/78/55/18/474785518.db2.gz UVIZLXMZRXUXPZ-RDJZCZTQSA-N 0 3 330.388 2.992 20 5 EFBDHN O=[N+]([O-])c1ccc(N2C[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)nc1 ZINC000311234511 474835721 /nfs/dbraw/zinc/83/57/21/474835721.db2.gz SLBCGGJUCLRICT-DLBZAZTESA-N 0 3 338.411 2.948 20 5 EFBDHN O=[N+]([O-])c1ccc(N2C[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)nc1 ZINC000311234514 474837036 /nfs/dbraw/zinc/83/70/36/474837036.db2.gz SLBCGGJUCLRICT-SJORKVTESA-N 0 3 338.411 2.948 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)N2CC[C@]3(CCN(C)C3)C2)cc1[N+](=O)[O-] ZINC000293153082 474842206 /nfs/dbraw/zinc/84/22/06/474842206.db2.gz BYKYGPCIKGKSDR-KDOFPFPSSA-N 0 3 346.431 2.701 20 5 EFBDHN COCC[C@@H](NCCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccco1 ZINC000273331550 474846307 /nfs/dbraw/zinc/84/63/07/474846307.db2.gz ZLBGUFTYUWDUPH-CQSZACIVSA-N 0 3 347.371 2.884 20 5 EFBDHN C[C@@H](N[C@H]1CCN(c2ccccn2)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000284977873 474850459 /nfs/dbraw/zinc/85/04/59/474850459.db2.gz GAHZFDGZMVKSMJ-OCCSQVGLSA-N 0 3 327.388 2.502 20 5 EFBDHN O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000339027304 474851203 /nfs/dbraw/zinc/85/12/03/474851203.db2.gz LSAJFCKWXJYECR-MRXNPFEDSA-N 0 3 340.383 2.991 20 5 EFBDHN O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000339027302 474851352 /nfs/dbraw/zinc/85/13/52/474851352.db2.gz LSAJFCKWXJYECR-INIZCTEOSA-N 0 3 340.383 2.991 20 5 EFBDHN C[C@@H](NCCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)c1cnn(C)c1 ZINC000273363964 474860598 /nfs/dbraw/zinc/86/05/98/474860598.db2.gz JVNHJPCSLXLDCU-GFCCVEGCSA-N 0 3 341.371 2.877 20 5 EFBDHN Cc1c(C(=O)N(CCN(C)C)Cc2ccccn2)cccc1[N+](=O)[O-] ZINC000337295195 474869220 /nfs/dbraw/zinc/86/92/20/474869220.db2.gz PVTRGTNPSUDTEX-UHFFFAOYSA-N 0 3 342.399 2.502 20 5 EFBDHN C[C@@H](C1CCN(C)CC1)N(C)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000273383581 474872187 /nfs/dbraw/zinc/87/21/87/474872187.db2.gz ISUSMLWTRIBCHV-AWEZNQCLSA-N 0 3 348.447 2.509 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1CN(C)C[C@H]1CCCN1c1cccnn1 ZINC000273409269 474883317 /nfs/dbraw/zinc/88/33/17/474883317.db2.gz HNZXJWBZFPKISR-QGZVFWFLSA-N 0 3 341.415 2.794 20 5 EFBDHN C[C@H](NC[C@@](C)(O)c1ccc(F)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000285078972 474885008 /nfs/dbraw/zinc/88/50/08/474885008.db2.gz JMAJBWLIJRSYKE-APPDUMDISA-N 0 3 333.363 2.874 20 5 EFBDHN CCOC(=O)c1cc(N2CC[C@H](N3CCCCC3)C2)ccc1[N+](=O)[O-] ZINC000268250591 474887396 /nfs/dbraw/zinc/88/73/96/474887396.db2.gz ZGKAHNLIKMAFGT-HNNXBMFYSA-N 0 3 347.415 2.836 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(NCc2ccncc2OCCN(C)C)n1 ZINC000341066299 474936807 /nfs/dbraw/zinc/93/68/07/474936807.db2.gz HIYDKTRTSQXJIB-UHFFFAOYSA-N 0 3 345.403 2.554 20 5 EFBDHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000337393888 474972471 /nfs/dbraw/zinc/97/24/71/474972471.db2.gz DWGTWXOAAGBTJM-UHFFFAOYSA-N 0 3 343.387 2.586 20 5 EFBDHN Cc1ccc([C@@H](CNc2ncc([N+](=O)[O-])cn2)N2CCCC2)cc1 ZINC000273617127 474992611 /nfs/dbraw/zinc/99/26/11/474992611.db2.gz NSBBKYSLMFLMKH-MRXNPFEDSA-N 0 3 327.388 2.942 20 5 EFBDHN O=C(N[C@H]1CCN(C2CCCC2)C1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000609310259 480142630 /nfs/dbraw/zinc/14/26/30/480142630.db2.gz YKRGSUJICHPUDJ-ZDUSSCGKSA-N 0 3 342.399 2.823 20 5 EFBDHN Cc1c(CNC(=O)[C@@H](C)[C@H](N)c2ccccc2)cccc1[N+](=O)[O-] ZINC000261626397 475001131 /nfs/dbraw/zinc/00/11/31/475001131.db2.gz GUHVAVIFGKVRRL-GUYCJALGSA-N 0 3 327.384 2.856 20 5 EFBDHN CCN1CCN(c2ccc(Nc3ncc([N+](=O)[O-])cn3)c(C)c2)CC1 ZINC000273673679 475006566 /nfs/dbraw/zinc/00/65/66/475006566.db2.gz YCIHMPOJNOGBSZ-UHFFFAOYSA-N 0 3 342.403 2.579 20 5 EFBDHN CCOc1cc(N2CCN([C@@H](C)CCOC)CC2)ccc1[N+](=O)[O-] ZINC000280137573 475011602 /nfs/dbraw/zinc/01/16/02/475011602.db2.gz BQQBEZRWPQGILO-AWEZNQCLSA-N 0 3 337.420 2.541 20 5 EFBDHN Cc1c(CN[C@H](C)c2cccc(-n3cnnn3)c2)cccc1[N+](=O)[O-] ZINC000327885312 475025260 /nfs/dbraw/zinc/02/52/60/475025260.db2.gz UJJVRHJRPNWONA-CYBMUJFWSA-N 0 3 338.371 2.730 20 5 EFBDHN C[C@@H]1C[C@@H](c2ccccc2)N(CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000285749790 475038184 /nfs/dbraw/zinc/03/81/84/475038184.db2.gz QUWBBHUFLQGEBJ-PBHICJAKSA-N 0 3 327.384 2.840 20 5 EFBDHN CCOc1cc(CN2C[C@H](C)[C@](C)(C(=O)OC)C2)ccc1[N+](=O)[O-] ZINC000337479061 475055201 /nfs/dbraw/zinc/05/52/01/475055201.db2.gz ZTBJPMMFHANZKA-YVEFUNNKSA-N 0 3 336.388 2.625 20 5 EFBDHN Cc1ccc(C(=O)N2CCN(C3CCC3)C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000292506066 475062049 /nfs/dbraw/zinc/06/20/49/475062049.db2.gz XSQJOZIVMNHXSB-CYBMUJFWSA-N 0 3 331.416 2.850 20 5 EFBDHN Cc1ccc([C@@H](O)CN[C@@H](C)CC(=O)Nc2cccc([N+](=O)[O-])c2)o1 ZINC000269003465 475122234 /nfs/dbraw/zinc/12/22/34/475122234.db2.gz PURIXINPNRWBQL-NHYWBVRUSA-N 0 3 347.371 2.537 20 5 EFBDHN CCCCN1CCCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000337559857 475126644 /nfs/dbraw/zinc/12/66/44/475126644.db2.gz ZRTQFYAXXCNGJD-OAHLLOKOSA-N 0 3 349.431 2.988 20 5 EFBDHN CCc1ccc([C@H](CNC(=O)c2ccc([N+](=O)[O-])n2C)N(C)C)cc1 ZINC000345364112 475128514 /nfs/dbraw/zinc/12/85/14/475128514.db2.gz YNIIQIXJAABPLG-INIZCTEOSA-N 0 3 344.415 2.528 20 5 EFBDHN CS(=O)(=O)C1(CN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CCC1 ZINC000281236524 475128458 /nfs/dbraw/zinc/12/84/58/475128458.db2.gz VAOJZOHUQREJLC-OAHLLOKOSA-N 0 3 338.429 2.529 20 5 EFBDHN CSc1ccc([C@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]2)N(C)C)cc1 ZINC000341569659 475154147 /nfs/dbraw/zinc/15/41/47/475154147.db2.gz XDGDWFXYXQRIQA-HNNXBMFYSA-N 0 3 348.428 2.678 20 5 EFBDHN CCN(CCn1cc([N+](=O)[O-])ccc1=O)Cc1ccc(Cl)cc1 ZINC000341584893 475165871 /nfs/dbraw/zinc/16/58/71/475165871.db2.gz MKFZGUSKHGTBGE-UHFFFAOYSA-N 0 3 335.791 2.932 20 5 EFBDHN CCN(CCN1CCCCCC1)C(=O)c1cccc(OC)c1[N+](=O)[O-] ZINC000345452775 475200874 /nfs/dbraw/zinc/20/08/74/475200874.db2.gz DDEMQUNNRYYTIT-UHFFFAOYSA-N 0 3 349.431 2.942 20 5 EFBDHN COc1cc([C@@H](C)NCCn2cc([N+](=O)[O-])cn2)ccc1OC(C)C ZINC000341653851 475207255 /nfs/dbraw/zinc/20/72/55/475207255.db2.gz FGXFIKGJXXRHPA-CYBMUJFWSA-N 0 3 348.403 2.938 20 5 EFBDHN CC(C)O[C@H]1C[C@H](NCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1(C)C ZINC000296183196 475217756 /nfs/dbraw/zinc/21/77/56/475217756.db2.gz LKBUZVDRKCJOKN-HOTGVXAUSA-N 0 3 349.431 2.739 20 5 EFBDHN COc1ccc(OCCN2CC[C@H](OC)C(C)(C)C2)c([N+](=O)[O-])c1 ZINC000296279341 475250916 /nfs/dbraw/zinc/25/09/16/475250916.db2.gz YZHXLMNMVIEHDP-INIZCTEOSA-N 0 3 338.404 2.729 20 5 EFBDHN CCOc1ccc(C(=O)N[C@H](C)CN2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000347367077 475270590 /nfs/dbraw/zinc/27/05/90/475270590.db2.gz FEOFPUIWRHJYDZ-ZIAGYGMSSA-N 0 3 349.431 2.844 20 5 EFBDHN CC(=O)NCC1CCN(C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC1 ZINC000347370364 475272827 /nfs/dbraw/zinc/27/28/27/475272827.db2.gz VFHIHEPEBGTSNS-UVTDQMKNSA-N 0 3 331.416 2.846 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC[C@H](CCC(N)=O)C1 ZINC000347371715 475273069 /nfs/dbraw/zinc/27/30/69/475273069.db2.gz VSXVOPUKJWFXBX-BAAYTWLHSA-N 0 3 331.416 2.976 20 5 EFBDHN CC[C@@H]1CCCCN1CCNC(=O)c1cccc([N+](=O)[O-])c1NC ZINC000361214313 475275025 /nfs/dbraw/zinc/27/50/25/475275025.db2.gz VYVCYRCQIOJNRJ-CYBMUJFWSA-N 0 3 334.420 2.631 20 5 EFBDHN CC[C@H]1CCCCN1CCNC(=O)c1cccc([N+](=O)[O-])c1NC ZINC000361214514 475276219 /nfs/dbraw/zinc/27/62/19/475276219.db2.gz VYVCYRCQIOJNRJ-ZDUSSCGKSA-N 0 3 334.420 2.631 20 5 EFBDHN COCCN(C)CC[C@@H](Nc1ncc([N+](=O)[O-])cn1)c1ccccc1 ZINC000354608465 475287596 /nfs/dbraw/zinc/28/75/96/475287596.db2.gz RWTLAPXNEMLGRJ-MRXNPFEDSA-N 0 3 345.403 2.506 20 5 EFBDHN CC(C)C[C@@H]1CCCN1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000354684966 475336385 /nfs/dbraw/zinc/33/63/85/475336385.db2.gz NXPHAELGQDTUIQ-HNNXBMFYSA-N 0 3 331.416 2.994 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN[C@@H]1CC(=O)N2CCCC[C@H]12 ZINC000337848350 475374091 /nfs/dbraw/zinc/37/40/91/475374091.db2.gz ILCVTXSAYJSAAK-ZOHQOTHLSA-N 0 3 329.400 2.741 20 5 EFBDHN COCC[C@@H](N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)C(C)(C)C ZINC000337853049 475378369 /nfs/dbraw/zinc/37/83/69/475378369.db2.gz KBEUZJIXWLFQAJ-SWLSCSKDSA-N 0 3 337.420 2.963 20 5 EFBDHN C[C@H](NC(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000296590063 475385629 /nfs/dbraw/zinc/38/56/29/475385629.db2.gz WZBMFWCTCNKYEH-SGMGOOAPSA-N 0 3 332.404 2.580 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)CCN1C ZINC000358094060 475395283 /nfs/dbraw/zinc/39/52/83/475395283.db2.gz MVYTYFPOESNGMY-NWDGAFQWSA-N 0 3 337.395 2.610 20 5 EFBDHN Cc1c(CN2CCC[C@H](C(=O)N3CCCC3)C2)cccc1[N+](=O)[O-] ZINC000331732747 475396818 /nfs/dbraw/zinc/39/68/18/475396818.db2.gz QWABGQYASPICOB-INIZCTEOSA-N 0 3 331.416 2.738 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H](C(=O)N2CCCC2)C1 ZINC000331737978 475399435 /nfs/dbraw/zinc/39/94/35/475399435.db2.gz USPGGZRYWCIJFG-HUUCEWRRSA-N 0 3 331.416 2.990 20 5 EFBDHN CN(C)CCO[C@@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000339677566 475401969 /nfs/dbraw/zinc/40/19/69/475401969.db2.gz OGOGTQHWYZGTGC-GFCCVEGCSA-N 0 3 347.337 2.771 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H](C)N1CCCC[C@@H]1C ZINC000348116481 475403178 /nfs/dbraw/zinc/40/31/78/475403178.db2.gz JZWIFBNEQXWELS-UONOGXRCSA-N 0 3 349.431 2.986 20 5 EFBDHN COCCN1CC[C@H](Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000339689014 475411863 /nfs/dbraw/zinc/41/18/63/475411863.db2.gz YVWAVPPVRBWEHM-NSHDSACASA-N 0 3 333.310 2.746 20 5 EFBDHN COCCN1CC[C@@H](Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000339689013 475412792 /nfs/dbraw/zinc/41/27/92/475412792.db2.gz YVWAVPPVRBWEHM-LLVKDONJSA-N 0 3 333.310 2.746 20 5 EFBDHN C[C@@H]1[C@@H](NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)CCCN1C ZINC000345750742 475419074 /nfs/dbraw/zinc/41/90/74/475419074.db2.gz OHPWTCQFYNTGEB-DYVFJYSZSA-N 0 3 346.431 2.752 20 5 EFBDHN C[C@H]1[C@@H](NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)CCCN1C ZINC000345750743 475419536 /nfs/dbraw/zinc/41/95/36/475419536.db2.gz OHPWTCQFYNTGEB-GUYCJALGSA-N 0 3 346.431 2.752 20 5 EFBDHN C[C@H](NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCCOC1 ZINC000348146036 475425435 /nfs/dbraw/zinc/42/54/35/475425435.db2.gz MOKGWKFFAUAKCJ-WDEREUQCSA-N 0 3 341.795 2.591 20 5 EFBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCCN(C)[C@@H]1C ZINC000345778188 475443306 /nfs/dbraw/zinc/44/33/06/475443306.db2.gz LEOMHAFAWVTKMK-PBHICJAKSA-N 0 3 348.447 2.998 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@@H](C(C)C)C1(CO)CCC1 ZINC000339732187 475452038 /nfs/dbraw/zinc/45/20/38/475452038.db2.gz ZDQRKUVTAOQLKF-KRWDZBQOSA-N 0 3 349.431 2.619 20 5 EFBDHN Cc1cc(Cl)c(C(=O)N2CC[C@@H]3CCN(C)C[C@H]32)cc1[N+](=O)[O-] ZINC000296791809 475479860 /nfs/dbraw/zinc/47/98/60/475479860.db2.gz OFKHLBYHGIZMLG-XHDPSFHLSA-N 0 3 337.807 2.723 20 5 EFBDHN CNC(=O)[C@H]1CCC[C@@H]1NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000345824527 475484875 /nfs/dbraw/zinc/48/48/75/475484875.db2.gz WZUBHVANKLAKAK-HOTGVXAUSA-N 0 3 343.383 2.859 20 5 EFBDHN CNC(=O)[C@H]1CCC[C@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000345834995 475491769 /nfs/dbraw/zinc/49/17/69/475491769.db2.gz BZCDSUAGZMJYTF-JKSUJKDBSA-N 0 3 343.383 2.859 20 5 EFBDHN COc1cc(C(=O)NC[C@@H](C)N2CCCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000337999763 475495853 /nfs/dbraw/zinc/49/58/53/475495853.db2.gz LDKKEASVESTYGB-QWHCGFSZSA-N 0 3 335.404 2.596 20 5 EFBDHN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](C)N(C)C ZINC000342002133 475496228 /nfs/dbraw/zinc/49/62/28/475496228.db2.gz DQQYTWCHNSZCOW-LLVKDONJSA-N 0 3 325.434 2.775 20 5 EFBDHN Cc1cc(F)c(NC(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000296926868 475537985 /nfs/dbraw/zinc/53/79/85/475537985.db2.gz ZNHDSRREFHZXSQ-FZMZJTMJSA-N 0 3 338.383 2.893 20 5 EFBDHN CC(C)[C@@H](CN(C)Cc1ccccc1)NCc1c([N+](=O)[O-])ncn1C ZINC000348306069 475579792 /nfs/dbraw/zinc/57/97/92/475579792.db2.gz WWSZLQMLWYTRGB-MRXNPFEDSA-N 0 3 345.447 2.575 20 5 EFBDHN CC(C)(NC[C@@H](O)COc1cccc([N+](=O)[O-])c1)c1cccs1 ZINC000348310759 475583705 /nfs/dbraw/zinc/58/37/05/475583705.db2.gz RFCDVERARWNLBG-CYBMUJFWSA-N 0 3 336.413 2.921 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@H](CO)CCSC)cc1[N+](=O)[O-] ZINC000358315897 475585776 /nfs/dbraw/zinc/58/57/76/475585776.db2.gz HRLKMCXILWDAEH-AAEUAGOBSA-N 0 3 328.434 2.758 20 5 EFBDHN C[C@@H](C(=O)N1CCC[C@@H](N2CCCC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000332388304 475623674 /nfs/dbraw/zinc/62/36/74/475623674.db2.gz CHFYQECYEHQJQS-UKRRQHHQSA-N 0 3 349.406 2.924 20 5 EFBDHN O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CCCN(C2CCCC2)CC1 ZINC000358389504 475640898 /nfs/dbraw/zinc/64/08/98/475640898.db2.gz FMJKFUCQIYNOLB-UHFFFAOYSA-N 0 3 349.406 2.753 20 5 EFBDHN CC(C)N1CCCN(C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)CC1 ZINC000342890340 475651041 /nfs/dbraw/zinc/65/10/41/475651041.db2.gz WUBUHVKZENMSJC-UHFFFAOYSA-N 0 3 330.388 2.632 20 5 EFBDHN CC[C@@H]1CN2CCC[C@H]2CN1C(=O)CSc1ccccc1[N+](=O)[O-] ZINC000332577172 475674119 /nfs/dbraw/zinc/67/41/19/475674119.db2.gz GKLSCFCFYHOIFJ-KGLIPLIRSA-N 0 3 349.456 2.772 20 5 EFBDHN CO[C@@H]1CCCC[C@@H]1N[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000361755442 475724534 /nfs/dbraw/zinc/72/45/34/475724534.db2.gz QRWWSEWGNJIFPX-IVMMDQJWSA-N 0 3 335.404 2.777 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@H]1CCC[C@H]1OC(F)F ZINC000348535224 475734588 /nfs/dbraw/zinc/73/45/88/475734588.db2.gz QMBIAGUGJAMPAR-WCQYABFASA-N 0 3 343.330 2.592 20 5 EFBDHN COCCCN(C)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000338274825 475734877 /nfs/dbraw/zinc/73/48/77/475734877.db2.gz IFJQGROIWSQDKG-UHFFFAOYSA-N 0 3 335.326 2.994 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@H]1CCC[C@@H]1OC(F)F ZINC000348535222 475735809 /nfs/dbraw/zinc/73/58/09/475735809.db2.gz QMBIAGUGJAMPAR-AAEUAGOBSA-N 0 3 343.330 2.592 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN[C@@H]3CCC[C@@H]3OC(F)F)nc2c1 ZINC000348540237 475740142 /nfs/dbraw/zinc/74/01/42/475740142.db2.gz UYPDZYIIVKNBCV-PWSUYJOCSA-N 0 3 326.303 2.721 20 5 EFBDHN O=[N+]([O-])c1ccc(CNC[C@@]2(CO)C[C@@H]2c2ccccc2)c(F)c1 ZINC000353191904 475758923 /nfs/dbraw/zinc/75/89/23/475758923.db2.gz LAFOVIZMUDXOIF-SJLPKXTDSA-N 0 3 330.359 2.990 20 5 EFBDHN Cc1[nH]nc2ncc(CN(C)CCc3ccccc3[N+](=O)[O-])cc12 ZINC000348669693 475809110 /nfs/dbraw/zinc/80/91/10/475809110.db2.gz HHYQBXRMAGACQY-UHFFFAOYSA-N 0 3 325.372 2.849 20 5 EFBDHN Cc1nc(N(C)[C@@H]2CCCN(Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000297618532 475830366 /nfs/dbraw/zinc/83/03/66/475830366.db2.gz WGWJIBKAQCGXEV-MRXNPFEDSA-N 0 3 341.415 2.794 20 5 EFBDHN O=[N+]([O-])c1ccc(CCN[C@H](c2cccs2)c2nnc[nH]2)cc1 ZINC000340227718 475870251 /nfs/dbraw/zinc/87/02/51/475870251.db2.gz BELFSQHPMVDICG-CQSZACIVSA-N 0 3 329.385 2.696 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](C)N2CCCC[C@@H]2C)c1 ZINC000338408865 475876490 /nfs/dbraw/zinc/87/64/90/475876490.db2.gz KPDBSNVIPVVBPK-UONOGXRCSA-N 0 3 349.431 2.986 20 5 EFBDHN CC[C@@H]1CN(Cc2ccc(C(C)C)c([N+](=O)[O-])c2)CCN1C[C@H](C)O ZINC000353362667 475903251 /nfs/dbraw/zinc/90/32/51/475903251.db2.gz FTKWXLJMYMYQKX-DOTOQJQBSA-N 0 3 349.475 2.995 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCN(C)[C@H](C)C1 ZINC000343286303 475921305 /nfs/dbraw/zinc/92/13/05/475921305.db2.gz XTXKCHNLZKQBRS-NEPJUHHUSA-N 0 3 337.445 2.919 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@@H](C)C2CCN(C)CC2)c1 ZINC000338468534 475934777 /nfs/dbraw/zinc/93/47/77/475934777.db2.gz DHVZKWPANOAGPQ-ZDUSSCGKSA-N 0 3 349.431 2.796 20 5 EFBDHN CC(C)N1CCC[C@@H](NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])C1 ZINC000346888715 475939010 /nfs/dbraw/zinc/93/90/10/475939010.db2.gz BRINGLJDXGGSLI-CQSZACIVSA-N 0 3 333.432 2.861 20 5 EFBDHN C[C@@H](CNC(=O)CCNc1ccccc1[N+](=O)[O-])N1CCC(C)CC1 ZINC000343327111 475952818 /nfs/dbraw/zinc/95/28/18/475952818.db2.gz ALFJNOAHEVAAFX-HNNXBMFYSA-N 0 3 348.447 2.633 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCC1=CCN(C)CC1 ZINC000343355843 475980387 /nfs/dbraw/zinc/98/03/87/475980387.db2.gz ZFWKCHNZVHBAKN-UHFFFAOYSA-N 0 3 335.429 2.699 20 5 EFBDHN CCn1ccnc1[C@@H]1OCC[C@H]1NCc1ccc([N+](=O)[O-])cc1C ZINC000343408093 476037333 /nfs/dbraw/zinc/03/73/33/476037333.db2.gz WZTPICBIQLBOBF-HZPDHXFCSA-N 0 3 330.388 2.739 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCN1CCC(c2ccncn2)CC1 ZINC000298353168 476065949 /nfs/dbraw/zinc/06/59/49/476065949.db2.gz MQQJJUCMJZBNQT-UHFFFAOYSA-N 0 3 328.372 2.643 20 5 EFBDHN C[C@H]1[C@H](Nc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CCCN1C ZINC000343451706 476073062 /nfs/dbraw/zinc/07/30/62/476073062.db2.gz GDIJWKNILMVXEB-DZGCQCFKSA-N 0 3 326.400 2.973 20 5 EFBDHN COc1cc(C[NH2+]CCC2CCC(OC)CC2)c([N+](=O)[O-])cc1[O-] ZINC000350177950 476081805 /nfs/dbraw/zinc/08/18/05/476081805.db2.gz XONALSORIYTUPP-UHFFFAOYSA-N 0 3 338.404 2.994 20 5 EFBDHN C[C@H]1[C@@H](Nc2ncc(Br)cc2[N+](=O)[O-])CCCN1C ZINC000343614392 476093149 /nfs/dbraw/zinc/09/31/49/476093149.db2.gz YFEDLUSPTMIOFQ-WPRPVWTQSA-N 0 3 329.198 2.647 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(NCCCCN2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000338679071 476107070 /nfs/dbraw/zinc/10/70/70/476107070.db2.gz VKOOHHCMQAUCKY-OKILXGFUSA-N 0 3 337.420 2.905 20 5 EFBDHN COc1ccc(CN(C)C[C@H](O)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000338728284 476139862 /nfs/dbraw/zinc/13/98/62/476139862.db2.gz OMBOFMLAUMOAET-MRXNPFEDSA-N 0 3 330.384 2.639 20 5 EFBDHN C[C@H]1[C@H](C)N(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CCN1C ZINC000357031882 476174283 /nfs/dbraw/zinc/17/42/83/476174283.db2.gz CTZDTNLJNQNNQG-KBPBESRZSA-N 0 3 344.415 2.817 20 5 EFBDHN CN(CCNC(=O)Nc1cc(F)cc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000347227425 476186542 /nfs/dbraw/zinc/18/65/42/476186542.db2.gz IUDGHKSQAVMNHS-UHFFFAOYSA-N 0 3 346.362 2.987 20 5 EFBDHN Cc1ccccc1[C@H]([C@H](C)NC(=O)c1ccc([N+](=O)[O-])o1)N(C)C ZINC000344270199 476204294 /nfs/dbraw/zinc/20/42/94/476204294.db2.gz MWIHFZIUFASCKB-LRDDRELGSA-N 0 3 331.372 2.917 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CNC[C@@H]2CC[C@H](CO)O2)s1 ZINC000353718750 476215556 /nfs/dbraw/zinc/21/55/56/476215556.db2.gz ZNTGIGYHHQFBBE-QWHCGFSZSA-N 0 3 348.424 2.953 20 5 EFBDHN CC[C@H](NC(=O)N[C@H]1CCCN(C)[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000344285396 476217067 /nfs/dbraw/zinc/21/70/67/476217067.db2.gz KKYDUDWDQBFGCO-RCBQFDQVSA-N 0 3 334.420 2.828 20 5 EFBDHN O=[N+]([O-])c1cccc(N2CCN(CCCc3ccncc3)CC2)c1 ZINC000347300856 476241867 /nfs/dbraw/zinc/24/18/67/476241867.db2.gz RMXCSAOYGWUXPW-UHFFFAOYSA-N 0 3 326.400 2.745 20 5 EFBDHN COc1ccc(-c2ccc(CNC[C@H](O)C(C)C)o2)c([N+](=O)[O-])c1 ZINC000304210701 476269418 /nfs/dbraw/zinc/26/94/18/476269418.db2.gz DRJODPSHTBXCTJ-INIZCTEOSA-N 0 3 334.372 2.970 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCN1CCC[C@H](Cc2ccccc2)C1 ZINC000362467419 476269526 /nfs/dbraw/zinc/26/95/26/476269526.db2.gz GHMXXPQERAPYDW-QGZVFWFLSA-N 0 3 341.411 2.711 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@H]2CCc3c[nH]nc3C2)cc1[N+](=O)[O-] ZINC000360059898 476288369 /nfs/dbraw/zinc/28/83/69/476288369.db2.gz RALJXCUOBPWOPO-FZMZJTMJSA-N 0 3 330.388 2.925 20 5 EFBDHN CN(C)CCN(C(=O)CCNc1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000353846026 476299244 /nfs/dbraw/zinc/29/92/44/476299244.db2.gz PLMUFSAPEQPOQW-UHFFFAOYSA-N 0 3 348.447 2.730 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)C1CCN(C)CC1 ZINC000360580243 476308072 /nfs/dbraw/zinc/30/80/72/476308072.db2.gz FQROBEIBUQOSBX-HNNXBMFYSA-N 0 3 333.432 2.716 20 5 EFBDHN CN(Cc1ccccc1)[C@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]1)C1CC1 ZINC000357306623 476324443 /nfs/dbraw/zinc/32/44/43/476324443.db2.gz NWZDPHKQLSPRLI-QGZVFWFLSA-N 0 3 342.399 2.563 20 5 EFBDHN O=C(N[C@@H]1CCN(C2CCCC2)C1)c1ccc([N+](=O)[O-])cc1Cl ZINC000363389447 476359393 /nfs/dbraw/zinc/35/93/93/476359393.db2.gz COXZNBLGDHARIR-LLVKDONJSA-N 0 3 337.807 2.995 20 5 EFBDHN Cc1ccc(CN2CC[C@@]3(C2)c2ccccc2NC3=O)cc1[N+](=O)[O-] ZINC000373535055 476413282 /nfs/dbraw/zinc/41/32/82/476413282.db2.gz QBSGCGBAXCFAFH-LJQANCHMSA-N 0 3 337.379 2.999 20 5 EFBDHN O=C1CCCCN1[C@H]1CCCN(CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000377660844 476505561 /nfs/dbraw/zinc/50/55/61/476505561.db2.gz AELYJWMONLSOQL-KRWDZBQOSA-N 0 3 331.416 2.614 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NC2CC(N3CCCCC3)C2)c1 ZINC000374770451 476521928 /nfs/dbraw/zinc/52/19/28/476521928.db2.gz XJKVFRMVVQESBD-UHFFFAOYSA-N 0 3 347.415 2.740 20 5 EFBDHN CO[C@H](CN1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccccc1 ZINC000374781270 476526001 /nfs/dbraw/zinc/52/60/01/476526001.db2.gz UVSVKSFUMWEKOT-MRXNPFEDSA-N 0 3 330.388 2.816 20 5 EFBDHN O=C1CC[C@H](N[C@H]2CCCc3ccc([N+](=O)[O-])cc32)C2(CCC2)N1 ZINC000374808883 476537957 /nfs/dbraw/zinc/53/79/57/476537957.db2.gz OJJVLKBOUMERQX-HOTGVXAUSA-N 0 3 329.400 2.763 20 5 EFBDHN O=C1CCCN1C[C@@H]1CCCCN1CCc1ccc([N+](=O)[O-])cc1 ZINC000363081271 476552524 /nfs/dbraw/zinc/55/25/24/476552524.db2.gz HPOFRPQJTSNTSI-KRWDZBQOSA-N 0 3 331.416 2.614 20 5 EFBDHN O=[N+]([O-])c1ccccc1CNc1cccc(CN2CC[C@H](O)C2)c1 ZINC000361043850 476562448 /nfs/dbraw/zinc/56/24/48/476562448.db2.gz IOYIMPZPVUYWGM-KRWDZBQOSA-N 0 3 327.384 2.774 20 5 EFBDHN C[C@@H]1CCC[C@H](C)N(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000357735607 476567268 /nfs/dbraw/zinc/56/72/68/476567268.db2.gz YLXOMFAKZVJPOU-KGLIPLIRSA-N 0 3 331.416 2.994 20 5 EFBDHN C[C@H]1CCC[C@H](C)N(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000357737928 476568697 /nfs/dbraw/zinc/56/86/97/476568697.db2.gz GCJZBWIWWSUBIM-KBPBESRZSA-N 0 3 331.416 2.994 20 5 EFBDHN O=[N+]([O-])c1cccc(CNc2cccc(CN3CC[C@@H](O)C3)c2)c1 ZINC000361054525 476569207 /nfs/dbraw/zinc/56/92/07/476569207.db2.gz UIIAOACGKHVBGE-GOSISDBHSA-N 0 3 327.384 2.774 20 5 EFBDHN CCCN(CC)C[C@H](C)Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000357774415 476593328 /nfs/dbraw/zinc/59/33/28/476593328.db2.gz KPNZLFHAQRMHGM-LBPRGKRZSA-N 0 3 343.449 2.531 20 5 EFBDHN CNc1c(C(=O)NC[C@@H](c2ccccc2)N(C)C)cccc1[N+](=O)[O-] ZINC000361118703 476613525 /nfs/dbraw/zinc/61/35/25/476613525.db2.gz WPRHVCVUHVVLIB-INIZCTEOSA-N 0 3 342.399 2.669 20 5 EFBDHN CNc1c(C(=O)NC[C@H](C)N2CCCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000361144938 476633942 /nfs/dbraw/zinc/63/39/42/476633942.db2.gz MJLBFHSCHVJBPX-OLZOCXBDSA-N 0 3 334.420 2.629 20 5 EFBDHN C[C@H]1[C@@H](NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)CCCN1C ZINC000357853603 476649492 /nfs/dbraw/zinc/64/94/92/476649492.db2.gz ZNDBFTKGZPXOSM-NHYWBVRUSA-N 0 3 337.395 2.610 20 5 EFBDHN Cn1ccnc1[C@@H]1CCCN(CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000365620643 476650156 /nfs/dbraw/zinc/65/01/56/476650156.db2.gz CULPFLBTAXELHS-CQSZACIVSA-N 0 3 330.388 2.587 20 5 EFBDHN Cn1ccnc1[C@H]1CCCN(CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000365658232 476665448 /nfs/dbraw/zinc/66/54/48/476665448.db2.gz DOFSGHFVIRWBMO-AWEZNQCLSA-N 0 3 330.388 2.587 20 5 EFBDHN O=C(Nc1cccc([N+](=O)[O-])c1Cl)N1CC[C@H](N2CCCC2)C1 ZINC000375083634 476672954 /nfs/dbraw/zinc/67/29/54/476672954.db2.gz GTISZPYSCKQUKL-NSHDSACASA-N 0 3 338.795 2.950 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)C[C@@H]1CCCN1C ZINC000421704577 476691013 /nfs/dbraw/zinc/69/10/13/476691013.db2.gz PGZCSAPYUNENHU-OCCSQVGLSA-N 0 3 337.445 2.628 20 5 EFBDHN CN1CCC2(CCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000378350608 476695206 /nfs/dbraw/zinc/69/52/06/476695206.db2.gz SXHWLWVNLUGAOP-BQYQJAHWSA-N 0 3 329.400 2.695 20 5 EFBDHN COc1cc(C(=O)N[C@H]2CCN(C3CCCC3)C2)cc([N+](=O)[O-])c1C ZINC000370229460 476710286 /nfs/dbraw/zinc/71/02/86/476710286.db2.gz BKYNCLZCBWZIPX-AWEZNQCLSA-N 0 3 347.415 2.659 20 5 EFBDHN Cn1cnc([N+](=O)[O-])c1CN1CCN(C(C)(C)CC(C)(C)C)CC1 ZINC000451904306 476713809 /nfs/dbraw/zinc/71/38/09/476713809.db2.gz RIZYULFNXZFQQU-UHFFFAOYSA-N 0 3 337.468 2.661 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc2c(c1)CNCC2 ZINC000422828779 476799246 /nfs/dbraw/zinc/79/92/46/476799246.db2.gz BFKYMKQFMFVHFX-UHFFFAOYSA-N 0 3 341.367 2.892 20 5 EFBDHN Cc1ccccc1OC[C@H](O)CNCc1cccc([N+](=O)[O-])c1C ZINC000392540893 476826328 /nfs/dbraw/zinc/82/63/28/476826328.db2.gz TZHXCNKLIPVROD-MRXNPFEDSA-N 0 3 330.384 2.741 20 5 EFBDHN O=[N+]([O-])c1ccn(C2CCN(Cc3ccc4c[nH]nc4c3)CC2)n1 ZINC000366046131 476832521 /nfs/dbraw/zinc/83/25/21/476832521.db2.gz ZFKVZRCWLSBJCY-UHFFFAOYSA-N 0 3 326.360 2.505 20 5 EFBDHN CC(C)(CN1CCCC1)NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000457037788 476840421 /nfs/dbraw/zinc/84/04/21/476840421.db2.gz BZCIEGXVBCTAIY-UHFFFAOYSA-N 0 3 325.796 2.852 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NCCN2CCCC2(C)C)c1 ZINC000457066909 476856402 /nfs/dbraw/zinc/85/64/02/476856402.db2.gz ZHRJZWZORXBRHY-UHFFFAOYSA-N 0 3 335.404 2.598 20 5 EFBDHN CSc1ccc(C(=O)NCCN2CCCC2(C)C)cc1[N+](=O)[O-] ZINC000457079714 476863041 /nfs/dbraw/zinc/86/30/41/476863041.db2.gz SIBSGABWXUFMKG-UHFFFAOYSA-N 0 3 337.445 2.921 20 5 EFBDHN CC(C)N1CC[C@@H](N(C)C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000457104816 476877560 /nfs/dbraw/zinc/87/75/60/476877560.db2.gz BXYOZYCUGAPJTB-CQSZACIVSA-N 0 3 339.823 2.732 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N(C)[C@H]2CCN(C(C)C)C2)c1 ZINC000457110079 476880819 /nfs/dbraw/zinc/88/08/19/476880819.db2.gz HREFYQGYHYYJTQ-HNNXBMFYSA-N 0 3 349.431 2.613 20 5 EFBDHN CN(C)C[C@H]1CCCCN1C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000405100881 476924906 /nfs/dbraw/zinc/92/49/06/476924906.db2.gz MMJCTYDSBQQHQD-GFCCVEGCSA-N 0 3 325.796 2.805 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN[C@@H]3[C@H]4CCO[C@H]4C34CCC4)nc2c1 ZINC000446854532 476929937 /nfs/dbraw/zinc/92/99/37/476929937.db2.gz ZTIFIHPZTSTCSV-HFBAOOFYSA-N 0 3 328.372 2.518 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@@]3(CCO)CCOC3)s2)cc1 ZINC000447068667 476948235 /nfs/dbraw/zinc/94/82/35/476948235.db2.gz MEXVCSOSGQQZCM-KRWDZBQOSA-N 0 3 348.424 2.954 20 5 EFBDHN COC(=O)[C@](C)(CNCc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000447094614 476953443 /nfs/dbraw/zinc/95/34/43/476953443.db2.gz UBPDRNAZHHJIQB-GOSISDBHSA-N 0 3 346.358 2.954 20 5 EFBDHN C[C@H](Nc1ccn(C2CCN(C)CC2)n1)c1ccccc1[N+](=O)[O-] ZINC000447412201 476990807 /nfs/dbraw/zinc/99/08/07/476990807.db2.gz FMOQNWQUEFEWOB-ZDUSSCGKSA-N 0 3 329.404 2.653 20 5 EFBDHN O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2NCc2cccc3c2OCO3)n1 ZINC000447541975 477008020 /nfs/dbraw/zinc/00/80/20/477008020.db2.gz NMGNSZLLSXRWMI-KBPBESRZSA-N 0 3 344.371 2.794 20 5 EFBDHN C[C@H](NC[C@@H]1CNCCO1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423514498 477057409 /nfs/dbraw/zinc/05/74/09/477057409.db2.gz DDBCEFXGOSMHMQ-STQMWFEESA-N 0 3 347.440 2.962 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1CN1CCC[C@@H](Cc2nccn2C)C1 ZINC000366610613 477094835 /nfs/dbraw/zinc/09/48/35/477094835.db2.gz SNTPHVHLNCUMMB-AWEZNQCLSA-N 0 3 344.415 2.792 20 5 EFBDHN O=C([C@H]1CCCN1C1CC1)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452833887 477100506 /nfs/dbraw/zinc/10/05/06/477100506.db2.gz BJANNKGWLAVXRA-MAUKXSAKSA-N 0 3 343.427 2.928 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@@H]1NCCc2ccccc21 ZINC000423665776 477103728 /nfs/dbraw/zinc/10/37/28/477103728.db2.gz HPTZUYFTMHUDNM-KRWDZBQOSA-N 0 3 339.395 2.828 20 5 EFBDHN CC(C)[C@H](C(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)N(C)C ZINC000452850637 477106245 /nfs/dbraw/zinc/10/62/45/477106245.db2.gz MQZPVKZNTFSXBM-DOTOQJQBSA-N 0 3 333.432 2.887 20 5 EFBDHN CCN1CCC(NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000431862808 477111982 /nfs/dbraw/zinc/11/19/82/477111982.db2.gz ZCKGTDWWZLOWRY-UHFFFAOYSA-N 0 3 334.420 2.613 20 5 EFBDHN Cc1c(CNC(=O)NC[C@H]2N(C)CCCC2(C)C)cccc1[N+](=O)[O-] ZINC000448010589 477115759 /nfs/dbraw/zinc/11/57/59/477115759.db2.gz NKVUEOZFRUBCHD-MRXNPFEDSA-N 0 3 348.447 2.823 20 5 EFBDHN COc1ccc(C[C@@H]2CCCN(CCn3ccc([N+](=O)[O-])n3)C2)cc1 ZINC000371084198 477116012 /nfs/dbraw/zinc/11/60/12/477116012.db2.gz GEHWPJYIPZHVLN-INIZCTEOSA-N 0 3 344.415 2.755 20 5 EFBDHN CCN1CCN(C[C@H](C)CNc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000432347518 477199690 /nfs/dbraw/zinc/19/96/90/477199690.db2.gz OLMPIOLQNBIHDB-CYBMUJFWSA-N 0 3 340.855 2.934 20 5 EFBDHN C[C@H](CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCC[C@H](C)C1 ZINC000411417145 477227173 /nfs/dbraw/zinc/22/71/73/477227173.db2.gz DXBUAVODJKEPFS-IHETXDGRSA-N 0 3 345.443 2.935 20 5 EFBDHN O=C(CCN(Cc1ccncc1)C1CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411417650 477227198 /nfs/dbraw/zinc/22/71/98/477227198.db2.gz MRIKHVBXADBTHN-UHFFFAOYSA-N 0 3 340.383 2.983 20 5 EFBDHN CCOc1ccc([C@H](C)NC[C@H]2CN3CCC[C@H]3CO2)cc1[N+](=O)[O-] ZINC000371316308 477237557 /nfs/dbraw/zinc/23/75/57/477237557.db2.gz CRHFGLANERJBGN-BPUTZDHNSA-N 0 3 349.431 2.507 20 5 EFBDHN CCc1ccccc1[C@@H](N)CNC(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000423982375 477244130 /nfs/dbraw/zinc/24/41/30/477244130.db2.gz RNOFZDBMFRNXLL-HNNXBMFYSA-N 0 3 343.383 2.596 20 5 EFBDHN CCc1ccccc1[C@H](N)CNC(=O)c1cc([N+](=O)[O-])ccc1OC ZINC000423982610 477244817 /nfs/dbraw/zinc/24/48/17/477244817.db2.gz RSRLZNYAKFCOSK-MRXNPFEDSA-N 0 3 343.383 2.596 20 5 EFBDHN CCc1ccccc1[C@H](N)CNC(=O)c1cccc(C)c1[N+](=O)[O-] ZINC000423983320 477245134 /nfs/dbraw/zinc/24/51/34/477245134.db2.gz SUVLHCBAAMUECU-MRXNPFEDSA-N 0 3 327.384 2.895 20 5 EFBDHN CCOc1ccc(C(=O)N2C[C@@H](N)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000424068082 477280724 /nfs/dbraw/zinc/28/07/24/477280724.db2.gz AHXBDEUADSFUCV-AWEZNQCLSA-N 0 3 341.367 2.524 20 5 EFBDHN CC(C)c1ccc(CNCCCCS(C)(=O)=O)cc1[N+](=O)[O-] ZINC000424172071 477316506 /nfs/dbraw/zinc/31/65/06/477316506.db2.gz NGUURDHZQQZHOO-UHFFFAOYSA-N 0 3 328.434 2.633 20 5 EFBDHN CC1(C)C[C@@H](NCCN2CCSCC2)c2cc([N+](=O)[O-])ccc21 ZINC000433180518 477316919 /nfs/dbraw/zinc/31/69/19/477316919.db2.gz VSVNLRDLLCAFAQ-MRXNPFEDSA-N 0 3 335.473 2.956 20 5 EFBDHN O=C(CCCc1ccccc1)NCCNCc1cccc([N+](=O)[O-])c1 ZINC000424183997 477319908 /nfs/dbraw/zinc/31/99/08/477319908.db2.gz DGWNMKIHMMXHNW-UHFFFAOYSA-N 0 3 341.411 2.824 20 5 EFBDHN CCN1CCC(N(C)C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000448878580 477324350 /nfs/dbraw/zinc/32/43/50/477324350.db2.gz RVCSABZTNYOBLJ-UHFFFAOYSA-N 0 3 347.415 2.500 20 5 EFBDHN COc1cccc(C(=O)NC[C@@H](C)N2CCCC[C@H]2C)c1[N+](=O)[O-] ZINC000435541284 477348943 /nfs/dbraw/zinc/34/89/43/477348943.db2.gz HGRHZTIHJBZOBI-CHWSQXEVSA-N 0 3 335.404 2.596 20 5 EFBDHN O=C1C[C@H](N[C@H]2CCCc3ccc([N+](=O)[O-])cc32)[C@H]2CCCCN12 ZINC000367203081 477391520 /nfs/dbraw/zinc/39/15/20/477391520.db2.gz BPZFEAPNFGLJHF-YESZJQIVSA-N 0 3 329.400 2.715 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCCC23CCN(C)CC3)c1 ZINC000367229358 477405010 /nfs/dbraw/zinc/40/50/10/477405010.db2.gz DUBHKUCDCSPULI-UHFFFAOYSA-N 0 3 347.415 2.694 20 5 EFBDHN COc1cccc(C(=O)Nc2ccccc2CCN(C)C)c1[N+](=O)[O-] ZINC000436020690 477406918 /nfs/dbraw/zinc/40/69/18/477406918.db2.gz RHDSILCOSJZVOK-UHFFFAOYSA-N 0 3 343.383 2.960 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412086843 477409278 /nfs/dbraw/zinc/40/92/78/477409278.db2.gz BQIKBZJLJLTPPW-IXDOHACOSA-N 0 3 331.416 2.689 20 5 EFBDHN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CC[C@@H](N2CCCCC2)C1 ZINC000412088270 477410729 /nfs/dbraw/zinc/41/07/29/477410729.db2.gz BGZHDRLMUNKFAI-FGTMMUONSA-N 0 3 343.427 2.785 20 5 EFBDHN CC(C)Oc1cc(C(=O)N(C)[C@@H]2CCN(C(C)C)C2)ccc1[N+](=O)[O-] ZINC000412408195 477422577 /nfs/dbraw/zinc/42/25/77/477422577.db2.gz GWRYCEGXCGIDBF-OAHLLOKOSA-N 0 3 349.431 2.937 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C/CN[C@@H]1COc2ccccc2[C@@H]1O ZINC000367282936 477431458 /nfs/dbraw/zinc/43/14/58/477431458.db2.gz QABOMJWJLMQYLU-USVNEQSZSA-N 0 3 326.352 2.692 20 5 EFBDHN CC(C)Oc1cc(C(=O)N(C)C2CCN(C)CC2)ccc1[N+](=O)[O-] ZINC000413026166 477475142 /nfs/dbraw/zinc/47/51/42/477475142.db2.gz TUEOWEFAWIIQSO-UHFFFAOYSA-N 0 3 335.404 2.548 20 5 EFBDHN COc1cccc([C@@H](CNc2ncc([N+](=O)[O-])cc2F)N(C)C)c1 ZINC000413029200 477477269 /nfs/dbraw/zinc/47/72/69/477477269.db2.gz RLEKVVHQGBJDPZ-OAHLLOKOSA-N 0 3 334.351 2.852 20 5 EFBDHN CCc1nn(C)c(OC)c1CN[C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449246216 477504502 /nfs/dbraw/zinc/50/45/02/477504502.db2.gz CWQPEMLJLZSHDO-GFCCVEGCSA-N 0 3 332.404 2.620 20 5 EFBDHN CN(C)CCOc1ccccc1CNc1ncc([N+](=O)[O-])cc1F ZINC000413093924 477513700 /nfs/dbraw/zinc/51/37/00/477513700.db2.gz OZFKYRWBKYMHID-UHFFFAOYSA-N 0 3 334.351 2.681 20 5 EFBDHN CC[C@H]1CN(c2ccc([N+](=O)[O-])c3ncccc23)CCN1CCOC ZINC000413124353 477532103 /nfs/dbraw/zinc/53/21/03/477532103.db2.gz COKSBDPCEVQOFO-AWEZNQCLSA-N 0 3 344.415 2.690 20 5 EFBDHN CN(C[C@H]1CCCN(C)C1)c1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC000413132615 477537032 /nfs/dbraw/zinc/53/70/32/477537032.db2.gz BVQPSRKMHZGOAC-JTQLQIEISA-N 0 3 332.326 2.787 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CCC(Cc3cccnc3)CC2)c1 ZINC000367520717 477555141 /nfs/dbraw/zinc/55/51/41/477555141.db2.gz RCNMMTQMATYWSC-LJQANCHMSA-N 0 3 341.411 2.978 20 5 EFBDHN CN1C[C@@H]2CN(c3nc(-c4ccc([N+](=O)[O-])cc4)cs3)C[C@@H]2C1 ZINC000450485872 477604439 /nfs/dbraw/zinc/60/44/39/477604439.db2.gz QUUQBTPTQUXQTA-BETUJISGSA-N 0 3 330.413 2.716 20 5 EFBDHN NC(=O)C[C@@H]1CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000367711088 477651222 /nfs/dbraw/zinc/65/12/22/477651222.db2.gz XNTRYTPNZKHBQN-LBPRGKRZSA-N 0 3 329.356 2.552 20 5 EFBDHN CC1(C)CN(c2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)CCN1 ZINC000420263666 477652506 /nfs/dbraw/zinc/65/25/06/477652506.db2.gz AAMYQWKOVGIIBT-UHFFFAOYSA-N 0 3 342.399 2.757 20 5 EFBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCNC[C@](C)(F)C1 ZINC000420325846 477694736 /nfs/dbraw/zinc/69/47/36/477694736.db2.gz DKDRAHAZOBOPEI-INIZCTEOSA-N 0 3 325.384 2.515 20 5 EFBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCNC[C@@](C)(F)C1 ZINC000420325848 477694937 /nfs/dbraw/zinc/69/49/37/477694937.db2.gz DKDRAHAZOBOPEI-MRXNPFEDSA-N 0 3 325.384 2.515 20 5 EFBDHN CCOC(=O)c1cc(N2CCN([C@@H](C)CC)CC2)ccc1[N+](=O)[O-] ZINC000450865973 477742844 /nfs/dbraw/zinc/74/28/44/477742844.db2.gz XDIYBAKTBVDNDF-ZDUSSCGKSA-N 0 3 335.404 2.692 20 5 EFBDHN CN1CC[C@H]2[C@H](CCCN2C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000413621534 477754749 /nfs/dbraw/zinc/75/47/49/477754749.db2.gz CNQWRHZPJLWQAG-SPUZQDLCSA-N 0 3 343.427 2.641 20 5 EFBDHN CN1CC[C@@H]2[C@H](CCCN2C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000413621531 477755260 /nfs/dbraw/zinc/75/52/60/477755260.db2.gz CNQWRHZPJLWQAG-BZZMCLGOSA-N 0 3 343.427 2.641 20 5 EFBDHN CN(C)C1(CNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CCC1 ZINC000437936063 477777596 /nfs/dbraw/zinc/77/75/96/477777596.db2.gz TXDALNCQZRUOHZ-UHFFFAOYSA-N 0 3 326.784 2.854 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1C[C@H]2C[C@H](Cn3c(=O)cccc32)C1 ZINC000451226164 477889097 /nfs/dbraw/zinc/88/90/97/477889097.db2.gz HGBOYKOAYPUDDK-QLFBSQMISA-N 0 3 339.395 2.937 20 5 EFBDHN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)C[C@@H]1CCCN1C ZINC000421001721 477890882 /nfs/dbraw/zinc/89/08/82/477890882.db2.gz LTMJRXZUTSGXLM-DOMZBBRYSA-N 0 3 345.403 2.732 20 5 EFBDHN CC(C)N(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@@H](C)c1ccsc1 ZINC000421009658 477896407 /nfs/dbraw/zinc/89/64/07/477896407.db2.gz NHXRRDFMIGZNHE-SWLSCSKDSA-N 0 3 338.433 2.685 20 5 EFBDHN C[C@@H]1CC[C@@H](O)CN1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000421013824 477901843 /nfs/dbraw/zinc/90/18/43/477901843.db2.gz KGYMQALGBDDJIK-IUODEOHRSA-N 0 3 331.372 2.638 20 5 EFBDHN O=[N+]([O-])c1ccc(CNC[C@]2(CO)C[C@H]2c2ccc(F)cc2)cc1 ZINC000428541796 477923917 /nfs/dbraw/zinc/92/39/17/477923917.db2.gz CTOONODKUWZKFK-ROUUACIJSA-N 0 3 330.359 2.990 20 5 EFBDHN COc1ccc2c(c1)C[C@H](NCCOc1ccc([N+](=O)[O-])cc1)CO2 ZINC000516397835 477930211 /nfs/dbraw/zinc/93/02/11/477930211.db2.gz FZQKECBVASQTPK-AWEZNQCLSA-N 0 3 344.367 2.576 20 5 EFBDHN C[C@H](N[C@]1(C)CCO[C@H]1C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000494276821 477957106 /nfs/dbraw/zinc/95/71/06/477957106.db2.gz LUPNKTPNBRQBIH-AMJWSMQMSA-N 0 3 341.795 2.732 20 5 EFBDHN C[C@H]1CC[C@H](C)N1CC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000428730923 477970387 /nfs/dbraw/zinc/97/03/87/477970387.db2.gz QILQJYHIJLGMMH-KBPBESRZSA-N 0 3 331.416 2.959 20 5 EFBDHN C[C@@H]1C[C@H]1N1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000494373418 477973990 /nfs/dbraw/zinc/97/39/90/477973990.db2.gz XZSJQZZFHMUTDP-WOSRLPQWSA-N 0 3 332.404 2.789 20 5 EFBDHN C[C@@H]1C[C@@H]1N1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000494375877 477974428 /nfs/dbraw/zinc/97/44/28/477974428.db2.gz RWLHADYJXPFMBE-ZENOOKHLSA-N 0 3 332.404 2.789 20 5 EFBDHN COC(=O)[C@@]1(c2ccccc2)CCN(Cc2cccc([N+](=O)[O-])c2)C1 ZINC000428777497 477980154 /nfs/dbraw/zinc/98/01/54/477980154.db2.gz IRGFZHBMPKISJH-IBGZPJMESA-N 0 3 340.379 2.912 20 5 EFBDHN COC(=O)[C@]1(c2ccccc2)CCN(Cc2cccc([N+](=O)[O-])c2)C1 ZINC000428777498 477981069 /nfs/dbraw/zinc/98/10/69/477981069.db2.gz IRGFZHBMPKISJH-LJQANCHMSA-N 0 3 340.379 2.912 20 5 EFBDHN COCCN(CCc1ccc([N+](=O)[O-])cc1)Cc1c(C)nn(C)c1C ZINC000459575664 477985229 /nfs/dbraw/zinc/98/52/29/477985229.db2.gz UWUTWJUQSNYQTG-UHFFFAOYSA-N 0 3 346.431 2.636 20 5 EFBDHN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000451414598 478002011 /nfs/dbraw/zinc/00/20/11/478002011.db2.gz IJYVDDWMIZOPEI-ZFVVBOAOSA-N 0 3 347.415 2.547 20 5 EFBDHN CCOc1cc(CN2CC[C@@H](c3nccn3C)C2)ccc1[N+](=O)[O-] ZINC000516875860 478002974 /nfs/dbraw/zinc/00/29/74/478002974.db2.gz YLIQGMUKNFWZLQ-CQSZACIVSA-N 0 3 330.388 2.717 20 5 EFBDHN C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000451418726 478003661 /nfs/dbraw/zinc/00/36/61/478003661.db2.gz MWDUEKDNFHNUOO-ZFVVBOAOSA-N 0 3 347.415 2.547 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)CCN1C ZINC000494543259 478006598 /nfs/dbraw/zinc/00/65/98/478006598.db2.gz AUMRIONKHJMOBE-DZGCQCFKSA-N 0 3 346.431 2.752 20 5 EFBDHN C[C@@H]1CCCC[C@]1(C)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000459615502 478011406 /nfs/dbraw/zinc/01/14/06/478011406.db2.gz PDNNYINCHKCHNL-CJNGLKHVSA-N 0 3 340.445 2.927 20 5 EFBDHN CC(C)CN1CCCC[C@H]1CNC(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000439699681 478019339 /nfs/dbraw/zinc/01/93/39/478019339.db2.gz FHJMSYMSBPVTDC-HNNXBMFYSA-N 0 3 337.395 2.974 20 5 EFBDHN O=C(CN[C@@H]1CCC12CCCC2)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000451454939 478025397 /nfs/dbraw/zinc/02/53/97/478025397.db2.gz JEGWVYWEUCFUBK-OAHLLOKOSA-N 0 3 347.371 2.574 20 5 EFBDHN O=C(CN[C@H]1CCC12CCCC2)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000451454938 478025717 /nfs/dbraw/zinc/02/57/17/478025717.db2.gz JEGWVYWEUCFUBK-HNNXBMFYSA-N 0 3 347.371 2.574 20 5 EFBDHN COC(=O)COc1ccc(CN[C@@H]2C[C@H]2CC(C)C)cc1[N+](=O)[O-] ZINC000459662261 478028466 /nfs/dbraw/zinc/02/84/66/478028466.db2.gz ZVGAUJWHGPPHEK-ZIAGYGMSSA-N 0 3 336.388 2.671 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H](C)N1CCCC[C@@H]1C ZINC000494657237 478035284 /nfs/dbraw/zinc/03/52/84/478035284.db2.gz YXNFBVVWGCLWJZ-QWHCGFSZSA-N 0 3 335.404 2.596 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN[C@@H]1[C@H]2CCCO[C@H]2C1(C)C ZINC000451474147 478036814 /nfs/dbraw/zinc/03/68/14/478036814.db2.gz ADSFIHMYGJUBFZ-CSMYWGQOSA-N 0 3 347.415 2.635 20 5 EFBDHN CCO[C@@H]1C[C@H](N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C12CCC2 ZINC000451480017 478039111 /nfs/dbraw/zinc/03/91/11/478039111.db2.gz NZFXERLCAIUDPG-VBNZEHGJSA-N 0 3 347.415 2.859 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCCN(C)[C@H]1C ZINC000439917783 478049502 /nfs/dbraw/zinc/04/95/02/478049502.db2.gz SWUPHEAUMAZZNJ-WCQYABFASA-N 0 3 336.392 2.598 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CCN(CC2CCCC2)C1 ZINC000494703862 478050176 /nfs/dbraw/zinc/05/01/76/478050176.db2.gz QYJDZFNJQJQDAU-CQSZACIVSA-N 0 3 347.415 2.598 20 5 EFBDHN COc1cc(CN[C@@H]2[C@@H](C)[C@H](OC)C2(C)C)c([N+](=O)[O-])cc1F ZINC000451506882 478056913 /nfs/dbraw/zinc/05/69/13/478056913.db2.gz WJBJVHSXKUPGIF-ZWZTZDBGSA-N 0 3 326.368 2.892 20 5 EFBDHN CCOC[C@H]1CCCCN1CCOc1ccc(OC)cc1[N+](=O)[O-] ZINC000459726592 478062147 /nfs/dbraw/zinc/06/21/47/478062147.db2.gz XYPOGYUARDLAQH-CQSZACIVSA-N 0 3 338.404 2.873 20 5 EFBDHN COc1cc(CN[C@H]2C[C@H](OC)C23CCC3)c([N+](=O)[O-])cc1OC ZINC000459728094 478062388 /nfs/dbraw/zinc/06/23/88/478062388.db2.gz CRQMRXLSQUCBHT-HOTGVXAUSA-N 0 3 336.388 2.659 20 5 EFBDHN CC(C)COC[C@@H](O)CN1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548751 478085146 /nfs/dbraw/zinc/08/51/46/478085146.db2.gz OGSSWXHSXGVOCC-WMZOPIPTSA-N 0 3 336.432 2.808 20 5 EFBDHN Cc1c(NC(=O)[C@@H](C)N2CCN(C)[C@H](C(C)C)C2)cccc1[N+](=O)[O-] ZINC000487987735 478100825 /nfs/dbraw/zinc/10/08/25/478100825.db2.gz KWEFRTPKMYFSEM-PBHICJAKSA-N 0 3 348.447 2.502 20 5 EFBDHN Cc1c(NC(=O)CCN2CCN(C)[C@@H](C(C)C)C2)cccc1[N+](=O)[O-] ZINC000488038656 478110188 /nfs/dbraw/zinc/11/01/88/478110188.db2.gz HTGLGOLBCRQAAF-QGZVFWFLSA-N 0 3 348.447 2.504 20 5 EFBDHN O=[N+]([O-])c1cc(F)c(CN[C@H]([C@H](CO)C2CC2)C2CC2)c(F)c1 ZINC000451593584 478114453 /nfs/dbraw/zinc/11/44/53/478114453.db2.gz CWKQBEOPNOWMRA-CJNGLKHVSA-N 0 3 326.343 2.760 20 5 EFBDHN CCCN1CCC[C@H]1CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000451722511 478176590 /nfs/dbraw/zinc/17/65/90/478176590.db2.gz TXZAWGNLWUTSHS-INIZCTEOSA-N 0 3 347.415 2.548 20 5 EFBDHN COc1cc(N2CCN([C@@H]3C[C@@H]3C)C[C@@H](C)C2)c([N+](=O)[O-])cc1F ZINC000488743368 478178070 /nfs/dbraw/zinc/17/80/70/478178070.db2.gz HUHQMEQVRZVODN-MBNYWOFBSA-N 0 3 337.395 2.909 20 5 EFBDHN COc1cc(N2CCN([C@@H]3C[C@H]3C)C[C@H](C)C2)c([N+](=O)[O-])cc1F ZINC000488743369 478178074 /nfs/dbraw/zinc/17/80/74/478178074.db2.gz HUHQMEQVRZVODN-OUCADQQQSA-N 0 3 337.395 2.909 20 5 EFBDHN C[C@H]1C[C@H]1N1CCN(c2c3c(ccc2[N+](=O)[O-])NCC3)C[C@@H](C)C1 ZINC000488747164 478178822 /nfs/dbraw/zinc/17/88/22/478178822.db2.gz IJVGZISGKPGFIN-GDZNZVCISA-N 0 3 330.432 2.729 20 5 EFBDHN C[C@@H]1C[C@H]1N1CCN(c2c3c(ccc2[N+](=O)[O-])NCC3)C[C@@H](C)C1 ZINC000488747165 478178942 /nfs/dbraw/zinc/17/89/42/478178942.db2.gz IJVGZISGKPGFIN-OGHNNQOOSA-N 0 3 330.432 2.729 20 5 EFBDHN C[C@H]1C[C@H]1N1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000561765880 478204309 /nfs/dbraw/zinc/20/43/09/478204309.db2.gz WRMJFZJIQCSFCN-RLFYNMQTSA-N 0 3 345.443 2.716 20 5 EFBDHN CC(=O)NCC[C@H]1CCCN(C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000561982503 478211438 /nfs/dbraw/zinc/21/14/38/478211438.db2.gz HMYSWGNCMQRPBW-KQQSKNTNSA-N 0 3 331.416 2.846 20 5 EFBDHN C[C@H](C(=O)N1CC[C@@H](N2CCCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000562300324 478229875 /nfs/dbraw/zinc/22/98/75/478229875.db2.gz KFEWPJKDSSJQKI-WMLDXEAASA-N 0 3 331.416 2.785 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N[C@@H]2CCN(C3CC3)C2)cc1[N+](=O)[O-] ZINC000489540605 478255367 /nfs/dbraw/zinc/25/53/67/478255367.db2.gz IUUKYEJTRSRTQU-GXTWGEPZSA-N 0 3 332.404 2.500 20 5 EFBDHN C[C@@H](NCc1ccccc1[N+](=O)[O-])C1CN(C(=O)OC(C)(C)C)C1 ZINC000495669008 478260726 /nfs/dbraw/zinc/26/07/26/478260726.db2.gz KFEULRPBRNQIBF-GFCCVEGCSA-N 0 3 335.404 2.940 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N[C@@H]2CCN(C)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000489624035 478261845 /nfs/dbraw/zinc/26/18/45/478261845.db2.gz HXILKZPLAINFTN-VNHYZAJKSA-N 0 3 334.420 2.746 20 5 EFBDHN C[C@H](CNCc1cccc([N+](=O)[O-])c1)c1ccc(S(C)(=O)=O)cc1 ZINC000590643883 478274440 /nfs/dbraw/zinc/27/44/40/478274440.db2.gz DEDJXKBKXSSSKR-CYBMUJFWSA-N 0 3 348.424 2.892 20 5 EFBDHN C[C@H](NC(=O)N[C@@H]1CCCN2CCCC[C@@H]12)c1cccc([N+](=O)[O-])c1 ZINC000594213267 478277249 /nfs/dbraw/zinc/27/72/49/478277249.db2.gz UCWXUFWEEJIMQI-XKQJLSEDSA-N 0 3 346.431 2.972 20 5 EFBDHN C[C@H](NC(=O)N[C@H]1CCCN2CCCC[C@H]12)c1cccc([N+](=O)[O-])c1 ZINC000594213266 478277490 /nfs/dbraw/zinc/27/74/90/478277490.db2.gz UCWXUFWEEJIMQI-RRQGHBQHSA-N 0 3 346.431 2.972 20 5 EFBDHN O=[N+]([O-])c1cccnc1N1CCN(CC2Cc3ccccc3C2)CC1 ZINC000570165014 478300226 /nfs/dbraw/zinc/30/02/26/478300226.db2.gz XPPHGTGGGAXLIB-UHFFFAOYSA-N 0 3 338.411 2.527 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1CCCN2CCCC[C@@H]12 ZINC000594281054 478318005 /nfs/dbraw/zinc/31/80/05/478318005.db2.gz BDLRWTFUCSAYCO-RDJZCZTQSA-N 0 3 346.431 2.753 20 5 EFBDHN CC1(C)C[C@H](CNCc2cc3c(cc2[N+](=O)[O-])OCCO3)CCO1 ZINC000590781202 478336126 /nfs/dbraw/zinc/33/61/26/478336126.db2.gz FVJKHVDOFXJRBD-GFCCVEGCSA-N 0 3 336.388 2.661 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCC(=O)Nc1ccccn1 ZINC000538614531 478366628 /nfs/dbraw/zinc/36/66/28/478366628.db2.gz NJJVTSSSMYSVTD-CYBMUJFWSA-N 0 3 328.372 2.978 20 5 EFBDHN C[C@@H](C(=O)NC[C@H](C)N1CCC[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000570505426 478374300 /nfs/dbraw/zinc/37/43/00/478374300.db2.gz DOWKEOSHQPAUET-QLFBSQMISA-N 0 3 333.432 2.935 20 5 EFBDHN O=C(N[C@H]1CCCN2CCCC[C@@H]12)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000594418475 478374574 /nfs/dbraw/zinc/37/45/74/478374574.db2.gz JFLMTVQWBUWCEU-ZFWWWQNUSA-N 0 3 342.399 2.823 20 5 EFBDHN O=C(N[C@@H]1CCCN2CCCC[C@H]12)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000594419134 478376183 /nfs/dbraw/zinc/37/61/83/478376183.db2.gz NOIQGYXGYBBVQX-UKRRQHHQSA-N 0 3 342.399 2.823 20 5 EFBDHN O=C(/C=C\c1cccc([N+](=O)[O-])c1)N1CCN(C2CCCC2)CC1 ZINC000490787758 478386702 /nfs/dbraw/zinc/38/67/02/478386702.db2.gz CNCJIPWGXKPMFS-HJWRWDBZSA-N 0 3 329.400 2.695 20 5 EFBDHN C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1nnc([C@H]2CCCO2)[n-]1 ZINC000594514460 478421656 /nfs/dbraw/zinc/42/16/56/478421656.db2.gz YFKWYUXQHXDJGZ-SWLSCSKDSA-N 0 3 345.403 2.675 20 5 EFBDHN Cc1cnc(CCNCc2cc3c(cc2[N+](=O)[O-])OCCO3)c(C)c1 ZINC000594522966 478424538 /nfs/dbraw/zinc/42/45/38/478424538.db2.gz UDPCJQGEPGAJHO-UHFFFAOYSA-N 0 3 343.383 2.710 20 5 EFBDHN COC(=O)Cc1ccc(N[C@H]2CCCN3CCCC[C@@H]23)c([N+](=O)[O-])c1 ZINC000594599220 478458891 /nfs/dbraw/zinc/45/88/91/478458891.db2.gz IGIOQHJBCXEBHH-HOCLYGCPSA-N 0 3 347.415 2.739 20 5 EFBDHN CCOc1ccc(C(=O)N2CCNC3(CCCCC3)C2)cc1[N+](=O)[O-] ZINC000594628916 478474013 /nfs/dbraw/zinc/47/40/13/478474013.db2.gz PCPRPDSJXZNPDY-UHFFFAOYSA-N 0 3 347.415 2.742 20 5 EFBDHN CN(C)CCn1cc(Nc2nccc3ccc([N+](=O)[O-])cc32)cn1 ZINC000591143034 478474370 /nfs/dbraw/zinc/47/43/70/478474370.db2.gz LUCKAUPJBUDTTB-UHFFFAOYSA-N 0 3 326.360 2.645 20 5 EFBDHN CN1CC[C@]2(C1)CCCN(C(=O)c1c[nH]c3cccc([N+](=O)[O-])c13)C2 ZINC000597710121 478474598 /nfs/dbraw/zinc/47/45/98/478474598.db2.gz HEDLKLLZXZSLDR-SFHVURJKSA-N 0 3 342.399 2.634 20 5 EFBDHN CCOc1ccc(C(=O)N2CCC[C@@]3(CCN(C)C3)C2)cc1[N+](=O)[O-] ZINC000597714790 478475946 /nfs/dbraw/zinc/47/59/46/478475946.db2.gz JNGJRMCIJUJTCN-SFHVURJKSA-N 0 3 347.415 2.551 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC[C@@H](CN2CCOC2=O)C1 ZINC000496017678 478482695 /nfs/dbraw/zinc/48/26/95/478482695.db2.gz YLBFPKCUPPPQBN-SCZPIIQISA-N 0 3 345.399 2.772 20 5 EFBDHN COC(=O)COc1ccc(CN2CC[C@@H](C3CCC3)C2)cc1[N+](=O)[O-] ZINC000591267870 478503282 /nfs/dbraw/zinc/50/32/82/478503282.db2.gz PSNHURIJWUPCNI-OAHLLOKOSA-N 0 3 348.399 2.769 20 5 EFBDHN C[C@@H]1CN(CCN[C@H]2CCCCc3ccc([N+](=O)[O-])cc32)CCO1 ZINC000591347976 478532203 /nfs/dbraw/zinc/53/22/03/478532203.db2.gz NVTPOCZPXXFENL-KDOFPFPSSA-N 0 3 333.432 2.673 20 5 EFBDHN Cc1[nH]ncc1CN(C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000600865172 478544409 /nfs/dbraw/zinc/54/44/09/478544409.db2.gz YDBIPMAFRQRIRW-UHFFFAOYSA-N 0 3 327.344 2.913 20 5 EFBDHN O=C(CCN[C@H]1CCc2c1cccc2[N+](=O)[O-])Nc1ccccn1 ZINC000563418829 478554664 /nfs/dbraw/zinc/55/46/64/478554664.db2.gz QCTSDRIWHROZJZ-AWEZNQCLSA-N 0 3 326.356 2.596 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCN(c2ccncc2)CC1 ZINC000591528697 478574230 /nfs/dbraw/zinc/57/42/30/478574230.db2.gz PCCYSDKQULGIEV-UHFFFAOYSA-N 0 3 340.383 2.569 20 5 EFBDHN CC(C)(C)N1CC[C@@H](NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000597920866 478576000 /nfs/dbraw/zinc/57/60/00/478576000.db2.gz BXOFDSROKZFMAS-CQSZACIVSA-N 0 3 344.415 2.539 20 5 EFBDHN CSc1ccc(C(=O)N[C@@H]2CCN(C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000597924832 478579754 /nfs/dbraw/zinc/57/97/54/478579754.db2.gz LGNLDHNSXFYIFM-GFCCVEGCSA-N 0 3 337.445 2.919 20 5 EFBDHN O=C(/C=C\c1ccccc1[N+](=O)[O-])N1CC[C@@H](N2CCCCC2)C1 ZINC000491562582 478589261 /nfs/dbraw/zinc/58/92/61/478589261.db2.gz OBPDLIVBRFNLBR-HLRDLLSLSA-N 0 3 329.400 2.695 20 5 EFBDHN O=C(/C=C\c1cccc([N+](=O)[O-])c1)N1CC[C@H](N2CCCCC2)C1 ZINC000491564991 478591778 /nfs/dbraw/zinc/59/17/78/478591778.db2.gz ZWAMFCKSSSLEGN-QWPQOLDESA-N 0 3 329.400 2.695 20 5 EFBDHN CCC[C@@H](NC[C@@H](O)COc1ccccc1[N+](=O)[O-])c1ccccn1 ZINC000591734564 478615780 /nfs/dbraw/zinc/61/57/80/478615780.db2.gz PDNHRSFMZGVAKU-HUUCEWRRSA-N 0 3 345.399 2.861 20 5 EFBDHN CCC[C@@H](NC[C@H](O)COc1ccccc1[N+](=O)[O-])c1ccccn1 ZINC000591734565 478615896 /nfs/dbraw/zinc/61/58/96/478615896.db2.gz PDNHRSFMZGVAKU-LSDHHAIUSA-N 0 3 345.399 2.861 20 5 EFBDHN CNC(=O)CC1(CNCc2ccc([N+](=O)[O-])cc2F)CCCCC1 ZINC000594995224 478622831 /nfs/dbraw/zinc/62/28/31/478622831.db2.gz GUZAJUOAIXGKKG-UHFFFAOYSA-N 0 3 337.395 2.910 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@H](O)Cc1ccccc1 ZINC000595011745 478628198 /nfs/dbraw/zinc/62/81/98/478628198.db2.gz MEFZJZINSOXVKM-XJKSGUPXSA-N 0 3 330.384 2.858 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)N[C@H]1CCN(CC(F)(F)F)C1 ZINC000595017519 478629713 /nfs/dbraw/zinc/62/97/13/478629713.db2.gz WGXJANGATDKZNA-MNOVXSKESA-N 0 3 347.337 2.891 20 5 EFBDHN CN(C(=O)/C=C/c1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CCN(C2CC2)C1 ZINC000491684098 478631281 /nfs/dbraw/zinc/63/12/81/478631281.db2.gz CQXAVMNBQWMIPC-RRFAQUSLSA-N 0 3 349.818 2.957 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H](CO)Cc1ccc(F)cc1 ZINC000595036595 478637863 /nfs/dbraw/zinc/63/78/63/478637863.db2.gz SMCGUIQBWJIGCZ-SWLSCSKDSA-N 0 3 348.374 2.997 20 5 EFBDHN COCC1(CN[C@@H](C)c2ccc([N+](=O)[O-])cc2OC)CCOCC1 ZINC000595040704 478639183 /nfs/dbraw/zinc/63/91/83/478639183.db2.gz ZPIJBHFMFAJNSI-ZDUSSCGKSA-N 0 3 338.404 2.697 20 5 EFBDHN CCCN1C[C@@H](CN[C@@H](C)c2ccc([N+](=O)[O-])cc2OC)CC1=O ZINC000595044436 478639842 /nfs/dbraw/zinc/63/98/42/478639842.db2.gz MSMUGMPMAHQNMO-QWHCGFSZSA-N 0 3 335.404 2.513 20 5 EFBDHN CCn1cc(CN[C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])nn1 ZINC000595068322 478649570 /nfs/dbraw/zinc/64/95/70/478649570.db2.gz JRFJKWZJKNGGPU-CZUORRHYSA-N 0 3 329.404 2.707 20 5 EFBDHN CC(C)(NC(=O)[C@H]1CNCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000563887701 478655626 /nfs/dbraw/zinc/65/56/26/478655626.db2.gz LYFDEWRZSLXOGD-KRWDZBQOSA-N 0 3 339.395 2.833 20 5 EFBDHN Cc1cccc2c1CC[C@@H]2NC[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000582840402 478699055 /nfs/dbraw/zinc/69/90/55/478699055.db2.gz VZOHXJCNQVWAIO-BEFAXECRSA-N 0 3 342.395 2.920 20 5 EFBDHN COCC(C)(C)N1CCN(c2ccnc3ccc([N+](=O)[O-])cc32)CC1 ZINC000601179204 478709030 /nfs/dbraw/zinc/70/90/30/478709030.db2.gz OVNHWLZXQUQGLC-UHFFFAOYSA-N 0 3 344.415 2.690 20 5 EFBDHN C[C@H](C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21)c1cccc([N+](=O)[O-])c1 ZINC000564316106 478720298 /nfs/dbraw/zinc/72/02/98/478720298.db2.gz ZNZIWJAFLBKBAK-YSVLISHTSA-N 0 3 331.416 2.641 20 5 EFBDHN COc1cc(C(=O)N[C@@H](C)CN2CCC(C)CC2)cc([N+](=O)[O-])c1C ZINC000598260998 478730184 /nfs/dbraw/zinc/73/01/84/478730184.db2.gz CBPDBXITLPMGNI-ZDUSSCGKSA-N 0 3 349.431 2.762 20 5 EFBDHN C[C@H](CN1CCC(C)CC1)NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000598261998 478730815 /nfs/dbraw/zinc/73/08/15/478730815.db2.gz WUUUPUMLJYHYTP-CABCVRRESA-N 0 3 333.432 2.935 20 5 EFBDHN C[C@@H](CN1CCC(C)CC1)NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000598262483 478730880 /nfs/dbraw/zinc/73/08/80/478730880.db2.gz KUMAPDODDXOFIB-ZDUSSCGKSA-N 0 3 344.415 2.926 20 5 EFBDHN C[C@@H](C(=O)N[C@@H](C)CN1CCC(C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000598262005 478731096 /nfs/dbraw/zinc/73/10/96/478731096.db2.gz WUUUPUMLJYHYTP-LSDHHAIUSA-N 0 3 333.432 2.935 20 5 EFBDHN C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)/C=C\c1ccc(F)cc1[N+](=O)[O-] ZINC000491909786 478733520 /nfs/dbraw/zinc/73/35/20/478733520.db2.gz XHNFGXWGDXDDJF-SQWULWQPSA-N 0 3 335.379 2.546 20 5 EFBDHN Cc1nn(C)c(N[C@H]2CCN(Cc3cccc(C)c3)C2)c1[N+](=O)[O-] ZINC000601239440 478741575 /nfs/dbraw/zinc/74/15/75/478741575.db2.gz KWFLBZJONYMAMM-HNNXBMFYSA-N 0 3 329.404 2.632 20 5 EFBDHN O=C(Nc1cccc([N+](=O)[O-])c1)N1CCCN(c2ccncc2)CC1 ZINC000601250930 478746428 /nfs/dbraw/zinc/74/64/28/478746428.db2.gz PQKUUWOVTYDEDT-UHFFFAOYSA-N 0 3 341.371 2.734 20 5 EFBDHN Cc1noc(CN[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000595441076 478783670 /nfs/dbraw/zinc/78/36/70/478783670.db2.gz ULRWTBXJNYRQDS-XJKSGUPXSA-N 0 3 344.415 2.891 20 5 EFBDHN Cc1noc(CN[C@H]2CCN(Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000595441072 478783884 /nfs/dbraw/zinc/78/38/84/478783884.db2.gz ULRWTBXJNYRQDS-CJNGLKHVSA-N 0 3 344.415 2.891 20 5 EFBDHN C[C@H]1CCN(CCNC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C1 ZINC000564765605 478804470 /nfs/dbraw/zinc/80/44/70/478804470.db2.gz DTYQSAFGMGPVRT-ZDUSSCGKSA-N 0 3 333.432 2.964 20 5 EFBDHN CC[C@@H](CC(F)(F)F)NC[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000583259180 478805915 /nfs/dbraw/zinc/80/59/15/478805915.db2.gz XEYZRDQIZKAPBF-JQWIXIFHSA-N 0 3 336.310 2.655 20 5 EFBDHN CC(C)(C)[C@H]1CCN(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000544189208 478816044 /nfs/dbraw/zinc/81/60/44/478816044.db2.gz FYUDKRLZAMKGLP-AWEZNQCLSA-N 0 3 331.416 2.852 20 5 EFBDHN C[C@H]1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CC2(CCCC2)O1 ZINC000592196703 478822647 /nfs/dbraw/zinc/82/26/47/478822647.db2.gz XDSZVSUDRSVJEZ-AWEZNQCLSA-N 0 3 347.415 2.957 20 5 EFBDHN CC[C@@H]1C[C@]1(NCCn1cc([N+](=O)[O-])ccc1=O)c1cccc(C)c1 ZINC000502590034 478824701 /nfs/dbraw/zinc/82/47/01/478824701.db2.gz BKNDJSXXBFTTKN-DNVCBOLYSA-N 0 3 341.411 2.980 20 5 EFBDHN CCCN(C(=O)Nc1cc([N+](=O)[O-])ccc1OC)[C@H]1CCN(C)C1 ZINC000592211793 478829024 /nfs/dbraw/zinc/82/90/24/478829024.db2.gz IYDSZELEAXGAMA-ZDUSSCGKSA-N 0 3 336.392 2.551 20 5 EFBDHN CN(CCOc1ccccc1[N+](=O)[O-])[C@@H](CO)Cc1ccccc1 ZINC000595595302 478874859 /nfs/dbraw/zinc/87/48/59/478874859.db2.gz JOHOUEXDCPDQJK-MRXNPFEDSA-N 0 3 330.384 2.509 20 5 EFBDHN CC(C)(C)N(Cc1ccsc1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000595600045 478877810 /nfs/dbraw/zinc/87/78/10/478877810.db2.gz FXDNCTLVNWHBQI-AWEZNQCLSA-N 0 3 338.433 2.514 20 5 EFBDHN CS[C@@H]1CN(Cc2c(Cl)cccc2[N+](=O)[O-])C[C@H]1N(C)C ZINC000492262592 478898858 /nfs/dbraw/zinc/89/88/58/478898858.db2.gz XMAQMIDWXOPWSW-ZIAGYGMSSA-N 0 3 329.853 2.726 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCN[C@H](C(C)C)C1 ZINC000598569152 478901164 /nfs/dbraw/zinc/90/11/64/478901164.db2.gz AZJZXWQACCNKGV-AWEZNQCLSA-N 0 3 337.445 2.777 20 5 EFBDHN CNC(=O)c1ccc(NC[C@@H](C)N2CCCC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000507134464 478904673 /nfs/dbraw/zinc/90/46/73/478904673.db2.gz MCCSNDSDJJWQNC-QWHCGFSZSA-N 0 3 334.420 2.629 20 5 EFBDHN O=c1[nH]cnc2cc(NC[C@@H]3CCCCN3C3CC3)c([N+](=O)[O-])cc21 ZINC000572798353 478921701 /nfs/dbraw/zinc/92/17/01/478921701.db2.gz UMFUYIOYWXWGCX-LBPRGKRZSA-N 0 3 343.387 2.672 20 5 EFBDHN C[C@H](C1CCN(C)CC1)N(C)C(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000492315159 478925122 /nfs/dbraw/zinc/92/51/22/478925122.db2.gz AENHOUKUKOTDGM-DEBLGDTFSA-N 0 3 331.416 2.797 20 5 EFBDHN COC[C@H](NCCOc1ccccc1[N+](=O)[O-])c1cccc(OC)c1 ZINC000595683361 478933736 /nfs/dbraw/zinc/93/37/36/478933736.db2.gz HXSQDKXWIJXZQH-INIZCTEOSA-N 0 3 346.383 2.960 20 5 EFBDHN C[C@@H](C(=O)N1CCC[C@@H]1CN1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000583787024 478940353 /nfs/dbraw/zinc/94/03/53/478940353.db2.gz SVKOSNPRKZCXBE-RHSMWYFYSA-N 0 3 331.416 2.785 20 5 EFBDHN CCOc1ccccc1CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000583929473 478972882 /nfs/dbraw/zinc/97/28/82/478972882.db2.gz LRGIGYFYHDPBIP-MRXNPFEDSA-N 0 3 346.383 2.523 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CCC3(C=Cc4ccccc4O3)CC2)n1 ZINC000595879542 479047820 /nfs/dbraw/zinc/04/78/20/479047820.db2.gz SOHUTJKZPHHTLN-UHFFFAOYSA-N 0 3 340.383 2.732 20 5 EFBDHN COc1ccc(NC(=O)[C@H](C)N(C)C[C@H]2CC2(C)C)c([N+](=O)[O-])c1 ZINC000595907539 479062571 /nfs/dbraw/zinc/06/25/71/479062571.db2.gz AHJCBUPKOJEBNI-NWDGAFQWSA-N 0 3 335.404 2.908 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCSCCN(C)Cc1ccccc1 ZINC000601910918 479068326 /nfs/dbraw/zinc/06/83/26/479068326.db2.gz CFEQLQIVLVQYBN-UHFFFAOYSA-N 0 3 334.445 2.965 20 5 EFBDHN COc1cc(CNCC2(O)CCC(C)CC2)c([N+](=O)[O-])cc1OC ZINC000596058267 479112410 /nfs/dbraw/zinc/11/24/10/479112410.db2.gz GXZRDOMKZUSIRY-UHFFFAOYSA-N 0 3 338.404 2.643 20 5 EFBDHN CCN1CCN(CCNc2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000596073922 479122344 /nfs/dbraw/zinc/12/23/44/479122344.db2.gz OOZNQEPSXLYSRV-UHFFFAOYSA-N 0 3 346.353 2.663 20 5 EFBDHN COC(=O)C1CCN(CCCNc2cc(C)sc2[N+](=O)[O-])CC1 ZINC000596076170 479123343 /nfs/dbraw/zinc/12/33/43/479123343.db2.gz LZICNISWXDMEDU-UHFFFAOYSA-N 0 3 341.433 2.652 20 5 EFBDHN CN(C)CCN(C(=O)Cc1ccc(F)cc1[N+](=O)[O-])c1ccccc1 ZINC000593040559 479138060 /nfs/dbraw/zinc/13/80/60/479138060.db2.gz JOSFWSAOPYFTML-UHFFFAOYSA-N 0 3 345.374 2.871 20 5 EFBDHN Cc1ccc([C@H](CNc2cc[nH]c(=O)c2[N+](=O)[O-])N2CCCC2)o1 ZINC000596108388 479141895 /nfs/dbraw/zinc/14/18/95/479141895.db2.gz BMEJHDUGCUDUQF-ZDUSSCGKSA-N 0 3 332.360 2.846 20 5 EFBDHN C[C@@H](CSc1ccccc1)N(C)CCn1cc([N+](=O)[O-])ccc1=O ZINC000593046082 479142454 /nfs/dbraw/zinc/14/24/54/479142454.db2.gz MVCACUPPWITZMU-AWEZNQCLSA-N 0 3 347.440 2.869 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])NCc1cnnn1CC ZINC000599062440 479144006 /nfs/dbraw/zinc/14/40/06/479144006.db2.gz QCTYNIKMYMSZTK-GFCCVEGCSA-N 0 3 335.433 2.867 20 5 EFBDHN CN1CCC[C@]2(CCN(C(=O)/C=C\c3ccc(F)cc3[N+](=O)[O-])C2)C1 ZINC000493751574 479145284 /nfs/dbraw/zinc/14/52/84/479145284.db2.gz VMFPWURZCUXHOK-SUZKBHRPSA-N 0 3 347.390 2.691 20 5 EFBDHN CSC1(CNC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CCN(C)CC1 ZINC000493752742 479145904 /nfs/dbraw/zinc/14/59/04/479145904.db2.gz LEHZKUPTYWJQGH-VMPITWQZSA-N 0 3 349.456 2.552 20 5 EFBDHN CC[C@@H]1COC(C)(C)CN1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000593057307 479149233 /nfs/dbraw/zinc/14/92/33/479149233.db2.gz SLWGNKYIUUKWIG-CYBMUJFWSA-N 0 3 335.404 2.813 20 5 EFBDHN COc1cc(NC2CCN([C@H]3CCOC3)CC2)c([N+](=O)[O-])cc1C ZINC000596167472 479175567 /nfs/dbraw/zinc/17/55/67/479175567.db2.gz HXISZXUCBMAJSS-AWEZNQCLSA-N 0 3 335.404 2.577 20 5 EFBDHN CC[C@H]1CN(c2cc[nH]c(=O)c2[N+](=O)[O-])CCN1Cc1ccccc1 ZINC000596191723 479190298 /nfs/dbraw/zinc/19/02/98/479190298.db2.gz CWVUUIRORCBDMB-HNNXBMFYSA-N 0 3 342.399 2.796 20 5 EFBDHN CN(C(=O)C(C[C@@H]1CCCO1)C(F)(F)F)c1ccc([N+](=O)[O-])nc1 ZINC000593144385 479202747 /nfs/dbraw/zinc/20/27/47/479202747.db2.gz WBNCKYRKKITQIK-QWRGUYRKSA-N 0 3 347.293 2.700 20 5 EFBDHN COc1ccc(OCCN(C)CCOC(C)(C)C)c([N+](=O)[O-])c1 ZINC000610859984 479211993 /nfs/dbraw/zinc/21/19/93/479211993.db2.gz ZAFKLITYSQYXDJ-UHFFFAOYSA-N 0 3 326.393 2.729 20 5 EFBDHN CN1CCN(c2ncnc3ccc([N+](=O)[O-])cc32)CC12CCCCC2 ZINC000596251137 479224296 /nfs/dbraw/zinc/22/42/96/479224296.db2.gz ORLRBCDEKZORSM-UHFFFAOYSA-N 0 3 341.415 2.993 20 5 EFBDHN C[C@H]1CN(c2cc[n-]c(=O)c2[N+](=O)[O-])CC[N@H+](Cc2ccccc2)C1 ZINC000596257072 479226592 /nfs/dbraw/zinc/22/65/92/479226592.db2.gz KLWBNEGDIJJMNB-CQSZACIVSA-N 0 3 342.399 2.654 20 5 EFBDHN C[C@H]1CN(c2cc[n-]c(=O)c2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1 ZINC000596257072 479226601 /nfs/dbraw/zinc/22/66/01/479226601.db2.gz KLWBNEGDIJJMNB-CQSZACIVSA-N 0 3 342.399 2.654 20 5 EFBDHN O=[N+]([O-])c1cc(NC[C@@H]2CCCN2CCCO)ccc1C(F)(F)F ZINC000596259748 479227965 /nfs/dbraw/zinc/22/79/65/479227965.db2.gz VZWFLXUGEQHPHG-LBPRGKRZSA-N 0 3 347.337 2.872 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCC1(S(C)(=O)=O)CCCC1 ZINC000556921599 479236905 /nfs/dbraw/zinc/23/69/05/479236905.db2.gz QBQJWHJUGNFEPH-ZDUSSCGKSA-N 0 3 340.445 2.911 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCCN(c3ccncc3)CC2)c1 ZINC000603084596 479238745 /nfs/dbraw/zinc/23/87/45/479238745.db2.gz UVDAKKYPAWCCHI-UHFFFAOYSA-N 0 3 340.383 2.651 20 5 EFBDHN Cc1nc(NC(=O)[C@H]2CCN(Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000602284714 479270847 /nfs/dbraw/zinc/27/08/47/479270847.db2.gz GMSINTFGWATOSB-HNNXBMFYSA-N 0 3 340.383 2.759 20 5 EFBDHN Cc1nc(NC(=O)[C@@H]2CCN(Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000602284716 479271125 /nfs/dbraw/zinc/27/11/25/479271125.db2.gz GMSINTFGWATOSB-OAHLLOKOSA-N 0 3 340.383 2.759 20 5 EFBDHN CC[C@H](CN1CCCC1)NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000611151265 479295316 /nfs/dbraw/zinc/29/53/16/479295316.db2.gz WLJJALLJCNYZGP-CQSZACIVSA-N 0 3 344.415 2.609 20 5 EFBDHN CC(C)[C@H](N)c1cn(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)nn1 ZINC000603231022 479313320 /nfs/dbraw/zinc/31/33/20/479313320.db2.gz JTKBONDATZOQAU-ZDUSSCGKSA-N 0 3 343.309 2.909 20 5 EFBDHN CC(C)[C@@H](N)c1cn(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)nn1 ZINC000603231021 479313406 /nfs/dbraw/zinc/31/34/06/479313406.db2.gz JTKBONDATZOQAU-CYBMUJFWSA-N 0 3 343.309 2.909 20 5 EFBDHN COc1ccc2c(c1)ncc([N+](=O)[O-])c2N1CC[C@@H](N2CCCC2)C1 ZINC000574602438 479315045 /nfs/dbraw/zinc/31/50/45/479315045.db2.gz UNAIPCNPSJFFQB-CYBMUJFWSA-N 0 3 342.399 2.826 20 5 EFBDHN Cc1c(CN2CCC[C@@H](N3CCOCC3)CC2)cccc1[N+](=O)[O-] ZINC000585718322 479315966 /nfs/dbraw/zinc/31/59/66/479315966.db2.gz CKORFFGVTRVEDT-QGZVFWFLSA-N 0 3 333.432 2.590 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C/CN1CCCN(C[C@@H]2CCCO2)CC1 ZINC000611254050 479324883 /nfs/dbraw/zinc/32/48/83/479324883.db2.gz KFXRYXCSIAKSTJ-JGIVAVPZSA-N 0 3 345.443 2.795 20 5 EFBDHN C[C@@H](CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-])N1CCC(C)CC1 ZINC000593422995 479334481 /nfs/dbraw/zinc/33/44/81/479334481.db2.gz RIHUUAALBTULBV-ZDUSSCGKSA-N 0 3 337.395 2.513 20 5 EFBDHN Cn1cc(C[C@H]2CCN(C/C=C\c3ccccc3[N+](=O)[O-])C2)cn1 ZINC000611276251 479335522 /nfs/dbraw/zinc/33/55/22/479335522.db2.gz FMDRCLSNFNMVES-ZDTYVGOBSA-N 0 3 326.400 2.906 20 5 EFBDHN O=[N+]([O-])c1ccc2ncnc(NC[C@H]3CCN3Cc3ccccc3)c2c1 ZINC000596556319 479337993 /nfs/dbraw/zinc/33/79/93/479337993.db2.gz AMQVJGMHNRRVJI-MRXNPFEDSA-N 0 3 349.394 2.646 20 5 EFBDHN CCC1(O)CCC(NCc2cc(OC)c(OC)cc2[N+](=O)[O-])CC1 ZINC000611314612 479346827 /nfs/dbraw/zinc/34/68/27/479346827.db2.gz RXAWANGAPHYDFT-UHFFFAOYSA-N 0 3 338.404 2.785 20 5 EFBDHN O=c1ccc(CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c[nH]1 ZINC000602476314 479355409 /nfs/dbraw/zinc/35/54/09/479355409.db2.gz MUHYJXDLSGKDMR-UHFFFAOYSA-N 0 3 329.356 2.739 20 5 EFBDHN CCOCCN(CCn1cc([N+](=O)[O-])cn1)[C@@H]1CCc2ccccc21 ZINC000599626725 479358506 /nfs/dbraw/zinc/35/85/06/479358506.db2.gz ZDGANQAJXWYUIG-GOSISDBHSA-N 0 3 344.415 2.817 20 5 EFBDHN C[C@@H]1[C@@H](C)N(Cc2ccccc2)[C@@H](C)CN1c1c([N+](=O)[O-])ncn1C ZINC000593483851 479361658 /nfs/dbraw/zinc/36/16/58/479361658.db2.gz JVDGSEMIMIMNQD-RRFJBIMHSA-N 0 3 343.431 2.816 20 5 EFBDHN C[C@H](CNCc1nc2cc([N+](=O)[O-])ccc2o1)N1CCC[C@H](C)C1 ZINC000602513181 479376321 /nfs/dbraw/zinc/37/63/21/479376321.db2.gz AGSBLIIREBCEIC-QWHCGFSZSA-N 0 3 332.404 2.946 20 5 EFBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CN[C@@H](CO)CC2CCC2)c1 ZINC000603426029 479382337 /nfs/dbraw/zinc/38/23/37/479382337.db2.gz BYYUGVJUXRKWTC-GFCCVEGCSA-N 0 3 330.331 2.837 20 5 EFBDHN CCOc1ccc(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1 ZINC000575020506 479390203 /nfs/dbraw/zinc/39/02/03/479390203.db2.gz SPQKWTQFMIWDHT-HNNXBMFYSA-N 0 3 346.383 2.523 20 5 EFBDHN Cc1noc(C)c1[C@H](C)NC1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602555144 479395389 /nfs/dbraw/zinc/39/53/89/479395389.db2.gz OSMULLTZLYMXIC-NSHDSACASA-N 0 3 345.403 2.914 20 5 EFBDHN CCNC(=O)C(C)(C)CNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602575635 479404767 /nfs/dbraw/zinc/40/47/67/479404767.db2.gz UCBIBBQWGSRGOF-UHFFFAOYSA-N 0 3 347.337 2.866 20 5 EFBDHN CNC(=O)[C@H]1CCC[C@@H]1NCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602576212 479405957 /nfs/dbraw/zinc/40/59/57/479405957.db2.gz JXNFNCIHKMQSCM-RYUDHWBXSA-N 0 3 345.321 2.618 20 5 EFBDHN C[C@@H](CO)CCCNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602576378 479406371 /nfs/dbraw/zinc/40/63/71/479406371.db2.gz BLOZACBBDPCVCK-MRVPVSSYSA-N 0 3 337.239 2.917 20 5 EFBDHN COc1ccc(CN(C)C)cc1NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000603589974 479409783 /nfs/dbraw/zinc/40/97/83/479409783.db2.gz XGWMXHXBHVMSCM-UHFFFAOYSA-N 0 3 343.383 2.846 20 5 EFBDHN CC(C)(C)[C@@H](CO)NCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602607052 479421688 /nfs/dbraw/zinc/42/16/88/479421688.db2.gz FWWCGULVKUHJGK-SECBINFHSA-N 0 3 337.239 2.915 20 5 EFBDHN COC(=O)COc1ccc(CNC2CC3(CCC3)C2)cc1[N+](=O)[O-] ZINC000593687192 479422846 /nfs/dbraw/zinc/42/28/46/479422846.db2.gz FPLSCXGLVTULDV-UHFFFAOYSA-N 0 3 334.372 2.569 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2ccc(CNCC[C@@]3(O)CCCOC3)o2)c1 ZINC000593691034 479423702 /nfs/dbraw/zinc/42/37/02/479423702.db2.gz JNEYANZUJIYSHT-SFHVURJKSA-N 0 3 346.383 2.876 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CNCC[C@@]3(O)CCCOC3)o2)cc1 ZINC000593690989 479423756 /nfs/dbraw/zinc/42/37/56/479423756.db2.gz GQTCXONQAVULQH-SFHVURJKSA-N 0 3 346.383 2.876 20 5 EFBDHN CCOc1ccc([C@H](C)NCC[C@]2(O)CCCOC2)cc1[N+](=O)[O-] ZINC000593720960 479434518 /nfs/dbraw/zinc/43/45/18/479434518.db2.gz NMXWLSFFWNCOEM-SUMWQHHRSA-N 0 3 338.404 2.576 20 5 EFBDHN CN(C[C@]1(O)CCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])s1 ZINC000614533754 479437810 /nfs/dbraw/zinc/43/78/10/479437810.db2.gz ULGYDBKEPPBXGX-QGZVFWFLSA-N 0 3 347.440 2.730 20 5 EFBDHN O=[N+]([O-])c1ccc2oc(CNC[C@@H]3CCCCN3C3CC3)nc2c1 ZINC000602635474 479439504 /nfs/dbraw/zinc/43/95/04/479439504.db2.gz ZAGHVRAIUXAPSG-AWEZNQCLSA-N 0 3 330.388 2.843 20 5 EFBDHN CO[C@@H](CNCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@@H]1CCOC1 ZINC000602641481 479442652 /nfs/dbraw/zinc/44/26/52/479442652.db2.gz SCFBGFRBQQLJGK-RISCZKNCSA-N 0 3 348.321 2.755 20 5 EFBDHN CNC(=O)[C@@]1(C)CCN(Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602641827 479442843 /nfs/dbraw/zinc/44/28/43/479442843.db2.gz FMWZAQATMLGHCD-AWEZNQCLSA-N 0 3 345.321 2.572 20 5 EFBDHN O=[N+]([O-])c1sc(CNC[C@H]2CC[C@@H](O)C2)cc1Br ZINC000602647094 479446208 /nfs/dbraw/zinc/44/62/08/479446208.db2.gz SSMBOTJYXYCGMA-JGVFFNPUSA-N 0 3 335.223 2.669 20 5 EFBDHN CN(C)CCN(Cc1ccco1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602661907 479457654 /nfs/dbraw/zinc/45/76/54/479457654.db2.gz INRRREKPBAXHBX-UHFFFAOYSA-N 0 3 344.371 2.893 20 5 EFBDHN CC(C)(CO)CCNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602672732 479466022 /nfs/dbraw/zinc/46/60/22/479466022.db2.gz GVJOVRWIUQCUFL-UHFFFAOYSA-N 0 3 337.239 2.917 20 5 EFBDHN CCc1nc(C)c(CNC2CCN(c3ccc([N+](=O)[O-])nc3)CC2)o1 ZINC000602672379 479466186 /nfs/dbraw/zinc/46/61/86/479466186.db2.gz YNXMNEDZSSNDBH-UHFFFAOYSA-N 0 3 345.403 2.607 20 5 EFBDHN CCc1noc(C)c1CNC1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602675670 479468108 /nfs/dbraw/zinc/46/81/08/479468108.db2.gz NRFQQXGQSHWYHP-UHFFFAOYSA-N 0 3 345.403 2.607 20 5 EFBDHN CCN(C(=O)c1cc(Cl)cc([N+](=O)[O-])c1)C1CCN(C)CC1 ZINC000599985202 479487429 /nfs/dbraw/zinc/48/74/29/479487429.db2.gz ABMKLTMVIVOCRA-UHFFFAOYSA-N 0 3 325.796 2.805 20 5 EFBDHN CCN(C(=O)CCCNc1ccc([N+](=O)[O-])cc1)C1CCN(C)CC1 ZINC000599986507 479487966 /nfs/dbraw/zinc/48/79/66/479487966.db2.gz VWLAJQMHKDGRFL-UHFFFAOYSA-N 0 3 348.447 2.730 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNCC[C@]1(O)CCCOC1 ZINC000602707986 479492107 /nfs/dbraw/zinc/49/21/07/479492107.db2.gz VOVJYEJCRJCBLY-CQSZACIVSA-N 0 3 348.321 2.635 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N(C)CCN2CCCCC2)c1 ZINC000593884105 479496920 /nfs/dbraw/zinc/49/69/20/479496920.db2.gz QXJRNKMGBSDMKU-UHFFFAOYSA-N 0 3 337.445 2.875 20 5 EFBDHN CSc1ccc(C(=O)N(C)CCN2CCCCC2)cc1[N+](=O)[O-] ZINC000593884646 479497029 /nfs/dbraw/zinc/49/70/29/479497029.db2.gz VHCLWSVHINZERR-UHFFFAOYSA-N 0 3 337.445 2.875 20 5 EFBDHN O=[N+]([O-])c1ccc2oc(CN[C@@H]3CCCN4CCCC[C@@H]34)nc2c1 ZINC000602713005 479497055 /nfs/dbraw/zinc/49/70/55/479497055.db2.gz XRWOQPAWGVVVEY-HIFRSBDPSA-N 0 3 330.388 2.843 20 5 EFBDHN COC1CCN(CCN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000618571528 479497226 /nfs/dbraw/zinc/49/72/26/479497226.db2.gz BPZQGHUFAYKAIZ-GOSISDBHSA-N 0 3 333.432 2.673 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC[C@H](C(=O)N2CCCC2)C1 ZINC000575907893 479498621 /nfs/dbraw/zinc/49/86/21/479498621.db2.gz VQDCMEBWJWQMGN-JMPLCFMRSA-N 0 3 343.427 2.942 20 5 EFBDHN COC(=O)COc1ccc(CN2CCC[C@@H](C3CC3)C2)cc1[N+](=O)[O-] ZINC000589209371 479499998 /nfs/dbraw/zinc/49/99/98/479499998.db2.gz IZAHOYFAGGILBK-OAHLLOKOSA-N 0 3 348.399 2.769 20 5 EFBDHN CCOc1ccccc1CNC[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000575916640 479500186 /nfs/dbraw/zinc/50/01/86/479500186.db2.gz TVFIJDDVSYGZQI-OAHLLOKOSA-N 0 3 346.383 2.523 20 5 EFBDHN NC(=O)Cc1ccc(CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000589344785 479516246 /nfs/dbraw/zinc/51/62/46/479516246.db2.gz GONCRYYSVCYWFY-SFHVURJKSA-N 0 3 339.395 2.790 20 5 EFBDHN CC[C@]1(O)CCCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000602740957 479521863 /nfs/dbraw/zinc/52/18/63/479521863.db2.gz SILUWPPRNBYYSS-SFHVURJKSA-N 0 3 344.415 2.732 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN1CCC(c2ccc(O)cc2)CC1 ZINC000602759105 479532840 /nfs/dbraw/zinc/53/28/40/479532840.db2.gz PGEVGBBGDIQIPB-UHFFFAOYSA-N 0 3 330.388 2.685 20 5 EFBDHN COc1ccccc1[C@@H]1CCN(CCn2c(C)ncc2[N+](=O)[O-])C1 ZINC000602781578 479547995 /nfs/dbraw/zinc/54/79/95/479547995.db2.gz TZPLVHOBCGWGEU-CQSZACIVSA-N 0 3 330.388 2.598 20 5 EFBDHN CCC(C)(C)N1CCN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000594020987 479552394 /nfs/dbraw/zinc/55/23/94/479552394.db2.gz OQEPNQPMXKAAOI-UHFFFAOYSA-N 0 3 331.420 2.777 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCNC1(c2ccc(F)cc2)CCOCC1 ZINC000602791001 479555100 /nfs/dbraw/zinc/55/51/00/479555100.db2.gz BJSGSJSTDSRWLL-UHFFFAOYSA-N 0 3 348.378 2.534 20 5 EFBDHN Cc1nc2c(s1)[C@H](N(C)CCn1c(C)ncc1[N+](=O)[O-])CCC2 ZINC000602790007 479555547 /nfs/dbraw/zinc/55/55/47/479555547.db2.gz DONJSWWRIWJIOC-CYBMUJFWSA-N 0 3 335.433 2.874 20 5 EFBDHN CN(Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H]1CCC(=O)N(C)C1 ZINC000600178219 479564651 /nfs/dbraw/zinc/56/46/51/479564651.db2.gz HTDMOUSYCRGBDW-OAHLLOKOSA-N 0 3 343.383 2.907 20 5 EFBDHN CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCC(=O)N(C)C1 ZINC000600179244 479566219 /nfs/dbraw/zinc/56/62/19/479566219.db2.gz WWDHRCKGRGEELR-OAHLLOKOSA-N 0 3 343.383 2.907 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H]1CCCN2CCCC[C@@H]12 ZINC000594094443 479585830 /nfs/dbraw/zinc/58/58/30/479585830.db2.gz JYGLEVMELYPWLM-ZFWWWQNUSA-N 0 3 348.403 2.742 20 5 EFBDHN C[C@@H]1CCN(C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC12CCC2 ZINC000612113923 479587600 /nfs/dbraw/zinc/58/76/00/479587600.db2.gz ZOTKLJDLUZZBJV-HUUCEWRRSA-N 0 3 334.416 2.847 20 5 EFBDHN C[C@H]1CCN(C[C@H](O)COc2ccccc2[N+](=O)[O-])CC12CCC2 ZINC000612113922 479588153 /nfs/dbraw/zinc/58/81/53/479588153.db2.gz ZOTKLJDLUZZBJV-GJZGRUSLSA-N 0 3 334.416 2.847 20 5 EFBDHN O=[N+]([O-])c1cc(F)c(CN2CCCN(c3ccncc3)CC2)c(F)c1 ZINC000602849977 479592686 /nfs/dbraw/zinc/59/26/86/479592686.db2.gz SMXCOIUXRIGRAG-UHFFFAOYSA-N 0 3 348.353 2.980 20 5 EFBDHN O=[N+]([O-])c1cccc2c(N3CCN(c4ccncc4)CC3)ccnc21 ZINC000590078683 479600632 /nfs/dbraw/zinc/60/06/32/479600632.db2.gz ZZYXLJSHBDCWFH-UHFFFAOYSA-N 0 3 335.367 2.865 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC[C@@H]2NC(=O)CC[C@H]2C1 ZINC000597207183 479620612 /nfs/dbraw/zinc/62/06/12/479620612.db2.gz SQEKZLZVZHPGEV-NOPRJXFKSA-N 0 3 329.400 2.599 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN2CCC(O)(CO)CC2)s1 ZINC000597208293 479620735 /nfs/dbraw/zinc/62/07/35/479620735.db2.gz ZEVWVNQRUGOORU-UHFFFAOYSA-N 0 3 348.424 2.643 20 5 EFBDHN C[C@H](C(=O)N[C@@H]1CCCN2CCCC[C@@H]12)c1cccc([N+](=O)[O-])c1 ZINC000594195430 479627281 /nfs/dbraw/zinc/62/72/81/479627281.db2.gz GYDAQJXKKPFOHM-XKQJLSEDSA-N 0 3 331.416 2.831 20 5 EFBDHN O=C(CSc1ccc([N+](=O)[O-])cc1)N[C@H]1CCCN2CCCC[C@H]12 ZINC000594197190 479627923 /nfs/dbraw/zinc/62/79/23/479627923.db2.gz AVOBTWQILAGKSR-JKSUJKDBSA-N 0 3 349.456 2.820 20 5 EFBDHN COc1cc(C(=O)N[C@@H]2CCCN3CCCC[C@@H]23)cc([N+](=O)[O-])c1C ZINC000594197497 479628124 /nfs/dbraw/zinc/62/81/24/479628124.db2.gz OUGYQDIVJYQSLA-CABCVRRESA-N 0 3 347.415 2.659 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCCN2CCCC[C@@H]12 ZINC000594199397 479629207 /nfs/dbraw/zinc/62/92/07/479629207.db2.gz YIOPHDNJWYONBB-KGLIPLIRSA-N 0 3 347.415 2.740 20 5 EFBDHN CCNc1ccc(C(=O)N[C@@H]2CCCN3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC000594200263 479629687 /nfs/dbraw/zinc/62/96/87/479629687.db2.gz KHQRSRYOEQBXGE-HZPDHXFCSA-N 0 3 346.431 2.773 20 5 EFBDHN O=C(N[C@@H]1CCCN2CCCC[C@@H]12)c1ccc([N+](=O)[O-])cc1Cl ZINC000594202773 479631329 /nfs/dbraw/zinc/63/13/29/479631329.db2.gz RQLOXRDWDJBXAQ-CABCVRRESA-N 0 3 337.807 2.995 20 5 EFBDHN CC(C)(C(=O)NCc1cccc([N+](=O)[O-])c1)[C@H](N)c1ccccc1 ZINC000579108490 479661331 /nfs/dbraw/zinc/66/13/31/479661331.db2.gz SJDBTSJRWSSPCY-MRXNPFEDSA-N 0 3 327.384 2.937 20 5 EFBDHN O=[N+]([O-])c1cccc2ncnc(N3CC[C@H](N4CCCCC4)C3)c21 ZINC000612444419 479673583 /nfs/dbraw/zinc/67/35/83/479673583.db2.gz RQHUOOJVFOJNOU-ZDUSSCGKSA-N 0 3 327.388 2.603 20 5 EFBDHN CN1CCN(CC2(C)CCN(c3sccc3[N+](=O)[O-])CC2)CC1 ZINC000612455693 479676191 /nfs/dbraw/zinc/67/61/91/479676191.db2.gz ACICRFLIJQTFCA-UHFFFAOYSA-N 0 3 338.477 2.510 20 5 EFBDHN COc1ccc(OCCN[C@H](C)c2c(C)noc2C)c([N+](=O)[O-])c1 ZINC000612461818 479677334 /nfs/dbraw/zinc/67/73/34/479677334.db2.gz WYDHBSRQAOEXTH-SNVBAGLBSA-N 0 3 335.360 2.938 20 5 EFBDHN C[C@@H](CC1CCC1)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000612576139 479697754 /nfs/dbraw/zinc/69/77/54/479697754.db2.gz LXTKAQBLFDUDCP-LBPRGKRZSA-N 0 3 326.418 2.537 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@@H]2CCc3ccccc32)c1 ZINC000619558368 479828117 /nfs/dbraw/zinc/82/81/17/479828117.db2.gz LCDZWZKSKJYEEH-MAUKXSAKSA-N 0 3 328.368 2.612 20 5 EFBDHN C[C@@](CO)(NCCCOc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000609537126 480171510 /nfs/dbraw/zinc/17/15/10/480171510.db2.gz JDNPVYSOQMZZAF-SFHVURJKSA-N 0 3 330.384 2.861 20 5 EFBDHN C[C@H](CN1CCN(c2ccc([N+](=O)[O-])nc2)CC1)c1ccccc1 ZINC000609739461 480200224 /nfs/dbraw/zinc/20/02/24/480200224.db2.gz ODUBXBQDBAYXQN-OAHLLOKOSA-N 0 3 326.400 2.916 20 5 EFBDHN CC[C@@H](CN1CCCC1)NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000609851248 480213514 /nfs/dbraw/zinc/21/35/14/480213514.db2.gz YXJJEERHMQDALJ-AWEZNQCLSA-N 0 3 346.431 2.773 20 5 EFBDHN CC[C@H](CN1CCCC1)NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000609877263 480215314 /nfs/dbraw/zinc/21/53/14/480215314.db2.gz LBRQCPNTGKBLRD-CYBMUJFWSA-N 0 3 339.823 2.781 20 5 EFBDHN CC[C@@H](CN1CCCC1)NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000609877097 480215764 /nfs/dbraw/zinc/21/57/64/480215764.db2.gz JQSMOBPEZJIPNE-ZDUSSCGKSA-N 0 3 331.372 2.945 20 5 EFBDHN Cn1cc([N+](=O)[O-])cc1C(=O)N(CCN1CCCC1)c1ccccc1 ZINC000610052342 480231500 /nfs/dbraw/zinc/23/15/00/480231500.db2.gz CQSUWEGLBSPFFJ-UHFFFAOYSA-N 0 3 342.399 2.676 20 5 EFBDHN Cn1cnc([N+](=O)[O-])c1NC[C@H]1CCCN(C)[C@H]1c1cccs1 ZINC000610281307 480270638 /nfs/dbraw/zinc/27/06/38/480270638.db2.gz HTKSTDQPXAFBTP-DGCLKSJQSA-N 0 3 335.433 2.885 20 5 EFBDHN CC[C@H](NCc1ccc(CC(N)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000610517469 480327708 /nfs/dbraw/zinc/32/77/08/480327708.db2.gz GCRKJCOBKMZEAU-KRWDZBQOSA-N 0 3 327.384 2.864 20 5 EFBDHN CC[C@@H](NCc1ccc(CC(N)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000610517471 480327823 /nfs/dbraw/zinc/32/78/23/480327823.db2.gz GCRKJCOBKMZEAU-QGZVFWFLSA-N 0 3 327.384 2.864 20 5 EFBDHN CC[C@@H](CN1CCCC1)NC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000610717237 480373359 /nfs/dbraw/zinc/37/33/59/480373359.db2.gz CVZIHAOVZARIJS-LBPRGKRZSA-N 0 3 336.392 2.599 20 5 EFBDHN CC[C@@H](CN1CCCC1)NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000610719285 480374119 /nfs/dbraw/zinc/37/41/19/480374119.db2.gz PKTOBLVMZZUZFV-HIFRSBDPSA-N 0 3 334.420 2.829 20 5 EFBDHN COc1cc(C[NH2+][C@@H]2CCc3cc(O)ccc3C2)c([N+](=O)[O-])cc1[O-] ZINC000618197854 480566013 /nfs/dbraw/zinc/56/60/13/480566013.db2.gz JYBOYCJLTWCHAF-CQSZACIVSA-N 0 3 344.367 2.662 20 5 EFBDHN COc1cc(C[NH2+][C@H]2CCc3cc(O)ccc3C2)c([N+](=O)[O-])cc1[O-] ZINC000618197853 480566286 /nfs/dbraw/zinc/56/62/86/480566286.db2.gz JYBOYCJLTWCHAF-AWEZNQCLSA-N 0 3 344.367 2.662 20 5 EFBDHN Cc1c(CC(=O)NCc2ccccc2CN(C)C)cccc1[N+](=O)[O-] ZINC000178556052 533833562 /nfs/dbraw/zinc/83/35/62/533833562.db2.gz UWLMCYXITORCHM-UHFFFAOYSA-N 0 3 341.411 2.824 20 5 EFBDHN Cc1c(CC(=O)NC[C@H](c2ccccc2)N(C)C)cccc1[N+](=O)[O-] ZINC000159303462 533832945 /nfs/dbraw/zinc/83/29/45/533832945.db2.gz KDSFCCLVWZVGEP-GOSISDBHSA-N 0 3 341.411 2.865 20 5 EFBDHN C[C@H](NCc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000181520199 533914365 /nfs/dbraw/zinc/91/43/65/533914365.db2.gz IBHOGRJEPLPEIC-OLZOCXBDSA-N 0 3 327.384 2.976 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCN1CCCCC[C@H]1c1ccco1 ZINC000159836575 534320544 /nfs/dbraw/zinc/32/05/44/534320544.db2.gz YTMVXHDVLDMDBM-HNNXBMFYSA-N 0 3 331.372 2.967 20 5 EFBDHN NC(=O)[C@@H]1CCCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000154996610 534425955 /nfs/dbraw/zinc/42/59/55/534425955.db2.gz HXEKMVDGFTURLX-CYBMUJFWSA-N 0 3 329.356 2.552 20 5 EFBDHN CC(C)[C@@H](CCO)NCc1ccc(Br)cc1[N+](=O)[O-] ZINC000231072040 519793010 /nfs/dbraw/zinc/79/30/10/519793010.db2.gz QJWRPRUGLMUVAK-GFCCVEGCSA-N 0 3 331.210 2.854 20 5 EFBDHN NC(=O)[C@H]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000155039073 534450528 /nfs/dbraw/zinc/45/05/28/534450528.db2.gz SPLSXGKIBNPZPM-ZDUSSCGKSA-N 0 3 329.356 2.552 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@H](C)[C@H](CO)SC)cc1[N+](=O)[O-] ZINC000245507641 521261053 /nfs/dbraw/zinc/26/10/53/521261053.db2.gz QMKXIYZITLRQQT-RWSFTLGLSA-N 0 3 328.434 2.757 20 5 EFBDHN CCS[C@@H]1CC[C@@H](N(C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000072837676 521726999 /nfs/dbraw/zinc/72/69/99/521726999.db2.gz JPOGONFEMULYRM-ZIAGYGMSSA-N 0 3 337.445 2.800 20 5 EFBDHN CCS[C@@H]1CC[C@H](N(C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000072837670 521728104 /nfs/dbraw/zinc/72/81/04/521728104.db2.gz JPOGONFEMULYRM-UONOGXRCSA-N 0 3 337.445 2.800 20 5 EFBDHN CC[C@H]1CCCCN1CCNC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000154768025 523023563 /nfs/dbraw/zinc/02/35/63/523023563.db2.gz GVSCYKWRPRNYKM-AWEZNQCLSA-N 0 3 337.395 2.657 20 5 EFBDHN COCc1cccc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000179237224 523041723 /nfs/dbraw/zinc/04/17/23/523041723.db2.gz GTMLUBOXIMVBLA-INIZCTEOSA-N 0 3 342.399 2.823 20 5 EFBDHN CC[C@@H]1CCCCN1CCNC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000119407737 523172173 /nfs/dbraw/zinc/17/21/73/523172173.db2.gz SBFOOWGZTDGKMO-MRXNPFEDSA-N 0 3 348.447 2.701 20 5 EFBDHN COc1ccc(C(=O)NCC(C)(C)N2CCCCC2)cc1[N+](=O)[O-] ZINC000068937423 523689199 /nfs/dbraw/zinc/68/91/99/523689199.db2.gz WMAAQBCSESGVAW-UHFFFAOYSA-N 0 3 335.404 2.598 20 5 EFBDHN Cc1ccc(CN(C)C)cc1NC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000177316174 524387306 /nfs/dbraw/zinc/38/73/06/524387306.db2.gz MPQZWUVVCKULOT-UHFFFAOYSA-N 0 3 346.362 2.938 20 5 EFBDHN C[C@H]1CN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@@H](C)CN1 ZINC000237589180 524548777 /nfs/dbraw/zinc/54/87/77/524548777.db2.gz ANJZLDGKTZWMJI-QWRGUYRKSA-N 0 3 346.412 2.541 20 5 EFBDHN C[C@@H]1CN(CC(C)(C)O)CCN1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000189445864 524935349 /nfs/dbraw/zinc/93/53/49/524935349.db2.gz QHFGWYYSMDWMPS-GFCCVEGCSA-N 0 3 341.839 2.525 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000119717545 525011619 /nfs/dbraw/zinc/01/16/19/525011619.db2.gz YTURNJMEDXITEW-KDOFPFPSSA-N 0 3 339.395 2.845 20 5 EFBDHN C[C@@H]1CN[C@@H](C)CN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000237589213 525107361 /nfs/dbraw/zinc/10/73/61/525107361.db2.gz ANJZLDGKTZWMJI-WDEREUQCSA-N 0 3 346.412 2.541 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)CCN(C)CCC(F)(F)F ZINC000064634982 525465311 /nfs/dbraw/zinc/46/53/11/525465311.db2.gz JLYLLJXNEVUSDY-UHFFFAOYSA-N 0 3 349.309 2.816 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CN3CCC[C@@H](OCCO)C3)o2)cc1 ZINC000179573294 534881204 /nfs/dbraw/zinc/88/12/04/534881204.db2.gz CLFSJRWXJIZAHZ-MRXNPFEDSA-N 0 3 346.383 2.828 20 5 EFBDHN Cc1c(NC(=O)[C@@H](C)N(C)C[C@H]2CCCOC2)cccc1[N+](=O)[O-] ZINC000245497997 525851457 /nfs/dbraw/zinc/85/14/57/525851457.db2.gz VEVJFDITGJVZDK-ZIAGYGMSSA-N 0 3 335.404 2.589 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CCN(C)C[C@H]2C)c1 ZINC000120885437 526080506 /nfs/dbraw/zinc/08/05/06/526080506.db2.gz NUQJJRVSENFZDI-RISCZKNCSA-N 0 3 337.445 2.729 20 5 EFBDHN O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000193813493 526538592 /nfs/dbraw/zinc/53/85/92/526538592.db2.gz XOCOOENTTYFUSK-INIZCTEOSA-N 0 3 339.395 2.847 20 5 EFBDHN CC(C)(NCCc1ccc([N+](=O)[O-])cc1)C(=O)NCC1CCCC1 ZINC000155069845 527292788 /nfs/dbraw/zinc/29/27/88/527292788.db2.gz MWONNAZWVNJJQL-UHFFFAOYSA-N 0 3 333.432 2.812 20 5 EFBDHN O=[N+]([O-])c1ccc(CCN2CCC(OC[C@@H]3CCCO3)CC2)cc1 ZINC000083405916 527347640 /nfs/dbraw/zinc/34/76/40/527347640.db2.gz KOUNGMGOZVVYDH-SFHVURJKSA-N 0 3 334.416 2.797 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCN2CC[C@@H](Oc3ccncc3)C2)c1 ZINC000156383967 527390787 /nfs/dbraw/zinc/39/07/87/527390787.db2.gz BOBWZZYDBBNTJI-QGZVFWFLSA-N 0 3 329.356 2.522 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CCC[C@H](c3nc4ccccc4o3)C2)c1 ZINC000157639592 527414013 /nfs/dbraw/zinc/41/40/13/527414013.db2.gz DWAYQLMBFMNEJA-ZDUSSCGKSA-N 0 3 341.371 2.812 20 5 EFBDHN CCO[C@@H]1C[C@@](N)(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1(C)C ZINC000188003128 527877568 /nfs/dbraw/zinc/87/75/68/527877568.db2.gz YAASYDUJKLRPMA-WBHUJUFNSA-N 0 3 349.431 2.613 20 5 EFBDHN CC(C)[C@@H](CN[C@@H](C)c1cccc([N+](=O)[O-])c1)N1CCN(C)CC1 ZINC000132351126 528465428 /nfs/dbraw/zinc/46/54/28/528465428.db2.gz DJJLJIWLMYIKRH-MAUKXSAKSA-N 0 3 334.464 2.517 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000171853262 529009914 /nfs/dbraw/zinc/00/99/14/529009914.db2.gz LEIIVPFBIMYVTD-HNNXBMFYSA-N 0 3 334.420 2.611 20 5 EFBDHN CC(C)[C@H](CN[C@H](C)c1cccc([N+](=O)[O-])c1)N1CCN(C)CC1 ZINC000132351727 529016472 /nfs/dbraw/zinc/01/64/72/529016472.db2.gz DJJLJIWLMYIKRH-QAPCUYQASA-N 0 3 334.464 2.517 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H](N(C)C)C1 ZINC000131466857 529248213 /nfs/dbraw/zinc/24/82/13/529248213.db2.gz REKGSRGRNPMHSE-ZDUSSCGKSA-N 0 3 337.445 2.873 20 5 EFBDHN CC(C)Oc1cc(C(=O)N(CCN(C)C)C(C)C)ccc1[N+](=O)[O-] ZINC000412196119 534942549 /nfs/dbraw/zinc/94/25/49/534942549.db2.gz BGQRAWRUIGOTGX-UHFFFAOYSA-N 0 3 337.420 2.794 20 5 EFBDHN CC(C)Oc1cc(C(=O)N[C@@H]2C[C@@H](C)N(C3CC3)C2)ccc1[N+](=O)[O-] ZINC000412181947 534950307 /nfs/dbraw/zinc/95/03/07/534950307.db2.gz YVZBPKIVXHLXJG-TZMCWYRMSA-N 0 3 347.415 2.737 20 5 EFBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCN(C2CC2)C1 ZINC000359218127 535093864 /nfs/dbraw/zinc/09/38/64/535093864.db2.gz CPTHMIABSUXYHV-HNNXBMFYSA-N 0 3 346.431 2.752 20 5 EFBDHN CCCOc1ccc([C@@H](C)NCCn2cc([N+](=O)[O-])cn2)cc1OC ZINC000341649178 535281508 /nfs/dbraw/zinc/28/15/08/535281508.db2.gz XKILIBRCGODJIY-CYBMUJFWSA-N 0 3 348.403 2.940 20 5 EFBDHN CCN1CCC(NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000342657198 535469406 /nfs/dbraw/zinc/46/94/06/535469406.db2.gz FGBLZPNIKPHUID-UHFFFAOYSA-N 0 3 340.811 2.532 20 5 EFBDHN CCN1CCC[C@H]1CNC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000246976118 535601386 /nfs/dbraw/zinc/60/13/86/535601386.db2.gz JMDAEEVBHMSQBN-HIFRSBDPSA-N 0 3 334.420 2.748 20 5 EFBDHN CN(C)Cc1ccc(-c2noc(-c3ccc([N+](=O)[O-])n3C)n2)cc1 ZINC000355600800 535992808 /nfs/dbraw/zinc/99/28/08/535992808.db2.gz XLCHWDSFTAMULG-UHFFFAOYSA-N 0 3 327.344 2.712 20 5 EFBDHN CN(C)Cc1ccc(NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)cc1 ZINC000351835536 536015633 /nfs/dbraw/zinc/01/56/33/536015633.db2.gz TYFJHNJLPRZRNP-UHFFFAOYSA-N 0 3 343.339 2.637 20 5 EFBDHN CN(C)Cc1ccccc1C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000362960003 536044496 /nfs/dbraw/zinc/04/44/96/536044496.db2.gz HZPUVDGGEKDLLO-UHFFFAOYSA-N 0 3 327.384 2.629 20 5 EFBDHN CC[C@@]1(C)CCN(Cc2ccc(OCC(=O)OC)c([N+](=O)[O-])c2)C1 ZINC000355729773 536049378 /nfs/dbraw/zinc/04/93/78/536049378.db2.gz GFHVLVDJCSIKMC-KRWDZBQOSA-N 0 3 336.388 2.769 20 5 EFBDHN CN1CCCC(C)(C)[C@H]1CNC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000344639545 536351038 /nfs/dbraw/zinc/35/10/38/536351038.db2.gz GSDWCKQRNZQQLW-MRXNPFEDSA-N 0 3 333.432 2.764 20 5 EFBDHN CN1CCC[C@]2(CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3)C2)C1 ZINC000356269717 536394007 /nfs/dbraw/zinc/39/40/07/536394007.db2.gz AJHZJLMUZLZLIU-INIZCTEOSA-N 0 3 337.807 2.806 20 5 EFBDHN CO[C@](C)([C@@H](C)NCc1cc([N+](=O)[O-])cc2c1OCOC2)C1CC1 ZINC000411936505 536834824 /nfs/dbraw/zinc/83/48/24/536834824.db2.gz CHUXLYDCVGGLFB-PIGZYNQJSA-N 0 3 336.388 2.755 20 5 EFBDHN COc1ccc(OCCN[C@@H](C)c2ccnc(OC)c2)c([N+](=O)[O-])c1 ZINC000347553728 536849871 /nfs/dbraw/zinc/84/98/71/536849871.db2.gz IFBRQOWIERZRAI-LBPRGKRZSA-N 0 3 347.371 2.737 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCN(CCCc3ccncc3)CC2)cc1 ZINC000753915030 575359225 /nfs/dbraw/zinc/35/92/25/575359225.db2.gz GWTSFZRVDHOYJD-UHFFFAOYSA-N 0 3 326.400 2.745 20 5 EFBDHN C[C@@H]1CN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@@H](C)S1 ZINC000753917421 575359232 /nfs/dbraw/zinc/35/92/32/575359232.db2.gz PNHFGFQORDQNFY-GHMZBOCLSA-N 0 3 341.408 2.888 20 5 EFBDHN CCN(CC)C(=O)CN[C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000753940636 575363895 /nfs/dbraw/zinc/36/38/95/575363895.db2.gz UUMKYWJPJVLLFY-GDBMZVCRSA-N 0 3 333.432 2.764 20 5 EFBDHN C[C@H](NC[C@H](O)c1ccc([N+](=O)[O-])cc1)c1cccc([N+](=O)[O-])c1 ZINC000754250520 575410712 /nfs/dbraw/zinc/41/07/12/575410712.db2.gz JBXPGHSXVIPXKU-ZBEGNZNMSA-N 0 3 331.328 2.887 20 5 EFBDHN COC(=O)C[C@@H](NCc1cc([N+](=O)[O-])ccc1OC(C)C)C1CC1 ZINC000754539791 575449088 /nfs/dbraw/zinc/44/90/88/575449088.db2.gz MINJHYUFSDTZKN-OAHLLOKOSA-N 0 3 336.388 2.813 20 5 EFBDHN C[C@H](NCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CCCOC1 ZINC000754568707 575453974 /nfs/dbraw/zinc/45/39/74/575453974.db2.gz ODHPGRCGXUJHQR-QWRGUYRKSA-N 0 3 341.795 2.591 20 5 EFBDHN C[C@H](N[C@]1(C)CCO[C@@H]1C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000755170383 575555521 /nfs/dbraw/zinc/55/55/21/575555521.db2.gz QIIMIZPEBWOFSY-FEUHOPSXSA-N 0 3 341.795 2.732 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)CCN1C ZINC000756950058 575804338 /nfs/dbraw/zinc/80/43/38/575804338.db2.gz ASWNUONJCRJWID-CMPLNLGQSA-N 0 3 340.811 2.530 20 5 EFBDHN COc1ccc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(C)c1 ZINC000757661434 575848379 /nfs/dbraw/zinc/84/83/79/575848379.db2.gz MAXXZUBBDDUMJG-HNNXBMFYSA-N 0 3 342.399 2.993 20 5 EFBDHN Cc1cc(F)cc(C(=O)N2CCCN(C(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000758460409 575870201 /nfs/dbraw/zinc/87/02/01/575870201.db2.gz IRSVPCLBDZNHLD-UHFFFAOYSA-N 0 3 337.395 2.989 20 5 EFBDHN C[C@@H](CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCCCC1 ZINC000758582078 575873284 /nfs/dbraw/zinc/87/32/84/575873284.db2.gz KTKRBJSNQTVBIQ-ZDUSSCGKSA-N 0 3 344.415 2.609 20 5 EFBDHN C[C@H](CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCCCC1 ZINC000758582076 575873323 /nfs/dbraw/zinc/87/33/23/575873323.db2.gz KTKRBJSNQTVBIQ-CYBMUJFWSA-N 0 3 344.415 2.609 20 5 EFBDHN CN(C)CCOC1CCN(Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000761512396 576173214 /nfs/dbraw/zinc/17/32/14/576173214.db2.gz SKXLZONDUBYJHF-UHFFFAOYSA-N 0 3 341.839 2.791 20 5 EFBDHN CS(=O)(=O)[C@@H]1CCC[C@@H](NCc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000761525438 576174473 /nfs/dbraw/zinc/17/44/73/576174473.db2.gz JZZPKGXIFCFKDW-VXGBXAGGSA-N 0 3 346.836 2.694 20 5 EFBDHN CN(C)[C@]1(CNCc2ccc([N+](=O)[O-])c(Cl)c2)CCSC1 ZINC000761527218 576174777 /nfs/dbraw/zinc/17/47/77/576174777.db2.gz QGRDKQXPIOLYJJ-AWEZNQCLSA-N 0 3 329.853 2.775 20 5 EFBDHN CN(CCCNC(=O)C1CCC1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000763626080 576383099 /nfs/dbraw/zinc/38/30/99/576383099.db2.gz LDGLNFTWBMSMOA-UHFFFAOYSA-N 0 3 339.823 2.986 20 5 EFBDHN O=C(NC[C@H]1CCCCN1C1CC1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000765798718 577078135 /nfs/dbraw/zinc/07/81/35/577078135.db2.gz BWSKBGLAIRSHSM-CYBMUJFWSA-N 0 3 337.807 2.995 20 5 EFBDHN Cc1ccc([C@H](O)CN[C@H](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2)o1 ZINC000766141532 577113800 /nfs/dbraw/zinc/11/38/00/577113800.db2.gz MYBJZZHSKQKRRU-IAQYHMDHSA-N 0 3 347.371 2.537 20 5 EFBDHN CC(C)[NH+](CCCNc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)C(C)C ZINC000820115935 606037081 /nfs/dbraw/zinc/03/70/81/606037081.db2.gz CGUNPQRWXLTNOE-UHFFFAOYSA-N 0 3 347.423 2.696 20 5 EFBDHN CC(C)[NH+](CCCNc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1)C(C)C ZINC000820115935 606037087 /nfs/dbraw/zinc/03/70/87/606037087.db2.gz CGUNPQRWXLTNOE-UHFFFAOYSA-N 0 3 347.423 2.696 20 5 EFBDHN C[C@H](NCc1ccc([N+](=O)[O-])cc1Br)[C@@H]1CCOC1 ZINC000128468194 1248228065 /nfs/dbraw/zinc/22/80/65/1248228065.db2.gz SUWLUWHGLCYIIH-GXSJLCMTSA-N 0 3 329.194 2.872 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCCc1nnc2ccccn21 ZINC000850422268 1250478675 /nfs/dbraw/zinc/47/86/75/1250478675.db2.gz KTYCATCBJUHHND-GFCCVEGCSA-N 0 3 341.371 2.539 20 5 EFBDHN COc1ccc([C@H](O)CN[C@@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000850424832 1250481238 /nfs/dbraw/zinc/48/12/38/1250481238.db2.gz MAZKJXWKIINQGQ-YVEFUNNKSA-N 0 3 346.383 2.996 20 5 EFBDHN CN(C)Cc1cccc(C(=O)OCCOc2ccc([N+](=O)[O-])cc2)c1 ZINC000851355954 1250950325 /nfs/dbraw/zinc/95/03/25/1250950325.db2.gz FXKWDGYSPYMKFE-UHFFFAOYSA-N 0 3 344.367 2.892 20 5 EFBDHN CC(C)C(=O)N1CCC(CNCc2csc([N+](=O)[O-])c2)CC1 ZINC000997545618 1257944620 /nfs/dbraw/zinc/94/46/20/1257944620.db2.gz DMYQQZZEFWHPNJ-UHFFFAOYSA-N 0 3 325.434 2.641 20 5 EFBDHN CN(c1ccccc1)c1ccc(CNCC[S@](C)=O)cc1[N+](=O)[O-] ZINC000735084633 1267199910 /nfs/dbraw/zinc/19/99/10/1267199910.db2.gz MQIGODNVHLXNKL-DEOSSOPVSA-N 0 3 347.440 2.831 20 5 EFBDHN O=C(Cc1ccccc1[N+](=O)[O-])O[C@@H]1CCN(Cc2ccccc2)C1 ZINC000735210120 1267230972 /nfs/dbraw/zinc/23/09/72/1267230972.db2.gz KGEGDBFFQIPALD-QGZVFWFLSA-N 0 3 340.379 2.955 20 5 EFBDHN O=C(NC[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1)c1ccsc1 ZINC001086304135 1270913867 /nfs/dbraw/zinc/91/38/67/1270913867.db2.gz PBWODKSHSSSWAR-NNUKFRKNSA-N 0 3 345.424 2.955 20 5 EFBDHN Cc1[nH]ccc1C(=O)NC[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001086337873 1271056623 /nfs/dbraw/zinc/05/66/23/1271056623.db2.gz OCJAJHJFWBKOGZ-CTYIDZIISA-N 0 3 342.399 2.530 20 5 EFBDHN C[C@@H](NC[C@H](O)COc1cccc(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000746049934 1271744634 /nfs/dbraw/zinc/74/46/34/1271744634.db2.gz YHAKMGHNCUFSST-WBMJQRKESA-N 0 3 334.347 2.824 20 5 EFBDHN CC(C)C(=O)N[C@H]1CC[C@H](NCc2csc([N+](=O)[O-])c2)CC1 ZINC001034593565 1272345605 /nfs/dbraw/zinc/34/56/05/1272345605.db2.gz SHBSKZTWLFZNOO-JOCQHMNTSA-N 0 3 325.434 2.829 20 5 EFBDHN O=C(CN[C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(C(F)(F)F)cc1 ZINC001168976265 1272546164 /nfs/dbraw/zinc/54/61/64/1272546164.db2.gz CDYPMNVSXKOWPX-GXFFZTMASA-N 0 3 330.306 2.923 20 5 EFBDHN CCOc1ccccc1N1CCN([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169006200 1272580511 /nfs/dbraw/zinc/58/05/11/1272580511.db2.gz FZAPSPMEDJQFAM-JKSUJKDBSA-N 0 3 333.432 2.653 20 5 EFBDHN CCOc1ccccc1N1CCN([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169006194 1272580873 /nfs/dbraw/zinc/58/08/73/1272580873.db2.gz FZAPSPMEDJQFAM-CVEARBPZSA-N 0 3 333.432 2.653 20 5 EFBDHN COc1ccc(-c2nc(CN[C@@H]3CC[C@H](C[N+](=O)[O-])C3)co2)cc1 ZINC001168987922 1272588880 /nfs/dbraw/zinc/58/88/80/1272588880.db2.gz LIMATWMPWIQEMS-GXTWGEPZSA-N 0 3 331.372 2.885 20 5 EFBDHN CC[C@@H]1CN(C(=O)OC(C)(C)C)CCN1[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169033232 1272595823 /nfs/dbraw/zinc/59/58/23/1272595823.db2.gz BLVFFQGSEAYJDF-ZNMIVQPWSA-N 0 3 341.452 2.763 20 5 EFBDHN C[C@@H]1CN([C@H]2CC[C@@H](C[N+](=O)[O-])C2)C[C@H](C)N1C(=O)OC(C)(C)C ZINC001169037540 1272603103 /nfs/dbraw/zinc/60/31/03/1272603103.db2.gz SEDOFOLAONWQEW-BARDWOONSA-N 0 3 341.452 2.762 20 5 EFBDHN CC(C)(C)OC(=O)N1CCN([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C(C)(C)C1 ZINC001169038129 1272605973 /nfs/dbraw/zinc/60/59/73/1272605973.db2.gz VWLYRGKNUBBRNH-UONOGXRCSA-N 0 3 341.452 2.763 20 5 EFBDHN C[C@@H]1CN(C(=O)OC(C)(C)C)[C@@H](C)CN1[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169017538 1272616466 /nfs/dbraw/zinc/61/64/66/1272616466.db2.gz AKSLWYWRZGGDBS-BARDWOONSA-N 0 3 341.452 2.762 20 5 EFBDHN CCCSc1nc(Cl)c([N+](=O)[O-])c(-n2ccc([C@@H](C)N)n2)n1 ZINC001169228044 1272746882 /nfs/dbraw/zinc/74/68/82/1272746882.db2.gz KZOMIWHNOJLJSU-SSDOTTSWSA-N 0 3 342.812 2.746 20 5 EFBDHN CCOc1cc([N+](=O)[O-])ccc1N1CCCc2ccc(CN)nc21 ZINC001169592445 1273025761 /nfs/dbraw/zinc/02/57/61/1273025761.db2.gz SNYZAZYJJSVIIW-UHFFFAOYSA-N 0 3 328.372 2.932 20 5 EFBDHN Cc1cc(NCCCN(C)C(=O)CN(C)C2CCC2)ccc1[N+](=O)[O-] ZINC001109652759 1274522208 /nfs/dbraw/zinc/52/22/08/1274522208.db2.gz ACFFOZRZAGOQKA-UHFFFAOYSA-N 0 3 348.447 2.648 20 5 EFBDHN CC1(CCC(=O)NCCCNCc2csc([N+](=O)[O-])c2)CC1 ZINC001170022897 1274676744 /nfs/dbraw/zinc/67/67/44/1274676744.db2.gz LHUQORVBWXSODP-UHFFFAOYSA-N 0 3 325.434 2.833 20 5 EFBDHN Cc1c[nH]cc1C(=O)NC[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001086552695 1275744990 /nfs/dbraw/zinc/74/49/90/1275744990.db2.gz ZNEWCBYZUJZDOD-CTYIDZIISA-N 0 3 342.399 2.530 20 5 EFBDHN COc1ccc(C[C@H](C)NCC(=O)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC001170313321 1279008163 /nfs/dbraw/zinc/00/81/63/1279008163.db2.gz LEPXEUUZSPOKTI-AWEZNQCLSA-N 0 3 342.395 2.936 20 5 EFBDHN C[C@@H](NCc1ccc(NC(N)=O)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788506015 1276203861 /nfs/dbraw/zinc/20/38/61/1276203861.db2.gz IYWCHFYIUXWVAX-SNVBAGLBSA-N 0 3 329.360 2.518 20 5 EFBDHN CCOc1nccc(CN[C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])n1 ZINC001170324655 1279016063 /nfs/dbraw/zinc/01/60/63/1279016063.db2.gz RZGCYRQAHCOMDR-GFCCVEGCSA-N 0 3 346.387 2.513 20 5 EFBDHN CCOc1cc(CN[C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])ncn1 ZINC001170325339 1279016970 /nfs/dbraw/zinc/01/69/70/1279016970.db2.gz UCKJORSWFNQQQN-GFCCVEGCSA-N 0 3 346.387 2.513 20 5 EFBDHN CC(COC(=O)c1nn(-c2cccc(F)c2)c2c1CCCC2)[N+](=O)[O-] ZINC000817740247 1276286518 /nfs/dbraw/zinc/28/65/18/1276286518.db2.gz YQRCZBDTBONGOY-LLVKDONJSA-N 0 3 347.346 2.712 20 5 EFBDHN COc1ccc(C[C@@H](C)N2CCN(C3CCC3)CC2)c([N+](=O)[O-])c1 ZINC001170329315 1279018820 /nfs/dbraw/zinc/01/88/20/1279018820.db2.gz OIBXITPVYVECCR-CQSZACIVSA-N 0 3 333.432 2.705 20 5 EFBDHN CC(C)c1ocnc1C(=O)NCCCNCc1ccccc1[N+](=O)[O-] ZINC001170332089 1279022782 /nfs/dbraw/zinc/02/27/82/1279022782.db2.gz KVGKOMVVQAFHAY-UHFFFAOYSA-N 0 3 346.387 2.616 20 5 EFBDHN O=[N+]([O-])c1cc(F)c(NC2CCN(C[C@H]3CCCO3)CC2)c(F)c1 ZINC000749316159 1276444080 /nfs/dbraw/zinc/44/40/80/1276444080.db2.gz KXPUEWBIIUUUIA-CYBMUJFWSA-N 0 3 341.358 2.928 20 5 EFBDHN CC(C)Oc1ccc(CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000818962704 1276551327 /nfs/dbraw/zinc/55/13/27/1276551327.db2.gz WAJUHTHWDIAPDR-INIZCTEOSA-N 0 3 331.372 2.600 20 5 EFBDHN CCN(C)c1ccccc1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819032685 1276595386 /nfs/dbraw/zinc/59/53/86/1276595386.db2.gz JOXWAQZKNYAEID-GOSISDBHSA-N 0 3 329.400 2.874 20 5 EFBDHN CCN(C)c1ccccc1CNC[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819032686 1276595764 /nfs/dbraw/zinc/59/57/64/1276595764.db2.gz JOXWAQZKNYAEID-SFHVURJKSA-N 0 3 329.400 2.874 20 5 EFBDHN COc1ccc2c(c1)OCC[C@@H]2NC[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000819104692 1276609946 /nfs/dbraw/zinc/60/99/46/1276609946.db2.gz RYGZGJCLSFDIPN-IRXDYDNUSA-N 0 3 344.367 2.750 20 5 EFBDHN CCOc1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)ccc1OC ZINC000819069262 1276618743 /nfs/dbraw/zinc/61/87/43/1276618743.db2.gz NZMOOFYZZOUKKE-INIZCTEOSA-N 0 3 346.383 2.825 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CNCc2cccc3c2OCCCO3)c1 ZINC000819177195 1276659062 /nfs/dbraw/zinc/65/90/62/1276659062.db2.gz CIVYANLWMHQHFF-INIZCTEOSA-N 0 3 344.367 2.579 20 5 EFBDHN CCCCn1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c(C)n1 ZINC000819205053 1276677217 /nfs/dbraw/zinc/67/72/17/1276677217.db2.gz HEDMRTKKQACLKT-KRWDZBQOSA-N 0 3 332.404 2.723 20 5 EFBDHN O=[N+]([O-])c1ccc([C@@H](O)CN[C@H]2CCOc3c(F)cccc32)cc1 ZINC000819252364 1276686039 /nfs/dbraw/zinc/68/60/39/1276686039.db2.gz RKXAKNCRMGDUEV-HOTGVXAUSA-N 0 3 332.331 2.881 20 5 EFBDHN CC[C@@H](C)Oc1cc(CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)ccn1 ZINC000819215822 1276692557 /nfs/dbraw/zinc/69/25/57/1276692557.db2.gz OCPONJUGXAYENA-CXAGYDPISA-N 0 3 345.399 2.990 20 5 EFBDHN C[C@@H]1CN(C(=O)[C@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)CCN(C2CC2)C1 ZINC000820874913 1277355363 /nfs/dbraw/zinc/35/53/63/1277355363.db2.gz VASLPZIQHSDXLY-VHSSKADRSA-N 0 3 343.427 2.641 20 5 EFBDHN Cc1cc(F)cc(-n2nc(C(=O)OCC(C)[N+](=O)[O-])c3c2CCC3)c1 ZINC000821167007 1277473953 /nfs/dbraw/zinc/47/39/53/1277473953.db2.gz MRJBRHSXNJFCAJ-NSHDSACASA-N 0 3 347.346 2.631 20 5 EFBDHN COCCN(Cn1nc(C)c2cc([N+](=O)[O-])cnc21)[C@H]1CC[C@H](C)C1 ZINC000790476363 1277585403 /nfs/dbraw/zinc/58/54/03/1277585403.db2.gz CITWHNJQANCTHB-JSGCOSHPSA-N 0 3 347.419 2.742 20 5 EFBDHN Cc1cc(F)cc(C(=O)NC[C@@H]2N(C)CCCC2(C)C)c1[N+](=O)[O-] ZINC000791116018 1277952248 /nfs/dbraw/zinc/95/22/48/1277952248.db2.gz DGHWGGYXKNNCPG-AWEZNQCLSA-N 0 3 337.395 2.893 20 5 EFBDHN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1N(C)CCCC1(C)C ZINC000791118178 1277952886 /nfs/dbraw/zinc/95/28/86/1277952886.db2.gz WJBVRLDBWBJNNR-INIZCTEOSA-N 0 3 348.447 2.511 20 5 EFBDHN COc1ccc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])cn1 ZINC000845873396 1279900643 /nfs/dbraw/zinc/90/06/43/1279900643.db2.gz SZFPIEGALFTZBZ-ZUZCIYMTSA-N 0 3 334.303 2.793 20 5 EFBDHN CCc1nn(C)cc1C(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845874825 1279901710 /nfs/dbraw/zinc/90/17/10/1279901710.db2.gz ITZVZVRNLBPRCH-ZUZCIYMTSA-N 0 3 335.335 2.685 20 5 EFBDHN Cc1noc(C)c1CC(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845874259 1279901716 /nfs/dbraw/zinc/90/17/16/1279901716.db2.gz YOSXERZPWDCNNL-QLJPJBMISA-N 0 3 336.319 2.923 20 5 EFBDHN CCOc1cnc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])cn1 ZINC000845876766 1279902152 /nfs/dbraw/zinc/90/21/52/1279902152.db2.gz OOMHCIQKRNGCLD-BMIGLBTASA-N 0 3 349.318 2.578 20 5 EFBDHN CC([C@H](OC(=O)CC1CCOCC1)c1ccccc1F)[N+](=O)[O-] ZINC000845875937 1279902216 /nfs/dbraw/zinc/90/22/16/1279902216.db2.gz MBXXMNALMOFSCQ-ZBEGNZNMSA-N 0 3 325.336 2.892 20 5 EFBDHN Cc1ncc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])c(C)n1 ZINC000845875955 1279902306 /nfs/dbraw/zinc/90/23/06/1279902306.db2.gz MFVHAXVGVRKYQZ-MEBBXXQBSA-N 0 3 333.319 2.796 20 5 EFBDHN CC([C@@H](OC(=O)[C@@H]1CSCCS1)c1ccccc1F)[N+](=O)[O-] ZINC000845876721 1279903014 /nfs/dbraw/zinc/90/30/14/1279903014.db2.gz OATUOBHVYZNOEW-JIMOISOXSA-N 0 3 345.417 2.924 20 5 EFBDHN COc1cccnc1CC(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845881464 1279904245 /nfs/dbraw/zinc/90/42/45/1279904245.db2.gz KVZYAHWRJMWCKI-GTNSWQLSSA-N 0 3 348.330 2.722 20 5 EFBDHN CC([C@H](OC(=O)c1cc2n(n1)CCCC2)c1ccccc1F)[N+](=O)[O-] ZINC000845882320 1279904268 /nfs/dbraw/zinc/90/42/68/1279904268.db2.gz OMEXSYATBZLXTC-BZNIZROVSA-N 0 3 347.346 2.922 20 5 EFBDHN CCOC1CC(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])C1 ZINC000845880015 1279904282 /nfs/dbraw/zinc/90/42/82/1279904282.db2.gz JXEWPDWTBFUAIU-TVRADYJESA-N 0 3 325.336 2.890 20 5 EFBDHN CC([C@@H](OC(=O)[C@H](C)Cc1cnn(C)c1)c1ccccc1F)[N+](=O)[O-] ZINC000845883196 1279905670 /nfs/dbraw/zinc/90/56/70/1279905670.db2.gz ZVDBGCNXMCJQLL-BFQNTYOBSA-N 0 3 349.362 2.688 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H](O)COCC1CC1 ZINC000872030323 1287405638 /nfs/dbraw/zinc/40/56/38/1287405638.db2.gz CWRNYXHGPARZFA-FZMZJTMJSA-N 0 3 340.445 2.755 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H](O)COCC1CC1 ZINC000872030322 1287406080 /nfs/dbraw/zinc/40/60/80/1287406080.db2.gz CWRNYXHGPARZFA-BXUZGUMPSA-N 0 3 340.445 2.755 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCCN1CCO[C@H](C)C1 ZINC000872033979 1287407051 /nfs/dbraw/zinc/40/70/51/1287407051.db2.gz KUOFGJVFCHNJRJ-OLZOCXBDSA-N 0 3 339.461 2.688 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCNc1cnccn1 ZINC000872042898 1287409430 /nfs/dbraw/zinc/40/94/30/1287409430.db2.gz FFDLUCFVZCUWIS-LLVKDONJSA-N 0 3 333.417 2.869 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@]1(O)CCSC1 ZINC000872040596 1287409551 /nfs/dbraw/zinc/40/95/51/1287409551.db2.gz MJFQIWXOOBYQBY-YGRLFVJLSA-N 0 3 328.459 2.835 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H](O)C1CCOCC1 ZINC000872046961 1287410769 /nfs/dbraw/zinc/41/07/69/1287410769.db2.gz AFGCFJMWCFOLPM-XHDPSFHLSA-N 0 3 340.445 2.755 20 5 EFBDHN CNC(=O)C(C)(C)CN[C@@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872052614 1287412612 /nfs/dbraw/zinc/41/26/12/1287412612.db2.gz DLUMRWOXICFTJW-JTQLQIEISA-N 0 3 325.434 2.740 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](C)[C@H]1CN(C)CCO1 ZINC000872051232 1287412717 /nfs/dbraw/zinc/41/27/17/1287412717.db2.gz GOFPSPXDETYKTO-YWPYICTPSA-N 0 3 339.461 2.686 20 5 EFBDHN CCC(=O)N1CC[C@@H](N[C@@H](C)c2cc([N+](=O)[O-])ccc2SC)C1 ZINC000872044387 1287409842 /nfs/dbraw/zinc/40/98/42/1287409842.db2.gz UPFRYGORJZJQTN-NWDGAFQWSA-N 0 3 337.445 2.978 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCC1([S@@](C)=O)CC1 ZINC000872069058 1287418658 /nfs/dbraw/zinc/41/86/58/1287418658.db2.gz LMCXNSQJXOKNGR-LADRHHBVSA-N 0 3 328.459 2.878 20 5 EFBDHN CCN(C)C(C)(C)C(=O)NC[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001091490008 1280771743 /nfs/dbraw/zinc/77/17/43/1280771743.db2.gz IAJIRPVKJYTXJF-CTYIDZIISA-N 0 3 348.447 2.632 20 5 EFBDHN CCc1cccc(CC(=O)NCCNCc2ccc([N+](=O)[O-])cc2)c1 ZINC001130400550 1280807878 /nfs/dbraw/zinc/80/78/78/1280807878.db2.gz BRNJKCCBDXOMLA-UHFFFAOYSA-N 0 3 341.411 2.606 20 5 EFBDHN CC[C@@H](C)N[C@@H](CNC(=O)c1ccc(N)c([N+](=O)[O-])c1)c1ccco1 ZINC000807681126 1281388845 /nfs/dbraw/zinc/38/88/45/1281388845.db2.gz ZBQGCJMVGSYAMV-RISCZKNCSA-N 0 3 346.387 2.629 20 5 EFBDHN CCc1cc(C(=O)NCCNCc2cccc([N+](=O)[O-])c2)oc1CC ZINC001147986148 1281389766 /nfs/dbraw/zinc/38/97/66/1281389766.db2.gz FEAFRPSSGPWHCQ-UHFFFAOYSA-N 0 3 345.399 2.832 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C\CN[C@@H]1COc2ccccc2[C@H]1O ZINC000808454436 1281718749 /nfs/dbraw/zinc/71/87/49/1281718749.db2.gz QABOMJWJLMQYLU-JYAXHDLFSA-N 0 3 326.352 2.692 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1CNCC[C@@H](O)c1ccccc1)OCCO2 ZINC000809748271 1282447130 /nfs/dbraw/zinc/44/71/30/1282447130.db2.gz MVLUMCLIPYZOSR-MRXNPFEDSA-N 0 3 344.367 2.579 20 5 EFBDHN C[C@H](NC[C@H](O)c1c(F)cccc1F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815594639 1287623065 /nfs/dbraw/zinc/62/30/65/1287623065.db2.gz UYJSTYUMRWMZRK-VFZGTOFNSA-N 0 3 337.326 2.839 20 5 EFBDHN COc1cnc(-n2c(-c3ccccc3)cnc2[C@H](C)N)cc1[N+](=O)[O-] ZINC001170679943 1285234843 /nfs/dbraw/zinc/23/48/43/1285234843.db2.gz NBIVTACMSFYMLT-NSHDSACASA-N 0 3 339.355 2.871 20 5 EFBDHN Cc1ccc(C)c(-n2ccnc2SCC(=O)OCC(C)[N+](=O)[O-])c1 ZINC000813101898 1285651848 /nfs/dbraw/zinc/65/18/48/1285651848.db2.gz LCFNFXPKGHHTPZ-ZDUSSCGKSA-N 0 3 349.412 2.790 20 5 EFBDHN COc1ccc(C2(C(=O)OCC(C)[N+](=O)[O-])CCCC2)cc1OC ZINC000813102697 1285654403 /nfs/dbraw/zinc/65/44/03/1285654403.db2.gz IWLPVZBILHYIAR-LBPRGKRZSA-N 0 3 337.372 2.724 20 5 EFBDHN COCc1nc(C(=O)OCC(C)[N+](=O)[O-])c(-c2ccccc2)s1 ZINC000813106112 1285678965 /nfs/dbraw/zinc/67/89/65/1285678965.db2.gz YQOIXRHMKPZURE-JTQLQIEISA-N 0 3 336.369 2.779 20 5 EFBDHN CC(COC(=O)c1cccc(C(=O)Nc2ccccc2)c1)[N+](=O)[O-] ZINC000813107342 1285679632 /nfs/dbraw/zinc/67/96/32/1285679632.db2.gz PIBFWGIUBHJONE-GFCCVEGCSA-N 0 3 328.324 2.761 20 5 EFBDHN CC(COC(=O)c1ccc(NC(=O)c2ccccc2)cc1)[N+](=O)[O-] ZINC000813110052 1285681727 /nfs/dbraw/zinc/68/17/27/1285681727.db2.gz RMSBIFLGLXUUBO-LBPRGKRZSA-N 0 3 328.324 2.761 20 5 EFBDHN CCc1c(C)nn(-c2cccc(C(=O)OCC(C)[N+](=O)[O-])c2)c1C ZINC000813112001 1285682572 /nfs/dbraw/zinc/68/25/72/1285682572.db2.gz YIFQMEGVEZNHMR-LLVKDONJSA-N 0 3 331.372 2.874 20 5 EFBDHN Cc1nn(-c2ccccc2)c2nc(C(=O)OCC(C)[N+](=O)[O-])ccc12 ZINC000813109686 1285682904 /nfs/dbraw/zinc/68/29/04/1285682904.db2.gz NOUSTIWJWHCOIP-NSHDSACASA-N 0 3 340.339 2.551 20 5 EFBDHN CC(COC(=O)c1cn(C)nc1-c1ccc(Cl)s1)[N+](=O)[O-] ZINC000813109287 1285683126 /nfs/dbraw/zinc/68/31/26/1285683126.db2.gz RAMGEURTSNYPRW-ZETCQYMHSA-N 0 3 329.765 2.624 20 5 EFBDHN CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)OCC(C)[N+](=O)[O-])O[C@@H](C)C2 ZINC000813115693 1285685227 /nfs/dbraw/zinc/68/52/27/1285685227.db2.gz YBFIHVNHJNJYRL-UHXUCMFUSA-N 0 3 349.383 2.721 20 5 EFBDHN COc1cccc(C(=O)c2ccc(C(=O)OCC(C)[N+](=O)[O-])cc2)c1 ZINC000813114906 1285685499 /nfs/dbraw/zinc/68/54/99/1285685499.db2.gz XMWZUZNSVQMOMA-LBPRGKRZSA-N 0 3 343.335 2.748 20 5 EFBDHN CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)OCC(C)[N+](=O)[O-])O[C@H](C)C2 ZINC000813115695 1285685742 /nfs/dbraw/zinc/68/57/42/1285685742.db2.gz YBFIHVNHJNJYRL-ZSEWYUTFSA-N 0 3 349.383 2.721 20 5 EFBDHN C[C@@H]1CN(c2c([N+](=O)[O-])cccc2[N+](=O)[O-])CCN(C2CCC2)C1 ZINC000813630057 1286016925 /nfs/dbraw/zinc/01/69/25/1286016925.db2.gz GUTGPCTZTBJRMP-LBPRGKRZSA-N 0 3 334.376 2.814 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)NCc2cncs2)c1F ZINC001173177230 1286452401 /nfs/dbraw/zinc/45/24/01/1286452401.db2.gz RWRAQFQTVIBHML-SECBINFHSA-N 0 3 325.365 2.920 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)NCc2nccnc2C)c1F ZINC001173179135 1286453585 /nfs/dbraw/zinc/45/35/85/1286453585.db2.gz JUCFNRHHBARYQX-SNVBAGLBSA-N 0 3 334.351 2.562 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)N2CC[C@@H]3COC[C@@H]3C2)c1F ZINC001173180354 1286454922 /nfs/dbraw/zinc/45/49/22/1286454922.db2.gz KASYYCPQYZLNCL-UPJWGTAASA-N 0 3 338.379 2.642 20 5 EFBDHN CCCN1CCN([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])CC1 ZINC001173190544 1286458134 /nfs/dbraw/zinc/45/81/34/1286458134.db2.gz VMAUFMFNAZLADX-CYBMUJFWSA-N 0 3 339.411 2.701 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)NCc2ccnc(C)n2)c1F ZINC001173190147 1286458341 /nfs/dbraw/zinc/45/83/41/1286458341.db2.gz ULHBXDRSMFUJDH-SNVBAGLBSA-N 0 3 334.351 2.562 20 5 EFBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1C[C@@H](OCC2CC2)[C@H]2COC[C@H]21 ZINC001173226334 1286480800 /nfs/dbraw/zinc/48/08/00/1286480800.db2.gz ILVYGOLMOFDQCC-VUKOWNLVSA-N 0 3 346.427 2.652 20 5 EFBDHN Cc1ccn2c(c1)nnc2CN[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173209778 1286485454 /nfs/dbraw/zinc/48/54/54/1286485454.db2.gz FYSGRZWEFOYIJB-ZDUSSCGKSA-N 0 3 325.372 2.667 20 5 EFBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[C@H](Oc2ncc(F)cn2)C1 ZINC001173238321 1286496019 /nfs/dbraw/zinc/49/60/19/1286496019.db2.gz PHWBACCWTURABT-WBMJQRKESA-N 0 3 346.362 2.608 20 5 EFBDHN CC(C)N(C)CC(=O)N1CCC(CNc2ccccc2[N+](=O)[O-])CC1 ZINC001095261658 1286799254 /nfs/dbraw/zinc/79/92/54/1286799254.db2.gz GBRPUVCNYYOIDY-UHFFFAOYSA-N 0 3 348.447 2.586 20 5 EFBDHN O=C(NCCCNCc1csc([N+](=O)[O-])c1)C1CCC=CCC1 ZINC001176262313 1287934660 /nfs/dbraw/zinc/93/46/60/1287934660.db2.gz SLOLAJRBNODIFT-UHFFFAOYSA-N 0 3 337.445 2.999 20 5 EFBDHN Cc1cccc(F)c1C(=O)NCCCNCc1ccccc1[N+](=O)[O-] ZINC001177459027 1288427969 /nfs/dbraw/zinc/42/79/69/1288427969.db2.gz PQRGVNJXUITZSH-UHFFFAOYSA-N 0 3 345.374 2.952 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(N(C)C[C@@H]2CCCN2C)cc1Cl ZINC000817131748 1288432654 /nfs/dbraw/zinc/43/26/54/1288432654.db2.gz NMJLMSPWEWLLLT-JTQLQIEISA-N 0 3 341.795 2.565 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(N(C)C[C@H]2CCCN2C)cc1Cl ZINC000817131749 1288432758 /nfs/dbraw/zinc/43/27/58/1288432758.db2.gz NMJLMSPWEWLLLT-SNVBAGLBSA-N 0 3 341.795 2.565 20 5 EFBDHN Cc1cc([N+](=O)[O-])c(C(=O)N(C)C[C@H]2CCCN2C)cc1Cl ZINC000817496783 1288636385 /nfs/dbraw/zinc/63/63/85/1288636385.db2.gz VOUILPCTINULMC-LLVKDONJSA-N 0 3 325.796 2.723 20 5 EFBDHN Cc1cc(Cl)c(C(=O)N2CCC[C@H]3CN(C)C[C@H]32)cc1[N+](=O)[O-] ZINC000822438923 1288986471 /nfs/dbraw/zinc/98/64/71/1288986471.db2.gz ZWKZINUQXNLEPO-XHDPSFHLSA-N 0 3 337.807 2.723 20 5 EFBDHN CN(C)C[C@H]1CCc2ccccc2N1C(=O)CCC(C)(C)[N+](=O)[O-] ZINC000823905115 1289478845 /nfs/dbraw/zinc/47/88/45/1289478845.db2.gz DGUOCJJSJDUTNU-OAHLLOKOSA-N 0 3 333.432 2.732 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1Cc2ccccc2CN1 ZINC000873298439 1289711331 /nfs/dbraw/zinc/71/13/31/1289711331.db2.gz PEAXJHXLVSSMHD-HNNXBMFYSA-N 0 3 340.383 2.739 20 5 EFBDHN Cc1c(NC(=O)NC[C@@H]2Cc3ccccc3CN2)cccc1[N+](=O)[O-] ZINC000873299063 1289712257 /nfs/dbraw/zinc/71/22/57/1289712257.db2.gz IMCPKAQWRVZYHC-HNNXBMFYSA-N 0 3 340.383 2.739 20 5 EFBDHN Nc1ccc2n(C(=O)[C@@H]3CN4CCC3CC4)c3ccccc3cc-2c1=O ZINC001182009539 1290058100 /nfs/dbraw/zinc/05/81/00/1290058100.db2.gz BXNQXWSMBOYBMB-MRXNPFEDSA-N 0 3 347.418 2.671 20 5 EFBDHN CCN(C)C(C)(C)C(=O)NCC1(Nc2ccc(C)cc2[N+](=O)[O-])CC1 ZINC001110265877 1290134280 /nfs/dbraw/zinc/13/42/80/1290134280.db2.gz CIANRTAFKRRYBE-UHFFFAOYSA-N 0 3 348.447 2.694 20 5 EFBDHN CCN(C)C(C)(C)C(=O)NCC1(Nc2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC001110265913 1290134680 /nfs/dbraw/zinc/13/46/80/1290134680.db2.gz CUUCVIHUCYNIHH-UHFFFAOYSA-N 0 3 348.447 2.694 20 5 EFBDHN O=C(c1cc([N+](=O)[O-])ccc1F)N1CCC[C@H]1CN1CCCCC1 ZINC000825731647 1290266459 /nfs/dbraw/zinc/26/64/59/1290266459.db2.gz JUXVHENEJJGARK-AWEZNQCLSA-N 0 3 335.379 2.824 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000825797054 1290554758 /nfs/dbraw/zinc/55/47/58/1290554758.db2.gz PDZPXWYTQXFCLD-LBPRGKRZSA-N 0 3 325.796 2.852 20 5 EFBDHN O=[N+]([O-])c1sc(CN[C@H](CCO)C2CC2)cc1Br ZINC000877058739 1291120792 /nfs/dbraw/zinc/12/07/92/1291120792.db2.gz FWDLLCZJUCGEAC-SNVBAGLBSA-N 0 3 335.223 2.669 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNCCc1cnccn1 ZINC000877132087 1291140011 /nfs/dbraw/zinc/14/00/11/1291140011.db2.gz UGFKNGVAHUBAID-UHFFFAOYSA-N 0 3 326.278 2.736 20 5 EFBDHN C[C@@H]1CCCN1CCNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000877153166 1291149137 /nfs/dbraw/zinc/14/91/37/1291149137.db2.gz FSOHBQNQEPPZIG-SECBINFHSA-N 0 3 348.266 2.993 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1CCOC2(CCOCC2)CC1 ZINC000877398840 1291224276 /nfs/dbraw/zinc/22/42/76/1291224276.db2.gz HWVOKPLQUYDAMZ-UHFFFAOYSA-N 0 3 334.416 2.983 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1CCC(Cn2cncn2)CC1 ZINC000877430398 1291229901 /nfs/dbraw/zinc/22/99/01/1291229901.db2.gz HOCGKRJQHOGGPQ-UHFFFAOYSA-N 0 3 329.404 2.715 20 5 EFBDHN CN1CCC2(CCN(Cc3ccc([N+](=O)[O-])c(Cl)c3)CC2)C1=O ZINC000775204124 1291498353 /nfs/dbraw/zinc/49/83/53/1291498353.db2.gz NYCURYULIWJCRD-UHFFFAOYSA-N 0 3 337.807 2.693 20 5 EFBDHN CCN(C)C(C)(C)C(=O)N[C@H]1C[C@H](CNc2ccccc2[N+](=O)[O-])C1 ZINC001114798001 1292006436 /nfs/dbraw/zinc/00/64/36/1292006436.db2.gz KFZZJTYGLXIKFR-HDJSIYSDSA-N 0 3 348.447 2.632 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CNC2(c3ccc4c(c3)OCO4)CC2)c1 ZINC000775554687 1293093533 /nfs/dbraw/zinc/09/35/33/1293093533.db2.gz ZEXFKXCGAVAFSE-HNNXBMFYSA-N 0 3 342.351 2.636 20 5 EFBDHN CN(CCCNC(=O)CCc1ccco1)Cc1ccc([N+](=O)[O-])cc1 ZINC001233843016 1313002793 /nfs/dbraw/zinc/00/27/93/1313002793.db2.gz FOUDMQJCVUFYKT-UHFFFAOYSA-N 0 3 345.399 2.759 20 5 EFBDHN COc1cc(CN[C@H](C)C[C@H](O)c2ccco2)c([N+](=O)[O-])cc1O ZINC000130636271 1293412176 /nfs/dbraw/zinc/41/21/76/1293412176.db2.gz BGGSSKSJMYBLMG-MFKMUULPSA-N 0 3 336.344 2.504 20 5 EFBDHN CCc1ccsc1C(=O)NCCNCc1ccc([N+](=O)[O-])cc1 ZINC001152127419 1293572341 /nfs/dbraw/zinc/57/23/41/1293572341.db2.gz VOWDIRJFZJXALG-UHFFFAOYSA-N 0 3 333.413 2.738 20 5 EFBDHN CC(C)N1CC[C@@H](Oc2c([N+](=O)[O-])cc([N+](=O)[O-])c3cccnc32)C1 ZINC001233903018 1313015157 /nfs/dbraw/zinc/01/51/57/1313015157.db2.gz ZQHZYMIXOPJBLR-LLVKDONJSA-N 0 3 346.343 2.913 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc3c(c2)CNCCO3)c1C ZINC000884292319 1294084465 /nfs/dbraw/zinc/08/44/65/1294084465.db2.gz WHUIXKAQBWYPLG-UHFFFAOYSA-N 0 3 341.367 2.946 20 5 EFBDHN Cc1ccccc1OCCN(C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136869100 1294691656 /nfs/dbraw/zinc/69/16/56/1294691656.db2.gz PHGQQOWLKXGADH-QGZVFWFLSA-N 0 3 330.384 2.947 20 5 EFBDHN C/C(=C/C(=O)NCCCN(C)Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001234530814 1313148491 /nfs/dbraw/zinc/14/84/91/1313148491.db2.gz ZTABEHGAPSEADD-OWBHPGMISA-N 0 3 331.416 2.889 20 5 EFBDHN COCCN1CCC(Oc2nccc3c2cccc3[N+](=O)[O-])CC1 ZINC001234675836 1313181722 /nfs/dbraw/zinc/18/17/22/1313181722.db2.gz CTAZBBGDZLCBAV-UHFFFAOYSA-N 0 3 331.372 2.633 20 5 EFBDHN CCC[C@@H]1CN(Cn2cc([N+](=O)[O-])cn2)CCN1Cc1ccccc1 ZINC000776207624 1297052277 /nfs/dbraw/zinc/05/22/77/1297052277.db2.gz RSGBLKASOYNRDC-QGZVFWFLSA-N 0 3 343.431 2.735 20 5 EFBDHN O=[N+]([O-])c1ccc([C@H](O)CN2CCC[C@@H]2C[C@@H](O)c2ccco2)cc1 ZINC000776585990 1299651372 /nfs/dbraw/zinc/65/13/72/1299651372.db2.gz GMUOICBOLGMQMR-BRWVUGGUSA-N 0 3 346.383 2.809 20 5 EFBDHN COC[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)c1cccc(OC)c1 ZINC000852444090 1299706038 /nfs/dbraw/zinc/70/60/38/1299706038.db2.gz SFTVHPKPWCSCDU-ROUUACIJSA-N 0 3 346.383 2.614 20 5 EFBDHN Cc1n[nH]c(C)c1[C@H]1CCCN1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776601931 1299730990 /nfs/dbraw/zinc/73/09/90/1299730990.db2.gz NNCXOUJNBYZCSK-HZPDHXFCSA-N 0 3 330.388 2.805 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CN2CCC([C@H]3CCCCO3)CC2)c1 ZINC000852593345 1299774691 /nfs/dbraw/zinc/77/46/91/1299774691.db2.gz FHWVELXVYOOMAX-ZWKOTPCHSA-N 0 3 334.416 2.909 20 5 EFBDHN COc1ccc(C2(NC[C@@H](O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000776605498 1299795359 /nfs/dbraw/zinc/79/53/59/1299795359.db2.gz LNOLCEHBFCFFKR-QGZVFWFLSA-N 0 3 328.368 2.916 20 5 EFBDHN O=[N+]([O-])c1cc(NC[C@H]2CN3CCC[C@@H]3CO2)ccc1C(F)(F)F ZINC000853241465 1300062828 /nfs/dbraw/zinc/06/28/28/1300062828.db2.gz KBKIKTXLEVBQCC-NEPJUHHUSA-N 0 3 345.321 2.889 20 5 EFBDHN Nc1ccc([N+](=O)[O-])c(NCC2CCN(Cc3ccncc3)CC2)c1 ZINC000853810704 1300287245 /nfs/dbraw/zinc/28/72/45/1300287245.db2.gz FTKMBZPNDLELQY-UHFFFAOYSA-N 0 3 341.415 2.896 20 5 EFBDHN O=[N+]([O-])c1ccccc1Cc1noc(-c2cc3c(s2)CCNC3)n1 ZINC000854133817 1300441053 /nfs/dbraw/zinc/44/10/53/1300441053.db2.gz AVRCCARJFSNCMN-UHFFFAOYSA-N 0 3 342.380 2.943 20 5 EFBDHN CC(C)(C)N1CC[C@H](NC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C1 ZINC000855289810 1300893712 /nfs/dbraw/zinc/89/37/12/1300893712.db2.gz VGZVMWURUDNFCS-LBPRGKRZSA-N 0 3 341.358 2.676 20 5 EFBDHN CC([C@H](OC(=O)c1nn(C)cc1Cl)c1ccccc1F)[N+](=O)[O-] ZINC000860855398 1301943341 /nfs/dbraw/zinc/94/33/41/1301943341.db2.gz ZDJCCORRJZMTKN-OQPBUACISA-N 0 3 341.726 2.776 20 5 EFBDHN CCN(C(=O)c1ccc([N+](=O)[O-])c(Cl)c1)C1CCN(C)CC1 ZINC000861895083 1302237899 /nfs/dbraw/zinc/23/78/99/1302237899.db2.gz QKPHQVINDSSTKY-UHFFFAOYSA-N 0 3 325.796 2.805 20 5 EFBDHN CCOC[C@@H](NCC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])C(C)C ZINC000794600237 1302836176 /nfs/dbraw/zinc/83/61/76/1302836176.db2.gz MBKOABQSHHEMJJ-CYBMUJFWSA-N 0 3 343.811 2.837 20 5 EFBDHN CCN1CCN(CCNc2c(Cl)c(Cl)ccc2[N+](=O)[O-])CC1 ZINC000865438066 1303257015 /nfs/dbraw/zinc/25/70/15/1303257015.db2.gz YQIHGRSYQLSHAS-UHFFFAOYSA-N 0 3 347.246 2.951 20 5 EFBDHN C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])N[C@@H]1CCN(C(C)(C)C)C1=O ZINC000866380877 1303618009 /nfs/dbraw/zinc/61/80/09/1303618009.db2.gz LUAFLQLKUUMANT-SMDDNHRTSA-N 0 3 337.395 2.654 20 5 EFBDHN C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])N[C@H]1Cc2ccccc2NC1=O ZINC000866397982 1303622942 /nfs/dbraw/zinc/62/29/42/1303622942.db2.gz LDLGURWTHHFTNW-ZBEGNZNMSA-N 0 3 343.358 2.818 20 5 EFBDHN CC([C@@H](OC(=O)c1ncc2n1CCCC2)c1ccccc1F)[N+](=O)[O-] ZINC000870455144 1305331332 /nfs/dbraw/zinc/33/13/32/1305331332.db2.gz WDOHQCWZZCGTOT-IAQYHMDHSA-N 0 3 347.346 2.922 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)CN1C1CC1 ZINC000900998272 1309145810 /nfs/dbraw/zinc/14/58/10/1309145810.db2.gz YKITZAWDPMBBCF-WCBMZHEXSA-N 0 3 341.770 2.742 20 5 EFBDHN CN(CCNc1ccc([N+](=O)[O-])c2nonc21)Cc1ccc(F)cc1 ZINC000749102043 1314298318 /nfs/dbraw/zinc/29/83/18/1314298318.db2.gz JGGDFJYMKIPHKZ-UHFFFAOYSA-N 0 3 345.334 2.814 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1COC(=O)C1CCN(C2CC2)CC1 ZINC000801875700 1311042958 /nfs/dbraw/zinc/04/29/58/1311042958.db2.gz ZWHGYHXZICNXIV-UHFFFAOYSA-N 0 3 334.372 2.521 20 5 EFBDHN CN(C)[C@@H](CNC(=O)c1cc(F)ccc1[N+](=O)[O-])Cc1ccccc1 ZINC000751304011 1311116673 /nfs/dbraw/zinc/11/66/73/1311116673.db2.gz PIVLYPDDNIABKT-OAHLLOKOSA-N 0 3 345.374 2.637 20 5 EFBDHN CC(=O)O[C@@H]1C[C@@H]2C[C@H](OCc3cccc([N+](=O)[O-])c3C)C[C@H]1N2C ZINC001223330424 1311245730 /nfs/dbraw/zinc/24/57/30/1311245730.db2.gz PHYCPAGHFYGUDM-CWLKWCNXSA-N 0 3 348.399 2.587 20 5 EFBDHN CC(=O)O[C@H]1C[C@@H]2C[C@H](OCc3cccc(C)c3[N+](=O)[O-])C[C@H]1N2C ZINC001223665154 1311288923 /nfs/dbraw/zinc/28/89/23/1311288923.db2.gz OXUALENWRASVQJ-NXOAAHMSSA-N 0 3 348.399 2.587 20 5 EFBDHN Cc1cc(C(=O)NCCCNCc2csc([N+](=O)[O-])c2)cc(C)n1 ZINC001158927334 1311418017 /nfs/dbraw/zinc/41/80/17/1311418017.db2.gz IAEPBTTZNFCZRU-UHFFFAOYSA-N 0 3 348.428 2.578 20 5 EFBDHN C[C@@H](Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)[C@@H]1CNCCO1 ZINC001159499505 1311527665 /nfs/dbraw/zinc/52/76/65/1311527665.db2.gz ANLMGNIVUKBSFX-ABAIWWIYSA-N 0 3 346.362 2.585 20 5 EFBDHN O=[N+]([O-])c1cc([O-])cc(Nc2cc(F)ccc2N2CC[NH2+]CC2)c1 ZINC001160046721 1311635181 /nfs/dbraw/zinc/63/51/81/1311635181.db2.gz XLICMRNYSRKZGR-UHFFFAOYSA-N 0 3 332.335 2.593 20 5 EFBDHN Cc1ccc(-c2ccc(Nc3ccc(CN)nc3)nn2)cc1[N+](=O)[O-] ZINC001160401856 1311703388 /nfs/dbraw/zinc/70/33/88/1311703388.db2.gz BZJOPKXBWAKOKY-UHFFFAOYSA-N 0 3 336.355 2.958 20 5 EFBDHN C[C@@H]1CCN(Cc2ccccc2)C[C@H]1Oc1ncc([N+](=O)[O-])cn1 ZINC001226729195 1311714700 /nfs/dbraw/zinc/71/47/00/1311714700.db2.gz BPBXFQUTZKGHTR-CZUORRHYSA-N 0 3 328.372 2.674 20 5 EFBDHN CO[C@@H]1CCN(CCOc2ccc(C(F)(F)F)c([N+](=O)[O-])c2)C1 ZINC001226969374 1311747973 /nfs/dbraw/zinc/74/79/73/1311747973.db2.gz NSJFNNMKAARAAO-LLVKDONJSA-N 0 3 334.294 2.713 20 5 EFBDHN O=[N+]([O-])c1nc(Br)ccc1OC1CCN(C2CC2)CC1 ZINC001227257445 1311783985 /nfs/dbraw/zinc/78/39/85/1311783985.db2.gz ZMMPOMPXVKIQRF-UHFFFAOYSA-N 0 3 342.193 2.758 20 5 EFBDHN CCOC(=O)c1ccc(OC2CCN(C3CC3)CC2)c([N+](=O)[O-])c1 ZINC001227297758 1311790649 /nfs/dbraw/zinc/79/06/49/1311790649.db2.gz ZPCHWWFYTNCYLI-UHFFFAOYSA-N 0 3 334.372 2.777 20 5 EFBDHN C[NH+]1C(C)(C)CC(Oc2ncc([N+](=O)[O-])c3nc[n-]c32)CC1(C)C ZINC001227691397 1311839950 /nfs/dbraw/zinc/83/99/50/1311839950.db2.gz NQXMXQJEQNENNV-UHFFFAOYSA-N 0 3 333.392 2.896 20 5 EFBDHN Cc1nn(CN2CCN(C)C[C@H]2CC(C)C)c2cc([N+](=O)[O-])ccc12 ZINC000902542007 1311853717 /nfs/dbraw/zinc/85/37/17/1311853717.db2.gz KORCOZZXVUSDJA-MRXNPFEDSA-N 0 3 345.447 2.873 20 5 EFBDHN Cc1cc2nc(O[C@H]3[C@@H]4CCC[C@H]3C[N@@H+](C)C4)[n-]c2cc1[N+](=O)[O-] ZINC001228676358 1311980171 /nfs/dbraw/zinc/98/01/71/1311980171.db2.gz DFLDSYRNURGBTO-ATCWAGBWSA-N 0 3 330.388 2.889 20 5 EFBDHN Cc1cc2nc(O[C@H]3[C@@H]4CCC[C@H]3C[N@H+](C)C4)[n-]c2cc1[N+](=O)[O-] ZINC001228676358 1311980172 /nfs/dbraw/zinc/98/01/72/1311980172.db2.gz DFLDSYRNURGBTO-ATCWAGBWSA-N 0 3 330.388 2.889 20 5 EFBDHN Cc1cc2[n-]c(O[C@H]3[C@@H]4CCC[C@H]3C[N@@H+](C)C4)nc2cc1[N+](=O)[O-] ZINC001228676358 1311980175 /nfs/dbraw/zinc/98/01/75/1311980175.db2.gz DFLDSYRNURGBTO-ATCWAGBWSA-N 0 3 330.388 2.889 20 5 EFBDHN Cc1cc2[n-]c(O[C@H]3[C@@H]4CCC[C@H]3C[N@H+](C)C4)nc2cc1[N+](=O)[O-] ZINC001228676358 1311980176 /nfs/dbraw/zinc/98/01/76/1311980176.db2.gz DFLDSYRNURGBTO-ATCWAGBWSA-N 0 3 330.388 2.889 20 5 EFBDHN COC(=O)c1cc(Cl)cc([N+](=O)[O-])c1O[C@@H]1CCN(C(C)C)C1 ZINC001228967526 1312028353 /nfs/dbraw/zinc/02/83/53/1312028353.db2.gz RPUQJADWPFERPC-LLVKDONJSA-N 0 3 342.779 2.896 20 5 EFBDHN COCCN1CCC(Oc2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC001229009076 1312034897 /nfs/dbraw/zinc/03/48/97/1312034897.db2.gz RQGCCCRQRDDGJL-UHFFFAOYSA-N 0 3 331.372 2.633 20 5 EFBDHN CC(=O)Nc1cc(O[C@H]2CCCN(C)CC2)c(C(C)=O)cc1[N+](=O)[O-] ZINC001229131780 1312051831 /nfs/dbraw/zinc/05/18/31/1312051831.db2.gz YWJAUDLYQLBSDZ-ZDUSSCGKSA-N 0 3 349.387 2.619 20 5 EFBDHN C[C@H](N)c1nc2ccccc2n1-c1ncc2cccc([N+](=O)[O-])c2n1 ZINC001162763170 1312170191 /nfs/dbraw/zinc/17/01/91/1312170191.db2.gz NPKVMZDWHIBTSC-JTQLQIEISA-N 0 3 334.339 2.897 20 5 EFBDHN CCN1CCC(Oc2ncc(Br)c(C)c2[N+](=O)[O-])CC1 ZINC001230035276 1312175455 /nfs/dbraw/zinc/17/54/55/1312175455.db2.gz POKIXNIRDGBEJO-UHFFFAOYSA-N 0 3 344.209 2.924 20 5 EFBDHN O=C(CC1CC1)NCCC1(CNCc2csc([N+](=O)[O-])c2)CC1 ZINC001163116625 1312244347 /nfs/dbraw/zinc/24/43/47/1312244347.db2.gz MRMWJIPFTFACDC-UHFFFAOYSA-N 0 3 337.445 2.833 20 5 EFBDHN O=C(NCCCNCc1csc([N+](=O)[O-])c1)c1occ2c1CCC2 ZINC001163330178 1312290974 /nfs/dbraw/zinc/29/09/74/1312290974.db2.gz HIBJRNCAOGAGHZ-UHFFFAOYSA-N 0 3 349.412 2.648 20 5 EFBDHN O=[N+]([O-])c1cc(N[C@H]2CN3CCC2CC3)ccc1OC(F)(F)F ZINC001163392655 1312302573 /nfs/dbraw/zinc/30/25/73/1312302573.db2.gz AAOBHXRFTUREOX-NSHDSACASA-N 0 3 331.294 3.000 20 5 EFBDHN CC1(C(=O)NCCCNCc2csc([N+](=O)[O-])c2)CCCC1 ZINC001163510780 1312329791 /nfs/dbraw/zinc/32/97/91/1312329791.db2.gz ZWRCKPVUPDWUIV-UHFFFAOYSA-N 0 3 325.434 2.833 20 5 EFBDHN CN1C(=O)CCC12CCC(Nc1cc3c(cc1[N+](=O)[O-])CNC3)CC2 ZINC001163594528 1312343691 /nfs/dbraw/zinc/34/36/91/1312343691.db2.gz PYPOWGCWYXVOQF-UHFFFAOYSA-N 0 3 344.415 2.544 20 5 EFBDHN CC(=O)Cc1c(F)c(O[C@H]2C[C@H]3CC[C@@H](C2)N3C)ccc1[N+](=O)[O-] ZINC001230794812 1312345981 /nfs/dbraw/zinc/34/59/81/1312345981.db2.gz VVYBLLVATQZGQJ-ITGUQSILSA-N 0 3 336.363 2.869 20 5 EFBDHN COc1cc(N[C@H]2CCCC[C@@]23CNCCO3)cc([N+](=O)[O-])c1C ZINC001163650584 1312354403 /nfs/dbraw/zinc/35/44/03/1312354403.db2.gz TWEPNGRKCNMYDU-DLBZAZTESA-N 0 3 335.404 2.625 20 5 EFBDHN O=C(NCCC1(CNCc2ccccc2[N+](=O)[O-])CC1)C1CC=CC1 ZINC001163919084 1312407678 /nfs/dbraw/zinc/40/76/78/1312407678.db2.gz WSCLLRMSRYZAEB-UHFFFAOYSA-N 0 3 343.427 2.937 20 5 EFBDHN C/C=C(\C)C(=O)NCCC1(CNCc2ccccc2[N+](=O)[O-])CC1 ZINC001163991506 1312421404 /nfs/dbraw/zinc/42/14/04/1312421404.db2.gz AUPSDSYIKJFHQI-LZWSPWQCSA-N 0 3 331.416 2.937 20 5 EFBDHN CN(C)c1ccnc(CN[C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000903199491 1312455259 /nfs/dbraw/zinc/45/52/59/1312455259.db2.gz ZKRORKXNVZIHPZ-JKSUJKDBSA-N 0 3 344.419 2.526 20 5 EFBDHN O=C(NCCCNCc1ccccc1[N+](=O)[O-])C1(C(F)F)CCC1 ZINC001164507114 1312528863 /nfs/dbraw/zinc/52/88/63/1312528863.db2.gz VDEZABNXLSBVMO-UHFFFAOYSA-N 0 3 341.358 2.626 20 5 EFBDHN CN(CCN1CCCC1)C(F)(F)c1cnc(Cl)c([N+](=O)[O-])c1 ZINC001165139117 1312577180 /nfs/dbraw/zinc/57/71/80/1312577180.db2.gz BWXPCHMPZHZSDD-UHFFFAOYSA-N 0 3 334.754 2.720 20 5 EFBDHN CN(C)/C=C\c1cc(N2CCN(C)CC23CCCC3)ncc1[N+](=O)[O-] ZINC001165198328 1312584169 /nfs/dbraw/zinc/58/41/69/1312584169.db2.gz HWBMSZRXRLBFCY-TWGQIWQCSA-N 0 3 345.447 2.587 20 5 EFBDHN CN(C)Cc1ccc(-c2noc(-c3cccnc3[N+](=O)[O-])n2)cc1 ZINC001213172534 1314516666 /nfs/dbraw/zinc/51/66/66/1314516666.db2.gz XMRIKBHKLOKWMI-UHFFFAOYSA-N 0 3 325.328 2.768 20 5 EFBDHN O=C(N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1)c1ccccc1 ZINC001019945693 1314546331 /nfs/dbraw/zinc/54/63/31/1314546331.db2.gz QPJZUELDBMYDOZ-WKILWMFISA-N 0 3 325.368 2.645 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)CC[C@@H](N1CCNC[C@H]1C(F)(F)F)CC2 ZINC001246985370 1314723164 /nfs/dbraw/zinc/72/31/64/1314723164.db2.gz BLFVNDQWHOTSAD-ZFWWWQNUSA-N 0 3 343.349 2.678 20 5 EFBDHN O=[N+]([O-])c1cc2[n-]c(O[C@@H]3CCC[C@@H]4C[NH2+]C[C@@H]43)nc2cc1Cl ZINC001218146507 1315154767 /nfs/dbraw/zinc/15/47/67/1315154767.db2.gz DKXZIHWOEOZZSC-TVLCNXBWSA-N 0 3 336.779 2.891 20 5 EFBDHN O=[N+]([O-])c1ccc(C(F)(F)F)cc1O[C@H]1CNCCC1(F)F ZINC001218448123 1315196994 /nfs/dbraw/zinc/19/69/94/1315196994.db2.gz LRNACBLTIAIHPF-JTQLQIEISA-N 0 3 326.221 2.990 20 5 EFBDHN COC(=O)c1cc(O[C@@H]2CNCc3ccccc32)cc([N+](=O)[O-])c1 ZINC001218486265 1315203904 /nfs/dbraw/zinc/20/39/04/1315203904.db2.gz IUAJUHYPWXNKLS-MRXNPFEDSA-N 0 3 328.324 2.605 20 5 EFBDHN O=C(NC1CC1)[C@H]1CCCN(C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC001254004015 1315664659 /nfs/dbraw/zinc/66/46/59/1315664659.db2.gz FGFZDSGSADATHR-BYPUDFOVSA-N 0 3 329.400 2.599 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCC(NCc3cncc(Cl)n3)CC2)cc1 ZINC001254468530 1315706948 /nfs/dbraw/zinc/70/69/48/1315706948.db2.gz KYUCMFRUCIKZNW-UHFFFAOYSA-N 0 3 347.806 2.797 20 5 EFBDHN COc1ccnc(CNC2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC001254465544 1315707175 /nfs/dbraw/zinc/70/71/75/1315707175.db2.gz CDNJXGDXBSTVKY-UHFFFAOYSA-N 0 3 342.399 2.757 20 5 EFBDHN CC(C)[C@@H]1CN(C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CCO1 ZINC001254480510 1315708279 /nfs/dbraw/zinc/70/82/79/1315708279.db2.gz ICKOOWUFDDYFOG-SFHVURJKSA-N 0 3 333.432 2.920 20 5 EFBDHN COC(=O)[C@H](C(C)C)N(C)C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001254481598 1315708599 /nfs/dbraw/zinc/70/85/99/1315708599.db2.gz XLYOXGBCQUYANN-KRWDZBQOSA-N 0 3 349.431 2.693 20 5 EFBDHN CCOc1ccc([C@@H](CO)N[C@@H](C)Cc2ccccc2[N+](=O)[O-])cn1 ZINC001254531338 1315720632 /nfs/dbraw/zinc/72/06/32/1315720632.db2.gz DPXAMQAGEBQZTI-XJKSGUPXSA-N 0 3 345.399 2.643 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N(C)CCNC(=O)OC(C)(C)C ZINC001254550432 1315722555 /nfs/dbraw/zinc/72/25/55/1315722555.db2.gz JQPOZHPIZLJASR-CYBMUJFWSA-N 0 3 337.420 2.982 20 5 EFBDHN Cc1nccnc1O[C@@H]1CCN([C@H](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC001254568442 1315725250 /nfs/dbraw/zinc/72/52/50/1315725250.db2.gz FZEHAUOHPDYNRX-CZUORRHYSA-N 0 3 342.399 2.778 20 5 EFBDHN CCOC(=O)NC1CCN([C@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC001254570596 1315725580 /nfs/dbraw/zinc/72/55/80/1315725580.db2.gz OLFXLOQWMYZWTL-CYBMUJFWSA-N 0 3 335.404 2.736 20 5 EFBDHN CCC(=O)N(C)C1CCN([C@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC001254569729 1315725785 /nfs/dbraw/zinc/72/57/85/1315725785.db2.gz KIOMNYJCUAGWFG-CQSZACIVSA-N 0 3 333.432 2.859 20 5 EFBDHN NCc1cc(-c2ccncc2)nn1[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254581104 1315727054 /nfs/dbraw/zinc/72/70/54/1315727054.db2.gz KLBPYDDYPDJUPO-MRXNPFEDSA-N 0 3 335.367 2.652 20 5 EFBDHN CC(C)(F)c1ncncc1CN[C@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254581127 1315727115 /nfs/dbraw/zinc/72/71/15/1315727115.db2.gz KVKHEQLOYXIGIP-AWEZNQCLSA-N 0 3 330.363 2.846 20 5 EFBDHN CCOC(=O)C[C@H]1CCCN([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254592687 1315728505 /nfs/dbraw/zinc/72/85/05/1315728505.db2.gz FUKJGDWGQNNWIA-CXAGYDPISA-N 0 3 332.400 2.727 20 5 EFBDHN CC(C)(C)OC(=O)[C@H]1CCN([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254597442 1315728968 /nfs/dbraw/zinc/72/89/68/1315728968.db2.gz DQIYUOYMJZDVRB-XJKSGUPXSA-N 0 3 332.400 2.726 20 5 EFBDHN Cc1cnccc1O[C@H]1CCN([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254606319 1315730197 /nfs/dbraw/zinc/73/01/97/1315730197.db2.gz GJHMHVARPKWLHX-ROUUACIJSA-N 0 3 339.395 2.919 20 5 EFBDHN CC(=O)N(C(C)C)C1CCN([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254609264 1315731107 /nfs/dbraw/zinc/73/11/07/1315731107.db2.gz UYLBKOCIEVTOCE-IBGZPJMESA-N 0 3 345.443 2.783 20 5 EFBDHN C[C@@H]1[C@H](C)N(Cc2ccc([N+](=O)[O-])cc2Br)CCN1C ZINC001255184396 1315788339 /nfs/dbraw/zinc/78/83/39/1315788339.db2.gz NCMUSDXUFSEQCC-MNOVXSKESA-N 0 3 342.237 2.882 20 5 EFBDHN C[C@@H]1[C@@H](C)N(Cc2ccc([N+](=O)[O-])cc2Br)CCN1C ZINC001255184391 1315788449 /nfs/dbraw/zinc/78/84/49/1315788449.db2.gz NCMUSDXUFSEQCC-GHMZBOCLSA-N 0 3 342.237 2.882 20 5 EFBDHN COC(=O)[C@H]1CCC[C@@H]1NCc1cc([N+](=O)[O-])ccc1OC(F)F ZINC001255734672 1315862742 /nfs/dbraw/zinc/86/27/42/1315862742.db2.gz VZGCVJJWBMJTCC-RYUDHWBXSA-N 0 3 344.314 2.628 20 5 EFBDHN COc1cc(N2CCC(n3ccc([C@H](C)N)n3)CC2)ccc1[N+](=O)[O-] ZINC001256088642 1315903696 /nfs/dbraw/zinc/90/36/96/1315903696.db2.gz XRUNDQAXEOIUJY-LBPRGKRZSA-N 0 3 345.403 2.661 20 5 EFBDHN CC[C@H]1COCCN1C1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC001256100350 1315904057 /nfs/dbraw/zinc/90/40/57/1315904057.db2.gz GCZHRQYOILFSJP-AWEZNQCLSA-N 0 3 349.431 2.683 20 5 EFBDHN CN1CCCC[C@H]1CNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC001262652917 1316477532 /nfs/dbraw/zinc/47/75/32/1316477532.db2.gz UCAMABFZUQNJGR-JTQLQIEISA-N 0 3 329.759 2.601 20 5 EFBDHN COCCN1[C@H](C)CN(c2ccnc3c2cccc3[N+](=O)[O-])C[C@@H]1C ZINC001328142457 1330562664 /nfs/dbraw/zinc/56/26/64/1330562664.db2.gz AIPJOWLPKBYNPW-OKILXGFUSA-N 0 3 344.415 2.688 20 5 EFBDHN C[C@@H]1[C@H](C)N(c2ncnc3c(Cl)cc([N+](=O)[O-])cc32)CCN1C ZINC001328555919 1330602525 /nfs/dbraw/zinc/60/25/25/1330602525.db2.gz FYZGMHPCMHEJLC-ZJUUUORDSA-N 0 3 335.795 2.720 20 5 EFBDHN CC1CCN(CCNC(=O)[C@@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)CC1 ZINC001332747125 1331015516 /nfs/dbraw/zinc/01/55/16/1331015516.db2.gz XMPGQRUCKAUVAI-DLBZAZTESA-N 0 3 331.416 2.546 20 5 EFBDHN Cc1cc(CN2CCCN(CCc3ccc([N+](=O)[O-])cc3)CC2)no1 ZINC001333001778 1331063120 /nfs/dbraw/zinc/06/31/20/1331063120.db2.gz ZIFAROYOXBQBLW-UHFFFAOYSA-N 0 3 344.415 2.642 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]C[C@H]2CCCO[C@@H]2C(C)C)c1[N+](=O)[O-] ZINC001334185230 1331262771 /nfs/dbraw/zinc/26/27/71/1331262771.db2.gz AWMODTRXLLRPIL-CZUORRHYSA-N 0 3 338.404 2.850 20 5 EFBDHN COCCC1(C[NH2+]Cc2ccc([O-])c(OC)c2[N+](=O)[O-])CCCC1 ZINC001335478687 1331356192 /nfs/dbraw/zinc/35/61/92/1331356192.db2.gz KTYODDNUUAJXFN-UHFFFAOYSA-N 0 3 338.404 2.996 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]C[C@@H]2[C@@H]3Cc4ccccc4[C@H]23)c1[N+](=O)[O-] ZINC001336747943 1331499154 /nfs/dbraw/zinc/49/91/54/1331499154.db2.gz PGIWPSHGSISIEG-UXLLHSPISA-N 0 3 340.379 2.985 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCCCN1C ZINC001337477906 1331579322 /nfs/dbraw/zinc/57/93/22/1331579322.db2.gz AFMSJMHSRMIWOA-ZDUSSCGKSA-N 0 3 337.445 2.921 20 5 EFBDHN CC(C)(C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)N1CCCCC1 ZINC001339373175 1331852166 /nfs/dbraw/zinc/85/21/66/1331852166.db2.gz RRRIVRPKILXUQT-UHFFFAOYSA-N 0 3 331.416 2.744 20 5 EFBDHN COc1cc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])ccn1 ZINC001343829635 1332384218 /nfs/dbraw/zinc/38/42/18/1332384218.db2.gz IOCWYVATSAGWIS-ZUZCIYMTSA-N 0 3 334.303 2.793 20 5 EFBDHN CC([C@H](OC(=O)/C=C\c1cn(C)cn1)c1ccccc1F)[N+](=O)[O-] ZINC001345207372 1332521715 /nfs/dbraw/zinc/52/17/15/1332521715.db2.gz KPGMBIPPUUQTEQ-CNZFAKCFSA-N 0 3 333.319 2.522 20 5 EFBDHN CC([C@H](OC(=O)/C=C/c1cn(C)cn1)c1ccccc1F)[N+](=O)[O-] ZINC001345207373 1332522169 /nfs/dbraw/zinc/52/21/69/1332522169.db2.gz KPGMBIPPUUQTEQ-INAIPGEWSA-N 0 3 333.319 2.522 20 5 EFBDHN CN(CCNCc1ccc(Cl)cc1[N+](=O)[O-])CC(F)(F)F ZINC001351991269 1333345198 /nfs/dbraw/zinc/34/51/98/1333345198.db2.gz RZOGDRACACZZRR-UHFFFAOYSA-N 0 3 325.718 2.832 20 5 EFBDHN O=C(N[C@H]1CCCN2CCCC[C@@H]12)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000847256729 1333451609 /nfs/dbraw/zinc/45/16/09/1333451609.db2.gz RJBWLVOCENORSP-ZFWWWQNUSA-N 0 3 337.807 2.995 20 5 EFBDHN C[C@H](NCc1cc([N+](=O)[O-])ccc1Br)[C@H]1CCOC1 ZINC001354604401 1334403815 /nfs/dbraw/zinc/40/38/15/1334403815.db2.gz RPGIOQXLBDMQEH-UWVGGRQHSA-N 0 3 329.194 2.872 20 5 EFBDHN CC(C)CN1CCN(Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)CC1 ZINC000848473972 1334734144 /nfs/dbraw/zinc/73/41/44/1334734144.db2.gz SJRKHBQUYKUAAX-UHFFFAOYSA-N 0 3 343.431 2.689 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2N[C@H]1COc2ccccc2[C@H]1O ZINC000848550111 1334789692 /nfs/dbraw/zinc/78/96/92/1334789692.db2.gz CMECUEAMYDMTGQ-RLFYNMQTSA-N 0 3 326.352 2.666 20 5 EFBDHN O=C(N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1)c1cccc(F)c1 ZINC001021790099 714478276 /nfs/dbraw/zinc/47/82/76/714478276.db2.gz AEBOSGSWDALPKZ-IYBDPMFKSA-N 0 3 343.358 2.785 20 5 EFBDHN COc1ccc(C[C@](C)(CO)NCc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000933432520 714781053 /nfs/dbraw/zinc/78/10/53/714781053.db2.gz NYQFRVRLTBFDFN-GOSISDBHSA-N 0 3 348.374 2.826 20 5 EFBDHN COc1cc([N+](=O)[O-])cnc1N1CCCN(Cc2ccccc2)CC1 ZINC000891621584 714872779 /nfs/dbraw/zinc/87/27/79/714872779.db2.gz RIYYUVJQKBPKQI-UHFFFAOYSA-N 0 3 342.399 2.711 20 5 EFBDHN Cc1noc(C[C@@H]2CCCN(CCOc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000933575403 714900966 /nfs/dbraw/zinc/90/09/66/714900966.db2.gz ADIYEFBPESLPMR-AWEZNQCLSA-N 0 3 346.387 2.620 20 5 EFBDHN CCc1ccc(C(=O)N[C@H]2C[C@@H](NCc3ccccc3[N+](=O)[O-])C2)o1 ZINC001022297416 714983894 /nfs/dbraw/zinc/98/38/94/714983894.db2.gz VLGBAKDGZGGKGB-OKILXGFUSA-N 0 3 343.383 2.801 20 5 EFBDHN COc1c([O-])ccc(CN2CCC[C@@H]([NH+]3CCCC3)CC2)c1[N+](=O)[O-] ZINC000892086529 715246044 /nfs/dbraw/zinc/24/60/44/715246044.db2.gz RHYBYQVTIKVGDQ-OAHLLOKOSA-N 0 3 349.431 2.759 20 5 EFBDHN COc1c([O-])ccc(C[N@@H+]2CC[C@H](C3CCOCC3)C2)c1[N+](=O)[O-] ZINC000892144445 715272892 /nfs/dbraw/zinc/27/28/92/715272892.db2.gz DDFJAFLHKGINHX-ZDUSSCGKSA-N 0 3 336.388 2.558 20 5 EFBDHN COc1c([O-])ccc(C[N@H+]2CC[C@H](C3CCOCC3)C2)c1[N+](=O)[O-] ZINC000892144445 715272893 /nfs/dbraw/zinc/27/28/93/715272893.db2.gz DDFJAFLHKGINHX-ZDUSSCGKSA-N 0 3 336.388 2.558 20 5 EFBDHN C[C@H](Cc1cccnc1)NCc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000934240254 715275606 /nfs/dbraw/zinc/27/56/06/715275606.db2.gz TURMYFNPSNLQTD-GFCCVEGCSA-N 0 3 329.356 2.577 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1C[C@H](C)N(C2CC2)C1 ZINC000934398098 715449967 /nfs/dbraw/zinc/44/99/67/715449967.db2.gz RLSNIFNJNLDWMQ-QWRGUYRKSA-N 0 3 335.429 2.672 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)N(C)[C@@H]2CCCN(C)C2)cc1[N+](=O)[O-] ZINC000893453539 715570691 /nfs/dbraw/zinc/57/06/91/715570691.db2.gz PPKDYJAZTZNNIR-UKRRQHHQSA-N 0 3 334.420 2.700 20 5 EFBDHN Cc1cc(F)cc(C(=O)NC[C@H](C)N2CCC(C)CC2)c1[N+](=O)[O-] ZINC000176790553 716188216 /nfs/dbraw/zinc/18/82/16/716188216.db2.gz BSEJJFUWDPZELK-ZDUSSCGKSA-N 0 3 337.395 2.893 20 5 EFBDHN CCCN(C(=O)N[C@H](C)c1ccc([N+](=O)[O-])cc1)[C@H]1CCN(C)C1 ZINC000925247309 724487784 /nfs/dbraw/zinc/48/77/84/724487784.db2.gz RDAFXJUICQKPAL-CJNGLKHVSA-N 0 3 334.420 2.782 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCCN3CCCC[C@@H]23)c1C ZINC000892596066 718322289 /nfs/dbraw/zinc/32/22/89/718322289.db2.gz MVFXLEWNSCPKQD-CABCVRRESA-N 0 3 331.416 2.958 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]C[C@@]2(C)CCO[C@H]2C2CC2)c1[N+](=O)[O-] ZINC000893642222 719009108 /nfs/dbraw/zinc/00/91/08/719009108.db2.gz MTQDJCDCOMQEGX-DLBZAZTESA-N 0 3 336.388 2.604 20 5 EFBDHN CCc1nc(CCNCc2ccc(O)c(OC)c2[N+](=O)[O-])cs1 ZINC000892806476 719202000 /nfs/dbraw/zinc/20/20/00/719202000.db2.gz HUAHSGKHDLUUDZ-UHFFFAOYSA-N 0 3 337.401 2.660 20 5 EFBDHN Cc1cc(N2C[C@@H](C)N(C)C[C@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000351507535 719243328 /nfs/dbraw/zinc/24/33/28/719243328.db2.gz BTZOGOHKKMPBJY-ZIAGYGMSSA-N 0 3 341.415 2.889 20 5 EFBDHN COc1c([O-])ccc(C[NH2+][C@@H]2[C@H]3CCO[C@H]3C23CCCC3)c1[N+](=O)[O-] ZINC000893210652 720059856 /nfs/dbraw/zinc/05/98/56/720059856.db2.gz RHAOFQKTEUGSDK-CSMYWGQOSA-N 0 3 348.399 2.746 20 5 EFBDHN COCCN(Cc1ccc(O)c(OC)c1[N+](=O)[O-])[C@H]1CC[C@H](C)C1 ZINC000894002258 720216444 /nfs/dbraw/zinc/21/64/44/720216444.db2.gz VCJSWDMEWJQVBL-JSGCOSHPSA-N 0 3 338.404 2.946 20 5 EFBDHN COCC[N@H+](Cc1ccc([O-])c(OC)c1[N+](=O)[O-])[C@H]1CC[C@H](C)C1 ZINC000894002258 720216446 /nfs/dbraw/zinc/21/64/46/720216446.db2.gz VCJSWDMEWJQVBL-JSGCOSHPSA-N 0 3 338.404 2.946 20 5 EFBDHN COCC[N@@H+](Cc1ccc([O-])c(OC)c1[N+](=O)[O-])[C@H]1CC[C@H](C)C1 ZINC000894002258 720216450 /nfs/dbraw/zinc/21/64/50/720216450.db2.gz VCJSWDMEWJQVBL-JSGCOSHPSA-N 0 3 338.404 2.946 20 5 EFBDHN COCCN(Cc1ccc(O)c(OC)c1[N+](=O)[O-])[C@@H]1CC[C@H](C)C1 ZINC000894002257 720216589 /nfs/dbraw/zinc/21/65/89/720216589.db2.gz VCJSWDMEWJQVBL-GXTWGEPZSA-N 0 3 338.404 2.946 20 5 EFBDHN COCC[N@H+](Cc1ccc([O-])c(OC)c1[N+](=O)[O-])[C@@H]1CC[C@H](C)C1 ZINC000894002257 720216592 /nfs/dbraw/zinc/21/65/92/720216592.db2.gz VCJSWDMEWJQVBL-GXTWGEPZSA-N 0 3 338.404 2.946 20 5 EFBDHN COCC[N@@H+](Cc1ccc([O-])c(OC)c1[N+](=O)[O-])[C@@H]1CC[C@H](C)C1 ZINC000894002257 720216595 /nfs/dbraw/zinc/21/65/95/720216595.db2.gz VCJSWDMEWJQVBL-GXTWGEPZSA-N 0 3 338.404 2.946 20 5 EFBDHN O=[N+]([O-])c1cc(CNC2CCS(=O)CC2)cc(C(F)(F)F)c1 ZINC000894081927 720262794 /nfs/dbraw/zinc/26/27/94/720262794.db2.gz JXOZTWBCWIGUES-UHFFFAOYSA-N 0 3 336.335 2.614 20 5 EFBDHN COc1c([O-])ccc(C[N@@H+]2CCC[C@H]2C2CCOCC2)c1[N+](=O)[O-] ZINC000893317143 720588084 /nfs/dbraw/zinc/58/80/84/720588084.db2.gz KDVQUCDMXZPOOW-AWEZNQCLSA-N 0 3 336.388 2.700 20 5 EFBDHN COc1c([O-])ccc(C[N@H+]2CCC[C@H]2C2CCOCC2)c1[N+](=O)[O-] ZINC000893317143 720588086 /nfs/dbraw/zinc/58/80/86/720588086.db2.gz KDVQUCDMXZPOOW-AWEZNQCLSA-N 0 3 336.388 2.700 20 5 EFBDHN COc1c([O-])ccc(C[NH2+][C@@H]2CCO[C@@H](CC(C)C)C2)c1[N+](=O)[O-] ZINC000893320726 720607591 /nfs/dbraw/zinc/60/75/91/720607591.db2.gz UIHDWJGMGCTDKV-KGLIPLIRSA-N 0 3 338.404 2.992 20 5 EFBDHN CN(C)Cc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)c1 ZINC000047453269 721114530 /nfs/dbraw/zinc/11/45/30/721114530.db2.gz NOXDXTQNDXPOAZ-UHFFFAOYSA-N 0 3 342.399 2.975 20 5 EFBDHN Cc1occc1C(=O)N[C@H]1C[C@H](CNCc2csc([N+](=O)[O-])c2)C1 ZINC000983116997 721823796 /nfs/dbraw/zinc/82/37/96/721823796.db2.gz NMJDPURZDYYVPB-AULYBMBSSA-N 0 3 349.412 2.856 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]CC(C)(C)c2ccccn2)c1[N+](=O)[O-] ZINC000894674190 722814884 /nfs/dbraw/zinc/81/48/84/722814884.db2.gz TWEPMIBWMJEZRX-UHFFFAOYSA-N 0 3 331.372 2.771 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]C[C@H]2CCOC3(CCC3)C2)c1[N+](=O)[O-] ZINC000894711784 722823620 /nfs/dbraw/zinc/82/36/20/722823620.db2.gz LTMUWQXEOFEYEM-LBPRGKRZSA-N 0 3 336.388 2.748 20 5 EFBDHN COc1c(O)ccc(CNC[C@](C)(OC)c2ccccc2)c1[N+](=O)[O-] ZINC000894714247 722824311 /nfs/dbraw/zinc/82/43/11/722824311.db2.gz HQMJZQHDCATMRX-SFHVURJKSA-N 0 3 346.383 2.960 20 5 EFBDHN CC1(C(=O)N[C@H]2C[C@H](CNCc3csc([N+](=O)[O-])c3)C2)CC=CC1 ZINC000984748226 723400141 /nfs/dbraw/zinc/40/01/41/723400141.db2.gz GDVUPOLAKPLYQM-MQMHXKEQSA-N 0 3 349.456 2.997 20 5 EFBDHN CN(C)CCN(C)C(=O)c1cc(F)c(Cl)c([N+](=O)[O-])c1Cl ZINC000896822179 723509877 /nfs/dbraw/zinc/50/98/77/723509877.db2.gz ZQGAFDHCXDCXSM-UHFFFAOYSA-N 0 3 338.166 2.674 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000139320369 728830665 /nfs/dbraw/zinc/83/06/65/728830665.db2.gz NZHAAXBRWSNCFJ-LBPRGKRZSA-N 0 3 325.796 2.852 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN[C@H](CO)C[C@H]1CCCO1 ZINC000895748321 724293577 /nfs/dbraw/zinc/29/35/77/724293577.db2.gz LQCRBDFDQLLIFQ-QWHCGFSZSA-N 0 3 348.321 2.633 20 5 EFBDHN CCN1CCCN(C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000910266771 727425169 /nfs/dbraw/zinc/42/51/69/727425169.db2.gz OTIUSZQJYLIDAK-SNVBAGLBSA-N 0 3 343.786 2.944 20 5 EFBDHN CCN1CCCN(C(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)[C@@H](C)C1 ZINC000910284562 727427387 /nfs/dbraw/zinc/42/73/87/727427387.db2.gz QWHAIMNUAZEKJT-QWHCGFSZSA-N 0 3 337.395 2.780 20 5 EFBDHN CCOc1ccc(C(=O)N2CCCN(CC)C[C@H]2C)cc1[N+](=O)[O-] ZINC000910294826 727431076 /nfs/dbraw/zinc/43/10/76/727431076.db2.gz JCBKTTBYHHZIKG-CYBMUJFWSA-N 0 3 335.404 2.550 20 5 EFBDHN CCC[C@@H]1CN(Cc2cc(F)ccc2[N+](=O)[O-])CCN1CCOC ZINC000179673317 729607634 /nfs/dbraw/zinc/60/76/34/729607634.db2.gz QZCCPGIOHYCIHH-MRXNPFEDSA-N 0 3 339.411 2.667 20 5 EFBDHN COc1ccc(C[C@@](C)(CO)NCc2csc([N+](=O)[O-])c2)cc1 ZINC000873190698 1126118123 /nfs/dbraw/zinc/11/81/23/1126118123.db2.gz CNEIHAHQIZUEOF-INIZCTEOSA-N 0 3 336.413 2.748 20 5 EFBDHN CC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)[C@@H](CC)CN1 ZINC001573721128 1087883943 /nfs/dbraw/zinc/88/39/43/1087883943.db2.gz XJFHUIWGDRZLFM-MNOVXSKESA-N 0 3 325.796 2.851 20 5 EFBDHN COC(=O)c1cc(NC(=O)[C@H](N)C2CCCCCC2)cc([N+](=O)[O-])c1 ZINC001578859074 1090455300 /nfs/dbraw/zinc/45/53/00/1090455300.db2.gz CXDHZFQTZPOZBG-OAHLLOKOSA-N 0 3 349.387 2.618 20 5 EFBDHN COC(=O)c1cc(NC(=O)[C@@H](N)C2CCCCCC2)cc([N+](=O)[O-])c1 ZINC001578859073 1090455510 /nfs/dbraw/zinc/45/55/10/1090455510.db2.gz CXDHZFQTZPOZBG-HNNXBMFYSA-N 0 3 349.387 2.618 20 5 EFBDHN N[C@H](CC1CC1)C(=O)N[C@H](c1cccc([N+](=O)[O-])c1F)C(F)(F)F ZINC001580122247 1090779814 /nfs/dbraw/zinc/77/98/14/1090779814.db2.gz QCTNNOGTVLEZCM-BXKDBHETSA-N 0 3 349.284 2.581 20 5 EFBDHN N[C@@H](CC1CC1)C(=O)N[C@@H](c1cccc([N+](=O)[O-])c1F)C(F)(F)F ZINC001580122250 1090780233 /nfs/dbraw/zinc/78/02/33/1090780233.db2.gz QCTNNOGTVLEZCM-CABZTGNLSA-N 0 3 349.284 2.581 20 5 EFBDHN O=[N+]([O-])c1cnc2ccc(Cl)cc2c1N[C@@H]1CNCCC1(F)F ZINC001580875147 1091031399 /nfs/dbraw/zinc/03/13/99/1091031399.db2.gz BAVBQGKCBKGTCU-GFCCVEGCSA-N 0 3 342.733 2.627 20 5 EFBDHN CC(C)(C)[C@@H]1CC[N@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001589103783 1093032583 /nfs/dbraw/zinc/03/25/83/1093032583.db2.gz WSOZSRFQFIXSPI-CYBMUJFWSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)(C)[C@@H]1CC[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001589103783 1093032592 /nfs/dbraw/zinc/03/25/92/1093032592.db2.gz WSOZSRFQFIXSPI-CYBMUJFWSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)(C)[C@@H]1CC[N@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001589103783 1093032600 /nfs/dbraw/zinc/03/26/00/1093032600.db2.gz WSOZSRFQFIXSPI-CYBMUJFWSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)(C)[C@@H]1CC[N@@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001589103783 1093032609 /nfs/dbraw/zinc/03/26/09/1093032609.db2.gz WSOZSRFQFIXSPI-CYBMUJFWSA-N 0 3 330.392 2.643 20 5 EFBDHN C[C@@H]1C[C@H](C)[C@H](C)[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590189660 1093298121 /nfs/dbraw/zinc/29/81/21/1093298121.db2.gz WLZKOARPGBBJCT-WOPDTQHZSA-N 0 3 330.392 2.641 20 5 EFBDHN C[C@@H]1C[C@H](C)[C@H](C)[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590189660 1093298131 /nfs/dbraw/zinc/29/81/31/1093298131.db2.gz WLZKOARPGBBJCT-WOPDTQHZSA-N 0 3 330.392 2.641 20 5 EFBDHN C[C@@H]1C[C@H](C)[C@H](C)[N@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590189660 1093298138 /nfs/dbraw/zinc/29/81/38/1093298138.db2.gz WLZKOARPGBBJCT-WOPDTQHZSA-N 0 3 330.392 2.641 20 5 EFBDHN C[C@@H]1C[C@H](C)[C@H](C)[N@@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590189660 1093298143 /nfs/dbraw/zinc/29/81/43/1093298143.db2.gz WLZKOARPGBBJCT-WOPDTQHZSA-N 0 3 330.392 2.641 20 5 EFBDHN C[C@@H]1CCC[C@H](C)C[N@H+]1Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001590245013 1093332006 /nfs/dbraw/zinc/33/20/06/1093332006.db2.gz XPOZKQKWBORAAL-NWDGAFQWSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@H](C)C[N@@H+]1Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001590245013 1093332017 /nfs/dbraw/zinc/33/20/17/1093332017.db2.gz XPOZKQKWBORAAL-NWDGAFQWSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@H](C)C[N@H+]1Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001590245013 1093332024 /nfs/dbraw/zinc/33/20/24/1093332024.db2.gz XPOZKQKWBORAAL-NWDGAFQWSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@H](C)C[N@@H+]1Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001590245013 1093332031 /nfs/dbraw/zinc/33/20/31/1093332031.db2.gz XPOZKQKWBORAAL-NWDGAFQWSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1C[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])[C@H]2CCCC[C@H]12 ZINC001590307013 1093367097 /nfs/dbraw/zinc/36/70/97/1093367097.db2.gz DAZBMFOTEXHUNL-JMSVASOKSA-N 0 3 342.403 2.785 20 5 EFBDHN C[C@@H]1C[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])[C@H]2CCCC[C@H]12 ZINC001590307013 1093367106 /nfs/dbraw/zinc/36/71/06/1093367106.db2.gz DAZBMFOTEXHUNL-JMSVASOKSA-N 0 3 342.403 2.785 20 5 EFBDHN C[C@@H]1C[N@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])[C@H]2CCCC[C@H]12 ZINC001590307013 1093367115 /nfs/dbraw/zinc/36/71/15/1093367115.db2.gz DAZBMFOTEXHUNL-JMSVASOKSA-N 0 3 342.403 2.785 20 5 EFBDHN C[C@@H]1C[N@@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])[C@H]2CCCC[C@H]12 ZINC001590307013 1093367124 /nfs/dbraw/zinc/36/71/24/1093367124.db2.gz DAZBMFOTEXHUNL-JMSVASOKSA-N 0 3 342.403 2.785 20 5 EFBDHN CCC(CC)[C@@H](CNc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])[NH+](C)C ZINC001590433022 1093420771 /nfs/dbraw/zinc/42/07/71/1093420771.db2.gz WDYIECOSWUERNG-CQSZACIVSA-N 0 3 347.423 2.553 20 5 EFBDHN CCC(CC)[C@@H](CNc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])[NH+](C)C ZINC001590433022 1093420775 /nfs/dbraw/zinc/42/07/75/1093420775.db2.gz WDYIECOSWUERNG-CQSZACIVSA-N 0 3 347.423 2.553 20 5 EFBDHN CC[NH+](CC)CCC[C@@H](C)Nc1ccc(-c2nnn[n-]2)c([N+](=O)[O-])c1 ZINC001590687409 1093548307 /nfs/dbraw/zinc/54/83/07/1093548307.db2.gz MWRJPKATKPELNA-GFCCVEGCSA-N 0 3 347.423 2.697 20 5 EFBDHN C[N@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1cc(-c2nnn[n-]2)cs1 ZINC001591119580 1093662192 /nfs/dbraw/zinc/66/21/92/1093662192.db2.gz QRGKWCGHBJOLSN-UHFFFAOYSA-N 0 3 344.400 2.511 20 5 EFBDHN C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1cc(-c2nnn[n-]2)cs1 ZINC001591119580 1093662199 /nfs/dbraw/zinc/66/21/99/1093662199.db2.gz QRGKWCGHBJOLSN-UHFFFAOYSA-N 0 3 344.400 2.511 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[NH2+]C1(C2CCC2)CCC1 ZINC001593467015 1094309986 /nfs/dbraw/zinc/30/99/86/1094309986.db2.gz JWZXTCOVNWKLDB-UHFFFAOYSA-N 0 3 328.376 2.587 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1C[NH2+]C1(C2CCC2)CCC1 ZINC001593467015 1094309991 /nfs/dbraw/zinc/30/99/91/1094309991.db2.gz JWZXTCOVNWKLDB-UHFFFAOYSA-N 0 3 328.376 2.587 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[N@@H+]1CCC[C@H]2CCC[C@@H]21 ZINC001593483137 1094325453 /nfs/dbraw/zinc/32/54/53/1094325453.db2.gz VRYFJFRJMKTTET-RISCZKNCSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[N@H+]1CCC[C@H]2CCC[C@@H]21 ZINC001593483137 1094325461 /nfs/dbraw/zinc/32/54/61/1094325461.db2.gz VRYFJFRJMKTTET-RISCZKNCSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[N@@H+]1CCC[C@H]2CCC[C@@H]21 ZINC001593483137 1094325472 /nfs/dbraw/zinc/32/54/72/1094325472.db2.gz VRYFJFRJMKTTET-RISCZKNCSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[N@H+]1CCC[C@H]2CCC[C@@H]21 ZINC001593483137 1094325481 /nfs/dbraw/zinc/32/54/81/1094325481.db2.gz VRYFJFRJMKTTET-RISCZKNCSA-N 0 3 328.376 2.539 20 5 EFBDHN NCc1nn(-c2cc([N+](=O)[O-])cc(Br)n2)c2ccccc12 ZINC001167697617 1095985210 /nfs/dbraw/zinc/98/52/10/1095985210.db2.gz ICGPUMWSWIXUQS-UHFFFAOYSA-N 0 3 348.160 2.550 20 5 EFBDHN CC(C)[C@@H]1CCCC[N@@H+]1Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001603243762 1096482546 /nfs/dbraw/zinc/48/25/46/1096482546.db2.gz HPWBLKGGRACGNZ-AWEZNQCLSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)[C@@H]1CCCC[N@H+]1Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001603243762 1096482550 /nfs/dbraw/zinc/48/25/50/1096482550.db2.gz HPWBLKGGRACGNZ-AWEZNQCLSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)[C@@H]1CCCC[N@@H+]1Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001603243762 1096482557 /nfs/dbraw/zinc/48/25/57/1096482557.db2.gz HPWBLKGGRACGNZ-AWEZNQCLSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)[C@@H]1CCCC[N@H+]1Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001603243762 1096482560 /nfs/dbraw/zinc/48/25/60/1096482560.db2.gz HPWBLKGGRACGNZ-AWEZNQCLSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)[C@@H]1CCC[N@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001603245716 1096483680 /nfs/dbraw/zinc/48/36/80/1096483680.db2.gz LMHCMHACCOFLSZ-CYBMUJFWSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)[C@@H]1CCC[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001603245716 1096483688 /nfs/dbraw/zinc/48/36/88/1096483688.db2.gz LMHCMHACCOFLSZ-CYBMUJFWSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)[C@@H]1CCC[N@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001603245716 1096483695 /nfs/dbraw/zinc/48/36/95/1096483695.db2.gz LMHCMHACCOFLSZ-CYBMUJFWSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)[C@@H]1CCC[N@@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001603245716 1096483701 /nfs/dbraw/zinc/48/37/01/1096483701.db2.gz LMHCMHACCOFLSZ-CYBMUJFWSA-N 0 3 330.392 2.643 20 5 EFBDHN C[C@H]1CC[C@@]2(CC[N@H+](Cc3c(-c4nnn[n-]4)cccc3[N+](=O)[O-])C2)C1 ZINC001603880089 1096654044 /nfs/dbraw/zinc/65/40/44/1096654044.db2.gz DQHFHPDLBUPIBT-YVEFUNNKSA-N 0 3 342.403 2.787 20 5 EFBDHN C[C@H]1CC[C@@]2(CC[N@@H+](Cc3c(-c4nnn[n-]4)cccc3[N+](=O)[O-])C2)C1 ZINC001603880089 1096654046 /nfs/dbraw/zinc/65/40/46/1096654046.db2.gz DQHFHPDLBUPIBT-YVEFUNNKSA-N 0 3 342.403 2.787 20 5 EFBDHN C[C@H]1CC[C@@]2(CC[N@H+](Cc3c(-c4nn[n-]n4)cccc3[N+](=O)[O-])C2)C1 ZINC001603880089 1096654050 /nfs/dbraw/zinc/65/40/50/1096654050.db2.gz DQHFHPDLBUPIBT-YVEFUNNKSA-N 0 3 342.403 2.787 20 5 EFBDHN C[C@H]1CC[C@@]2(CC[N@@H+](Cc3c(-c4nn[n-]n4)cccc3[N+](=O)[O-])C2)C1 ZINC001603880089 1096654054 /nfs/dbraw/zinc/65/40/54/1096654054.db2.gz DQHFHPDLBUPIBT-YVEFUNNKSA-N 0 3 342.403 2.787 20 5 EFBDHN C[C@H]1C[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])CC(C)(C)C1 ZINC001603937314 1096673496 /nfs/dbraw/zinc/67/34/96/1096673496.db2.gz RKUCNMDLCAPHKI-LLVKDONJSA-N 0 3 330.392 2.643 20 5 EFBDHN C[C@H]1C[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])CC(C)(C)C1 ZINC001603937314 1096673499 /nfs/dbraw/zinc/67/34/99/1096673499.db2.gz RKUCNMDLCAPHKI-LLVKDONJSA-N 0 3 330.392 2.643 20 5 EFBDHN CC[C@@H]1CCC[N@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC1 ZINC001604102306 1096737805 /nfs/dbraw/zinc/73/78/05/1096737805.db2.gz AAHGFLBPDFUQGK-GFCCVEGCSA-N 0 3 330.392 2.787 20 5 EFBDHN CC[C@@H]1CCC[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC1 ZINC001604102306 1096737808 /nfs/dbraw/zinc/73/78/08/1096737808.db2.gz AAHGFLBPDFUQGK-GFCCVEGCSA-N 0 3 330.392 2.787 20 5 EFBDHN CC[C@@H]1CCC[N@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])CC1 ZINC001604102306 1096737811 /nfs/dbraw/zinc/73/78/11/1096737811.db2.gz AAHGFLBPDFUQGK-GFCCVEGCSA-N 0 3 330.392 2.787 20 5 EFBDHN CC[C@@H]1CCC[N@@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])CC1 ZINC001604102306 1096737815 /nfs/dbraw/zinc/73/78/15/1096737815.db2.gz AAHGFLBPDFUQGK-GFCCVEGCSA-N 0 3 330.392 2.787 20 5 EFBDHN O=[N+]([O-])c1cc(O[C@H]2CN3CCC2CC3)ccc1Br ZINC001225503960 1097447126 /nfs/dbraw/zinc/44/71/26/1097447126.db2.gz IYCCKQDTVMXLKO-ZDUSSCGKSA-N 0 3 327.178 2.830 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[N@H+](CC1CC1)C1CCC1 ZINC001607076752 1097505787 /nfs/dbraw/zinc/50/57/87/1097505787.db2.gz BDKQKJZAFYBHBK-UHFFFAOYSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[N@@H+](CC1CC1)C1CCC1 ZINC001607076752 1097505790 /nfs/dbraw/zinc/50/57/90/1097505790.db2.gz BDKQKJZAFYBHBK-UHFFFAOYSA-N 0 3 328.376 2.539 20 5 EFBDHN CN1C[C@@H]2CCN(C(=O)c3cccc4nc5ccccc5nc43)[C@@H]2C1 ZINC001269505110 1098193582 /nfs/dbraw/zinc/19/35/82/1098193582.db2.gz XEODQBXAYPGBLP-SCLBCKFNSA-N 0 3 332.407 2.559 20 5 EFBDHN CCC[C@H]1CCC[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001609206533 1098199266 /nfs/dbraw/zinc/19/92/66/1098199266.db2.gz CLRDHFCTJZJCKA-LBPRGKRZSA-N 0 3 330.392 2.787 20 5 EFBDHN CCC[C@H]1CCC[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001609206533 1098199272 /nfs/dbraw/zinc/19/92/72/1098199272.db2.gz CLRDHFCTJZJCKA-LBPRGKRZSA-N 0 3 330.392 2.787 20 5 EFBDHN CCC[C@H]1CCC[N@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001609206533 1098199276 /nfs/dbraw/zinc/19/92/76/1098199276.db2.gz CLRDHFCTJZJCKA-LBPRGKRZSA-N 0 3 330.392 2.787 20 5 EFBDHN CCC[C@H]1CCC[N@@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001609206533 1098199279 /nfs/dbraw/zinc/19/92/79/1098199279.db2.gz CLRDHFCTJZJCKA-LBPRGKRZSA-N 0 3 330.392 2.787 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[N@H+](CC1CC1)CC1CCC1 ZINC001609599908 1098394297 /nfs/dbraw/zinc/39/42/97/1098394297.db2.gz HPTWNJPTQLOQTN-UHFFFAOYSA-N 0 3 342.403 2.787 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[N@@H+](CC1CC1)CC1CCC1 ZINC001609599908 1098394304 /nfs/dbraw/zinc/39/43/04/1098394304.db2.gz HPTWNJPTQLOQTN-UHFFFAOYSA-N 0 3 342.403 2.787 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1C[N@H+](CC1CC1)CC1CCC1 ZINC001609599908 1098394310 /nfs/dbraw/zinc/39/43/10/1098394310.db2.gz HPTWNJPTQLOQTN-UHFFFAOYSA-N 0 3 342.403 2.787 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1C[N@@H+](CC1CC1)CC1CCC1 ZINC001609599908 1098394317 /nfs/dbraw/zinc/39/43/17/1098394317.db2.gz HPTWNJPTQLOQTN-UHFFFAOYSA-N 0 3 342.403 2.787 20 5 EFBDHN CC(C)[C@H]1N(C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC12CCOCC2 ZINC000840776251 1101671507 /nfs/dbraw/zinc/67/15/07/1101671507.db2.gz HWMWMTPCUAWCHJ-IAGOWNOFSA-N 0 3 334.416 2.765 20 5 EFBDHN O=C(NCCC1(CNCc2ccccc2[N+](=O)[O-])CC1)C1(CF)CC1 ZINC001167167020 1101973552 /nfs/dbraw/zinc/97/35/52/1101973552.db2.gz CDODQGPPGQAGEF-UHFFFAOYSA-N 0 3 349.406 2.721 20 5 EFBDHN O=C([C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1)N1CCNC2(CCCCC2)C1 ZINC000906635576 1104388004 /nfs/dbraw/zinc/38/80/04/1104388004.db2.gz ZRTUVRSQDBXJRS-DLBZAZTESA-N 0 3 343.427 2.833 20 5 EFBDHN COc1cc(CNCC[C@@H]2CCCC[C@@H]2O)c([N+](=O)[O-])cc1OC ZINC000897539355 1105363502 /nfs/dbraw/zinc/36/35/02/1105363502.db2.gz ZSSZUTLGRVGGGM-WFASDCNBSA-N 0 3 338.404 2.643 20 5 EFBDHN Cc1ccoc1C(=O)N1CCC(NCc2csc([N+](=O)[O-])c2)CC1 ZINC000989949714 1107025449 /nfs/dbraw/zinc/02/54/49/1107025449.db2.gz KHZNGYMZEKIDAO-UHFFFAOYSA-N 0 3 349.412 2.952 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCO[C@H]1CCOC1 ZINC000927082654 1108821769 /nfs/dbraw/zinc/82/17/69/1108821769.db2.gz GZOFBEIDTRSVEC-YPMHNXCESA-N 0 3 326.418 2.773 20 5 EFBDHN O=C(C=C1CCC1)N1CCC(NCc2csc([N+](=O)[O-])c2)CC1 ZINC000990956616 1110060178 /nfs/dbraw/zinc/06/01/78/1110060178.db2.gz YDAPOPIJSVMJKT-UHFFFAOYSA-N 0 3 335.429 2.847 20 5 EFBDHN CCCN(C)CC(=O)N1CCC(C)(Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC001112353803 1111231745 /nfs/dbraw/zinc/23/17/45/1111231745.db2.gz CFFAOFQWZUYIGR-UHFFFAOYSA-N 0 3 348.447 2.730 20 5 EFBDHN CCN(CCNc1cc(C)ccc1[N+](=O)[O-])C(=O)CN(C)C(C)C ZINC001106778956 1111825784 /nfs/dbraw/zinc/82/57/84/1111825784.db2.gz NXEHQMRBQZSANM-UHFFFAOYSA-N 0 3 336.436 2.504 20 5 EFBDHN CCCN(C)CC(=O)N(CC)CCNc1ccc([N+](=O)[O-])c(C)c1 ZINC001106809275 1111866893 /nfs/dbraw/zinc/86/68/93/1111866893.db2.gz HRUMNNCMGWKBBC-UHFFFAOYSA-N 0 3 336.436 2.505 20 5 EFBDHN Cc1cc(Cl)c(NCCCN2CCN(C)CC2)c([N+](=O)[O-])c1 ZINC001161710354 1118717430 /nfs/dbraw/zinc/71/74/30/1118717430.db2.gz DGFSVVIJYYCPTI-UHFFFAOYSA-N 0 3 326.828 2.606 20 5 EFBDHN C[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)[C@@H](c1ccccc1)N(C)C ZINC000187222207 299065219 /nfs/dbraw/zinc/06/52/19/299065219.db2.gz DZSUFKHDJRWQMB-LIRRHRJNSA-N 0 3 341.411 2.945 20 5 EFBDHN CCN1CCC[C@@H]1CNc1ncc(Br)cc1[N+](=O)[O-] ZINC000040713363 213373451 /nfs/dbraw/zinc/37/34/51/213373451.db2.gz ZLNSUJUQRCWWGJ-SNVBAGLBSA-N 0 3 329.198 2.649 20 5 EFBDHN C[C@@H](CN1CCCCC1)NC(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000429834996 295901916 /nfs/dbraw/zinc/90/19/16/295901916.db2.gz YLYLXBHNYCBUNJ-AWEZNQCLSA-N 0 3 333.432 2.863 20 5 EFBDHN Cn1cc(CN2CCC(C)(CO)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000184072513 235298878 /nfs/dbraw/zinc/29/88/78/235298878.db2.gz FKMPXCLXWJBEJP-UHFFFAOYSA-N 0 3 344.415 2.590 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1csc([N+](=O)[O-])c1 ZINC000184077173 235300328 /nfs/dbraw/zinc/30/03/28/235300328.db2.gz OVLHJMLXIFAOOS-DOMZBBRYSA-N 0 3 345.424 2.907 20 5 EFBDHN CCCN(CCN1CCCCCC1)c1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000341066438 283258638 /nfs/dbraw/zinc/25/86/38/283258638.db2.gz PMKNXLLXORPMNO-UHFFFAOYSA-N 0 3 348.447 2.786 20 5 EFBDHN CN(C)C1(CN(C)C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CCC1 ZINC000188035362 236394906 /nfs/dbraw/zinc/39/49/06/236394906.db2.gz BKEKHGFFSBZLDQ-UHFFFAOYSA-N 0 3 346.431 2.725 20 5 EFBDHN C[C@@H]1C[C@H](Nc2ncc(Br)cc2[N+](=O)[O-])CN1C1CC1 ZINC000131309728 223221971 /nfs/dbraw/zinc/22/19/71/223221971.db2.gz JUBZCYXPDBBQOE-SCZZXKLOSA-N 0 3 341.209 2.789 20 5 EFBDHN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CC[C@@H](N2CCCCC2)C1 ZINC000264543455 201212232 /nfs/dbraw/zinc/21/22/32/201212232.db2.gz BFLWSXRWXTYCTI-CYBMUJFWSA-N 0 3 337.807 2.949 20 5 EFBDHN Cc1nn(C)c(N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000268102768 201226279 /nfs/dbraw/zinc/22/62/79/201226279.db2.gz APAWNEUBJZHCKF-DOMZBBRYSA-N 0 3 329.404 2.712 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)CC[C@H]1Nc1c([N+](=O)[O-])ncn1C ZINC000267189702 201221831 /nfs/dbraw/zinc/22/18/31/201221831.db2.gz HCFGOLOOOUCEKC-UKRRQHHQSA-N 0 3 329.404 2.651 20 5 EFBDHN C[C@@H](NCCn1cc(Br)cn1)c1cccc([N+](=O)[O-])c1 ZINC000271626406 201246378 /nfs/dbraw/zinc/24/63/78/201246378.db2.gz DRQSYTBPGLSSGQ-SNVBAGLBSA-N 0 3 339.193 2.905 20 5 EFBDHN C[C@H](NC(=O)NCCN1CCC[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000079983998 201237895 /nfs/dbraw/zinc/23/78/95/201237895.db2.gz VJVGGQPYNGYXLE-KBPBESRZSA-N 0 3 334.420 2.687 20 5 EFBDHN CCC[C@@]1(COC)CCCN1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000194942264 240192683 /nfs/dbraw/zinc/19/26/83/240192683.db2.gz VSKCMBKQCLRIFG-SFHVURJKSA-N 0 3 349.431 2.839 20 5 EFBDHN O=[N+]([O-])c1ccc(CN2CCN(C3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC000193670483 240256663 /nfs/dbraw/zinc/25/66/63/240256663.db2.gz MCCADRYFEDUWFW-UHFFFAOYSA-N 0 3 334.376 2.563 20 5 EFBDHN C[C@@H](CNc1ncc(Br)cc1[N+](=O)[O-])N(C)C1CC1 ZINC000230214853 242251316 /nfs/dbraw/zinc/25/13/16/242251316.db2.gz DYBCBGIYMJWPFW-QMMMGPOBSA-N 0 3 329.198 2.647 20 5 EFBDHN CO[C@H]1c2ccccc2C[C@H]1NCCOc1ccc([N+](=O)[O-])cc1 ZINC000411893705 243020595 /nfs/dbraw/zinc/02/05/95/243020595.db2.gz PKUFIQOGTRAQMA-MSOLQXFVSA-N 0 3 328.368 2.876 20 5 EFBDHN CO[C@@](C)([C@@H](C)NCC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000411972696 243049593 /nfs/dbraw/zinc/04/95/93/243049593.db2.gz QIMQVONTLVVPHN-PXAZEXFGSA-N 0 3 335.404 2.635 20 5 EFBDHN CO[C@@](C)([C@@H](C)NCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000411978501 243052980 /nfs/dbraw/zinc/05/29/80/243052980.db2.gz ZCEIWMZVRANCFS-PXAZEXFGSA-N 0 3 335.404 2.635 20 5 EFBDHN CO[C@@](C)([C@H](C)NCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000411978504 243053665 /nfs/dbraw/zinc/05/36/65/243053665.db2.gz ZCEIWMZVRANCFS-SJCJKPOMSA-N 0 3 335.404 2.635 20 5 EFBDHN CN(C)C1(CN(C)C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000412272176 243240430 /nfs/dbraw/zinc/24/04/30/243240430.db2.gz DUMZZPBDINENHI-JKSUJKDBSA-N 0 3 331.416 2.641 20 5 EFBDHN CN1CCCC(C)(C)[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412312892 243261984 /nfs/dbraw/zinc/26/19/84/243261984.db2.gz VJRQSGMCUJITQK-BBWFWOEESA-N 0 3 345.443 2.935 20 5 EFBDHN C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000247159843 243382758 /nfs/dbraw/zinc/38/27/58/243382758.db2.gz AKJQYBOTMCFGCB-QMTHXVAHSA-N 0 3 325.796 2.660 20 5 EFBDHN CSc1ccc(C(=O)N(C)[C@@H]2CCN(C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000247200804 243391634 /nfs/dbraw/zinc/39/16/34/243391634.db2.gz BVLSUTJQPYCFHE-WCQYABFASA-N 0 3 337.445 2.729 20 5 EFBDHN COCCN1CCC(Nc2ncc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000413079602 243459425 /nfs/dbraw/zinc/45/94/25/243459425.db2.gz DLNNEFFPJXAING-UHFFFAOYSA-N 0 3 348.325 2.531 20 5 EFBDHN CN1CCC(N(Cc2ccco2)C(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC000069596426 203025592 /nfs/dbraw/zinc/02/55/92/203025592.db2.gz LQNROCYCZSOSKI-UHFFFAOYSA-N 0 3 343.383 2.924 20 5 EFBDHN O=C(NCC1CCN(c2ccncc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000070928490 203083483 /nfs/dbraw/zinc/08/34/83/203083483.db2.gz IBKFVNXHLQJTCW-UHFFFAOYSA-N 0 3 340.383 2.636 20 5 EFBDHN Cc1ccc([C@H](C)NCCC(C)(C)S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000414272465 244071396 /nfs/dbraw/zinc/07/13/96/244071396.db2.gz XEQZIECULNSBHC-LBPRGKRZSA-N 0 3 328.434 2.767 20 5 EFBDHN Cc1c([C@@H](C)NCC2(CS(C)(=O)=O)CCC2)cccc1[N+](=O)[O-] ZINC000414320157 244087070 /nfs/dbraw/zinc/08/70/70/244087070.db2.gz ADMBVAFENUUOTK-CYBMUJFWSA-N 0 3 340.445 2.769 20 5 EFBDHN COC[C@@H]1C[C@H](O)CN1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000414481196 244187692 /nfs/dbraw/zinc/18/76/92/244187692.db2.gz BYIMPOPRCSGZSX-STQMWFEESA-N 0 3 348.424 2.905 20 5 EFBDHN CC(C)c1ccc(CNC(C)(C)CN2CCOCC2)cc1[N+](=O)[O-] ZINC000414566644 244236430 /nfs/dbraw/zinc/23/64/30/244236430.db2.gz XDUVKIUPMOVEDK-UHFFFAOYSA-N 0 3 335.448 2.919 20 5 EFBDHN C[C@@]1(F)CNCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000414771833 244339301 /nfs/dbraw/zinc/33/93/01/244339301.db2.gz SAOQGMWVRFOVHY-QGZVFWFLSA-N 0 3 333.363 2.988 20 5 EFBDHN C[C@H](NC(=O)N1CC[C@H]2CC[C@@H](C1)N2C)c1cccc([N+](=O)[O-])c1 ZINC000073758317 203272612 /nfs/dbraw/zinc/27/26/12/203272612.db2.gz GLXDBRKXCITMAT-BJJXKVORSA-N 0 3 332.404 2.534 20 5 EFBDHN Cc1ccc([C@@H]2CCCCCN2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)o1 ZINC000076089514 203337866 /nfs/dbraw/zinc/33/78/66/203337866.db2.gz BFHCEGFFCRHDEJ-HOTGVXAUSA-N 0 3 348.403 2.671 20 5 EFBDHN O=[N+]([O-])c1cccc(N2CCN(CCCCCn3cccn3)CC2)c1 ZINC000104674257 204114199 /nfs/dbraw/zinc/11/41/99/204114199.db2.gz SYPKMKYRCXMQJV-UHFFFAOYSA-N 0 3 343.431 2.784 20 5 EFBDHN CC(C)N1CCN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000104667326 204114592 /nfs/dbraw/zinc/11/45/92/204114592.db2.gz PZIKABGXRRXTKW-UHFFFAOYSA-N 0 3 344.415 2.818 20 5 EFBDHN CC(C)[C@@H](C(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl)N(C)C ZINC000106903071 204219227 /nfs/dbraw/zinc/21/92/27/204219227.db2.gz CHHOEYQDPQBLGD-AWEZNQCLSA-N 0 3 327.812 2.793 20 5 EFBDHN C[C@H]1C[C@@H](N(C)C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)CCN1C ZINC000127871592 205121434 /nfs/dbraw/zinc/12/14/34/205121434.db2.gz HUALABBIGQRZSR-RYUDHWBXSA-N 0 3 330.388 2.631 20 5 EFBDHN C[C@H]1CCCC[C@@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000129244582 205186616 /nfs/dbraw/zinc/18/66/16/205186616.db2.gz MWYKRKLPWCODJW-WFASDCNBSA-N 0 3 326.418 2.537 20 5 EFBDHN C[C@@H](NCCC(=O)Nc1cc([N+](=O)[O-])ccc1F)c1cccnc1 ZINC000129698787 205208433 /nfs/dbraw/zinc/20/84/33/205208433.db2.gz KQVZAZBENMWAJG-LLVKDONJSA-N 0 3 332.335 2.808 20 5 EFBDHN CN(C[C@H]1CCCN1C)C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000421701421 246068208 /nfs/dbraw/zinc/06/82/08/246068208.db2.gz HNKYYZNQJXKPEW-LLVKDONJSA-N 0 3 345.321 2.780 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)C[C@H]1CCCN1C ZINC000421704578 246068957 /nfs/dbraw/zinc/06/89/57/246068957.db2.gz PGZCSAPYUNENHU-TZMCWYRMSA-N 0 3 337.445 2.628 20 5 EFBDHN Cc1cc(C(=O)N(CCN(C)C)Cc2ccco2)cc([N+](=O)[O-])c1 ZINC000156422880 206077081 /nfs/dbraw/zinc/07/70/81/206077081.db2.gz GZZIADYQPXVWSW-UHFFFAOYSA-N 0 3 331.372 2.700 20 5 EFBDHN C[C@@H]1CCN(CCOc2ccccc2[N+](=O)[O-])C[C@@H]1n1ccnc1 ZINC000156506536 206082578 /nfs/dbraw/zinc/08/25/78/206082578.db2.gz VFXVHHKCGPYSEX-ZBFHGGJFSA-N 0 3 330.388 2.753 20 5 EFBDHN CN(CCn1cc([N+](=O)[O-])cn1)Cc1ccc(OC(F)F)cc1 ZINC000157365425 206132425 /nfs/dbraw/zinc/13/24/25/206132425.db2.gz UCFITFMZYBNHQT-UHFFFAOYSA-N 0 3 326.303 2.525 20 5 EFBDHN NC(=O)C1CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000158614834 206201360 /nfs/dbraw/zinc/20/13/60/206201360.db2.gz CVMWMSAXAKHGMA-UHFFFAOYSA-N 0 3 329.356 2.552 20 5 EFBDHN COC(=O)COc1ccc(CN2CC[C@@H](C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000425360372 247059096 /nfs/dbraw/zinc/05/90/96/247059096.db2.gz VIUNJUIGWKYPIS-CHWSQXEVSA-N 0 3 336.388 2.767 20 5 EFBDHN CN(C)c1ncc(CN2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1C ZINC000425367106 247060997 /nfs/dbraw/zinc/06/09/97/247060997.db2.gz HCYNCSSINIZSER-HNNXBMFYSA-N 0 3 343.431 2.774 20 5 EFBDHN Nc1nc(S[C@@H]2CCCN(Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000425276847 247026556 /nfs/dbraw/zinc/02/65/56/247026556.db2.gz DYAJLCRTLREYRI-CYBMUJFWSA-N 0 3 345.428 2.554 20 5 EFBDHN C[C@]1(CO)CCC[C@H]1NCc1ccc(Br)cc1[N+](=O)[O-] ZINC000425444136 247088920 /nfs/dbraw/zinc/08/89/20/247088920.db2.gz LVDDHNQQWCVKDO-ZIAGYGMSSA-N 0 3 343.221 2.998 20 5 EFBDHN Cc1ccnc(NCc2ccc(OCCN(C)C)cc2)c1[N+](=O)[O-] ZINC000265233797 247324115 /nfs/dbraw/zinc/32/41/15/247324115.db2.gz NHDNLBKFKRDGET-UHFFFAOYSA-N 0 3 330.388 2.851 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)N(CCN(C)C)C1CCCC1 ZINC000427405861 247347728 /nfs/dbraw/zinc/34/77/28/247347728.db2.gz RSHZSBGFTWOHBW-UHFFFAOYSA-N 0 3 335.404 2.550 20 5 EFBDHN CC(C)(NCCC(=O)Nc1cccnc1)c1ccccc1[N+](=O)[O-] ZINC000429257914 247606151 /nfs/dbraw/zinc/60/61/51/247606151.db2.gz SRIQBZYPYOVSNM-UHFFFAOYSA-N 0 3 328.372 2.843 20 5 EFBDHN CCO[C@@H]1C[C@@](N)(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1(C)C ZINC000249096325 206345283 /nfs/dbraw/zinc/34/52/83/206345283.db2.gz YAASYDUJKLRPMA-CDHAZOANSA-N 0 3 349.431 2.613 20 5 EFBDHN CC(C)[C@H](CCO)N[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000162184139 206390181 /nfs/dbraw/zinc/39/01/81/206390181.db2.gz SJFBYDNHUHFQEN-MFKMUULPSA-N 0 3 343.811 2.572 20 5 EFBDHN CN(C)[C@@H](CC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000433309920 248043774 /nfs/dbraw/zinc/04/37/74/248043774.db2.gz FJJAMFJJKLSAMU-SFHVURJKSA-N 0 3 341.411 2.947 20 5 EFBDHN COC(=O)COc1ccc(CN(C)[C@H]2CC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000433054349 248009018 /nfs/dbraw/zinc/00/90/18/248009018.db2.gz UTTLBUUMIZUCDN-JSGCOSHPSA-N 0 3 336.388 2.767 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCN1CCC[C@@H](c2ccccc2)C1 ZINC000433075366 248012410 /nfs/dbraw/zinc/01/24/10/248012410.db2.gz HASFOGPFKFEXCX-MRXNPFEDSA-N 0 3 327.384 2.636 20 5 EFBDHN O=[N+]([O-])c1ccc2nc(NC[C@@H]3CCCCN3C3CC3)ccc2c1 ZINC000433812256 248092166 /nfs/dbraw/zinc/09/21/66/248092166.db2.gz VGNBXSJGFKBJHC-INIZCTEOSA-N 0 3 326.400 2.994 20 5 EFBDHN C[C@@H](N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCOC1 ZINC000266280936 248220176 /nfs/dbraw/zinc/22/01/76/248220176.db2.gz GMTVTIGOHLHYIE-VWYCJHECSA-N 0 3 341.795 2.590 20 5 EFBDHN C[C@H](N[C@@H](C)[C@H]1CCOC1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000266299891 248233187 /nfs/dbraw/zinc/23/31/87/248233187.db2.gz MEIJUMYVBIZKQH-GVXVVHGQSA-N 0 3 332.360 2.720 20 5 EFBDHN C[C@@H](N[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCOC1 ZINC000266299895 248233418 /nfs/dbraw/zinc/23/34/18/248233418.db2.gz MEIJUMYVBIZKQH-NTZNESFSSA-N 0 3 332.360 2.720 20 5 EFBDHN Cc1cc(C)n(CCN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000266578699 248368282 /nfs/dbraw/zinc/36/82/82/248368282.db2.gz HIFIPUVRLQCBQK-UHFFFAOYSA-N 0 3 344.415 2.952 20 5 EFBDHN C[C@@H]1CCN(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@@H](C)C1 ZINC000443641851 250214818 /nfs/dbraw/zinc/21/48/18/250214818.db2.gz MOPUIDIMPCYNDH-KGLIPLIRSA-N 0 3 331.416 2.852 20 5 EFBDHN COc1cccc(C(=O)NC[C@H]2CCCCN2CC(C)C)c1[N+](=O)[O-] ZINC000444336199 250289508 /nfs/dbraw/zinc/28/95/08/250289508.db2.gz CHSIJHGCIZWNSX-CQSZACIVSA-N 0 3 349.431 2.844 20 5 EFBDHN CC1(C)CCCN(CCNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C1 ZINC000444628097 250319696 /nfs/dbraw/zinc/31/96/96/250319696.db2.gz GQFNQLLWZULXTI-UHFFFAOYSA-N 0 3 344.415 2.928 20 5 EFBDHN CC1(C)CCCN(CCNC(=O)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000444627903 250320442 /nfs/dbraw/zinc/32/04/42/250320442.db2.gz FTKSAJOUNQULCI-UHFFFAOYSA-N 0 3 349.431 2.602 20 5 EFBDHN COC(=O)[C@H]1CCCC[C@]1(C)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444668819 250326076 /nfs/dbraw/zinc/32/60/76/250326076.db2.gz ZREFKJHSYWDKFP-PXAZEXFGSA-N 0 3 346.387 2.683 20 5 EFBDHN C[C@H](NCCn1ccc([N+](=O)[O-])n1)c1ccc(Br)s1 ZINC000444756664 250342867 /nfs/dbraw/zinc/34/28/67/250342867.db2.gz GFAINKKAICBDHS-QMMMGPOBSA-N 0 3 345.222 2.966 20 5 EFBDHN Cc1cc(CN(C)C[C@H](O)COc2ccccc2[N+](=O)[O-])ccc1F ZINC000444731799 250337666 /nfs/dbraw/zinc/33/76/66/250337666.db2.gz HMPVGBVVCRXVEB-HNNXBMFYSA-N 0 3 348.374 2.914 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC2(CCN(C)C2=O)CC1 ZINC000447089533 250542932 /nfs/dbraw/zinc/54/29/32/250542932.db2.gz WXCLCQRBSNAEOQ-NTCAYCPXSA-N 0 3 343.427 2.942 20 5 EFBDHN C[C@@H](CNC(=O)c1csc([N+](=O)[O-])c1)N(C)Cc1ccccc1 ZINC000171881153 206760475 /nfs/dbraw/zinc/76/04/75/206760475.db2.gz UYYRBPIBVYRXSE-LBPRGKRZSA-N 0 3 333.413 2.907 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H](CO)[C@@H]2CCCO2)s1 ZINC000447990198 250650193 /nfs/dbraw/zinc/65/01/93/250650193.db2.gz RDDVGRAFVFGCGZ-ZBFHGGJFSA-N 0 3 348.424 2.953 20 5 EFBDHN CN(C)[C@@]1(CNc2ccc([N+](=O)[O-])c3cnccc23)CCSC1 ZINC000267072741 250700955 /nfs/dbraw/zinc/70/09/55/250700955.db2.gz IYQRMXDCLTXJMV-MRXNPFEDSA-N 0 3 332.429 2.992 20 5 EFBDHN CC(C)OC(=O)CCN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174240735 207001960 /nfs/dbraw/zinc/00/19/60/207001960.db2.gz LUROCGZUDLCKSL-UHFFFAOYSA-N 0 3 336.388 2.780 20 5 EFBDHN COc1nccc(CN[C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])n1 ZINC000449373560 251002197 /nfs/dbraw/zinc/00/21/97/251002197.db2.gz RYORVFKZNFDYOU-CZUORRHYSA-N 0 3 342.399 2.894 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CC[C@@H](CSc3ccccc3)C2)c1 ZINC000174879115 207068192 /nfs/dbraw/zinc/06/81/92/207068192.db2.gz CJQCEFMHUNWZSM-CQSZACIVSA-N 0 3 332.429 2.906 20 5 EFBDHN CO[C@H]1COCC[C@H]1CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000449453186 251031456 /nfs/dbraw/zinc/03/14/56/251031456.db2.gz HMIHXJNTLJSUFS-UGSOOPFHSA-N 0 3 346.383 2.996 20 5 EFBDHN C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])o1 ZINC000267413258 251036719 /nfs/dbraw/zinc/03/67/19/251036719.db2.gz KTATXFZBCUAJKS-ZFWWWQNUSA-N 0 3 343.383 2.828 20 5 EFBDHN O=[N+]([O-])c1cc(CN2CCC[C@@H]2[C@@H]2CCC[C@H]2O)c2c(c1)COCO2 ZINC000449477934 251040205 /nfs/dbraw/zinc/04/02/05/251040205.db2.gz XLWKEVFMOQSBCZ-GVDBMIGSSA-N 0 3 348.399 2.587 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN1CC[C@@H]2C[C@H](O)CC[C@H]2C1 ZINC000449559454 251065385 /nfs/dbraw/zinc/06/53/85/251065385.db2.gz YIPVKBDJKVXZGZ-JKIFEVAISA-N 0 3 334.416 2.976 20 5 EFBDHN COc1cc(C[NH2+]CC(C)(C)C2(O)CCCC2)c([N+](=O)[O-])cc1[O-] ZINC000449738119 251134264 /nfs/dbraw/zinc/13/42/64/251134264.db2.gz YPQPDZZCKOLTFO-UHFFFAOYSA-N 0 3 338.404 2.730 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)NC[C@H](C)N(C)C2CC2)cc1[N+](=O)[O-] ZINC000176137792 207193119 /nfs/dbraw/zinc/19/31/19/207193119.db2.gz KMOGZVPTXSYSJV-STQMWFEESA-N 0 3 334.420 2.746 20 5 EFBDHN CCc1cc(N2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)ccn1 ZINC000450257316 251318423 /nfs/dbraw/zinc/31/84/23/251318423.db2.gz KWVSFZOKPSYDFZ-UHFFFAOYSA-N 0 3 346.412 2.576 20 5 EFBDHN CCN1CCCC[C@H]1CNc1ccc(CC(=O)OC)cc1[N+](=O)[O-] ZINC000450337380 251351106 /nfs/dbraw/zinc/35/11/06/251351106.db2.gz ULPLTQRTYSQXOB-AWEZNQCLSA-N 0 3 335.404 2.597 20 5 EFBDHN COc1ccc2c(c1)ncc([N+](=O)[O-])c2N(C)CCN(C)C1CC1 ZINC000450457210 251394777 /nfs/dbraw/zinc/39/47/77/251394777.db2.gz FYYXTBLXHQMQJH-UHFFFAOYSA-N 0 3 330.388 2.682 20 5 EFBDHN CN1CC=C(CNc2nc(-c3ccc([N+](=O)[O-])cc3)cs2)CC1 ZINC000450425963 251382824 /nfs/dbraw/zinc/38/28/24/251382824.db2.gz OSRVOJXSPYNGKT-UHFFFAOYSA-N 0 3 330.413 2.814 20 5 EFBDHN CC[C@@H](NC(=O)N1CC[C@H]2CC[C@@H](C1)N2C)c1cccc([N+](=O)[O-])c1 ZINC000176707459 207251156 /nfs/dbraw/zinc/25/11/56/207251156.db2.gz XWMKBMUGILLMED-HYVNUMGLSA-N 0 3 346.431 2.924 20 5 EFBDHN C[C@@H]1C[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CN1C1CC1 ZINC000177100508 207292379 /nfs/dbraw/zinc/29/23/79/207292379.db2.gz GFPGHHXJIFDSQC-ZYHUDNBSSA-N 0 3 337.807 2.532 20 5 EFBDHN Cc1ccc([C@H](C)NC[C@H](O)COc2ccccc2)cc1[N+](=O)[O-] ZINC000268737705 252188339 /nfs/dbraw/zinc/18/83/39/252188339.db2.gz CASIDSQHRNNRJW-HOCLYGCPSA-N 0 3 330.384 2.994 20 5 EFBDHN C[C@H](NC(=O)N1CC[C@H]2CC[C@@H](C1)N2C)c1ccc([N+](=O)[O-])cc1 ZINC000458891935 255790838 /nfs/dbraw/zinc/79/08/38/255790838.db2.gz SOYBBPQCKWGJHW-BJJXKVORSA-N 0 3 332.404 2.534 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)CCN[C@@H](C)c1ccccn1 ZINC000181813573 533224795 /nfs/dbraw/zinc/22/47/95/533224795.db2.gz CMORDZLOAHUVHC-LBPRGKRZSA-N 0 3 344.371 2.678 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@@H]1CC(C)(C)OC1(C)C ZINC000119696172 221379537 /nfs/dbraw/zinc/37/95/37/221379537.db2.gz LNBIUFGHKBBCAE-CQSZACIVSA-N 0 3 335.404 2.777 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@H]1CC(C)(C)OC1(C)C ZINC000119696309 221379550 /nfs/dbraw/zinc/37/95/50/221379550.db2.gz LNBIUFGHKBBCAE-AWEZNQCLSA-N 0 3 335.404 2.777 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CNC[C@H]1CCCCS1(=O)=O ZINC000344827227 533408884 /nfs/dbraw/zinc/40/88/84/533408884.db2.gz ZDYKKAFTYDVTHO-LRFDDAOPSA-N 0 3 338.429 2.555 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CNC[C@@H]1CCCCS1(=O)=O ZINC000344827230 533409063 /nfs/dbraw/zinc/40/90/63/533409063.db2.gz ZDYKKAFTYDVTHO-WQMJKPAKSA-N 0 3 338.429 2.555 20 5 EFBDHN COc1cc([C@H](C)NCCn2ccc([N+](=O)[O-])n2)ccc1OC(C)C ZINC000341635231 141842360 /nfs/dbraw/zinc/84/23/60/141842360.db2.gz HXDFVFQHGNASPE-ZDUSSCGKSA-N 0 3 348.403 2.938 20 5 EFBDHN O=C(N[C@@H]1CCN(C2CC2)C1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000343452214 142000356 /nfs/dbraw/zinc/00/03/56/142000356.db2.gz RIGYZCUYRCYSJS-CQSZACIVSA-N 0 3 344.415 2.506 20 5 EFBDHN C[C@H](CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CCC[C@@H](C)C1 ZINC000344475837 142024067 /nfs/dbraw/zinc/02/40/67/142024067.db2.gz RAWBYLONCZZGGR-CHWSQXEVSA-N 0 3 344.415 2.926 20 5 EFBDHN CN1CCCC(C)(C)[C@@H]1CNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000344607352 142048498 /nfs/dbraw/zinc/04/84/98/142048498.db2.gz DXHKYNJSDJJEDZ-HNNXBMFYSA-N 0 3 344.415 2.926 20 5 EFBDHN C[C@@H]1CN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)CCN(C2CCC2)C1 ZINC000344702006 142063381 /nfs/dbraw/zinc/06/33/81/142063381.db2.gz QYZKWVZVJJPHHA-LBPRGKRZSA-N 0 3 335.379 2.680 20 5 EFBDHN CN1CCCC(C)(C)[C@@H]1CNC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000344718649 142066344 /nfs/dbraw/zinc/06/63/44/142066344.db2.gz PXLYWFZRAZEIRK-INIZCTEOSA-N 0 3 349.431 2.600 20 5 EFBDHN C[C@H]1C[C@H]1N1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000346152991 142156011 /nfs/dbraw/zinc/15/60/11/142156011.db2.gz FKUFKWURNFBULZ-MQIPJXDCSA-N 0 3 335.379 2.536 20 5 EFBDHN C[C@@H]1C[C@@H]1N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)C[C@@H](C)C1 ZINC000346187841 142163865 /nfs/dbraw/zinc/16/38/65/142163865.db2.gz OISSCBWYDDTKEQ-OZVIIMIRSA-N 0 3 335.379 2.536 20 5 EFBDHN CCN(CCN1CCCCCC1)C(=O)COc1ccccc1[N+](=O)[O-] ZINC000346289930 142184351 /nfs/dbraw/zinc/18/43/51/142184351.db2.gz MEWLKERDOPNYIK-UHFFFAOYSA-N 0 3 349.431 2.698 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)c2ccc3c(c2)CNC3)cc1[N+](=O)[O-] ZINC000347545450 142233641 /nfs/dbraw/zinc/23/36/41/142233641.db2.gz CMHLHFDKHVCXOK-LBPRGKRZSA-N 0 3 325.368 2.997 20 5 EFBDHN COc1ccc(OCCN[C@H](C)c2ccnc(OC)c2)c([N+](=O)[O-])c1 ZINC000347553726 142234707 /nfs/dbraw/zinc/23/47/07/142234707.db2.gz IFBRQOWIERZRAI-GFCCVEGCSA-N 0 3 347.371 2.737 20 5 EFBDHN CC1(C)CCCN(CCNC(=O)NCCc2ccccc2[N+](=O)[O-])C1 ZINC000347833585 142278751 /nfs/dbraw/zinc/27/87/51/142278751.db2.gz QCMVAYIADWMHFC-UHFFFAOYSA-N 0 3 348.447 2.559 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCCN(C(C)C)C2)c1 ZINC000347934068 142295531 /nfs/dbraw/zinc/29/55/31/142295531.db2.gz BUVYATGLYUGEMU-GFCCVEGCSA-N 0 3 337.445 2.919 20 5 EFBDHN O=[N+]([O-])c1ccc(S(=O)(=O)CCN[C@@H]2CCC[C@H]2C2CC2)cc1 ZINC000349661906 142344992 /nfs/dbraw/zinc/34/49/92/142344992.db2.gz GZPVWYARGBJPLN-JKSUJKDBSA-N 0 3 338.429 2.537 20 5 EFBDHN C[C@@H](CC1CCCC1)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000349674593 142347491 /nfs/dbraw/zinc/34/74/91/142347491.db2.gz ZKDNCDVPDMLYDY-ZDUSSCGKSA-N 0 3 340.445 2.927 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CCC(Cc3ccc(F)cc3)CC2)c1 ZINC000350059073 142395739 /nfs/dbraw/zinc/39/57/39/142395739.db2.gz IONZWIKXCJJMAV-UHFFFAOYSA-N 0 3 332.379 2.885 20 5 EFBDHN COCC[C@H](N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)C(C)(C)C ZINC000337853050 143824680 /nfs/dbraw/zinc/82/46/80/143824680.db2.gz KBEUZJIXWLFQAJ-WFASDCNBSA-N 0 3 337.420 2.963 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(NCc2ccncc2OCCN(C)C)c1 ZINC000341032519 144976385 /nfs/dbraw/zinc/97/63/85/144976385.db2.gz GOGLICOSQULYLY-UHFFFAOYSA-N 0 3 330.388 2.851 20 5 EFBDHN CCOc1ccc([C@H](C)NCCn2cc([N+](=O)[O-])cn2)cc1OC ZINC000341436680 145051909 /nfs/dbraw/zinc/05/19/09/145051909.db2.gz VCEICCWYNIXDTN-LBPRGKRZSA-N 0 3 334.376 2.549 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CCN1C ZINC000342655657 145167012 /nfs/dbraw/zinc/16/70/12/145167012.db2.gz NCZFBUODTBJLRJ-CMPLNLGQSA-N 0 3 340.811 2.530 20 5 EFBDHN CCCN(CCN1CCCCC1)C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000342783680 145192326 /nfs/dbraw/zinc/19/23/26/145192326.db2.gz PKDAEESGMZNECP-UHFFFAOYSA-N 0 3 348.447 2.731 20 5 EFBDHN CC1CCN(CCNC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)CC1 ZINC000342929148 145223322 /nfs/dbraw/zinc/22/33/22/145223322.db2.gz SYPDXCGIIYNULN-UHFFFAOYSA-N 0 3 330.388 2.538 20 5 EFBDHN CCCN1CCC[C@@H]1CNC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000343556993 145236826 /nfs/dbraw/zinc/23/68/26/145236826.db2.gz SNIIVTNQPZOQEI-GXTWGEPZSA-N 0 3 337.395 2.828 20 5 EFBDHN COc1cc(N2CC(N(C)Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000343614931 145252499 /nfs/dbraw/zinc/25/24/99/145252499.db2.gz BYISFPAHLLTTBB-UHFFFAOYSA-N 0 3 327.384 2.924 20 5 EFBDHN CCCN1CCC[C@@H]1CNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000343624418 145255074 /nfs/dbraw/zinc/25/50/74/145255074.db2.gz WMWXSNMQEGQHEZ-CYBMUJFWSA-N 0 3 325.796 2.852 20 5 EFBDHN C[C@@H]1[C@H](NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)CCCN1C ZINC000343764757 145289831 /nfs/dbraw/zinc/28/98/31/145289831.db2.gz WOAWANRJRBVGFW-RHSMWYFYSA-N 0 3 348.447 2.699 20 5 EFBDHN CCO[C@@H]1C[C@@H](NCC(=O)Nc2ccccc2[N+](=O)[O-])C12CCCC2 ZINC000344097118 145367196 /nfs/dbraw/zinc/36/71/96/145367196.db2.gz IETRKMULAPPULE-HZPDHXFCSA-N 0 3 347.415 2.861 20 5 EFBDHN CN(CCCNC(=O)c1cc(F)cc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000344166911 145383233 /nfs/dbraw/zinc/38/32/33/145383233.db2.gz DHBYRQXTVIESDO-UHFFFAOYSA-N 0 3 345.374 2.986 20 5 EFBDHN C[C@H]1CCCN(C(C)(C)CNC(=O)c2cc(F)cc([N+](=O)[O-])c2)C1 ZINC000344216007 145394788 /nfs/dbraw/zinc/39/47/88/145394788.db2.gz LHZMQRWVALGDEB-LBPRGKRZSA-N 0 3 337.395 2.974 20 5 EFBDHN COc1cc(NC[C@]2(N(C)C)CCSC2)c(F)cc1[N+](=O)[O-] ZINC000351477985 146126583 /nfs/dbraw/zinc/12/65/83/146126583.db2.gz BBUSLNVEGBVCBQ-CQSZACIVSA-N 0 3 329.397 2.592 20 5 EFBDHN C[C@H]1CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCC1(F)F ZINC000352028845 146269905 /nfs/dbraw/zinc/26/99/05/146269905.db2.gz RXSZADYGBKQMJU-NSHDSACASA-N 0 3 327.331 2.901 20 5 EFBDHN C[C@H](NCCn1cc([N+](=O)[O-])ccc1=O)c1cc2cccc(F)c2o1 ZINC000355737444 147049601 /nfs/dbraw/zinc/04/96/01/147049601.db2.gz XVXFKBBAMPQREI-NSHDSACASA-N 0 3 345.330 2.993 20 5 EFBDHN O=[N+]([O-])c1ccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)c(F)c1 ZINC000355762048 147055993 /nfs/dbraw/zinc/05/59/93/147055993.db2.gz UKWHANSSVMOMCL-GOSISDBHSA-N 0 3 345.374 2.783 20 5 EFBDHN CN1CCC[C@@]2(CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3)C2)C1 ZINC000356269720 147194875 /nfs/dbraw/zinc/19/48/75/147194875.db2.gz AJHZJLMUZLZLIU-MRXNPFEDSA-N 0 3 337.807 2.806 20 5 EFBDHN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCN(C)C1 ZINC000356348865 147219553 /nfs/dbraw/zinc/21/95/53/147219553.db2.gz UABUBKUVOSHQNP-GFCCVEGCSA-N 0 3 337.445 2.778 20 5 EFBDHN CCCN1CCC[C@@H]1CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000358287116 147761999 /nfs/dbraw/zinc/76/19/99/147761999.db2.gz CJKRPKAHJUUXKL-QGZVFWFLSA-N 0 3 346.431 2.537 20 5 EFBDHN C[C@@H](C(=O)N(C)CCc1ccccc1[N+](=O)[O-])N1[C@H](C)CC[C@H]1C ZINC000359128275 148003851 /nfs/dbraw/zinc/00/38/51/148003851.db2.gz HIXCDBDUUTXIMA-KFWWJZLASA-N 0 3 333.432 2.857 20 5 EFBDHN CC[C@@H](C)N[C@@H](CNC(=O)Cc1ccccc1[N+](=O)[O-])c1ccco1 ZINC000359541375 148115680 /nfs/dbraw/zinc/11/56/80/148115680.db2.gz DDPKWUHQHQGOHS-HIFRSBDPSA-N 0 3 345.399 2.976 20 5 EFBDHN Cc1c(CNC(=O)c2cccc(CN(C)C)c2)cccc1[N+](=O)[O-] ZINC000360524810 148382877 /nfs/dbraw/zinc/38/28/77/148382877.db2.gz KOIUGWYHMLTMNO-UHFFFAOYSA-N 0 3 327.384 2.895 20 5 EFBDHN COc1ccc(CNC[C@](C)(CO)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000361734296 148687429 /nfs/dbraw/zinc/68/74/29/148687429.db2.gz OVLYMZGCDNJKLA-LJQANCHMSA-N 0 3 344.411 2.934 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1CN1CC[C@@H](N2CCN(C(C)C)CC2)C1 ZINC000363874110 149025430 /nfs/dbraw/zinc/02/54/30/149025430.db2.gz HAQPIFVNTWDZPZ-LJQANCHMSA-N 0 3 346.475 2.504 20 5 EFBDHN Cc1ccc([C@]2(C)CCN(CCn3cc([N+](=O)[O-])ccc3=O)C2)cc1 ZINC000364848827 149258249 /nfs/dbraw/zinc/25/82/49/149258249.db2.gz QZJOXUKXAJELJD-LJQANCHMSA-N 0 3 341.411 2.729 20 5 EFBDHN O=C1Nc2ccccc2[C@@]12CCN(Cc1ccc([N+](=O)[O-])c(F)c1)C2 ZINC000368484115 150129252 /nfs/dbraw/zinc/12/92/52/150129252.db2.gz RACMLUCIUQBOOY-SFHVURJKSA-N 0 3 341.342 2.830 20 5 EFBDHN COC[C@H]1CCCCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000368654802 150172317 /nfs/dbraw/zinc/17/23/17/150172317.db2.gz CPYDFHMMEQMDPG-ZDUSSCGKSA-N 0 3 336.388 2.710 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCCN2CCC(c3cn[nH]c3)CC2)cc1 ZINC000369225570 150304585 /nfs/dbraw/zinc/30/45/85/150304585.db2.gz JKNKTFIXZNNLBN-UHFFFAOYSA-N 0 3 330.388 2.966 20 5 EFBDHN Cc1nn(C)cc1[C@@H]1CCCN1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000372729625 151052542 /nfs/dbraw/zinc/05/25/42/151052542.db2.gz VYOVMONDLHDHSQ-DLBZAZTESA-N 0 3 330.388 2.507 20 5 EFBDHN Cc1c(CC(=O)N2CCCC23CCN(C)CC3)cccc1[N+](=O)[O-] ZINC000378334166 152060647 /nfs/dbraw/zinc/06/06/47/152060647.db2.gz LEIGPXPESDFEPM-UHFFFAOYSA-N 0 3 331.416 2.533 20 5 EFBDHN CO[C@H]1CCCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000378629796 152131970 /nfs/dbraw/zinc/13/19/70/152131970.db2.gz DOHSJOCXHVXXJA-KRWDZBQOSA-N 0 3 344.415 2.996 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)CN2C[C@H](C)C[C@@H](C)C2)c1 ZINC000246677834 292283666 /nfs/dbraw/zinc/28/36/66/292283666.db2.gz INDFQVPJDAXFED-RBSFLKMASA-N 0 3 333.432 2.999 20 5 EFBDHN C[C@@H]1C[C@H](N(C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CCN1C ZINC000123357502 222262578 /nfs/dbraw/zinc/26/25/78/222262578.db2.gz HIKPQKZXJDBFKU-TZMCWYRMSA-N 0 3 345.403 2.559 20 5 EFBDHN Cc1c(CN(C)C[C@H](O)COCc2ccccc2)cccc1[N+](=O)[O-] ZINC000114189606 544571092 /nfs/dbraw/zinc/57/10/92/544571092.db2.gz NESURPOTBFOQSN-SFHVURJKSA-N 0 3 344.411 2.913 20 5 EFBDHN C[C@@H](NCc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H](C)c1ccccc1 ZINC000181520181 544934148 /nfs/dbraw/zinc/93/41/48/544934148.db2.gz IBHOGRJEPLPEIC-QWHCGFSZSA-N 0 3 327.384 2.976 20 5 EFBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CNCC2(CO)CCCC2)c1 ZINC000185806578 265049488 /nfs/dbraw/zinc/04/94/88/265049488.db2.gz NBSOWVBBJIYPTA-UHFFFAOYSA-N 0 3 330.331 2.839 20 5 EFBDHN COc1ccc(CN[C@H](CO)Cc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000188989983 265166436 /nfs/dbraw/zinc/16/64/36/265166436.db2.gz WHZABSHFHXGSCN-INIZCTEOSA-N 0 3 330.384 2.605 20 5 EFBDHN COC(=O)[C@](C)(CNCc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000191591499 265269137 /nfs/dbraw/zinc/26/91/37/265269137.db2.gz BXBGLLFFYVMZDA-MRXNPFEDSA-N 0 3 334.397 2.877 20 5 EFBDHN C[C@H](NCCN1CCc2ccccc2C1=O)c1cccc([N+](=O)[O-])c1 ZINC000191622009 265271035 /nfs/dbraw/zinc/27/10/35/265271035.db2.gz QNIVRCPKEMYUDD-AWEZNQCLSA-N 0 3 339.395 2.944 20 5 EFBDHN Cc1ccc(C)n1C1CCN(CCn2cc([N+](=O)[O-])ccc2=O)CC1 ZINC000270468240 265723093 /nfs/dbraw/zinc/72/30/93/265723093.db2.gz BQPCORYGWIBDNP-UHFFFAOYSA-N 0 3 344.415 2.512 20 5 EFBDHN C[C@@H](C1CCN(C)CC1)N(C)C(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000270748034 265795469 /nfs/dbraw/zinc/79/54/69/265795469.db2.gz AENHOUKUKOTDGM-MRZGDXHCSA-N 0 3 331.416 2.797 20 5 EFBDHN C[C@](O)(CN[C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)C(F)(F)F ZINC000271474829 265986353 /nfs/dbraw/zinc/98/63/53/265986353.db2.gz ITPPIWNPEWXCRG-JSGCOSHPSA-N 0 3 332.322 2.819 20 5 EFBDHN CO[C@@H]1[C@H](C)[C@H](N[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1(C)C ZINC000271854645 266079653 /nfs/dbraw/zinc/07/96/53/266079653.db2.gz UQDVQAWFJNVTJZ-HKCMKHECSA-N 0 3 335.404 2.571 20 5 EFBDHN COC(=O)[C@H]1CCCC[C@]1(C)NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000271992869 266117099 /nfs/dbraw/zinc/11/70/99/266117099.db2.gz GNNJFJLWTQUODC-DYVFJYSZSA-N 0 3 336.388 2.815 20 5 EFBDHN C[C@@H](NCCn1cc([N+](=O)[O-])cn1)c1ccc(Br)s1 ZINC000090537777 272996707 /nfs/dbraw/zinc/99/67/07/272996707.db2.gz FMSLCGIEKJRZDY-MRVPVSSYSA-N 0 3 345.222 2.966 20 5 EFBDHN C[C@H](C1CCN(C)CC1)N(C)C(=O)c1cc(F)c([N+](=O)[O-])cc1F ZINC000272125920 266162587 /nfs/dbraw/zinc/16/25/87/266162587.db2.gz ALDUORLJNZUSND-SNVBAGLBSA-N 0 3 341.358 2.675 20 5 EFBDHN C[C@H](C1CCN(C)CC1)N(C)C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000272168163 266175352 /nfs/dbraw/zinc/17/53/52/266175352.db2.gz IVHAFYPPFIBGET-GFCCVEGCSA-N 0 3 344.415 2.878 20 5 EFBDHN CN1CC[C@@H]2CCN(c3ccc(Br)cc3[N+](=O)[O-])[C@H]2C1 ZINC000272223827 266195063 /nfs/dbraw/zinc/19/50/63/266195063.db2.gz SLXUDYJHAYITEU-YGRLFVJLSA-N 0 3 340.221 2.888 20 5 EFBDHN C[C@@H](C1CCN(C)CC1)N(C)C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000272247015 266203405 /nfs/dbraw/zinc/20/34/05/266203405.db2.gz YLBKMAHXRNGBTB-AWEZNQCLSA-N 0 3 349.431 2.552 20 5 EFBDHN COc1cc(CNCC[C@@H](C)OC)c([N+](=O)[O-])cc1OCC(F)F ZINC000272371144 266244014 /nfs/dbraw/zinc/24/40/14/266244014.db2.gz GOAQDTPZMSOGTR-SNVBAGLBSA-N 0 3 348.346 2.762 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[C@@H]2CCN(C)C[C@@H]21 ZINC000272413098 266257758 /nfs/dbraw/zinc/25/77/58/266257758.db2.gz LDVACMUYANMAAF-ZFWWWQNUSA-N 0 3 332.404 2.770 20 5 EFBDHN CN(C)C[C@@H]1CCCCN1C(=O)/C=C/c1ccc(F)cc1[N+](=O)[O-] ZINC000104413477 273003130 /nfs/dbraw/zinc/00/31/30/273003130.db2.gz HOVOWWZOTQQWFK-HEWZJLJBSA-N 0 3 335.379 2.690 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CCCN(C)C1 ZINC000108329812 273009121 /nfs/dbraw/zinc/00/91/21/273009121.db2.gz XXFDMQBVUKWRDC-QWHCGFSZSA-N 0 3 337.445 2.533 20 5 EFBDHN COc1ccc(CN[C@@H](C)CNC(=O)OC(C)(C)C)cc1[N+](=O)[O-] ZINC000276999298 267095597 /nfs/dbraw/zinc/09/55/97/267095597.db2.gz WEDOGJDJJMSYEA-NSHDSACASA-N 0 3 339.392 2.606 20 5 EFBDHN O=C(CSc1ccc([N+](=O)[O-])cc1)NC[C@H]1CCCCN1C1CC1 ZINC000277637677 267218993 /nfs/dbraw/zinc/21/89/93/267218993.db2.gz XSHKPHGYTVKYGT-OAHLLOKOSA-N 0 3 349.456 2.820 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccccc1CCN(C)C ZINC000277638788 267219475 /nfs/dbraw/zinc/21/94/75/267219475.db2.gz TVBIMOLNBHOVDD-UHFFFAOYSA-N 0 3 343.383 2.960 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)N(CCN(C)C)C1CCCCC1 ZINC000277692088 267235969 /nfs/dbraw/zinc/23/59/69/267235969.db2.gz ZRRRDSDDXCGMCQ-UHFFFAOYSA-N 0 3 349.431 2.940 20 5 EFBDHN C[C@@H]1CN(CCCNc2c(F)cc([N+](=O)[O-])cc2F)CCCO1 ZINC000277966137 267309715 /nfs/dbraw/zinc/30/97/15/267309715.db2.gz JHWNIMYSSYRUFQ-LLVKDONJSA-N 0 3 329.347 2.786 20 5 EFBDHN C[C@H]1CN(CCCNc2ncc([N+](=O)[O-])cc2Cl)CCCO1 ZINC000278017981 267321991 /nfs/dbraw/zinc/32/19/91/267321991.db2.gz MMUQOUVLASHVLS-NSHDSACASA-N 0 3 328.800 2.556 20 5 EFBDHN C[C@H](C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)[C@H](N)c1ccccc1 ZINC000237560691 273071502 /nfs/dbraw/zinc/07/15/02/273071502.db2.gz YMIJBUNWKKVDEP-UGSOOPFHSA-N 0 3 339.395 2.816 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@@H]1CCCCNC1=O ZINC000271116592 273098856 /nfs/dbraw/zinc/09/88/56/273098856.db2.gz INWNOZIUFGRVEJ-CHWSQXEVSA-N 0 3 337.445 2.724 20 5 EFBDHN CCO[C@@H]1C[C@H](NC/C=C/c2ccccc2[N+](=O)[O-])[C@@]12CCCO2 ZINC000273638703 273116065 /nfs/dbraw/zinc/11/60/65/273116065.db2.gz UFDQREVPNDGJAU-YQBWCRNHSA-N 0 3 332.400 2.924 20 5 EFBDHN O=[N+]([O-])c1ccc(CNCCc2cn3c(n2)SCC3)c(Cl)c1 ZINC000274236355 273126376 /nfs/dbraw/zinc/12/63/76/273126376.db2.gz GLBUIGVOTQXGKX-UHFFFAOYSA-N 0 3 338.820 2.883 20 5 EFBDHN CC1(C)C[C@@H](NCCCN2CCOCC2)c2cc([N+](=O)[O-])ccc21 ZINC000279020616 273167312 /nfs/dbraw/zinc/16/73/12/273167312.db2.gz HOKBPZWTZYCHRO-QGZVFWFLSA-N 0 3 333.432 2.629 20 5 EFBDHN CCC(=O)N1CC[C@@H](N[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000279058423 273171802 /nfs/dbraw/zinc/17/18/02/273171802.db2.gz KPLYRTZNXIFBST-MLGOLLRUSA-N 0 3 331.416 2.918 20 5 EFBDHN COCCN1CC[C@H](N[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000279079942 273174338 /nfs/dbraw/zinc/17/43/38/273174338.db2.gz MMMNNNDJBZFPKX-SUMWQHHRSA-N 0 3 333.432 2.628 20 5 EFBDHN C[C@H](CN1CCOCC1)N[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000279156076 273182854 /nfs/dbraw/zinc/18/28/54/273182854.db2.gz TTYGUQGONQMEJX-DYVFJYSZSA-N 0 3 333.432 2.628 20 5 EFBDHN CC1(C)C[C@H](NC[C@@H](O)C2CCOCC2)c2cc([N+](=O)[O-])ccc21 ZINC000279212906 273189119 /nfs/dbraw/zinc/18/91/19/273189119.db2.gz YJVIOEBPJRVYAJ-DLBZAZTESA-N 0 3 334.416 2.694 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2nc(CN[C@@H]3CCC[C@H]3CCO)co2)cc1 ZINC000279254116 273193675 /nfs/dbraw/zinc/19/36/75/273193675.db2.gz LKZAIKIDHZRHPG-BLLLJJGKSA-N 0 3 331.372 2.891 20 5 EFBDHN CO[C@]1(C)CCCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000279271666 273196128 /nfs/dbraw/zinc/19/61/28/273196128.db2.gz JGSDWQCRPGLJDQ-MRXNPFEDSA-N 0 3 339.367 2.563 20 5 EFBDHN CC[C@@H](C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N(C)C ZINC000279317624 273202178 /nfs/dbraw/zinc/20/21/78/273202178.db2.gz OIIMCIMSBRWBOK-LBPRGKRZSA-N 0 3 333.310 2.570 20 5 EFBDHN C[C@@H](CC(=O)N(C)C)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000279581348 273230631 /nfs/dbraw/zinc/23/06/31/273230631.db2.gz UNONDPDWSWPKOT-VIFPVBQESA-N 0 3 333.310 2.570 20 5 EFBDHN Cn1cc(CN2CCC[C@](C)(O)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000279690639 273242545 /nfs/dbraw/zinc/24/25/45/273242545.db2.gz PSMLHQLVFNFCKM-SFHVURJKSA-N 0 3 344.415 2.732 20 5 EFBDHN C[C@]1(C(N)=O)CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000280109504 273291660 /nfs/dbraw/zinc/29/16/60/273291660.db2.gz AZCOIJCKJHIAHL-KRWDZBQOSA-N 0 3 329.356 2.552 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CNC[C@@H](CO)[C@@H]2CCOC2)o1 ZINC000280150544 273296356 /nfs/dbraw/zinc/29/63/56/273296356.db2.gz AHEQVTRBULHHNX-KGLIPLIRSA-N 0 3 346.383 2.589 20 5 EFBDHN CN(CCOc1cccc([N+](=O)[O-])c1)[C@H](CC(N)=O)c1ccccc1 ZINC000280557779 273340794 /nfs/dbraw/zinc/34/07/94/273340794.db2.gz QXNFTPNPUFEJPX-QGZVFWFLSA-N 0 3 343.383 2.522 20 5 EFBDHN O=c1[nH]c(NCCN2CCCCCC2)nc2ccc([N+](=O)[O-])cc21 ZINC000280971455 273387009 /nfs/dbraw/zinc/38/70/09/273387009.db2.gz MDUSCMFBSXXEOU-UHFFFAOYSA-N 0 3 331.376 2.532 20 5 EFBDHN CC1(C)[C@H](NCc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H]2CCCO[C@H]21 ZINC000344680564 273593344 /nfs/dbraw/zinc/59/33/44/273593344.db2.gz NZSPRINOBIOIDN-USXIJHARSA-N 0 3 348.399 2.755 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@H](C)C(=O)NCCF ZINC000282842244 273627652 /nfs/dbraw/zinc/62/76/52/273627652.db2.gz SUFLKTFUKSQZLN-VXGBXAGGSA-N 0 3 343.424 2.529 20 5 EFBDHN C[C@@](CO)(NCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C1CCCCC1 ZINC000284208494 273810088 /nfs/dbraw/zinc/81/00/88/273810088.db2.gz SVZCNKDBBQTUOK-INIZCTEOSA-N 0 3 337.376 2.924 20 5 EFBDHN C[C@H](NC[C@](C)(O)c1ccc(F)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000285078978 273938224 /nfs/dbraw/zinc/93/82/24/273938224.db2.gz JMAJBWLIJRSYKE-GTNSWQLSSA-N 0 3 333.363 2.874 20 5 EFBDHN C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000285624587 274040280 /nfs/dbraw/zinc/04/02/80/274040280.db2.gz KNIOSLJWPCZQFH-DGCLKSJQSA-N 0 3 336.367 2.824 20 5 EFBDHN O=[N+]([O-])c1ccc(CCN2CCC[C@](O)(C(F)(F)F)CC2)cc1 ZINC000285709505 274058202 /nfs/dbraw/zinc/05/82/02/274058202.db2.gz WHSPKMMUVBWDOA-CQSZACIVSA-N 0 3 332.322 2.917 20 5 EFBDHN CCc1ccc(C(=O)N2C[C@H](N3CCCC3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000285895885 274096115 /nfs/dbraw/zinc/09/61/15/274096115.db2.gz RPIQLBUXHUVVOQ-CZUORRHYSA-N 0 3 331.416 2.856 20 5 EFBDHN COc1ccc(OCCN2CCSCC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000285966733 274108421 /nfs/dbraw/zinc/10/84/21/274108421.db2.gz DNFWSXOSSLXTLO-LBPRGKRZSA-N 0 3 326.418 2.810 20 5 EFBDHN CCOC[C@@H](NCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C(C)C ZINC000286088464 274130982 /nfs/dbraw/zinc/13/09/82/274130982.db2.gz KMBAYQRNMPABOA-CYBMUJFWSA-N 0 3 343.811 2.837 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1C[C@H](N2CCOCC2)C[C@H]1C ZINC000286144395 274142258 /nfs/dbraw/zinc/14/22/58/274142258.db2.gz VQVHGFRAXOSANQ-HLLBOEOZSA-N 0 3 333.432 2.759 20 5 EFBDHN CCS[C@H]1CCC[C@@H]1NCC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000286193445 274151206 /nfs/dbraw/zinc/15/12/06/274151206.db2.gz PSUUYOGNODAYRQ-HOCLYGCPSA-N 0 3 349.456 2.748 20 5 EFBDHN Cc1cc(NCCC2(O)CCOCC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000286227130 274157815 /nfs/dbraw/zinc/15/78/15/274157815.db2.gz DKMHRZRUSJBCOH-UHFFFAOYSA-N 0 3 331.372 2.795 20 5 EFBDHN CCOC[C@H](NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C(C)C ZINC000286286510 274169920 /nfs/dbraw/zinc/16/99/20/274169920.db2.gz UXEFUBGHVCUIOW-ZDUSSCGKSA-N 0 3 343.811 2.837 20 5 EFBDHN C[C@H]1C[C@@H](N2CCCC2)CN1c1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000286333966 274180303 /nfs/dbraw/zinc/18/03/03/274180303.db2.gz LQXJXZVTRRWWLF-GXTWGEPZSA-N 0 3 344.415 2.543 20 5 EFBDHN CCOc1cc(CN2CCCC[C@@H]2CCC(=O)NC)ccc1[N+](=O)[O-] ZINC000286532021 274219909 /nfs/dbraw/zinc/21/99/09/274219909.db2.gz RGMDQXRKUYDEKI-OAHLLOKOSA-N 0 3 349.431 2.874 20 5 EFBDHN C[C@@H](NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCCOC1 ZINC000348146033 274245456 /nfs/dbraw/zinc/24/54/56/274245456.db2.gz MOKGWKFFAUAKCJ-GHMZBOCLSA-N 0 3 341.795 2.591 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[C@H](C(=O)N2CCCC2)C1 ZINC000286702741 274255053 /nfs/dbraw/zinc/25/50/53/274255053.db2.gz AFDPASFULCMMHI-CABCVRRESA-N 0 3 331.416 2.909 20 5 EFBDHN CS[C@@H]1CN(c2ccc([N+](=O)[O-])c(C(C)=O)c2)C[C@@H]1N1CCCC1 ZINC000286800559 274275773 /nfs/dbraw/zinc/27/57/73/274275773.db2.gz KMFWPNCXKWBSSA-DLBZAZTESA-N 0 3 349.456 2.813 20 5 EFBDHN CS[C@H]1CN(c2ccc([N+](=O)[O-])c(C(C)=O)c2)C[C@@H]1N1CCCC1 ZINC000286802348 274276019 /nfs/dbraw/zinc/27/60/19/274276019.db2.gz KMFWPNCXKWBSSA-IRXDYDNUSA-N 0 3 349.456 2.813 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)N1C[C@@H](N2CCCC2)C[C@@H]1C ZINC000286926254 274302288 /nfs/dbraw/zinc/30/22/88/274302288.db2.gz LDSZADVGJUBYOT-JSGCOSHPSA-N 0 3 348.403 2.694 20 5 EFBDHN C[C@H]1[C@H](N2CCCC2)CCN1C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000287000927 274319489 /nfs/dbraw/zinc/31/94/89/274319489.db2.gz HJGFTYULMNGEPV-SMDDNHRTSA-N 0 3 337.807 2.947 20 5 EFBDHN C[C@@H]1[C@@H](N2CCCC2)CCN1C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000288108722 274528809 /nfs/dbraw/zinc/52/88/09/274528809.db2.gz IOZMGSHBKZIRHR-ABAIWWIYSA-N 0 3 337.807 2.947 20 5 EFBDHN O=C1C[C@@]2(CCN(Cc3cc(=O)oc4ccc5ccccc5c34)C2)CN1 ZINC000278888575 275020210 /nfs/dbraw/zinc/02/02/10/275020210.db2.gz NZJIDMDQANSTNQ-NRFANRHFSA-N 0 3 348.402 2.658 20 5 EFBDHN O=[N+]([O-])c1ccc(CCN2CC[C@](O)(c3ccc(F)cc3)C2)cc1 ZINC000371525911 275035081 /nfs/dbraw/zinc/03/50/81/275035081.db2.gz OWRSXCGAEVWGGE-GOSISDBHSA-N 0 3 330.359 2.870 20 5 EFBDHN CC(C)(C)N1C[C@@H](N[C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1=O ZINC000193012702 275513963 /nfs/dbraw/zinc/51/39/63/275513963.db2.gz PPKPTWKIXUBFIW-BBRMVZONSA-N 0 3 331.416 2.961 20 5 EFBDHN CC(C)[C@@H](C(=O)NCCc1ccc([N+](=O)[O-])cc1)N1CCCCC1 ZINC000354730130 275665812 /nfs/dbraw/zinc/66/58/12/275665812.db2.gz ZGNPSYQPTGQKEC-KRWDZBQOSA-N 0 3 333.432 2.764 20 5 EFBDHN CCO[C@H]1COCC[C@H]1NCc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339089991 276361082 /nfs/dbraw/zinc/36/10/82/276361082.db2.gz FHKYAANKFBKKJN-KGLIPLIRSA-N 0 3 348.321 2.897 20 5 EFBDHN CN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000269120877 277157366 /nfs/dbraw/zinc/15/73/66/277157366.db2.gz SROKVPIQTJFCMU-IUODEOHRSA-N 0 3 343.383 2.897 20 5 EFBDHN COc1ccccc1C[C@@H](NCc1c([N+](=O)[O-])ncn1C)C(C)C ZINC000348283059 278050780 /nfs/dbraw/zinc/05/07/80/278050780.db2.gz UWBVDCKDHFTUKG-CQSZACIVSA-N 0 3 332.404 2.694 20 5 EFBDHN C[C@H](C(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1)N1CCCCCC1 ZINC000359630456 278142345 /nfs/dbraw/zinc/14/23/45/278142345.db2.gz FNRNENXBHSNKRH-CQSZACIVSA-N 0 3 347.415 2.580 20 5 EFBDHN CS[C@@H]1CN(c2cc(C)nc3c2cccc3[N+](=O)[O-])C[C@H]1N(C)C ZINC000345077547 278156900 /nfs/dbraw/zinc/15/69/00/278156900.db2.gz USTYADXNGCMUMB-HZPDHXFCSA-N 0 3 346.456 2.933 20 5 EFBDHN CS[C@H]1CN(c2ccc3ncccc3c2[N+](=O)[O-])C[C@@H]1N(C)C ZINC000347772875 278167979 /nfs/dbraw/zinc/16/79/79/278167979.db2.gz YLOXCQXHKWPUQF-GJZGRUSLSA-N 0 3 332.429 2.625 20 5 EFBDHN CC(C)(C(=O)NCCN1CCCCCC1)c1ccccc1[N+](=O)[O-] ZINC000429840636 278272747 /nfs/dbraw/zinc/27/27/47/278272747.db2.gz VRGFDNLXMWCNLU-UHFFFAOYSA-N 0 3 333.432 2.865 20 5 EFBDHN CCC[C@@H](N[C@@H]1CCc2nc(C)nn2C1)c1cccc([N+](=O)[O-])c1 ZINC000160453377 278872744 /nfs/dbraw/zinc/87/27/44/278872744.db2.gz JUVAEAVXMQDAMZ-GDBMZVCRSA-N 0 3 329.404 2.941 20 5 EFBDHN Cc1ccccc1[C@H]([C@H](C)NC(=O)c1ccc([N+](=O)[O-])n1C)N(C)C ZINC000357860824 278964698 /nfs/dbraw/zinc/96/46/98/278964698.db2.gz XATHFQGEWVKNPP-GUYCJALGSA-N 0 3 344.415 2.663 20 5 EFBDHN CCN(C)CCNC(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000112925748 279033006 /nfs/dbraw/zinc/03/30/06/279033006.db2.gz MYJKFEWOFKVBFS-AWEZNQCLSA-N 0 3 348.447 2.513 20 5 EFBDHN C[C@H](CCS(C)(=O)=O)N[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433288792 279270612 /nfs/dbraw/zinc/27/06/12/279270612.db2.gz OCKFVHDCXJYHDX-ABAIWWIYSA-N 0 3 340.445 2.730 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CCC[C@H]2CN(C)C[C@H]21 ZINC000425060432 280397477 /nfs/dbraw/zinc/39/74/77/280397477.db2.gz VRDYNVWQDUUCAL-LSDHHAIUSA-N 0 3 331.416 2.686 20 5 EFBDHN Cc1ccc([C@H](CNC(=O)c2c(N)cccc2[N+](=O)[O-])N(C)C)cc1 ZINC000180714433 280987081 /nfs/dbraw/zinc/98/70/81/280987081.db2.gz AYKBUHIOVXYEHP-INIZCTEOSA-N 0 3 342.399 2.518 20 5 EFBDHN CC[C@H]1CCCCN1CCNC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000113601530 281056333 /nfs/dbraw/zinc/05/63/33/281056333.db2.gz CPHDNFYQBBIUFE-INIZCTEOSA-N 0 3 348.447 2.701 20 5 EFBDHN CC1(C)C[C@H](N[C@@H]2CCC(=O)N[C@H]2C2CC2)c2cc([N+](=O)[O-])ccc21 ZINC000342808260 281359292 /nfs/dbraw/zinc/35/92/92/281359292.db2.gz AVGQXJCLJGYNJF-RYRKJORJSA-N 0 3 343.427 2.964 20 5 EFBDHN CN(C)C1(CN(C)C(=O)c2cccc(Cl)c2[N+](=O)[O-])CCC1 ZINC000187888725 289042507 /nfs/dbraw/zinc/04/25/07/289042507.db2.gz JTTZYAVNIXLMOG-UHFFFAOYSA-N 0 3 325.796 2.805 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)CN1CCCCC1 ZINC000075942957 292748437 /nfs/dbraw/zinc/74/84/37/292748437.db2.gz NAUGKLCZIHEFDG-LBPRGKRZSA-N 0 3 336.392 2.599 20 5 EFBDHN CCN1CCC(N(C)C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CC1 ZINC000126957104 293055030 /nfs/dbraw/zinc/05/50/30/293055030.db2.gz PJCDVUFMNHSCCA-UHFFFAOYSA-N 0 3 344.415 2.561 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)CN1C1CC1 ZINC000130368578 293163267 /nfs/dbraw/zinc/16/32/67/293163267.db2.gz FPDADWFUYDDANY-GXTWGEPZSA-N 0 3 346.431 2.754 20 5 EFBDHN O=C(N[C@@H]1CCN(CC2CCCC2)C1)c1ccc(F)cc1[N+](=O)[O-] ZINC000133560905 293261262 /nfs/dbraw/zinc/26/12/62/293261262.db2.gz IXGRPIAWMZYUCG-CQSZACIVSA-N 0 3 335.379 2.728 20 5 EFBDHN C[C@@H]1CCCN1C(=O)CCN(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000153292595 293369271 /nfs/dbraw/zinc/36/92/71/293369271.db2.gz JJCNFEWWGYVGPB-CQSZACIVSA-N 0 3 331.416 2.960 20 5 EFBDHN CN(C)C[C@@H](NC(=O)c1ccc([N+](=O)[O-])s1)c1ccc(F)cc1 ZINC000290681821 294155860 /nfs/dbraw/zinc/15/58/60/294155860.db2.gz VNSHLCUWTNFBFH-GFCCVEGCSA-N 0 3 337.376 2.828 20 5 EFBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNC[C@@]1(O)CCSC1 ZINC000290948131 294228140 /nfs/dbraw/zinc/22/81/40/294228140.db2.gz UUUJIILXKKTMPR-LBPRGKRZSA-N 0 3 337.228 2.859 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCN2CC[C@](CO)(c3ccccc3)C2)cc1 ZINC000291230734 294318123 /nfs/dbraw/zinc/31/81/23/294318123.db2.gz MHVUTRZVNDFECO-IBGZPJMESA-N 0 3 342.395 2.610 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)N(CC(C)C)C2CCN(C)CC2)c1 ZINC000291353736 294356193 /nfs/dbraw/zinc/35/61/93/294356193.db2.gz AFRPURKLYZLZGV-UHFFFAOYSA-N 0 3 349.431 2.796 20 5 EFBDHN CCCN(CCN1CCCCCC1)C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000292115711 294583999 /nfs/dbraw/zinc/58/39/99/294583999.db2.gz KMRVEVIMVQEYHB-UHFFFAOYSA-N 0 3 348.447 2.905 20 5 EFBDHN C[C@H]1CCC[C@]1(O)CNCc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000293174966 294899152 /nfs/dbraw/zinc/89/91/52/294899152.db2.gz WKDHZHBZHVYVFI-BONVTDFDSA-N 0 3 330.331 2.837 20 5 EFBDHN C[C@H]1CCC[C@@]1(O)CNCc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000293174976 294899217 /nfs/dbraw/zinc/89/92/17/294899217.db2.gz WKDHZHBZHVYVFI-ZUZCIYMTSA-N 0 3 330.331 2.837 20 5 EFBDHN CN(C)[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000293359073 294950933 /nfs/dbraw/zinc/95/09/33/294950933.db2.gz ZUDQYDWRZBPXEN-NSHDSACASA-N 0 3 345.321 2.780 20 5 EFBDHN C[C@@H](NCCC(=O)N1CCCCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000293563462 295000333 /nfs/dbraw/zinc/00/03/33/295000333.db2.gz CZPLPRWIVBZNCO-CYBMUJFWSA-N 0 3 334.420 2.620 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])CN1C1CC1 ZINC000293587933 295005673 /nfs/dbraw/zinc/00/56/73/295005673.db2.gz XEUQXUKILJJSKT-QWHCGFSZSA-N 0 3 346.431 2.754 20 5 EFBDHN C[C@H](NC[C@@]1(CO)C[C@@H]1c1ccccc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294016168 295098429 /nfs/dbraw/zinc/09/84/29/295098429.db2.gz DNUIYTRUNQZZPE-URKNILKWSA-N 0 3 341.411 2.994 20 5 EFBDHN Cn1cc(CN2CCC[C@H](CO)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000294132866 295116358 /nfs/dbraw/zinc/11/63/58/295116358.db2.gz UOAFASDBTNFUJU-AWEZNQCLSA-N 0 3 344.415 2.590 20 5 EFBDHN CCN1CCC[C@@H]1CNC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000294502606 295177103 /nfs/dbraw/zinc/17/71/03/295177103.db2.gz SAYQMAKARCGHHT-LLVKDONJSA-N 0 3 345.321 2.828 20 5 EFBDHN CN(Cc1ccc(Br)c([N+](=O)[O-])c1)CC(C)(C)CO ZINC000294709254 295212326 /nfs/dbraw/zinc/21/23/26/295212326.db2.gz DMZRUQZGFGFEKD-UHFFFAOYSA-N 0 3 331.210 2.808 20 5 EFBDHN C[C@@H](NC[C@]1(O)CCc2ccccc21)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294826126 295233410 /nfs/dbraw/zinc/23/34/10/295233410.db2.gz QSAJNGGCMGORJB-KZULUSFZSA-N 0 3 327.384 2.662 20 5 EFBDHN COc1ccc2c(c1)ncc([N+](=O)[O-])c2N1CC[C@@H]2CCN(C)C[C@@H]21 ZINC000294827073 295233552 /nfs/dbraw/zinc/23/35/52/295233552.db2.gz AHHYOADWMVNVLC-SJCJKPOMSA-N 0 3 342.399 2.682 20 5 EFBDHN COc1ccc(CNC[C@H](Cc2ccccc2)OC)cc1[N+](=O)[O-] ZINC000294889549 295241714 /nfs/dbraw/zinc/24/17/14/295241714.db2.gz WHUZATGVSGTUEC-INIZCTEOSA-N 0 3 330.384 2.951 20 5 EFBDHN C[C@@H](c1ccncc1)N1CCC(NC(=O)CCC(C)(C)[N+](=O)[O-])CC1 ZINC000295007327 295257083 /nfs/dbraw/zinc/25/70/83/295257083.db2.gz BFEKRVMEGQCYFF-AWEZNQCLSA-N 0 3 348.447 2.559 20 5 EFBDHN CN(C)C1(CNC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)CCC1 ZINC000295019094 295258293 /nfs/dbraw/zinc/25/82/93/295258293.db2.gz WLFCXPQJVYARHL-UHFFFAOYSA-N 0 3 345.321 2.828 20 5 EFBDHN C[C@@H]1CN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CCN(C2CC2)C1 ZINC000295219144 295284022 /nfs/dbraw/zinc/28/40/22/295284022.db2.gz AGWZKMGATMKRHX-LBPRGKRZSA-N 0 3 342.399 2.632 20 5 EFBDHN C[C@@H](CC(C)(C)C)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000295345590 295304492 /nfs/dbraw/zinc/30/44/92/295304492.db2.gz IGJDLLUMBSIRCI-LBPRGKRZSA-N 0 3 328.434 2.783 20 5 EFBDHN Cc1cc(Cl)c(C(=O)N2CC[C@H]3CC[C@@H](C2)N3C)cc1[N+](=O)[O-] ZINC000295421468 295317588 /nfs/dbraw/zinc/31/75/88/295317588.db2.gz VYGALDTZFWPXOG-NEPJUHHUSA-N 0 3 337.807 2.865 20 5 EFBDHN C[C@@H]1[C@@H](N2CCCC2)CCN1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000295762728 295372086 /nfs/dbraw/zinc/37/20/86/295372086.db2.gz PFKSWTXONFZDOJ-RISCZKNCSA-N 0 3 337.807 2.947 20 5 EFBDHN CCn1cc([C@@H](C)NCCOc2ccc(OC)cc2[N+](=O)[O-])cn1 ZINC000296287172 295453048 /nfs/dbraw/zinc/45/30/48/295453048.db2.gz ZAOQAJHUTMCTEG-GFCCVEGCSA-N 0 3 334.376 2.549 20 5 EFBDHN C[C@H]1CN2CCC[C@H]2CN1C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000265993890 300317059 /nfs/dbraw/zinc/31/70/59/300317059.db2.gz MWEQJJMAXNUOIP-BBRMVZONSA-N 0 3 331.416 2.568 20 5 EFBDHN CCO[C@@H]1C[C@H](N[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C12CCC2 ZINC000296504705 310827231 /nfs/dbraw/zinc/82/72/31/310827231.db2.gz ZIEOBKUZROULPS-VBNZEHGJSA-N 0 3 347.415 2.859 20 5 EFBDHN Cc1cccc(CN(CCN(C)C)c2ncc([N+](=O)[O-])c(C)n2)c1 ZINC000297380372 310887969 /nfs/dbraw/zinc/88/79/69/310887969.db2.gz DJAJCRBEHGDJEA-UHFFFAOYSA-N 0 3 329.404 2.570 20 5 EFBDHN CS[C@H]1CN(c2nccc3cc([N+](=O)[O-])ccc32)C[C@@H]1N(C)C ZINC000297557678 310908162 /nfs/dbraw/zinc/90/81/62/310908162.db2.gz RIYJGWXXJIPCBC-GJZGRUSLSA-N 0 3 332.429 2.625 20 5 EFBDHN Cc1nc(N(CCN(C)C)Cc2cccc(Cl)c2)ncc1[N+](=O)[O-] ZINC000297582673 310910714 /nfs/dbraw/zinc/91/07/14/310910714.db2.gz SWBZPJOOXPFTBU-UHFFFAOYSA-N 0 3 349.822 2.915 20 5 EFBDHN CCO[C@@H]1C[C@@H](NCc2ccc(OC)c([N+](=O)[O-])c2)[C@H]1SC ZINC000298601693 311007198 /nfs/dbraw/zinc/00/71/98/311007198.db2.gz ZEYBRRCNDKPTIF-KCPJHIHWSA-N 0 3 326.418 2.602 20 5 EFBDHN CC(C)(CCC(=O)N1C[C@H]2CCCN2Cc2ccccc21)[N+](=O)[O-] ZINC000298615690 311008243 /nfs/dbraw/zinc/00/82/43/311008243.db2.gz RVNZWGLTSLXLKH-OAHLLOKOSA-N 0 3 331.416 2.833 20 5 EFBDHN COC(=O)C1CCN(CCCNc2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC000298699967 311015565 /nfs/dbraw/zinc/01/55/65/311015565.db2.gz GXTGBTXMTIJDNB-UHFFFAOYSA-N 0 3 335.404 2.590 20 5 EFBDHN Cc1ccccc1CN(C)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000298711630 311016863 /nfs/dbraw/zinc/01/68/63/311016863.db2.gz GQGYPKAMIJKVAT-INIZCTEOSA-N 0 3 330.384 2.775 20 5 EFBDHN C[C@@H](CN1CCCCC1)NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000298720326 311017444 /nfs/dbraw/zinc/01/74/44/311017444.db2.gz DFBURYVOUIFQDC-LBPRGKRZSA-N 0 3 331.372 2.945 20 5 EFBDHN CC(C)CN(C(=O)c1ccc([N+](=O)[O-])s1)C1CCN(C)CC1 ZINC000299032269 311043718 /nfs/dbraw/zinc/04/37/18/311043718.db2.gz BGZDZHNGLVOIQP-UHFFFAOYSA-N 0 3 325.434 2.849 20 5 EFBDHN C[C@@H]1CN(C[C@H]2CCCN2Cc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000299198168 311060916 /nfs/dbraw/zinc/06/09/16/311060916.db2.gz RCLKTGBCMQWZHI-RVKKMQEKSA-N 0 3 333.432 2.668 20 5 EFBDHN COCCN1CCC(Nc2ccc([N+](=O)[O-])c3cnccc23)CC1 ZINC000299230813 311063796 /nfs/dbraw/zinc/06/37/96/311063796.db2.gz GFQLTTYEEOCQIX-UHFFFAOYSA-N 0 3 330.388 2.666 20 5 EFBDHN COCCN1CCC(Nc2ccc([N+](=O)[O-])c3cccnc23)CC1 ZINC000299258150 311066280 /nfs/dbraw/zinc/06/62/80/311066280.db2.gz WJHRPKCRAILDLW-UHFFFAOYSA-N 0 3 330.388 2.666 20 5 EFBDHN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@H]1CN1CCCC1 ZINC000299524791 311093278 /nfs/dbraw/zinc/09/32/78/311093278.db2.gz LVCNRGXIMFLFII-ZDUSSCGKSA-N 0 3 337.807 2.949 20 5 EFBDHN CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H](c1cccs1)N(C)C ZINC000301125598 311120443 /nfs/dbraw/zinc/12/04/43/311120443.db2.gz VPGXRPOZGKJGLU-CQSZACIVSA-N 0 3 348.428 2.731 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC[C@H](O)CN1CCc2ccccc2C1 ZINC000301495910 311140836 /nfs/dbraw/zinc/14/08/36/311140836.db2.gz AYVCWMVJGQTQJV-SFHVURJKSA-N 0 3 341.411 2.734 20 5 EFBDHN Cc1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000301509590 311141534 /nfs/dbraw/zinc/14/15/34/311141534.db2.gz HYQYKSHTENSYCP-QGZVFWFLSA-N 0 3 341.411 2.734 20 5 EFBDHN O=[N+]([O-])c1ccc(NC[C@@H]2C[C@@H](O)CN2Cc2ccccc2)cc1 ZINC000301840645 311162104 /nfs/dbraw/zinc/16/21/04/311162104.db2.gz AWSGUAVARLCTFW-ZWKOTPCHSA-N 0 3 327.384 2.642 20 5 EFBDHN O=[N+]([O-])c1ccccc1NC[C@@H]1C[C@@H](O)CN1Cc1ccccc1 ZINC000301885885 311164930 /nfs/dbraw/zinc/16/49/30/311164930.db2.gz PRHDQUYDMNGAPB-JKSUJKDBSA-N 0 3 327.384 2.642 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@H]2CN(Cc3ccccc3)CC[C@H]2CO)cc1 ZINC000302007328 311171557 /nfs/dbraw/zinc/17/15/57/311171557.db2.gz WJVYHJJVXSTMPS-LPHOPBHVSA-N 0 3 341.411 2.890 20 5 EFBDHN Cc1cc(N2CCN(CC3CC3)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000302040973 311174101 /nfs/dbraw/zinc/17/41/01/311174101.db2.gz WHKXHWIDZZAXOP-UHFFFAOYSA-N 0 3 326.400 2.983 20 5 EFBDHN Cc1cc(NCCn2cc([N+](=O)[O-])cn2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302065289 311175985 /nfs/dbraw/zinc/17/59/85/311175985.db2.gz DWGMMRQRSDFJLJ-UHFFFAOYSA-N 0 3 342.315 2.668 20 5 EFBDHN CCC[C@@H]1CN(c2ncc([N+](=O)[O-])cn2)CCN1Cc1ccccc1 ZINC000302232954 311186636 /nfs/dbraw/zinc/18/66/36/311186636.db2.gz STFKHGZGWQLQPN-MRXNPFEDSA-N 0 3 341.415 2.876 20 5 EFBDHN Cc1c(CNC[C@H](O)COc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000326233320 311243787 /nfs/dbraw/zinc/24/37/87/311243787.db2.gz VIKPGMZXPJPEIZ-HNNXBMFYSA-N 0 3 334.347 2.572 20 5 EFBDHN C[C@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000330596881 311323501 /nfs/dbraw/zinc/32/35/01/311323501.db2.gz VUYYCCVOWSVBCQ-IJLUTSLNSA-N 0 3 325.434 2.753 20 5 EFBDHN CC(C)c1ccc(C(=O)N[C@H]2CN(C3CC3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000331483995 311381745 /nfs/dbraw/zinc/38/17/45/311381745.db2.gz JVMOPTSZNZFFJL-WBMJQRKESA-N 0 3 331.416 2.931 20 5 EFBDHN CC(C)c1ccc(C(=O)N[C@@H]2CN(C3CC3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000331483988 311381795 /nfs/dbraw/zinc/38/17/95/311381795.db2.gz JVMOPTSZNZFFJL-MLGOLLRUSA-N 0 3 331.416 2.931 20 5 EFBDHN C[C@H](C(=O)N1CC[C@H](N2CCCCC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000332655255 311531920 /nfs/dbraw/zinc/53/19/20/311531920.db2.gz JEUMJOGNKRKHPZ-ZFWWWQNUSA-N 0 3 349.406 2.924 20 5 EFBDHN CCC(=O)N1CC[C@@H](N[C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417308221 312206766 /nfs/dbraw/zinc/20/67/66/312206766.db2.gz HQRHPKASBJVJDE-RHSMWYFYSA-N 0 3 331.416 2.963 20 5 EFBDHN O=C1C[C@@H](N[C@H]2CCCCc3ccc([N+](=O)[O-])cc32)CN1C1CC1 ZINC000417308734 312206975 /nfs/dbraw/zinc/20/69/75/312206975.db2.gz IEOPXKQGVFFFDE-DYVFJYSZSA-N 0 3 329.400 2.715 20 5 EFBDHN C[C@H](CN1CCCC1=O)N[C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417345389 312212158 /nfs/dbraw/zinc/21/21/58/312212158.db2.gz UHQSDYDLTLYDDQ-DYVFJYSZSA-N 0 3 331.416 2.963 20 5 EFBDHN Cc1ccc([C@@H](CNc2c(C(N)=O)cccc2[N+](=O)[O-])N(C)C)cc1 ZINC000420580126 312373319 /nfs/dbraw/zinc/37/33/19/312373319.db2.gz DPVYVXOGTSPXSL-MRXNPFEDSA-N 0 3 342.399 2.717 20 5 EFBDHN Cc1cc(NC[C@H]2CC[C@H](C(N)=O)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000420611807 312375735 /nfs/dbraw/zinc/37/57/35/312375735.db2.gz SGJQOWZUJXYPHS-JOCQHMNTSA-N 0 3 342.399 2.577 20 5 EFBDHN CN(C[C@H]1CCCN1C)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000420795394 312391740 /nfs/dbraw/zinc/39/17/40/312391740.db2.gz LUPUGYCVAFUJIS-QGZVFWFLSA-N 0 3 348.447 2.653 20 5 EFBDHN CN(C)[C@@]1(CNc2ccnc3c2cccc3[N+](=O)[O-])CCSC1 ZINC000432315508 312555544 /nfs/dbraw/zinc/55/55/44/312555544.db2.gz ZQLMYENSZYRBCA-MRXNPFEDSA-N 0 3 332.429 2.992 20 5 EFBDHN CS[C@H]1CN(c2nccc3c2cccc3[N+](=O)[O-])C[C@H]1N(C)C ZINC000450409082 312692713 /nfs/dbraw/zinc/69/27/13/312692713.db2.gz XANVNZWDGGKEEO-CABCVRRESA-N 0 3 332.429 2.625 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC[C@H](CN2CCOCC2)C1 ZINC000470169856 313129057 /nfs/dbraw/zinc/12/90/57/313129057.db2.gz LAMXVWRFJAZKDO-MUMAZLPKSA-N 0 3 345.443 2.652 20 5 EFBDHN CNC(=O)CC1CCN(C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC1 ZINC000470175397 313129143 /nfs/dbraw/zinc/12/91/43/313129143.db2.gz CSKCJQLJWZZAIS-GXDHUFHOSA-N 0 3 331.416 2.846 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCN(CC(C)(C)O)[C@H](C)C1 ZINC000470211301 313130055 /nfs/dbraw/zinc/13/00/55/313130055.db2.gz HJEPYSBFBLLSOU-AAGJOFLKSA-N 0 3 347.459 2.775 20 5 EFBDHN COc1c(C(=O)N[C@@H]2CCN(CC3CCCC3)C2)cccc1[N+](=O)[O-] ZINC000476201511 313229793 /nfs/dbraw/zinc/22/97/93/313229793.db2.gz VRERUKATTJEMIV-CQSZACIVSA-N 0 3 347.415 2.598 20 5 EFBDHN CSc1cccc(C(=O)N[C@H]2CCCN(C(C)C)C2)c1[N+](=O)[O-] ZINC000487133656 313369764 /nfs/dbraw/zinc/36/97/64/313369764.db2.gz GQUMTWPFSXELNS-LBPRGKRZSA-N 0 3 337.445 2.919 20 5 EFBDHN Cc1c(CNC(=O)c2ccccc2CN(C)C)cccc1[N+](=O)[O-] ZINC000487309667 313384516 /nfs/dbraw/zinc/38/45/16/313384516.db2.gz WIDLFUHHEXBQBF-UHFFFAOYSA-N 0 3 327.384 2.895 20 5 EFBDHN Cn1ccnc1C(=O)c1ccc(N2CCc3cnccc32)c([N+](=O)[O-])c1 ZINC000487782123 313427679 /nfs/dbraw/zinc/42/76/79/313427679.db2.gz IZROFHCVCKJMNI-UHFFFAOYSA-N 0 3 349.350 2.649 20 5 EFBDHN COc1ccccc1OCCN1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000488748325 313509642 /nfs/dbraw/zinc/50/96/42/313509642.db2.gz KMBBDKNUTRFQAX-UHFFFAOYSA-N 0 3 346.387 2.516 20 5 EFBDHN CCOC(=O)N(C)C1CCN(CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000491547641 313762669 /nfs/dbraw/zinc/76/26/69/313762669.db2.gz BXDZDWCDIUEYNZ-UHFFFAOYSA-N 0 3 335.404 2.690 20 5 EFBDHN C[C@@H](NC(=O)/C=C\c1ccc(F)cc1[N+](=O)[O-])C1=CCN(C)CC1 ZINC000492486623 314008337 /nfs/dbraw/zinc/00/83/37/314008337.db2.gz GDFXSUKFEFAIKD-TXNVCOODSA-N 0 3 333.363 2.514 20 5 EFBDHN C[C@H](NC(=O)/C=C\c1ccc(F)cc1[N+](=O)[O-])C1=CCN(C)CC1 ZINC000492486619 314008554 /nfs/dbraw/zinc/00/85/54/314008554.db2.gz GDFXSUKFEFAIKD-RNZFLTOJSA-N 0 3 333.363 2.514 20 5 EFBDHN CCOC(=O)N1CC[C@@H](NC/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000492511597 314019691 /nfs/dbraw/zinc/01/96/91/314019691.db2.gz QQGZVUBKOOXHFI-UZGISAJGSA-N 0 3 333.388 2.819 20 5 EFBDHN C[C@@H]1CN(C(=O)/C=C\c2ccccc2[N+](=O)[O-])CCN(C2CC2)C1 ZINC000493170089 314264769 /nfs/dbraw/zinc/26/47/69/314264769.db2.gz HTLGTTVXBMJUSD-PIZKADEWSA-N 0 3 329.400 2.551 20 5 EFBDHN COC(=O)N1CCC[C@H]([C@H](C)NCc2ccc([N+](=O)[O-])cc2F)C1 ZINC000495567055 314758947 /nfs/dbraw/zinc/75/89/47/314758947.db2.gz SKVTUXPVYSELOY-AAEUAGOBSA-N 0 3 339.367 2.690 20 5 EFBDHN CC(C)(C)OC(=O)N1C[C@@H]2C[C@]2(CNCc2ccccc2[N+](=O)[O-])C1 ZINC000496290355 315014087 /nfs/dbraw/zinc/01/40/87/315014087.db2.gz CWRJOWXXGJBIMA-KSSFIOAISA-N 0 3 347.415 2.941 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[C@@H](CN2CCOC2=O)C1 ZINC000496362969 315040426 /nfs/dbraw/zinc/04/04/26/315040426.db2.gz NXLALTBIAFSEEJ-ZIAGYGMSSA-N 0 3 333.388 2.738 20 5 EFBDHN CC(COC(=O)Cc1ccc(NC(=O)OC(C)(C)C)cc1)[N+](=O)[O-] ZINC000497010833 315277176 /nfs/dbraw/zinc/27/71/76/315277176.db2.gz KWVWKGLWPXGVSC-NSHDSACASA-N 0 3 338.360 2.785 20 5 EFBDHN CCOC(=O)c1cc(N2C[C@@H](C)N(CC)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000497515446 315393057 /nfs/dbraw/zinc/39/30/57/315393057.db2.gz MVUMMAWYAPGXDS-CHWSQXEVSA-N 0 3 335.404 2.690 20 5 EFBDHN CN(C)C[C@@H]1CCCCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000519142382 315847027 /nfs/dbraw/zinc/84/70/27/315847027.db2.gz KVOTZVDNCPQGSR-AWEZNQCLSA-N 0 3 331.372 2.897 20 5 EFBDHN CCCCN1CCCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1OC ZINC000522186004 316078451 /nfs/dbraw/zinc/07/84/51/316078451.db2.gz DLTVSKANJQLZLG-OAHLLOKOSA-N 0 3 349.431 2.988 20 5 EFBDHN C[C@@H]1CCN(CCNCc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000524771445 316173723 /nfs/dbraw/zinc/17/37/23/316173723.db2.gz QOHMHMTTZRXABW-LLVKDONJSA-N 0 3 329.347 2.628 20 5 EFBDHN COc1c(C(=O)N2CCCN(C(C)(C)C)CC2)cccc1[N+](=O)[O-] ZINC000527241269 316354122 /nfs/dbraw/zinc/35/41/22/316354122.db2.gz GPSDKXOWVZKRMF-UHFFFAOYSA-N 0 3 335.404 2.550 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H]1CN(CC(C)C)CCO1 ZINC000531931489 317334412 /nfs/dbraw/zinc/33/44/12/317334412.db2.gz OMUAXRBRAYHNPC-RDJZCZTQSA-N 0 3 335.448 2.911 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H](O)COc1ccccc1 ZINC000532198684 317369156 /nfs/dbraw/zinc/36/91/56/317369156.db2.gz MQKBLYAPAAZHRO-GDBMZVCRSA-N 0 3 330.384 2.994 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCN(Cc3cccc4[nH]ccc43)CC2)cn1 ZINC000535072308 317578264 /nfs/dbraw/zinc/57/82/64/317578264.db2.gz GAHGTTOFRAFOHQ-UHFFFAOYSA-N 0 3 337.383 2.793 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCN2CCC(Nc3ccccn3)CC2)cc1 ZINC000536371438 317630745 /nfs/dbraw/zinc/63/07/45/317630745.db2.gz PCWWKQNDZHQPRZ-UHFFFAOYSA-N 0 3 342.399 2.945 20 5 EFBDHN Cc1c([C@H](C)N[C@@H]2CCC[C@@H](S(C)(=O)=O)C2)cccc1[N+](=O)[O-] ZINC000537981482 317687073 /nfs/dbraw/zinc/68/70/73/317687073.db2.gz NMVCJWUTBIFQIE-BFHYXJOUSA-N 0 3 340.445 2.910 20 5 EFBDHN Cc1cc(NC[C@@H](CO)Cc2ccco2)c2cc([N+](=O)[O-])ccc2n1 ZINC000541174949 317769775 /nfs/dbraw/zinc/76/97/75/317769775.db2.gz WOVKSNPTTFDSFM-ZDUSSCGKSA-N 0 3 341.367 2.729 20 5 EFBDHN COc1cc(CN[C@H](CO)C2CCCCC2)c([N+](=O)[O-])cc1F ZINC000546629014 317969013 /nfs/dbraw/zinc/96/90/13/317969013.db2.gz ZCTRDNKAKLFNEO-CQSZACIVSA-N 0 3 326.368 2.773 20 5 EFBDHN CCN(C[C@@H]1CCCN1CC)C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000547798282 318043396 /nfs/dbraw/zinc/04/33/96/318043396.db2.gz WSWLJRXNQFMHNK-KRWDZBQOSA-N 0 3 333.432 2.860 20 5 EFBDHN C[C@@H](C(=O)NC[C@H]1N(C)CCCC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000548403922 318104370 /nfs/dbraw/zinc/10/43/70/318104370.db2.gz WVOQZKARFOQJDK-CZUORRHYSA-N 0 3 333.432 2.935 20 5 EFBDHN O=C(Nc1cccc(CN2CCCCC2)c1)c1c[nH]nc1[N+](=O)[O-] ZINC000548410567 318104665 /nfs/dbraw/zinc/10/46/65/318104665.db2.gz ZYOBUDDIVPFQJP-UHFFFAOYSA-N 0 3 329.360 2.556 20 5 EFBDHN O=C(Nc1cccc(C[NH+]2CCCCC2)c1)c1c[n-]nc1[N+](=O)[O-] ZINC000548410567 318104668 /nfs/dbraw/zinc/10/46/68/318104668.db2.gz ZYOBUDDIVPFQJP-UHFFFAOYSA-N 0 3 329.360 2.556 20 5 EFBDHN COc1ccccc1CNCCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000548761475 318140749 /nfs/dbraw/zinc/14/07/49/318140749.db2.gz PBQPQUCKECLWSO-UHFFFAOYSA-N 0 3 329.356 2.722 20 5 EFBDHN O=C(CCNCc1cc(F)cc(F)c1)Nc1ccccc1[N+](=O)[O-] ZINC000548761749 318140936 /nfs/dbraw/zinc/14/09/36/318140936.db2.gz NQPYWDIIFWDFIF-UHFFFAOYSA-N 0 3 335.310 2.991 20 5 EFBDHN Cc1cc(N2CCCN(C)CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000548763376 318141431 /nfs/dbraw/zinc/14/14/31/318141431.db2.gz VJMFUZINMLYJBJ-UHFFFAOYSA-N 0 3 327.388 2.502 20 5 EFBDHN Cc1ccccc1OC[C@@H](O)CN(C)CCc1cccc([N+](=O)[O-])c1 ZINC000549173499 318168014 /nfs/dbraw/zinc/16/80/14/318168014.db2.gz RHBKUXLMYDQCMZ-SFHVURJKSA-N 0 3 344.411 2.817 20 5 EFBDHN Cc1cc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)ccc1F ZINC000550084844 318187331 /nfs/dbraw/zinc/18/73/31/318187331.db2.gz ADTZDMPPHHPIAF-OAHLLOKOSA-N 0 3 334.347 2.572 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1CC[C@H](N2CCCCC2)C1 ZINC000553388947 318281446 /nfs/dbraw/zinc/28/14/46/318281446.db2.gz MYFVTNUFWYNJGA-AWEZNQCLSA-N 0 3 347.415 2.754 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(C)cc1N[C@@H]1C[C@H](C)N(C2CC2)C1 ZINC000553448051 318283625 /nfs/dbraw/zinc/28/36/25/318283625.db2.gz MDPKSOSJPHEFHB-NWDGAFQWSA-N 0 3 333.388 2.727 20 5 EFBDHN CCCN(CCN1CCCC1)C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000554408184 318311559 /nfs/dbraw/zinc/31/15/59/318311559.db2.gz GYIBCBXSKCZACM-UHFFFAOYSA-N 0 3 334.420 2.612 20 5 EFBDHN COCc1ccc(CNCCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000554527554 318321014 /nfs/dbraw/zinc/32/10/14/318321014.db2.gz ONXJFTSSXNIEKT-UHFFFAOYSA-N 0 3 343.383 2.860 20 5 EFBDHN CCCN(CCN1CCCCC1)C(=O)c1ccc(NC)c([N+](=O)[O-])c1 ZINC000557631281 318444577 /nfs/dbraw/zinc/44/45/77/318444577.db2.gz VTZGEDCDKYYYRV-UHFFFAOYSA-N 0 3 348.447 2.975 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2cc3ccccc3o2)c1 ZINC000558752139 318490771 /nfs/dbraw/zinc/49/07/71/318490771.db2.gz DEDAFQJUGSDIKM-HNNXBMFYSA-N 0 3 342.351 2.871 20 5 EFBDHN CC[C@H](C)C[C@H](C)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000565593777 318985590 /nfs/dbraw/zinc/98/55/90/318985590.db2.gz DOUMOHHLUCDTNJ-STQMWFEESA-N 0 3 328.434 2.783 20 5 EFBDHN Cn1cc([C@H]2OCCC[C@@H]2N[C@H]2CCc3c2cccc3[N+](=O)[O-])cn1 ZINC000566483374 319082978 /nfs/dbraw/zinc/08/29/78/319082978.db2.gz KYMWMOBTFQMKBF-XYJFISCASA-N 0 3 342.399 2.826 20 5 EFBDHN CC(C)N1CCCC[C@@H]1Cn1nc(-c2ccccc2[N+](=O)[O-])oc1=O ZINC000567897626 319223753 /nfs/dbraw/zinc/22/37/53/319223753.db2.gz JXUWHHMXLKESBL-CYBMUJFWSA-N 0 3 346.387 2.674 20 5 EFBDHN O=C(CCNCc1ccc2c(c1)COC2)Nc1ccccc1[N+](=O)[O-] ZINC000568078598 319244458 /nfs/dbraw/zinc/24/44/58/319244458.db2.gz XPXWSQFNSKMPBQ-UHFFFAOYSA-N 0 3 341.367 2.743 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)[C@@H]2CNCc3ccccc32)cc1[N+](=O)[O-] ZINC000568390428 319279675 /nfs/dbraw/zinc/27/96/75/319279675.db2.gz MUTRUIITOKUGCE-CXAGYDPISA-N 0 3 339.395 2.967 20 5 EFBDHN C[C@H](N[C@@H]1CCCC[C@H]1N1CCOCC1)c1ccccc1[N+](=O)[O-] ZINC000568462483 319284628 /nfs/dbraw/zinc/28/46/28/319284628.db2.gz AJVGBVROAIWTHX-YXJHDRRASA-N 0 3 333.432 2.889 20 5 EFBDHN C[C@H](N[C@H]1CCCC[C@H]1N1CCOCC1)c1ccccc1[N+](=O)[O-] ZINC000568462482 319284700 /nfs/dbraw/zinc/28/47/00/319284700.db2.gz AJVGBVROAIWTHX-QILLFSRXSA-N 0 3 333.432 2.889 20 5 EFBDHN CS(=O)(=O)[C@@H]1CCC[C@@H](N[C@@H]2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000568531371 319293547 /nfs/dbraw/zinc/29/35/47/319293547.db2.gz CBVVIYBCXZAPIU-LALPHHSUSA-N 0 3 338.429 2.528 20 5 EFBDHN C[C@@H]1CN(CCCN[C@H]2CCc3c2cccc3[N+](=O)[O-])C[C@H](C)O1 ZINC000568662583 319306923 /nfs/dbraw/zinc/30/69/23/319306923.db2.gz DGHFCSLJURFVMT-VBQJREDUSA-N 0 3 333.432 2.671 20 5 EFBDHN CSc1ccc(OC[C@H](O)CNCc2cccc([N+](=O)[O-])c2)cc1 ZINC000569095562 319347917 /nfs/dbraw/zinc/34/79/17/319347917.db2.gz SGOWXFAIYIOKQZ-OAHLLOKOSA-N 0 3 348.424 2.846 20 5 EFBDHN O=C(CCN[C@@H]1CCc2c1cccc2[N+](=O)[O-])NCc1ccccc1 ZINC000570174621 319451805 /nfs/dbraw/zinc/45/18/05/319451805.db2.gz CKLHMWDALHOQFG-QGZVFWFLSA-N 0 3 339.395 2.878 20 5 EFBDHN CCO[C@@H]1C[C@H](N[C@H]2CCc3c2cccc3[N+](=O)[O-])[C@@]12CCCO2 ZINC000570650091 319498327 /nfs/dbraw/zinc/49/83/27/319498327.db2.gz OCWWBNXMDAPGFG-OWLYRPNTSA-N 0 3 332.400 2.898 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CNCc1ccc(Cl)s1 ZINC000570963806 319530240 /nfs/dbraw/zinc/53/02/40/319530240.db2.gz SKMZSRBLUAJEQZ-SNVBAGLBSA-N 0 3 342.804 2.839 20 5 EFBDHN CCOc1cccc(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])c1 ZINC000571039524 319536141 /nfs/dbraw/zinc/53/61/41/319536141.db2.gz BLMJUGJIQNCVPZ-OAHLLOKOSA-N 0 3 346.383 2.523 20 5 EFBDHN CCc1cnccc1CNCCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000576817495 320051179 /nfs/dbraw/zinc/05/11/79/320051179.db2.gz JTEPNOCRIXTVFQ-UHFFFAOYSA-N 0 3 328.372 2.671 20 5 EFBDHN Cc1cccc(OC[C@H](O)CN[C@@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000577963421 320160729 /nfs/dbraw/zinc/16/07/29/320160729.db2.gz ZCIPBBRCQFIIEN-RDTXWAMCSA-N 0 3 342.395 2.920 20 5 EFBDHN C[C@@H](CC(N)=O)NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000578036732 320167455 /nfs/dbraw/zinc/16/74/55/320167455.db2.gz CNOOKNTVQHSMFI-NSHDSACASA-N 0 3 347.346 2.880 20 5 EFBDHN C[C@H](C(=O)NCCN1CCCC(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000578062566 320169542 /nfs/dbraw/zinc/16/95/42/320169542.db2.gz QXNONFMSHSONCL-AWEZNQCLSA-N 0 3 333.432 2.937 20 5 EFBDHN O=[N+]([O-])c1ccc(S(=O)(=O)CCNCCC2=CCCCC2)cc1 ZINC000578395609 320201978 /nfs/dbraw/zinc/20/19/78/320201978.db2.gz IMGDXNKOPMWGLF-UHFFFAOYSA-N 0 3 338.429 2.849 20 5 EFBDHN O=C(CCN1CC[C@H](c2cccnc2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000578623295 320223601 /nfs/dbraw/zinc/22/36/01/320223601.db2.gz WHRYYVIKGIBMHD-HNNXBMFYSA-N 0 3 340.383 2.808 20 5 EFBDHN CCC1(CC)[C@H](OC)C[C@@H]1NCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000181844327 323253110 /nfs/dbraw/zinc/25/31/10/323253110.db2.gz MRFBITYODCYOJA-LSDHHAIUSA-N 0 3 335.404 2.717 20 5 EFBDHN Cc1ccc([C@@H](C)NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC000182331158 323277227 /nfs/dbraw/zinc/27/72/27/323277227.db2.gz IGVUYDVNNPOHMI-PBHICJAKSA-N 0 3 330.384 2.994 20 5 EFBDHN CC[C@@H](NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CCCO1 ZINC000182367256 323279528 /nfs/dbraw/zinc/27/95/28/323279528.db2.gz JBXSDEGMBBMWMN-BXUZGUMPSA-N 0 3 341.795 2.734 20 5 EFBDHN C[C@H](C(=O)N1CCCC[C@@H]1CN(C)C)c1ccc([N+](=O)[O-])cc1F ZINC000185129925 323384355 /nfs/dbraw/zinc/38/43/55/323384355.db2.gz PHHUUSLIGQEOJX-GXTWGEPZSA-N 0 3 337.395 2.780 20 5 EFBDHN Cc1cccc2c1CC[C@@H]2NC[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000578859582 323826989 /nfs/dbraw/zinc/82/69/89/323826989.db2.gz FFJWFZRPNPTCHY-PBHICJAKSA-N 0 3 342.395 2.920 20 5 EFBDHN COC(=O)COc1ccc(CN[C@H]2CCC[C@H](F)C2)cc1[N+](=O)[O-] ZINC000580193537 324117900 /nfs/dbraw/zinc/11/79/00/324117900.db2.gz HHVPVAFVTNKEMX-STQMWFEESA-N 0 3 340.351 2.517 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CN[C@@H]1CCc2cc(F)ccc21 ZINC000580737431 324224167 /nfs/dbraw/zinc/22/41/67/324224167.db2.gz UCLZAHINEMEBDG-GDBMZVCRSA-N 0 3 346.358 2.751 20 5 EFBDHN COc1ccc(OCCN2CC[C@H](c3cccnc3)C2)c([N+](=O)[O-])c1 ZINC000581188615 324323983 /nfs/dbraw/zinc/32/39/83/324323983.db2.gz DNGZKXDQENDDFA-HNNXBMFYSA-N 0 3 343.383 2.867 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2N[C@H](CO)Cc1ccc(F)cc1 ZINC000581200517 324328268 /nfs/dbraw/zinc/32/82/68/324328268.db2.gz QTNHRLDZGWNOFK-WMLDXEAASA-N 0 3 330.359 2.914 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H](C)N1CCCC1 ZINC000581462529 324381974 /nfs/dbraw/zinc/38/19/74/324381974.db2.gz IRQVPSCYUBTHGZ-HOCLYGCPSA-N 0 3 333.432 2.764 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2NCCc1cn2c(n1)SCC2 ZINC000583574552 324835823 /nfs/dbraw/zinc/83/58/23/324835823.db2.gz CGZVUMNYFQIPMC-AWEZNQCLSA-N 0 3 330.413 2.717 20 5 EFBDHN CCO[C@H]1CCCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000155450187 472551522 /nfs/dbraw/zinc/55/15/22/472551522.db2.gz YQAKCZAMLGKMRG-KRWDZBQOSA-N 0 3 344.415 2.996 20 5 EFBDHN CCOc1ccc([C@@H](C)NCCCNC(=O)C2CCC2)cc1[N+](=O)[O-] ZINC000090184554 472608836 /nfs/dbraw/zinc/60/88/36/472608836.db2.gz KEJWLENLMLKTHP-CYBMUJFWSA-N 0 3 349.431 2.951 20 5 EFBDHN CCNc1ccc(C(=O)N(CCN(C)C)C2CCCC2)cc1[N+](=O)[O-] ZINC000081551924 473217790 /nfs/dbraw/zinc/21/77/90/473217790.db2.gz VJOOTLYROWMQHK-UHFFFAOYSA-N 0 3 348.447 2.973 20 5 EFBDHN CN1CCN(CCOc2cccc([N+](=O)[O-])c2)C2(CCCCC2)C1 ZINC000081597774 473227955 /nfs/dbraw/zinc/22/79/55/473227955.db2.gz XCAVWYRIHJRWGG-UHFFFAOYSA-N 0 3 333.432 2.924 20 5 EFBDHN C[C@]1(O)CCCN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000124300449 473230119 /nfs/dbraw/zinc/23/01/19/473230119.db2.gz VWMIXLDGNNBTNY-KRWDZBQOSA-N 0 3 331.372 2.639 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@H]2CCc3nc(C)nn3C2)cc1[N+](=O)[O-] ZINC000095982160 473241767 /nfs/dbraw/zinc/24/17/67/473241767.db2.gz XKQQNPDYCCUQJA-FZMZJTMJSA-N 0 3 345.403 2.559 20 5 EFBDHN O=C(NC[C@@H]1CCCN(Cc2cccs2)C1)c1cc([N+](=O)[O-])c[nH]1 ZINC000140119427 473242657 /nfs/dbraw/zinc/24/26/57/473242657.db2.gz QMGRBGHGLKBEIQ-LBPRGKRZSA-N 0 3 348.428 2.626 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN(C)CCc1ccccn1 ZINC000124429197 473244934 /nfs/dbraw/zinc/24/49/34/473244934.db2.gz TYPYNQTYYNKFOV-UHFFFAOYSA-N 0 3 342.399 2.801 20 5 EFBDHN C[C@H]1C[C@H](Nc2ncc(Br)cc2[N+](=O)[O-])CCN1C ZINC000161673919 473252825 /nfs/dbraw/zinc/25/28/25/473252825.db2.gz OUWQLAXZSYIRBD-WCBMZHEXSA-N 0 3 329.198 2.647 20 5 EFBDHN Cc1cc(C(=O)N2CCC[C@H]2CN2CCCCC2)cc([N+](=O)[O-])c1 ZINC000171041236 473261736 /nfs/dbraw/zinc/26/17/36/473261736.db2.gz UJZJRUXAFCZRFW-INIZCTEOSA-N 0 3 331.416 2.994 20 5 EFBDHN C[C@H]1CCCC[N@@H+]1CC[N-]c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000486954894 468015090 /nfs/dbraw/zinc/01/50/90/468015090.db2.gz JWZRQNLBEUJDRS-LBPRGKRZSA-N 0 3 331.376 2.931 20 5 EFBDHN C[C@H]1CCCC[N@H+]1CC[N-]c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000486954894 468015093 /nfs/dbraw/zinc/01/50/93/468015093.db2.gz JWZRQNLBEUJDRS-LBPRGKRZSA-N 0 3 331.376 2.931 20 5 EFBDHN C[C@H]1CCCCN1CCNc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000486954894 468015094 /nfs/dbraw/zinc/01/50/94/468015094.db2.gz JWZRQNLBEUJDRS-LBPRGKRZSA-N 0 3 331.376 2.931 20 5 EFBDHN C[C@@H](C(=O)NC1CCN(C2CC2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000184942948 473279612 /nfs/dbraw/zinc/27/96/12/473279612.db2.gz BDWPQSPECKPQDU-LLVKDONJSA-N 0 3 335.379 2.580 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)NC2CCN(CCOC(C)C)CC2)c1 ZINC000081995622 473283668 /nfs/dbraw/zinc/28/36/68/473283668.db2.gz MBGQQVQMPCDQGB-UHFFFAOYSA-N 0 3 349.431 2.522 20 5 EFBDHN C[C@@H](CNC(=O)NCCc1ccc([N+](=O)[O-])cc1)N1CCC(C)CC1 ZINC000171167715 473308443 /nfs/dbraw/zinc/30/84/43/473308443.db2.gz SWEPRSYYMWOKSH-HNNXBMFYSA-N 0 3 348.447 2.557 20 5 EFBDHN CN(CCNC(=O)NCc1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000171169970 473308619 /nfs/dbraw/zinc/30/86/19/473308619.db2.gz WEPNWBBUFNRIEE-UHFFFAOYSA-N 0 3 342.399 2.526 20 5 EFBDHN O=[N+]([O-])c1ccc2oc(CN3CC[C@H](N4CCCCC4)C3)nc2c1 ZINC000083171094 473327383 /nfs/dbraw/zinc/32/73/83/473327383.db2.gz OEDDQHSZGINVFM-AWEZNQCLSA-N 0 3 330.388 2.796 20 5 EFBDHN COc1cc(C(=O)N(CCN(C)C)C2CCCC2)ccc1[N+](=O)[O-] ZINC000112916043 473330112 /nfs/dbraw/zinc/33/01/12/473330112.db2.gz KMBXUFLFTUMSKS-UHFFFAOYSA-N 0 3 335.404 2.550 20 5 EFBDHN COc1ccc([C@@H](CO)N(C)CCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000112995843 473345302 /nfs/dbraw/zinc/34/53/02/473345302.db2.gz GWYJTVXBSJWIQJ-GOSISDBHSA-N 0 3 346.383 2.648 20 5 EFBDHN CNC(=O)[C@@H]1CCCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000125074525 473352546 /nfs/dbraw/zinc/35/25/46/473352546.db2.gz TYGRYNIAJMYFHU-CQSZACIVSA-N 0 3 343.383 2.813 20 5 EFBDHN C[C@H](C(=O)N1C[C@H]2CCCN2C[C@@H]1C)c1ccc([N+](=O)[O-])cc1F ZINC000185243362 473374445 /nfs/dbraw/zinc/37/44/45/473374445.db2.gz PWYYVGRQRBJEBX-SGMGOOAPSA-N 0 3 335.379 2.533 20 5 EFBDHN CN(Cc1ccccc1)[C@H](CNC(=O)c1ccc([N+](=O)[O-])o1)C1CC1 ZINC000185304606 473390256 /nfs/dbraw/zinc/39/02/56/473390256.db2.gz XOWTYORZNITUPS-OAHLLOKOSA-N 0 3 343.383 2.828 20 5 EFBDHN CCc1ccccc1[C@H](N)CNC(=O)c1ccc([N+](=O)[O-])cc1C ZINC000423975267 477241303 /nfs/dbraw/zinc/24/13/03/477241303.db2.gz LSGIYUYGNBUELC-QGZVFWFLSA-N 0 3 327.384 2.895 20 5 EFBDHN CN(CCN1CCCC1)Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602657630 479453769 /nfs/dbraw/zinc/45/37/69/479453769.db2.gz PEUMIMWMHSRPGK-UHFFFAOYSA-N 0 3 348.266 2.946 20 5 EFBDHN C[C@@H](C(=O)N(C)CCN1CCCCC1)c1ccc([N+](=O)[O-])cc1F ZINC000593882652 479495550 /nfs/dbraw/zinc/49/55/50/479495550.db2.gz JJSSQLAZBMUFKI-CYBMUJFWSA-N 0 3 337.395 2.782 20 5 EFBDHN CN(CCN1CCCCC1)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000593882291 479495780 /nfs/dbraw/zinc/49/57/80/479495780.db2.gz GKYFIEKNJDYGMB-UHFFFAOYSA-N 0 3 344.415 2.563 20 5 EFBDHN C[C@H](CNCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000619845119 479894681 /nfs/dbraw/zinc/89/46/81/479894681.db2.gz QKUFTOCDQIAWDH-GFCCVEGCSA-N 0 3 328.434 2.640 20 5 EFBDHN CC[C@@H](CN1CCCC1)NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000619819437 479889563 /nfs/dbraw/zinc/88/95/63/479889563.db2.gz GAZZRLZXEXHAAI-INIZCTEOSA-N 0 3 348.447 2.653 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCCN(CC2CCC2)CC1 ZINC000619868435 479898140 /nfs/dbraw/zinc/89/81/40/479898140.db2.gz OIYKWFWJEOCGDR-UHFFFAOYSA-N 0 3 331.416 2.851 20 5 EFBDHN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCCN(CC2CCC2)CC1 ZINC000619868441 479898341 /nfs/dbraw/zinc/89/83/41/479898341.db2.gz WAEUEHAWQOGZML-UHFFFAOYSA-N 0 3 345.443 2.862 20 5 EFBDHN Cc1cc(C(=O)N2CCCN(CC3CCC3)CC2)ccc1[N+](=O)[O-] ZINC000619868418 479898550 /nfs/dbraw/zinc/89/85/50/479898550.db2.gz ZFURWVMYQNGAMW-UHFFFAOYSA-N 0 3 331.416 2.851 20 5 EFBDHN Cc1cc(C(=O)NCc2ccccc2CN(C)C)ccc1[N+](=O)[O-] ZINC000006992447 471583066 /nfs/dbraw/zinc/58/30/66/471583066.db2.gz NHYOYFZNTIFNAX-UHFFFAOYSA-N 0 3 327.384 2.895 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(CN(C)C)cc1 ZINC000015172155 471891844 /nfs/dbraw/zinc/89/18/44/471891844.db2.gz ZPPXWRSLHXYKJL-UHFFFAOYSA-N 0 3 343.383 2.595 20 5 EFBDHN CN(CCCNC(=O)c1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000016470615 471938109 /nfs/dbraw/zinc/93/81/09/471938109.db2.gz FKTFOSFQTJFKJX-UHFFFAOYSA-N 0 3 327.384 2.847 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](C)N2CCCC[C@@H]2C)c1 ZINC000067548482 472047917 /nfs/dbraw/zinc/04/79/17/472047917.db2.gz HWNQKGPQORXBMW-STQMWFEESA-N 0 3 335.404 2.596 20 5 EFBDHN CN(CCCNC(=O)c1ccc([N+](=O)[O-])cc1F)Cc1ccccc1 ZINC000054130788 472060227 /nfs/dbraw/zinc/06/02/27/472060227.db2.gz NTWZJXXPUPGECY-UHFFFAOYSA-N 0 3 345.374 2.986 20 5 EFBDHN Cc1cccc(C(=O)NCCN(C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000054281645 472072385 /nfs/dbraw/zinc/07/23/85/472072385.db2.gz BDWLHCXBWBVFOF-UHFFFAOYSA-N 0 3 327.384 2.765 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CNCCOCCO)o2)c(Cl)c1 ZINC000067697499 472073447 /nfs/dbraw/zinc/07/34/47/472073447.db2.gz BFPYABZJIQTZCJ-UHFFFAOYSA-N 0 3 340.763 2.607 20 5 EFBDHN C[C@H]1CCCN(C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000054287804 472073988 /nfs/dbraw/zinc/07/39/88/472073988.db2.gz KKROCFYWNWAYHN-LBPRGKRZSA-N 0 3 337.395 2.974 20 5 EFBDHN C[C@@H](CNC(=O)NCc1cccc([N+](=O)[O-])c1)N1CCCC[C@H]1C ZINC000067725683 472079522 /nfs/dbraw/zinc/07/95/22/472079522.db2.gz ZOYJFLWPFKSQQZ-KGLIPLIRSA-N 0 3 334.420 2.657 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CN(Cc2ccccc2)C2CC2)c1 ZINC000025259859 472088167 /nfs/dbraw/zinc/08/81/67/472088167.db2.gz LXJMJBGHWNZUHQ-GOSISDBHSA-N 0 3 342.395 2.999 20 5 EFBDHN COc1ccc(CC(=O)NC[C@H](C)N2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000067813577 472093113 /nfs/dbraw/zinc/09/31/13/472093113.db2.gz MNFTWVLAPPHGFX-KGLIPLIRSA-N 0 3 349.431 2.525 20 5 EFBDHN C[C@H]1CCCN(CCNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000068122189 472137202 /nfs/dbraw/zinc/13/72/02/472137202.db2.gz DHYKPIYWDXLZQL-HNNXBMFYSA-N 0 3 348.447 2.635 20 5 EFBDHN O=C(c1cc(F)ccc1[N+](=O)[O-])N1CCC[C@@H]1CN1CCCCC1 ZINC000068131951 472139661 /nfs/dbraw/zinc/13/96/61/472139661.db2.gz FFEHXGLVCFFPHX-CQSZACIVSA-N 0 3 335.379 2.824 20 5 EFBDHN O=C(Cc1ccccc1[N+](=O)[O-])N1CCC[C@H]1CN1CCCCC1 ZINC000068134711 472140075 /nfs/dbraw/zinc/14/00/75/472140075.db2.gz UHJQXQRVKLUEAD-INIZCTEOSA-N 0 3 331.416 2.614 20 5 EFBDHN Cc1c(NC(=O)[C@H](C)N2CCN(CC(C)C)CC2)cccc1[N+](=O)[O-] ZINC000042507826 472141192 /nfs/dbraw/zinc/14/11/92/472141192.db2.gz SUDQXJPKGGOYMW-HNNXBMFYSA-N 0 3 348.447 2.504 20 5 EFBDHN O=C(N[C@H](CN1CCCCC1)c1ccccc1)c1cc([N+](=O)[O-])c[nH]1 ZINC000075630886 472172630 /nfs/dbraw/zinc/17/26/30/472172630.db2.gz ZAJGPGJGHPERDC-QGZVFWFLSA-N 0 3 342.399 2.880 20 5 EFBDHN Cc1ccc(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)cc1[N+](=O)[O-] ZINC000027580618 472185241 /nfs/dbraw/zinc/18/52/41/472185241.db2.gz QAORTKNIFGVBHM-QGZVFWFLSA-N 0 3 341.411 2.806 20 5 EFBDHN C[C@H](CN1CCCCC1)NC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000027750515 472193710 /nfs/dbraw/zinc/19/37/10/472193710.db2.gz YRQKHYWTDMRZNC-OAHLLOKOSA-N 0 3 348.447 2.778 20 5 EFBDHN O=[N+]([O-])c1cnn(C[C@@H](O)CN(Cc2ccoc2)C2CCCCC2)c1 ZINC000075767229 472194086 /nfs/dbraw/zinc/19/40/86/472194086.db2.gz MYIRKUNNIQEVAQ-KRWDZBQOSA-N 0 3 348.403 2.580 20 5 EFBDHN O=C(NC1CCN(CCc2ccccc2)CC1)c1ccc([N+](=O)[O-])o1 ZINC000027939383 472203303 /nfs/dbraw/zinc/20/33/03/472203303.db2.gz RLGFGWTVLDIZGB-UHFFFAOYSA-N 0 3 343.383 2.625 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CCN(C3CC3)C2)c1 ZINC000075849357 472206453 /nfs/dbraw/zinc/20/64/53/472206453.db2.gz OMQXOLXFXTZZQW-LLVKDONJSA-N 0 3 335.429 2.531 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000087102220 472306056 /nfs/dbraw/zinc/30/60/56/472306056.db2.gz ZROGUAYVDGMVFI-KRWDZBQOSA-N 0 3 346.431 2.537 20 5 EFBDHN C[C@H](C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)N1CCCCCC1 ZINC000088252082 472352088 /nfs/dbraw/zinc/35/20/88/472352088.db2.gz XHKUTIMXTIEERY-CQSZACIVSA-N 0 3 331.416 2.744 20 5 EFBDHN Cc1cc(C(=O)N(CCN(C)C)Cc2ccco2)ccc1[N+](=O)[O-] ZINC000088250950 472352182 /nfs/dbraw/zinc/35/21/82/472352182.db2.gz VQOKEKNIVWWOCO-UHFFFAOYSA-N 0 3 331.372 2.700 20 5 EFBDHN CC(C)[C@@H](C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)N1CCCCC1 ZINC000088349636 472358566 /nfs/dbraw/zinc/35/85/66/472358566.db2.gz PMFOYILVBMUGKU-SFHVURJKSA-N 0 3 345.443 2.990 20 5 EFBDHN O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CC[C@@H](N2CCCCC2)C1 ZINC000076694170 472385896 /nfs/dbraw/zinc/38/58/96/472385896.db2.gz VXERQBNWPUCWBH-CYBMUJFWSA-N 0 3 337.807 2.949 20 5 EFBDHN CC(C)CN1CCCC[C@@H]1CNC(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000154170242 472397180 /nfs/dbraw/zinc/39/71/80/472397180.db2.gz KERONHBJUYLQCD-CQSZACIVSA-N 0 3 337.395 2.974 20 5 EFBDHN CC1CCN(CCNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CC1 ZINC000057213357 472398083 /nfs/dbraw/zinc/39/80/83/472398083.db2.gz MOMUKHGVMAXFAI-UHFFFAOYSA-N 0 3 330.388 2.538 20 5 EFBDHN CC1CCN(CCNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)CC1 ZINC000057213346 472398134 /nfs/dbraw/zinc/39/81/34/472398134.db2.gz MDQWGLUGMVMWGH-UHFFFAOYSA-N 0 3 348.447 2.635 20 5 EFBDHN COc1cc(CN[C@H](CO)[C@H](C)c2ccccc2)c([N+](=O)[O-])cc1F ZINC000613390000 479985370 /nfs/dbraw/zinc/98/53/70/479985370.db2.gz PNAFICCZFIYTSS-MLGOLLRUSA-N 0 3 348.374 2.997 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1CNCCCc1nccs1)OCCO2 ZINC000076892326 472420972 /nfs/dbraw/zinc/42/09/72/472420972.db2.gz VGJXYLXTHWPLEQ-UHFFFAOYSA-N 0 3 335.385 2.545 20 5 EFBDHN O=[N+]([O-])c1cc(F)c(NC2CCN([C@@H]3CCOC3)CC2)c(F)c1 ZINC000089603392 472468499 /nfs/dbraw/zinc/46/84/99/472468499.db2.gz GUIAUSGNVPTUNZ-LLVKDONJSA-N 0 3 327.331 2.538 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC[C@@H]1C[C@H](O)CN1Cc1ccccc1 ZINC000089643947 472476331 /nfs/dbraw/zinc/47/63/31/472476331.db2.gz QOEUEVYLKMTLPS-ROUUACIJSA-N 0 3 341.411 2.951 20 5 EFBDHN Cc1cc(NC[C@H]2C[C@H](O)CN2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000089643940 472476589 /nfs/dbraw/zinc/47/65/89/472476589.db2.gz WBTOLJKUSYJWFF-MSOLQXFVSA-N 0 3 341.411 2.951 20 5 EFBDHN Cc1cccc(C(=O)NCc2cccc(CN(C)C)c2)c1[N+](=O)[O-] ZINC000033089317 472494819 /nfs/dbraw/zinc/49/48/19/472494819.db2.gz ZBLAYDJDGKWDHE-UHFFFAOYSA-N 0 3 327.384 2.895 20 5 EFBDHN CN(C)Cc1cccc(CNC(=O)/C=C\c2ccccc2[N+](=O)[O-])c1 ZINC000098004645 472511513 /nfs/dbraw/zinc/51/15/13/472511513.db2.gz MKSOIQOZRNXEON-KHPPLWFESA-N 0 3 339.395 2.986 20 5 EFBDHN CN(C)Cc1cccc(CNC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)c1 ZINC000046379178 472551602 /nfs/dbraw/zinc/55/16/02/472551602.db2.gz WDBVCSQTPLEVSG-DHZHZOJOSA-N 0 3 339.395 2.986 20 5 EFBDHN CCOC(=O)CC1CCN(CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000120092562 472628897 /nfs/dbraw/zinc/62/88/97/472628897.db2.gz KLUPJBOHJZIUFL-UHFFFAOYSA-N 0 3 336.388 2.639 20 5 EFBDHN CCOc1ccc(C(=O)NC[C@H](C)N2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000046953884 472629344 /nfs/dbraw/zinc/62/93/44/472629344.db2.gz GJRJROKHUMNAOK-KBPBESRZSA-N 0 3 349.431 2.844 20 5 EFBDHN C[C@H]1C[C@@H](c2ccccc2F)N(CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000090550922 472634117 /nfs/dbraw/zinc/63/41/17/472634117.db2.gz PZEPUYSTNRGARA-GUYCJALGSA-N 0 3 345.374 2.979 20 5 EFBDHN CC(C)C(=O)NC[C@@H]1CCCN(CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000060361105 472647139 /nfs/dbraw/zinc/64/71/39/472647139.db2.gz VSBIVVQLVWQHRQ-INIZCTEOSA-N 0 3 333.432 2.622 20 5 EFBDHN CC[C@H](NC(=O)N1CCC[C@@H](N(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000090688467 472652469 /nfs/dbraw/zinc/65/24/69/472652469.db2.gz QFIKUDVCQOVBST-CVEARBPZSA-N 0 3 334.420 2.782 20 5 EFBDHN CC1CCN(CCNC(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000047119629 472655985 /nfs/dbraw/zinc/65/59/85/472655985.db2.gz NXOQPHGYRAFIAB-UHFFFAOYSA-N 0 3 325.796 2.710 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN(C[C@H](C)O)C1CCCCC1 ZINC000104684520 472684549 /nfs/dbraw/zinc/68/45/49/472684549.db2.gz CFWYLRFWQCMTAP-AWEZNQCLSA-N 0 3 349.431 2.857 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCN2CC[C@H](Oc3ccncc3)C2)c1 ZINC000156383837 472700268 /nfs/dbraw/zinc/70/02/68/472700268.db2.gz BOBWZZYDBBNTJI-KRWDZBQOSA-N 0 3 329.356 2.522 20 5 EFBDHN CC1(C)CCCC[C@@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000120518480 472702893 /nfs/dbraw/zinc/70/28/93/472702893.db2.gz DNRPOXVQHIXCKK-HNNXBMFYSA-N 0 3 340.445 2.927 20 5 EFBDHN CN(C(=O)c1cc([N+](=O)[O-])c[nH]1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000072733198 472709891 /nfs/dbraw/zinc/70/98/91/472709891.db2.gz FWZFHHCTKAMPTF-OAHLLOKOSA-N 0 3 342.399 2.660 20 5 EFBDHN CSc1ccc(C(=O)N(C)[C@H]2CCN(C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000120614182 472718055 /nfs/dbraw/zinc/71/80/55/472718055.db2.gz BVLSUTJQPYCFHE-YPMHNXCESA-N 0 3 337.445 2.729 20 5 EFBDHN COc1cc(CNCC2(CCO)CCCC2)c([N+](=O)[O-])cc1OC ZINC000072925981 472742007 /nfs/dbraw/zinc/74/20/07/472742007.db2.gz GLOYSRIBZMEEMN-UHFFFAOYSA-N 0 3 338.404 2.644 20 5 EFBDHN Cc1cnc(N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)c([N+](=O)[O-])c1 ZINC000078658005 472748902 /nfs/dbraw/zinc/74/89/02/472748902.db2.gz ASTXYODSGSQLQF-GASCZTMLSA-N 0 3 348.447 2.624 20 5 EFBDHN O=C1CC[C@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CN1 ZINC000105481580 472755095 /nfs/dbraw/zinc/75/50/95/472755095.db2.gz WWYHYJIQIFTRPR-LBPRGKRZSA-N 0 3 331.397 2.692 20 5 EFBDHN Cc1nn(C)c(N2CC[C@H](C)N(Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000078689425 472755001 /nfs/dbraw/zinc/75/50/01/472755001.db2.gz JKWVVUOJTMIDPM-AWEZNQCLSA-N 0 3 343.431 2.738 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@@H]2CN(Cc3ccccc3)CC[C@@H]2CO)cc1 ZINC000091486184 472773067 /nfs/dbraw/zinc/77/30/67/472773067.db2.gz WJVYHJJVXSTMPS-VQIMIIECSA-N 0 3 341.411 2.890 20 5 EFBDHN Cc1cccc(C)c1OC[C@@H](O)CNCc1cccc([N+](=O)[O-])c1 ZINC000063525722 472785209 /nfs/dbraw/zinc/78/52/09/472785209.db2.gz JKWHNXCRHYJZHT-KRWDZBQOSA-N 0 3 330.384 2.741 20 5 EFBDHN O=c1cc(CN[C@H]2CCc3ncnn3C2)c2c(ccc3ccccc32)o1 ZINC000105870830 472794163 /nfs/dbraw/zinc/79/41/63/472794163.db2.gz WSCXGKWYKBQZBV-HNNXBMFYSA-N 0 3 346.390 2.642 20 5 EFBDHN CC(C)c1nc2n(n1)C[C@@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000105873927 472794502 /nfs/dbraw/zinc/79/45/02/472794502.db2.gz ZNHHKZHYCJUJMW-OCCSQVGLSA-N 0 3 329.404 2.975 20 5 EFBDHN C[C@H](CN1C[C@@H](C)C[C@H](C)C1)NC(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000133514995 472812750 /nfs/dbraw/zinc/81/27/50/472812750.db2.gz DAJIIBXEGKLXQP-RWMBFGLXSA-N 0 3 337.395 2.830 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CCC(OCc3ccccc3F)CC2)n1 ZINC000091869066 472819959 /nfs/dbraw/zinc/81/99/59/472819959.db2.gz HBDHUXFFVHDGEP-UHFFFAOYSA-N 0 3 348.378 2.612 20 5 EFBDHN COC[C@@H](NCc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000121424212 472849076 /nfs/dbraw/zinc/84/90/76/472849076.db2.gz YHPDYYUGMCBBRX-LLVKDONJSA-N 0 3 346.330 2.719 20 5 EFBDHN C[C@@H]1CCCN(CCNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000134607584 472937493 /nfs/dbraw/zinc/93/74/93/472937493.db2.gz WLEJHZIWJQLZFP-LLVKDONJSA-N 0 3 325.796 2.710 20 5 EFBDHN Cc1cc([N+](=O)[O-])cnc1N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000092642473 472949814 /nfs/dbraw/zinc/94/98/14/472949814.db2.gz FPAXKCXOIDXNKG-HUUCEWRRSA-N 0 3 348.447 2.624 20 5 EFBDHN C[C@H](NC(=O)NCCN1CCC[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000079983996 472953942 /nfs/dbraw/zinc/95/39/42/472953942.db2.gz VJVGGQPYNGYXLE-KGLIPLIRSA-N 0 3 334.420 2.687 20 5 EFBDHN CC(C)[C@@H]1CN(C)CCN1c1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000092656373 472954631 /nfs/dbraw/zinc/95/46/31/472954631.db2.gz HKIKILCLYSEBIO-ZDUSSCGKSA-N 0 3 329.347 2.973 20 5 EFBDHN C[C@H]1CN(C)CC[C@@H]1N(C)c1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000092668140 472959042 /nfs/dbraw/zinc/95/90/42/472959042.db2.gz HHJDWUJCXFIJON-JQWIXIFHSA-N 0 3 329.347 2.973 20 5 EFBDHN C[C@@H]1CCCN(CCNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000080073336 472971318 /nfs/dbraw/zinc/97/13/18/472971318.db2.gz QGGWFYMOGNMITC-CQSZACIVSA-N 0 3 348.447 2.861 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000134904937 472987030 /nfs/dbraw/zinc/98/70/30/472987030.db2.gz GRZBEZHNBWFELZ-CYBMUJFWSA-N 0 3 325.796 2.852 20 5 EFBDHN C[C@@H]1C[C@H](NC(=O)c2cccc([N+](=O)[O-])c2)CN1Cc1ccccc1 ZINC000134931134 472992135 /nfs/dbraw/zinc/99/21/35/472992135.db2.gz NOTZGVQBOPUDIA-PBHICJAKSA-N 0 3 339.395 2.988 20 5 EFBDHN CCc1nn(C)c(NC[C@H](c2cccc(F)c2)N(C)C)c1[N+](=O)[O-] ZINC000092827045 472994940 /nfs/dbraw/zinc/99/49/40/472994940.db2.gz ZMCKRCCNQIZFLK-CQSZACIVSA-N 0 3 335.383 2.745 20 5 EFBDHN CCc1nn(C)c(NC[C@@H](c2cccc(F)c2)N(C)C)c1[N+](=O)[O-] ZINC000092827044 472995246 /nfs/dbraw/zinc/99/52/46/472995246.db2.gz ZMCKRCCNQIZFLK-AWEZNQCLSA-N 0 3 335.383 2.745 20 5 EFBDHN C[C@H](CS(=O)(=O)c1ccccc1)NCCc1ccc([N+](=O)[O-])cc1 ZINC000122346572 473004213 /nfs/dbraw/zinc/00/42/13/473004213.db2.gz PIHNYZNHTHJAGK-CQSZACIVSA-N 0 3 348.424 2.589 20 5 EFBDHN CN(C)CCN(C(=O)COc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000065746068 473006188 /nfs/dbraw/zinc/00/61/88/473006188.db2.gz SATZDMVIKWNKOV-UHFFFAOYSA-N 0 3 349.431 2.697 20 5 EFBDHN COC[C@H](Cc1ccccc1)NCc1cc([N+](=O)[O-])ccc1OC ZINC000122424836 473012936 /nfs/dbraw/zinc/01/29/36/473012936.db2.gz NJGCQIQUXUBZEI-INIZCTEOSA-N 0 3 330.384 2.951 20 5 EFBDHN Cc1cc(C(=O)NCc2cccc(CN(C)C)c2)cc([N+](=O)[O-])c1 ZINC000122461975 473017209 /nfs/dbraw/zinc/01/72/09/473017209.db2.gz VERLOOBMJVAAEP-UHFFFAOYSA-N 0 3 327.384 2.895 20 5 EFBDHN COCCN(CCO)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000093005826 473022769 /nfs/dbraw/zinc/02/27/69/473022769.db2.gz VPFJTYXGCYPWMA-UHFFFAOYSA-N 0 3 336.413 2.764 20 5 EFBDHN CCCCNC(=O)[C@H]1CCCN(CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000051058587 473024041 /nfs/dbraw/zinc/02/40/41/473024041.db2.gz MPOWCNXOVMIRTB-HNNXBMFYSA-N 0 3 349.431 2.602 20 5 EFBDHN Cc1cc(N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)ncc1[N+](=O)[O-] ZINC000074746549 473055769 /nfs/dbraw/zinc/05/57/69/473055769.db2.gz MBHAJJZHKIMBEK-GJZGRUSLSA-N 0 3 348.447 2.624 20 5 EFBDHN Cc1c(CC(=O)N(CCN(C)C)C2CCCC2)cccc1[N+](=O)[O-] ZINC000122772543 473057004 /nfs/dbraw/zinc/05/70/04/473057004.db2.gz HZILNMNKCRPSOJ-UHFFFAOYSA-N 0 3 333.432 2.779 20 5 EFBDHN O=C(NCCN1CCCCCC1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000122860513 473065600 /nfs/dbraw/zinc/06/56/00/473065600.db2.gz HYZMEWXZLYDNNZ-UHFFFAOYSA-N 0 3 342.399 2.749 20 5 EFBDHN COC[C@H]1CCCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000093337375 473089161 /nfs/dbraw/zinc/08/91/61/473089161.db2.gz SGEXOPSGGVGZQR-AWEZNQCLSA-N 0 3 344.415 2.854 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCC(CN3CCOCC3)CC2)c(Cl)c1 ZINC000052325951 473100296 /nfs/dbraw/zinc/10/02/96/473100296.db2.gz BNYKPZABTPALGB-UHFFFAOYSA-N 0 3 339.823 2.797 20 5 EFBDHN CN(CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cccc(O)c1 ZINC000080924855 473102180 /nfs/dbraw/zinc/10/21/80/473102180.db2.gz XELGUHSWEDDJJL-UHFFFAOYSA-N 0 3 329.356 2.761 20 5 EFBDHN C[C@@H](CNC(=O)c1cc(F)ccc1[N+](=O)[O-])N(C)Cc1ccccc1 ZINC000110348699 473153125 /nfs/dbraw/zinc/15/31/25/473153125.db2.gz DOUPDCHHZTYEIR-ZDUSSCGKSA-N 0 3 345.374 2.984 20 5 EFBDHN Cn1cc(C[C@H]2CCN(C/C=C/c3ccccc3[N+](=O)[O-])C2)cn1 ZINC000093869998 473155430 /nfs/dbraw/zinc/15/54/30/473155430.db2.gz FMDRCLSNFNMVES-CSPWOOARSA-N 0 3 326.400 2.906 20 5 EFBDHN COC[C@H](N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000136652220 473170384 /nfs/dbraw/zinc/17/03/84/473170384.db2.gz OYVFUTHLFSJZRU-OTYXRUKQSA-N 0 3 341.795 2.590 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCN(CC2CCCC2)C1 ZINC000081290099 473177716 /nfs/dbraw/zinc/17/77/16/473177716.db2.gz VYOPJFILIRSSJR-CQSZACIVSA-N 0 3 347.415 2.598 20 5 EFBDHN Cc1cc(C(=O)NCCCCN2C[C@H](C)O[C@@H](C)C2)cc([N+](=O)[O-])c1 ZINC000123735961 473179721 /nfs/dbraw/zinc/17/97/21/473179721.db2.gz VLPZJHAMTXQFEF-GJZGRUSLSA-N 0 3 349.431 2.522 20 5 EFBDHN CCCN(CCN(C)C)C(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000123795612 473186689 /nfs/dbraw/zinc/18/66/89/473186689.db2.gz BJDNFOBHNFUZEI-UHFFFAOYSA-N 0 3 325.434 2.731 20 5 EFBDHN CSc1ccc(C(=O)N(C)CC2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000171564479 473411936 /nfs/dbraw/zinc/41/19/36/473411936.db2.gz DWMPLQRZZYCQRW-UHFFFAOYSA-N 0 3 337.445 2.731 20 5 EFBDHN C[C@H](C(=O)NCCc1ccc([N+](=O)[O-])cc1)[C@@H](N)c1ccccc1 ZINC000163575589 473455933 /nfs/dbraw/zinc/45/59/33/473455933.db2.gz PWDBETYBLVUUAA-SUMWQHHRSA-N 0 3 327.384 2.590 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCN(CCO)[C@@H]2CCc3ccccc32)cc1 ZINC000114467045 473470456 /nfs/dbraw/zinc/47/04/56/473470456.db2.gz KGSMXBLTEPQKBI-LJQANCHMSA-N 0 3 342.395 2.955 20 5 EFBDHN CN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000164088429 473478089 /nfs/dbraw/zinc/47/80/89/473478089.db2.gz HZIHBVUPYCMUJN-IAQYHMDHSA-N 0 3 337.807 2.805 20 5 EFBDHN O=C(NC[C@H]1CCCN1Cc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000114643335 473488388 /nfs/dbraw/zinc/48/83/88/473488388.db2.gz MMERMKXFTKIEGN-MRXNPFEDSA-N 0 3 339.395 2.989 20 5 EFBDHN CC(C)N(CCN(C)C)C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000151892341 473505254 /nfs/dbraw/zinc/50/52/54/473505254.db2.gz SISHBJQZUFJKEB-CYBMUJFWSA-N 0 3 339.461 2.874 20 5 EFBDHN C[C@H](NCCn1cc([N+](=O)[O-])cn1)c1ccc(Br)cc1 ZINC000178399668 473505657 /nfs/dbraw/zinc/50/56/57/473505657.db2.gz FCKKOXJVRNBMGG-JTQLQIEISA-N 0 3 339.193 2.905 20 5 EFBDHN CCC[C@H](N[C@H](CC)C(=O)N1CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000165117062 473506635 /nfs/dbraw/zinc/50/66/35/473506635.db2.gz IASOIOUHPFBSTR-SJORKVTESA-N 0 3 349.431 2.663 20 5 EFBDHN CC(C)N(CCN(C)C)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000151980154 473512430 /nfs/dbraw/zinc/51/24/30/473512430.db2.gz LFCWASSFNJDYHE-UHFFFAOYSA-N 0 3 327.812 2.589 20 5 EFBDHN COc1ccc(C(=O)NCCN[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000178647522 473542154 /nfs/dbraw/zinc/54/21/54/473542154.db2.gz SZKKVHDODFTZAV-CYBMUJFWSA-N 0 3 343.383 2.684 20 5 EFBDHN Cn1cc(CNC[C@H](O)CC(C)(C)C)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000172269391 473565501 /nfs/dbraw/zinc/56/55/01/473565501.db2.gz KTHVVKNFAFUMQR-MRXNPFEDSA-N 0 3 346.431 2.882 20 5 EFBDHN CCc1nc2c(s1)[C@@H](N(C)CCn1ccc([N+](=O)[O-])n1)CCC2 ZINC000152494133 473569298 /nfs/dbraw/zinc/56/92/98/473569298.db2.gz BQKAOLVPWJZFKG-LBPRGKRZSA-N 0 3 335.433 2.820 20 5 EFBDHN O=C(CN(CC1CC1)CC1CC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000115563070 473581996 /nfs/dbraw/zinc/58/19/96/473581996.db2.gz URCBSYGUEKFUMW-UHFFFAOYSA-N 0 3 329.400 2.606 20 5 EFBDHN CCN1CCC(n2nccc2NC(=O)c2csc([N+](=O)[O-])c2)CC1 ZINC000170765718 473606759 /nfs/dbraw/zinc/60/67/59/473606759.db2.gz AFYVEQVYECMHIB-UHFFFAOYSA-N 0 3 349.416 2.762 20 5 EFBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCN(CC2CCOCC2)CC1 ZINC000172427020 473607763 /nfs/dbraw/zinc/60/77/63/473607763.db2.gz NVKUTHXJMPFTCD-HNNXBMFYSA-N 0 3 333.432 2.700 20 5 EFBDHN CN1CCC[C@H](CNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000172488997 473623043 /nfs/dbraw/zinc/62/30/43/473623043.db2.gz HVJAMEWYSRRENM-MRXNPFEDSA-N 0 3 348.447 2.559 20 5 EFBDHN CCOc1ccc(C(=O)N[C@@H](C)CN2CCCCCC2)cc1[N+](=O)[O-] ZINC000186298951 473642592 /nfs/dbraw/zinc/64/25/92/473642592.db2.gz AEKUSDYZEFKNTK-AWEZNQCLSA-N 0 3 349.431 2.988 20 5 EFBDHN CC(C)C[C@H]1OCCC[C@H]1NCC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000186305380 473643430 /nfs/dbraw/zinc/64/34/30/473643430.db2.gz RWKLMDAZOCBRIW-IAGOWNOFSA-N 0 3 349.431 2.741 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000153945817 473653309 /nfs/dbraw/zinc/65/33/09/473653309.db2.gz LFTUBCZWMKCTNQ-ZDUSSCGKSA-N 0 3 342.399 2.747 20 5 EFBDHN Cc1ccccc1C1CCN(CCn2cc([N+](=O)[O-])ccc2=O)CC1 ZINC000179212568 473655597 /nfs/dbraw/zinc/65/55/97/473655597.db2.gz WYTCNKPAKJYMIJ-UHFFFAOYSA-N 0 3 341.411 2.945 20 5 EFBDHN Cc1c(OC[C@H](O)CN(C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000154025689 473660398 /nfs/dbraw/zinc/66/03/98/473660398.db2.gz ZSMBVZUORZIZHU-MRXNPFEDSA-N 0 3 330.384 2.775 20 5 EFBDHN CSc1ccc(C(=O)NCCN2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000192472972 473683503 /nfs/dbraw/zinc/68/35/03/473683503.db2.gz DEBGNVAJLCJKEZ-GFCCVEGCSA-N 0 3 337.445 2.778 20 5 EFBDHN COc1cccc(C(=O)N2CCCN(C3CCCC3)CC2)c1[N+](=O)[O-] ZINC000192601582 473695489 /nfs/dbraw/zinc/69/54/89/473695489.db2.gz IFRQOVSJQUQRFY-UHFFFAOYSA-N 0 3 347.415 2.694 20 5 EFBDHN C[C@H]1CCCC[C@H]1N(C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000192629768 473697993 /nfs/dbraw/zinc/69/79/93/473697993.db2.gz JLGBTXJUOUJHEK-XJKSGUPXSA-N 0 3 331.416 2.994 20 5 EFBDHN C[C@H]1CCCC[C@H]1N(C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000192632136 473698023 /nfs/dbraw/zinc/69/80/23/473698023.db2.gz NFFXHKXVLGHQKD-XJKSGUPXSA-N 0 3 331.416 2.994 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)Nc1ccn(CCN(C)C)n1 ZINC000186622016 473703624 /nfs/dbraw/zinc/70/36/24/473703624.db2.gz RUOXQIQNPCQBRX-UHFFFAOYSA-N 0 3 346.391 2.614 20 5 EFBDHN C[C@@H](CN(C)Cc1ccccc1)NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000179710346 473712456 /nfs/dbraw/zinc/71/24/56/473712456.db2.gz FYCRJVOMQXFXPG-HNNXBMFYSA-N 0 3 341.411 2.774 20 5 EFBDHN CN(C)[C@H]1Cc2ccccc2N(C(=O)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000173004046 473724350 /nfs/dbraw/zinc/72/43/50/473724350.db2.gz ZVTGPGAUZHADQI-KRWDZBQOSA-N 0 3 339.395 2.657 20 5 EFBDHN CNC(=O)C1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000179822698 473735388 /nfs/dbraw/zinc/73/53/88/473735388.db2.gz XYZOJICTJADOGC-UHFFFAOYSA-N 0 3 343.383 2.813 20 5 EFBDHN CNC(=O)C1CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000179824360 473735883 /nfs/dbraw/zinc/73/58/83/473735883.db2.gz WENUARRUSPQJHW-UHFFFAOYSA-N 0 3 343.383 2.813 20 5 EFBDHN C[C@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CCOCC1 ZINC000179838529 473739432 /nfs/dbraw/zinc/73/94/32/473739432.db2.gz RAIULMFNXMFZPP-JTQLQIEISA-N 0 3 341.795 2.591 20 5 EFBDHN C[C@@H](NCc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CCOCC1 ZINC000179865775 473745095 /nfs/dbraw/zinc/74/50/95/473745095.db2.gz MJOAWYBURWBOKJ-LLVKDONJSA-N 0 3 332.360 2.550 20 5 EFBDHN COc1ccc(CN[C@H]2CCO[C@@H](C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000287826260 473771434 /nfs/dbraw/zinc/77/14/34/473771434.db2.gz VKZHIVWXNSAPMJ-GXFFZTMASA-N 0 3 334.294 2.803 20 5 EFBDHN CC(C)c1[nH]nc(C(=O)N(CCN(C)C)c2ccccc2)c1[N+](=O)[O-] ZINC000269320001 473772966 /nfs/dbraw/zinc/77/29/66/473772966.db2.gz AZRROSLXIKBXBF-UHFFFAOYSA-N 0 3 345.403 2.650 20 5 EFBDHN NC(=O)C[C@H]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000180063242 473788855 /nfs/dbraw/zinc/78/88/55/473788855.db2.gz IKYCAVAFEXDFNU-CYBMUJFWSA-N 0 3 343.383 2.942 20 5 EFBDHN CC(C)c1[nH]nc(C(=O)Nc2cccc(CN(C)C)c2)c1[N+](=O)[O-] ZINC000269369081 473789632 /nfs/dbraw/zinc/78/96/32/473789632.db2.gz LOBYMIFRMAFPJD-UHFFFAOYSA-N 0 3 331.376 2.755 20 5 EFBDHN O=C(N[C@H]1CCN(CC2CCCC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000173279222 473792438 /nfs/dbraw/zinc/79/24/38/473792438.db2.gz HSFOEPZDDLPFLB-ZDUSSCGKSA-N 0 3 335.379 2.728 20 5 EFBDHN CC(C)N1CCC[C@@H](NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000274415418 473813447 /nfs/dbraw/zinc/81/34/47/473813447.db2.gz CPDDRJIKCAWFIF-GFCCVEGCSA-N 0 3 325.796 2.851 20 5 EFBDHN C[C@H](NCCC(=O)NCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000173366965 473817675 /nfs/dbraw/zinc/81/76/75/473817675.db2.gz IAOKQLCQLLNXIO-AWEZNQCLSA-N 0 3 327.384 2.952 20 5 EFBDHN C[C@@H]1CN(CC2CCN(Cc3ccccc3[N+](=O)[O-])CC2)C[C@@H](C)O1 ZINC000263739047 473829179 /nfs/dbraw/zinc/82/91/79/473829179.db2.gz NEAHHEQMGTVEJE-HZPDHXFCSA-N 0 3 347.459 2.916 20 5 EFBDHN CCNC(=O)[C@H](C)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000263789228 473849590 /nfs/dbraw/zinc/84/95/90/473849590.db2.gz HIAWYNYATYYURB-NSHDSACASA-N 0 3 333.413 2.938 20 5 EFBDHN COc1ccc(CNC(=O)[C@H]2CCCN2C2CCCC2)cc1[N+](=O)[O-] ZINC000269684512 473859563 /nfs/dbraw/zinc/85/95/63/473859563.db2.gz NKESBRMIDWUFBO-OAHLLOKOSA-N 0 3 347.415 2.627 20 5 EFBDHN C[C@@H](NCc1ccc([N+](=O)[O-])cc1Cl)C1CCS(=O)(=O)CC1 ZINC000187560865 473884094 /nfs/dbraw/zinc/88/40/94/473884094.db2.gz FBOWZVPEYBUTOW-SNVBAGLBSA-N 0 3 346.836 2.551 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H]2CC[C@@H](C1)N2C ZINC000281950927 473896324 /nfs/dbraw/zinc/89/63/24/473896324.db2.gz MEOUYDCOACCBRD-OCCSQVGLSA-N 0 3 348.403 2.694 20 5 EFBDHN O=[N+]([O-])c1cccc(CNCCCn2cc(Br)cn2)c1 ZINC000288336971 473913578 /nfs/dbraw/zinc/91/35/78/473913578.db2.gz BBYVDZOXWAVXPB-UHFFFAOYSA-N 0 3 339.193 2.734 20 5 EFBDHN CCN(CCn1cc([N+](=O)[O-])ccc1=O)[C@@H](C)Cc1ccsc1 ZINC000187790512 473922375 /nfs/dbraw/zinc/92/23/75/473922375.db2.gz RHOPQXZDESCLAG-ZDUSSCGKSA-N 0 3 335.429 2.771 20 5 EFBDHN C[C@H]1CN(CCCCNc2ccc([N+](=O)[O-])c(N)c2F)C[C@H](C)O1 ZINC000274700011 473925288 /nfs/dbraw/zinc/92/52/88/473925288.db2.gz UDPKCKGTIJBKNI-RYUDHWBXSA-N 0 3 340.399 2.617 20 5 EFBDHN CC[C@@H](O)[C@H]1CCCCN1CCOc1ccc(OC)cc1[N+](=O)[O-] ZINC000173778723 473929756 /nfs/dbraw/zinc/92/97/56/473929756.db2.gz YQLLWGQLCFSILZ-GDBMZVCRSA-N 0 3 338.404 2.608 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@@H]1CCCC12CCOCC2 ZINC000282056608 473931869 /nfs/dbraw/zinc/93/18/69/473931869.db2.gz MIKQQWMGNFNEOR-MRXNPFEDSA-N 0 3 347.415 2.781 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@H]1CCCC12CCOCC2 ZINC000282056604 473932086 /nfs/dbraw/zinc/93/20/86/473932086.db2.gz MIKQQWMGNFNEOR-INIZCTEOSA-N 0 3 347.415 2.781 20 5 EFBDHN C[C@H](N[C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])c1nncn1C ZINC000269989491 473944662 /nfs/dbraw/zinc/94/46/62/473944662.db2.gz GDVHZQUGNGZROX-YDHLFZDLSA-N 0 3 329.404 2.785 20 5 EFBDHN C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000288462660 473949833 /nfs/dbraw/zinc/94/98/33/473949833.db2.gz QBLFDIUCUUYEIF-YPMHNXCESA-N 0 3 337.807 2.947 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1C(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1 ZINC000194814524 473957871 /nfs/dbraw/zinc/95/78/71/473957871.db2.gz UUYDGJPJLUWPOY-GASCZTMLSA-N 0 3 349.431 2.522 20 5 EFBDHN C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000288582854 473989486 /nfs/dbraw/zinc/98/94/86/473989486.db2.gz XNUFRDUVDSQIQN-NEPJUHHUSA-N 0 3 337.807 2.947 20 5 EFBDHN CSc1cccc(C(=O)N[C@@H]2C[C@H](C)N(C3CC3)C2)c1[N+](=O)[O-] ZINC000188188695 474013236 /nfs/dbraw/zinc/01/32/36/474013236.db2.gz ZUXPHDFABWYRLI-WDEREUQCSA-N 0 3 335.429 2.672 20 5 EFBDHN Cc1ccc(NC(=O)N2CC[C@H](N3CCCCC3)C2)cc1[N+](=O)[O-] ZINC000264512122 474018196 /nfs/dbraw/zinc/01/81/96/474018196.db2.gz TVCXMWKKEYYZMP-HNNXBMFYSA-N 0 3 332.404 2.995 20 5 EFBDHN CCOc1ccc([C@H](C)NCCn2ccc([N+](=O)[O-])n2)cc1OCC ZINC000181385259 474031452 /nfs/dbraw/zinc/03/14/52/474031452.db2.gz FCJTYIUSJVUEMV-ZDUSSCGKSA-N 0 3 348.403 2.940 20 5 EFBDHN C[C@H]1NC(=O)CC[C@H]1NCc1cc(=O)oc2ccc3ccccc3c12 ZINC000282416949 474057009 /nfs/dbraw/zinc/05/70/09/474057009.db2.gz QMVNFNASCDUXIH-MLGOLLRUSA-N 0 3 336.391 2.703 20 5 EFBDHN COCCN1CC[C@H](NCc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000264640665 474069882 /nfs/dbraw/zinc/06/98/82/474069882.db2.gz VNYYMLROJMBZGL-AWEZNQCLSA-N 0 3 345.399 2.665 20 5 EFBDHN COc1cccc(C(=O)N[C@H](C)CN2C[C@H](C)C[C@@H](C)C2)c1[N+](=O)[O-] ZINC000195450773 474077020 /nfs/dbraw/zinc/07/70/20/474077020.db2.gz WPDOHACISVXPSF-MGPQQGTHSA-N 0 3 349.431 2.700 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@@H](C(=O)NCC(F)(F)F)C1 ZINC000275141879 474082501 /nfs/dbraw/zinc/08/25/01/474082501.db2.gz VLXKHNFUHITFRM-GHMZBOCLSA-N 0 3 345.321 2.656 20 5 EFBDHN C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000247265320 474103392 /nfs/dbraw/zinc/10/33/92/474103392.db2.gz FGEHPMZTDFKWJW-RHSMWYFYSA-N 0 3 348.447 2.586 20 5 EFBDHN C[C@H](c1cccc(O)c1)N(C)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182165033 474113306 /nfs/dbraw/zinc/11/33/06/474113306.db2.gz HQMRLWPMASTTGT-CJNGLKHVSA-N 0 3 346.383 2.733 20 5 EFBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCN(C)C1CC1 ZINC000264779446 474125330 /nfs/dbraw/zinc/12/53/30/474125330.db2.gz BKYKPIOYSHKODR-UHFFFAOYSA-N 0 3 334.420 2.609 20 5 EFBDHN CN(C)Cc1ccc(CNC(=O)Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000175019197 474130915 /nfs/dbraw/zinc/13/09/15/474130915.db2.gz WLHMTILFSHFKCM-UHFFFAOYSA-N 0 3 327.384 2.515 20 5 EFBDHN CO[C@H]1CCCC[C@H]1NCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000275299836 474135884 /nfs/dbraw/zinc/13/58/84/474135884.db2.gz ZIBQVCUJCQBPHX-OCCSQVGLSA-N 0 3 341.795 2.734 20 5 EFBDHN COC(=O)C1(CNCc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000188670853 474162199 /nfs/dbraw/zinc/16/21/99/474162199.db2.gz BZMNFOBMGPNGNY-UHFFFAOYSA-N 0 3 330.340 2.898 20 5 EFBDHN CCCCN(C)C[C@H](C)Nc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000289144974 474162818 /nfs/dbraw/zinc/16/28/18/474162818.db2.gz SMACCSCDJHMDJE-NSHDSACASA-N 0 3 333.392 2.776 20 5 EFBDHN C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000247501834 474166550 /nfs/dbraw/zinc/16/65/50/474166550.db2.gz UZQMPAZZJYTFGO-QMTHXVAHSA-N 0 3 325.796 2.660 20 5 EFBDHN C[C@H]1CN(C)CC[C@H]1N(C)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000247520669 474171496 /nfs/dbraw/zinc/17/14/96/474171496.db2.gz WKSJSZZNUJTDPV-BLLLJJGKSA-N 0 3 346.431 2.581 20 5 EFBDHN COc1cc(C[NH2+][C@@H]2CCO[C@H](C(C)(C)C)C2)c([N+](=O)[O-])cc1[O-] ZINC000270601117 474185839 /nfs/dbraw/zinc/18/58/39/474185839.db2.gz ARVNIZFQUSCLNG-WBMJQRKESA-N 0 3 338.404 2.992 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2noc([C@@H]3CCCN3C3CCOCC3)n2)c1 ZINC000275442443 474186496 /nfs/dbraw/zinc/18/64/96/474186496.db2.gz KMPSVKDJOMOJKH-HNNXBMFYSA-N 0 3 344.371 2.961 20 5 EFBDHN CN(Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)CC1(O)CCOCC1 ZINC000188841064 474213492 /nfs/dbraw/zinc/21/34/92/474213492.db2.gz HLPGDYYGECEGGU-UHFFFAOYSA-N 0 3 346.383 2.828 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CCCCN2C2CC2)c1 ZINC000282852176 474219175 /nfs/dbraw/zinc/21/91/75/474219175.db2.gz SHCLTTQQUCXHEK-CQSZACIVSA-N 0 3 347.415 2.740 20 5 EFBDHN CC1(C)CN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC[C@H]1O ZINC000275533196 474224340 /nfs/dbraw/zinc/22/43/40/474224340.db2.gz XKAVHPBRUTZRJC-MRXNPFEDSA-N 0 3 345.399 2.885 20 5 EFBDHN C[C@@H](NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000182695462 474235770 /nfs/dbraw/zinc/23/57/70/474235770.db2.gz PHSCTFFULSVICE-CYBMUJFWSA-N 0 3 340.445 2.927 20 5 EFBDHN O=C(Nc1ccccc1)N1CC[C@H](NCc2ccc([N+](=O)[O-])cc2)C1 ZINC000282936426 474247262 /nfs/dbraw/zinc/24/72/62/474247262.db2.gz IJSZIKFHMWMVEF-INIZCTEOSA-N 0 3 340.383 2.991 20 5 EFBDHN CCN1CCN([C@H]2CCN([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)CC1 ZINC000182766930 474251833 /nfs/dbraw/zinc/25/18/33/474251833.db2.gz WPUMLRQKTOHLLY-WMZOPIPTSA-N 0 3 346.475 2.676 20 5 EFBDHN COc1ccc(CN[C@H](CO)Cc2cccc(C)c2)cc1[N+](=O)[O-] ZINC000189027290 474269397 /nfs/dbraw/zinc/26/93/97/474269397.db2.gz JAGPCUDHCPTQKM-INIZCTEOSA-N 0 3 330.384 2.605 20 5 EFBDHN CCN(CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)Cc1ccncc1 ZINC000275684023 474279562 /nfs/dbraw/zinc/27/95/62/474279562.db2.gz ZNHCQTFBVYHDGU-UHFFFAOYSA-N 0 3 346.362 2.980 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN[C@H](CO)c1ccccc1 ZINC000182924197 474288447 /nfs/dbraw/zinc/28/84/47/474288447.db2.gz BNWFSRMOWOCFEY-QGZVFWFLSA-N 0 3 343.383 2.555 20 5 EFBDHN CN1CC[C@H]2CCN(C(=O)Nc3cccc([N+](=O)[O-])c3Cl)[C@@H]2C1 ZINC000289540485 474314506 /nfs/dbraw/zinc/31/45/06/474314506.db2.gz DNMNQBJUJXDWKQ-GXFFZTMASA-N 0 3 338.795 2.806 20 5 EFBDHN O=C1C[C@H]2CC[C@@H](C1)N2CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000289577390 474330964 /nfs/dbraw/zinc/33/09/64/474330964.db2.gz QYRBRPPKTSXUOV-OKILXGFUSA-N 0 3 341.367 2.988 20 5 EFBDHN C[C@H](C(=O)N(C)[C@@H]1CCN(C)C[C@H]1C)c1ccc([N+](=O)[O-])cc1F ZINC000248545018 474352252 /nfs/dbraw/zinc/35/22/52/474352252.db2.gz DGUUDFIJOFYVJY-BFQNTYOBSA-N 0 3 337.395 2.636 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000248566411 474360189 /nfs/dbraw/zinc/36/01/89/474360189.db2.gz KWWZNUAORRQJNR-TZMCWYRMSA-N 0 3 337.395 2.828 20 5 EFBDHN CC1(C)CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H]1[C@@H]1CCCO1 ZINC000289667846 474369143 /nfs/dbraw/zinc/36/91/43/474369143.db2.gz GZQNOKSSPFAYOK-RDJZCZTQSA-N 0 3 347.415 2.813 20 5 EFBDHN Cn1cc(CN2CC[C@@H](O)C(C)(C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000275976271 474377302 /nfs/dbraw/zinc/37/73/02/474377302.db2.gz MBOQVVFASXOTEL-MRXNPFEDSA-N 0 3 344.415 2.588 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CN(CCO)C3CCOCC3)o2)cc1 ZINC000276005362 474384714 /nfs/dbraw/zinc/38/47/14/474384714.db2.gz PDOZQYHYBIOYEB-UHFFFAOYSA-N 0 3 346.383 2.828 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](CC(C)C)CN(C)C)c1 ZINC000283421846 474399000 /nfs/dbraw/zinc/39/90/00/474399000.db2.gz XRBIQLKOMNMMPJ-ZDUSSCGKSA-N 0 3 337.420 2.700 20 5 EFBDHN CN(CCn1ccc([N+](=O)[O-])n1)Cc1ccccc1N1CCCC1 ZINC000176198319 474407069 /nfs/dbraw/zinc/40/70/69/474407069.db2.gz GPALGAJKMRMUTG-UHFFFAOYSA-N 0 3 329.404 2.524 20 5 EFBDHN CCN(CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H]1CCOC(C)(C)C1 ZINC000289759862 474413529 /nfs/dbraw/zinc/41/35/29/474413529.db2.gz KOUFFTBOPJRWQX-CYBMUJFWSA-N 0 3 335.404 2.813 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CCC(c3c[nH]c4ncccc34)CC2)n1 ZINC000176246185 474419409 /nfs/dbraw/zinc/41/94/09/474419409.db2.gz OSVYXPAMTUAPEL-UHFFFAOYSA-N 0 3 340.387 2.547 20 5 EFBDHN COC(=O)[C@H]1CC12CCN(C/C=C/c1ccccc1[N+](=O)[O-])CC2 ZINC000271179862 474426300 /nfs/dbraw/zinc/42/63/00/474426300.db2.gz KRTPQYKWOCBYRA-CSPWOOARSA-N 0 3 330.384 2.883 20 5 EFBDHN C[C@@H]1CN[C@@H](C)CN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000237588944 474435389 /nfs/dbraw/zinc/43/53/89/474435389.db2.gz MFVMIMPBBNCUNG-WDEREUQCSA-N 0 3 346.412 2.541 20 5 EFBDHN C[C@H](CCc1ccccc1[N+](=O)[O-])NCc1nnc2n1CCCC2 ZINC000183871241 474439641 /nfs/dbraw/zinc/43/96/41/474439641.db2.gz KRPOJGZMOHXMES-CYBMUJFWSA-N 0 3 329.404 2.634 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@@H](N2CCOCC2)[C@H]1C ZINC000289824526 474442169 /nfs/dbraw/zinc/44/21/69/474442169.db2.gz OHFVKDHSXBHEMY-HDMKZQKVSA-N 0 3 333.432 2.759 20 5 EFBDHN C[C@@H](C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)[C@H](N)c1ccccc1 ZINC000237699016 474460596 /nfs/dbraw/zinc/46/05/96/474460596.db2.gz YMIJBUNWKKVDEP-ACJLOTCBSA-N 0 3 339.395 2.816 20 5 EFBDHN CS[C@H]1CN(c2ccc([N+](=O)[O-])c3cccnc32)C[C@H]1N(C)C ZINC000271290399 474477664 /nfs/dbraw/zinc/47/76/64/474477664.db2.gz DYASYXPOHBEWFO-CABCVRRESA-N 0 3 332.429 2.625 20 5 EFBDHN CS[C@H]1CN(c2ccc([N+](=O)[O-])c3cccnc32)C[C@@H]1N(C)C ZINC000271290400 474477969 /nfs/dbraw/zinc/47/79/69/474477969.db2.gz DYASYXPOHBEWFO-GJZGRUSLSA-N 0 3 332.429 2.625 20 5 EFBDHN Cc1cccc(OC[C@@H](O)CN[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000266779064 474479632 /nfs/dbraw/zinc/47/96/32/474479632.db2.gz CEZUNCKNFIRGHJ-PBHICJAKSA-N 0 3 330.384 2.994 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN[C@@H]3CCO[C@@H](C(F)(F)F)C3)nc2c1 ZINC000289908800 474481163 /nfs/dbraw/zinc/48/11/63/474481163.db2.gz XUUOEEYLUXFZKE-PRHODGIISA-N 0 3 344.293 2.671 20 5 EFBDHN C[C@@H]1CN(CC2CCN(c3ccc(N)cc3[N+](=O)[O-])CC2)C[C@H](C)O1 ZINC000283738238 474482491 /nfs/dbraw/zinc/48/24/91/474482491.db2.gz ITBZGCJDUCWARJ-OKILXGFUSA-N 0 3 348.447 2.503 20 5 EFBDHN C[C@@H](C(=O)N1CC[C@H]2CC[C@@H](C1)N2C)c1ccc([N+](=O)[O-])cc1F ZINC000184354299 474504877 /nfs/dbraw/zinc/50/48/77/474504877.db2.gz MQLRSFMNPQHNBG-BZPMIXESSA-N 0 3 335.379 2.533 20 5 EFBDHN O=[N+]([O-])c1cc(CNCC2(N3CCOCC3)CCCCC2)cs1 ZINC000237972481 474514500 /nfs/dbraw/zinc/51/45/00/474514500.db2.gz FQTYAKGPYYUIJE-UHFFFAOYSA-N 0 3 339.461 2.781 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCCN(C(C)C)CC2)c1 ZINC000283886212 474519705 /nfs/dbraw/zinc/51/97/05/474519705.db2.gz IPEKFBQNYCMQEL-UHFFFAOYSA-N 0 3 335.404 2.550 20 5 EFBDHN CN(CCn1cc([N+](=O)[O-])cn1)Cc1cccc(Br)c1 ZINC000266900325 474522836 /nfs/dbraw/zinc/52/28/36/474522836.db2.gz HYLCMAPAVDYIQW-UHFFFAOYSA-N 0 3 339.193 2.686 20 5 EFBDHN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000276401308 474528646 /nfs/dbraw/zinc/52/86/46/474528646.db2.gz KQERZQKJDAVUEY-ZDUSSCGKSA-N 0 3 332.404 2.984 20 5 EFBDHN COc1cc(C(=O)N[C@H](C)CN2CCC[C@H](C)C2)cc([N+](=O)[O-])c1C ZINC000189992119 474529377 /nfs/dbraw/zinc/52/93/77/474529377.db2.gz AQKIQGVULGVBQQ-QWHCGFSZSA-N 0 3 349.431 2.762 20 5 EFBDHN N[C@@H](Cc1ccccc1)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000238083059 474532806 /nfs/dbraw/zinc/53/28/06/474532806.db2.gz KHSWIEPHSCJFKA-SFHVURJKSA-N 0 3 341.411 2.604 20 5 EFBDHN C[C@H](N[C@H](CO)C[C@@H](O)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000271447667 474551516 /nfs/dbraw/zinc/55/15/16/474551516.db2.gz DAKHQXSWECLWGM-QANKJYHBSA-N 0 3 330.384 2.730 20 5 EFBDHN C[C@H](N[C@H](CO)C[C@H](O)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000271447666 474552075 /nfs/dbraw/zinc/55/20/75/474552075.db2.gz DAKHQXSWECLWGM-OWQGQXMQSA-N 0 3 330.384 2.730 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN1CCC2(C[C@@H]2C(=O)OC)CC1 ZINC000267001215 474561692 /nfs/dbraw/zinc/56/16/92/474561692.db2.gz CZTOHZVYNTYKPC-OAHLLOKOSA-N 0 3 348.399 2.769 20 5 EFBDHN C[C@](O)(CN[C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)C(F)(F)F ZINC000271474832 474564180 /nfs/dbraw/zinc/56/41/80/474564180.db2.gz ITPPIWNPEWXCRG-OCCSQVGLSA-N 0 3 332.322 2.819 20 5 EFBDHN COc1cccc([C@H](O)CN[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000284100768 474572462 /nfs/dbraw/zinc/57/24/62/474572462.db2.gz MUKYKKWYLOZJFY-PIGZYNQJSA-N 0 3 331.372 2.570 20 5 EFBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CN[C@@H]2C[C@H]3OCCC[C@@H]23)c1 ZINC000249452201 474574579 /nfs/dbraw/zinc/57/45/79/474574579.db2.gz CPKZRERIYMXTLU-OUCADQQQSA-N 0 3 328.315 2.853 20 5 EFBDHN CN(CCn1ccc([N+](=O)[O-])n1)Cc1cccc(Br)c1 ZINC000267097162 474589287 /nfs/dbraw/zinc/58/92/87/474589287.db2.gz RZDRFLCWPJBKAZ-UHFFFAOYSA-N 0 3 339.193 2.686 20 5 EFBDHN COc1cc(C[NH2+]CC2([C@@H](C)CCO)CCC2)c([N+](=O)[O-])cc1[O-] ZINC000271795464 474591498 /nfs/dbraw/zinc/59/14/98/474591498.db2.gz HSXLDVVSFCWGKY-LBPRGKRZSA-N 0 3 338.404 2.587 20 5 EFBDHN Cc1cccc(C(=O)N[C@H](C)CN2C[C@H](C)C[C@@H](C)C2)c1[N+](=O)[O-] ZINC000249732130 474607974 /nfs/dbraw/zinc/60/79/74/474607974.db2.gz AZBUBJQNVDVZBR-UMVBOHGHSA-N 0 3 333.432 2.999 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1C[C@H](C)N(C2CC2)C1 ZINC000184846198 474618699 /nfs/dbraw/zinc/61/86/99/474618699.db2.gz BSTKBIWUBHPLFN-IMJJTQAJSA-N 0 3 345.443 2.905 20 5 EFBDHN O=C1OCCN1c1cc([N+](=O)[O-])ccc1NCCN1CCCCCC1 ZINC000267239803 474626572 /nfs/dbraw/zinc/62/65/72/474626572.db2.gz ROHVZCOYGXIJOX-UHFFFAOYSA-N 0 3 348.403 2.839 20 5 EFBDHN Cc1cc([N+](=O)[O-])cc(C(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)c1F ZINC000284365375 474628050 /nfs/dbraw/zinc/62/80/50/474628050.db2.gz ZMAVYCBHSGJRSE-WFASDCNBSA-N 0 3 335.379 2.599 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CN2CC[C@H](c3ccccc3)C2)c1 ZINC000250201506 474631053 /nfs/dbraw/zinc/63/10/53/474631053.db2.gz CVUHSFRLZYGVBV-FUHWJXTLSA-N 0 3 342.395 2.824 20 5 EFBDHN CSc1ccc(C(=O)N[C@H](C)C2=CCN(C)CC2)cc1[N+](=O)[O-] ZINC000272961625 474651087 /nfs/dbraw/zinc/65/10/87/474651087.db2.gz NMHNXXNDMFXEPZ-LLVKDONJSA-N 0 3 335.429 2.697 20 5 EFBDHN C[C@@H]1CN(CCC2CCN(c3ccc([N+](=O)[O-])cn3)CC2)C[C@H](C)O1 ZINC000267366337 474659219 /nfs/dbraw/zinc/65/92/19/474659219.db2.gz JBGQYQSMTRRHLC-GASCZTMLSA-N 0 3 348.447 2.706 20 5 EFBDHN C[C@@H]1[C@H](NC(=O)c2ccccc2[N+](=O)[O-])CCN1Cc1ccccc1 ZINC000291730270 474659492 /nfs/dbraw/zinc/65/94/92/474659492.db2.gz IGKCRKROUQGZRZ-RHSMWYFYSA-N 0 3 339.395 2.988 20 5 EFBDHN CS[C@H]1CN(c2cc(C)nc3ccc([N+](=O)[O-])cc32)C[C@H]1N(C)C ZINC000340783293 474664013 /nfs/dbraw/zinc/66/40/13/474664013.db2.gz QWCMRAFGXJEUFG-SJORKVTESA-N 0 3 346.456 2.933 20 5 EFBDHN Cn1nccc1N1CCC[C@@H](NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000278500611 474664441 /nfs/dbraw/zinc/66/44/41/474664441.db2.gz NVACXCAZWVHJAL-CYBMUJFWSA-N 0 3 349.822 2.740 20 5 EFBDHN Cc1cc(NCCN(C)CC(F)(F)F)c2cc([N+](=O)[O-])ccc2n1 ZINC000340810732 474683059 /nfs/dbraw/zinc/68/30/59/474683059.db2.gz ZPRZYIVXBRNSBC-UHFFFAOYSA-N 0 3 342.321 2.779 20 5 EFBDHN COc1cc(CNC[C@@]2(O)CCCC2(C)C)c([N+](=O)[O-])cc1OC ZINC000292986411 474751509 /nfs/dbraw/zinc/75/15/09/474751509.db2.gz NPCWABQMJWKAGZ-KRWDZBQOSA-N 0 3 338.404 2.643 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@H](CO)CN2CCCCC2)cc1C(F)(F)F ZINC000253431879 474756023 /nfs/dbraw/zinc/75/60/23/474756023.db2.gz YASIPMVOASGDCI-LBPRGKRZSA-N 0 3 347.337 2.872 20 5 EFBDHN CCc1oc(CNCCc2ccccc2[N+](=O)[O-])cc1C(=O)OC ZINC000338941224 474756705 /nfs/dbraw/zinc/75/67/05/474756705.db2.gz DBGUWFRBLXKUCU-UHFFFAOYSA-N 0 3 332.356 2.869 20 5 EFBDHN CON(C)C(=O)C1CCN([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000291979766 474785344 /nfs/dbraw/zinc/78/53/44/474785344.db2.gz WFLHMVORMKSMMV-CYBMUJFWSA-N 0 3 335.404 2.696 20 5 EFBDHN CCOC(=O)c1cc(N(C)C[C@H]2CCCN(C)C2)ccc1[N+](=O)[O-] ZINC000268131219 474816378 /nfs/dbraw/zinc/81/63/78/474816378.db2.gz AKOIBSUKBUKKLG-ZDUSSCGKSA-N 0 3 335.404 2.550 20 5 EFBDHN O=[N+]([O-])c1ccc(NCc2ccccc2CN2CC[C@H](O)C2)cc1 ZINC000273286096 474823876 /nfs/dbraw/zinc/82/38/76/474823876.db2.gz YSXMSHONTACBJW-SFHVURJKSA-N 0 3 327.384 2.774 20 5 EFBDHN CSc1ccc(C(=O)N[C@@H]2CN(C3CC3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000268149370 474826582 /nfs/dbraw/zinc/82/65/82/474826582.db2.gz FYGSWRZATSTREU-ZWNOBZJWSA-N 0 3 335.429 2.529 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@@H](COC)[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000278787058 474835658 /nfs/dbraw/zinc/83/56/58/474835658.db2.gz LZHFRVZJRFDBDC-NOLJZWGESA-N 0 3 338.404 2.838 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)N2CC[C@@]3(CCN(C)C3)C2)cc1[N+](=O)[O-] ZINC000293153092 474841047 /nfs/dbraw/zinc/84/10/47/474841047.db2.gz BYKYGPCIKGKSDR-RDTXWAMCSA-N 0 3 346.431 2.701 20 5 EFBDHN O=C(NCC1CC1)[C@H]1CCCN(C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000255567193 474874354 /nfs/dbraw/zinc/87/43/54/474874354.db2.gz ZDGFIQNLHCYETF-SVEBXFOSSA-N 0 3 343.427 2.846 20 5 EFBDHN C[C@H]1CN(C2CCOCC2)CCN1c1ccc(Cl)cc1[N+](=O)[O-] ZINC000278874568 474886114 /nfs/dbraw/zinc/88/61/14/474886114.db2.gz ZRWNVYPEJXVZGF-LBPRGKRZSA-N 0 3 339.823 2.938 20 5 EFBDHN CN(C)CCOc1cnccc1CNc1ccc([N+](=O)[O-])cc1F ZINC000341036096 474902091 /nfs/dbraw/zinc/90/20/91/474902091.db2.gz CGNYVUBFOITOMJ-UHFFFAOYSA-N 0 3 334.351 2.681 20 5 EFBDHN C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H]2CCN(C)C[C@@H]21 ZINC000273457673 474906647 /nfs/dbraw/zinc/90/66/47/474906647.db2.gz DXRAJGZKRUOVSK-SADTYBKJSA-N 0 3 329.400 2.551 20 5 EFBDHN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@H](N2CCCC2)C1 ZINC000320571826 474913976 /nfs/dbraw/zinc/91/39/76/474913976.db2.gz MIHVOFLTXJJKTP-ZDUSSCGKSA-N 0 3 337.807 2.949 20 5 EFBDHN C[C@@H](CN1CCC[C@H](C)C1)NC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000341056044 474922828 /nfs/dbraw/zinc/92/28/28/474922828.db2.gz MFWIZNCMWDLYBK-GJZGRUSLSA-N 0 3 348.447 2.557 20 5 EFBDHN CN(C)CCN(Cc1cccc(Cl)c1)c1c([N+](=O)[O-])ncn1C ZINC000268345363 474932735 /nfs/dbraw/zinc/93/27/35/474932735.db2.gz SXOQBHFYLWOHIW-UHFFFAOYSA-N 0 3 337.811 2.550 20 5 EFBDHN CNC(=O)[C@@H]1CCC[C@H]1NCc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339125410 474952127 /nfs/dbraw/zinc/95/21/27/474952127.db2.gz VJWGUTJUSSMBKK-DGCLKSJQSA-N 0 3 345.321 2.618 20 5 EFBDHN CC(C)[C@H](NCCn1cc([N+](=O)[O-])ccc1=O)c1ccc(F)cc1 ZINC000337380649 474958122 /nfs/dbraw/zinc/95/81/22/474958122.db2.gz CWEKHVLSOUWFAX-KRWDZBQOSA-N 0 3 333.363 2.883 20 5 EFBDHN CS[C@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2C)C[C@@H]1N1CCCC1 ZINC000273549656 474958651 /nfs/dbraw/zinc/95/86/51/474958651.db2.gz VFVDPABRXALRPE-HOTGVXAUSA-N 0 3 349.456 2.555 20 5 EFBDHN CN1C[C@@H]2CN(C(=O)c3ccc4[nH]c5ccccc5c(=O)c4c3)C[C@@H]2C1 ZINC000279233292 474966473 /nfs/dbraw/zinc/96/64/73/474966473.db2.gz ROPQYMHAODUUPN-GASCZTMLSA-N 0 3 347.418 2.727 20 5 EFBDHN COC1CCN(C2(CNc3ncccc3[N+](=O)[O-])CCCC2)CC1 ZINC000341094571 474968323 /nfs/dbraw/zinc/96/83/23/474968323.db2.gz GBVSYURSYLHSTK-UHFFFAOYSA-N 0 3 334.420 2.825 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN1CCC[C@@H](c2n[nH]c(C)n2)C1 ZINC000268423781 474970212 /nfs/dbraw/zinc/97/02/12/474970212.db2.gz DDVWLPWIMUVLAJ-CYBMUJFWSA-N 0 3 345.403 2.800 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN1CCC[C@@H](c2nc(C)n[nH]2)C1 ZINC000268423781 474970216 /nfs/dbraw/zinc/97/02/16/474970216.db2.gz DDVWLPWIMUVLAJ-CYBMUJFWSA-N 0 3 345.403 2.800 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN1CCC[C@@H](c2nnc(C)[nH]2)C1 ZINC000268423781 474970224 /nfs/dbraw/zinc/97/02/24/474970224.db2.gz DDVWLPWIMUVLAJ-CYBMUJFWSA-N 0 3 345.403 2.800 20 5 EFBDHN Cc1cc(C(=O)NC[C@@H]2NCCc3ccccc32)ccc1[N+](=O)[O-] ZINC000261613024 474996452 /nfs/dbraw/zinc/99/64/52/474996452.db2.gz DZNIDCCAFVERLD-INIZCTEOSA-N 0 3 325.368 2.520 20 5 EFBDHN CN(CCOCC(F)(F)C(F)F)CCc1ccccc1[N+](=O)[O-] ZINC000285393846 475002872 /nfs/dbraw/zinc/00/28/72/475002872.db2.gz SPQXDPPYDSFUPR-UHFFFAOYSA-N 0 3 338.301 2.986 20 5 EFBDHN COc1ccc(COc2ccc3c(c2)OCCNC3)cc1[N+](=O)[O-] ZINC000326501944 475006929 /nfs/dbraw/zinc/00/69/29/475006929.db2.gz IIRKYCPGJGODLL-UHFFFAOYSA-N 0 3 330.340 2.664 20 5 EFBDHN C[C@@H]1CN(c2nc3sccn3c2[N+](=O)[O-])CCN(C2CCC2)C1 ZINC000292427575 475019435 /nfs/dbraw/zinc/01/94/35/475019435.db2.gz WYNUBMSBHODWIH-NSHDSACASA-N 0 3 335.433 2.615 20 5 EFBDHN CN(CCc1ccccc1[N+](=O)[O-])C[C@H](O)COc1ccc(F)cc1 ZINC000285436836 475024438 /nfs/dbraw/zinc/02/44/38/475024438.db2.gz XFOSISFQTVCPBD-INIZCTEOSA-N 0 3 348.374 2.648 20 5 EFBDHN Cc1cc(C(=O)NC[C@H]2NCCc3ccccc32)cc([N+](=O)[O-])c1 ZINC000261684210 475024634 /nfs/dbraw/zinc/02/46/34/475024634.db2.gz MZKLKJKUBLHBQT-QGZVFWFLSA-N 0 3 325.368 2.520 20 5 EFBDHN Cc1c(CN[C@@H](C)c2cccc(-n3cnnn3)c2)cccc1[N+](=O)[O-] ZINC000327885313 475025062 /nfs/dbraw/zinc/02/50/62/475025062.db2.gz UJJVRHJRPNWONA-ZDUSSCGKSA-N 0 3 338.371 2.730 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)N2CCCN(CC3CCC3)CC2)c1 ZINC000339205371 475037950 /nfs/dbraw/zinc/03/79/50/475037950.db2.gz KTIIDGNLDKHTNR-UHFFFAOYSA-N 0 3 347.415 2.551 20 5 EFBDHN C[C@@H]1C[C@H](c2ccccc2)N(CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000285749794 475038742 /nfs/dbraw/zinc/03/87/42/475038742.db2.gz QUWBBHUFLQGEBJ-RHSMWYFYSA-N 0 3 327.384 2.840 20 5 EFBDHN O=[N+]([O-])c1cc2c(ncnc2NC[C@@H]2NCCc3ccccc32)s1 ZINC000261728830 475042234 /nfs/dbraw/zinc/04/22/34/475042234.db2.gz RLJYGTVBRFUCOM-ZDUSSCGKSA-N 0 3 341.396 2.898 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CN1CCNC[C@@H]1c1cccc(F)c1 ZINC000261761822 475053361 /nfs/dbraw/zinc/05/33/61/475053361.db2.gz OAJFMVLVBZQGCW-QGZVFWFLSA-N 0 3 345.374 2.889 20 5 EFBDHN O=[N+]([O-])c1ccc(CNC2CCN(c3nccs3)CC2)c(F)c1 ZINC000341514359 475103834 /nfs/dbraw/zinc/10/38/34/475103834.db2.gz RSTJCTHXJXKADG-UHFFFAOYSA-N 0 3 336.392 2.949 20 5 EFBDHN C[C@H]1CN(C2CC2)C[C@H]1NC(=O)NC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000292625664 475122570 /nfs/dbraw/zinc/12/25/70/475122570.db2.gz OUUQBJLGPZLJMH-SWLSCSKDSA-N 0 3 346.431 2.612 20 5 EFBDHN C[C@H](N[C@@H]1CCCN(C(=O)N2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000287495622 475171988 /nfs/dbraw/zinc/17/19/88/475171988.db2.gz NMVBWAQSXBXQJE-GOEBONIOSA-N 0 3 346.431 2.926 20 5 EFBDHN CCN1CC[C@@H]2OCCN(Cc3c(Cl)cccc3[N+](=O)[O-])[C@H]2C1 ZINC000339378164 475174529 /nfs/dbraw/zinc/17/45/29/475174529.db2.gz CNTJRMGJNONXRP-HOTGVXAUSA-N 0 3 339.823 2.543 20 5 EFBDHN COc1cc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)c([N+](=O)[O-])cc1F ZINC000296041247 475174707 /nfs/dbraw/zinc/17/47/07/475174707.db2.gz ODDSQROMRYTWQF-XZJROXQQSA-N 0 3 336.363 2.790 20 5 EFBDHN CCn1cc([C@H](C)NCCC(=O)Nc2cc([N+](=O)[O-])ccc2C)cn1 ZINC000296088174 475193473 /nfs/dbraw/zinc/19/34/73/475193473.db2.gz POZWWYBALZOOTO-ZDUSSCGKSA-N 0 3 345.403 2.799 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CCC[C@H](c3ccncc3)C2)c1 ZINC000296089790 475193537 /nfs/dbraw/zinc/19/35/37/475193537.db2.gz WLXWDKUDODYRFS-FUHWJXTLSA-N 0 3 327.384 2.903 20 5 EFBDHN CCCOc1ccc([C@H](C)NCCn2ccc([N+](=O)[O-])n2)cc1OC ZINC000341629449 475195164 /nfs/dbraw/zinc/19/51/64/475195164.db2.gz PADKCSXGEIYVNC-ZDUSSCGKSA-N 0 3 348.403 2.940 20 5 EFBDHN CC[C@H](NC[C@H](O)COCC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000292813035 475205628 /nfs/dbraw/zinc/20/56/28/475205628.db2.gz CLOOUYQHZLMMGA-STQMWFEESA-N 0 3 336.310 2.575 20 5 EFBDHN CCn1cc([C@H](C)NCCC(=O)Nc2ccc([N+](=O)[O-])cc2C)cn1 ZINC000296209572 475224345 /nfs/dbraw/zinc/22/43/45/475224345.db2.gz VOARXDXQGIZWPP-ZDUSSCGKSA-N 0 3 345.403 2.799 20 5 EFBDHN CCN1CCCC[C@H]1C(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-] ZINC000352378786 475233479 /nfs/dbraw/zinc/23/34/79/475233479.db2.gz LSIDDYSSKFTBJJ-INIZCTEOSA-N 0 3 348.447 2.696 20 5 EFBDHN CCN1CCCC[C@@H]1C(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-] ZINC000352378787 475233809 /nfs/dbraw/zinc/23/38/09/475233809.db2.gz LSIDDYSSKFTBJJ-MRXNPFEDSA-N 0 3 348.447 2.696 20 5 EFBDHN CNc1c(C(=O)NCC(C)(C)N2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000361162374 475234513 /nfs/dbraw/zinc/23/45/13/475234513.db2.gz SRRQIBCDOBPCEH-ZDUSSCGKSA-N 0 3 348.447 2.877 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCN(CC3CC3)C2)c1 ZINC000609383519 480155100 /nfs/dbraw/zinc/15/51/00/480155100.db2.gz ROYUATLXASSVAK-LBPRGKRZSA-N 0 3 335.429 2.531 20 5 EFBDHN O=[N+]([O-])c1ccccc1Cc1noc(C2CCN(C3CC3)CC2)n1 ZINC000345523845 475239401 /nfs/dbraw/zinc/23/94/01/475239401.db2.gz CBWYVKVVNSRSPW-UHFFFAOYSA-N 0 3 328.372 2.910 20 5 EFBDHN NC(=O)C[C@H](NC/C=C\c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000339529945 475278121 /nfs/dbraw/zinc/27/81/21/475278121.db2.gz FDNGKSCDXZDXJK-DIEDAUMRSA-N 0 3 325.368 2.814 20 5 EFBDHN C[C@@H]1[C@H](O)CCCN1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000296369247 475286686 /nfs/dbraw/zinc/28/66/86/475286686.db2.gz SNIBFFNKGAWAHT-IUODEOHRSA-N 0 3 331.372 2.638 20 5 EFBDHN C[C@@H]1CN(C)C[C@@H]1c1nc(Cc2c[nH]c3ccc([N+](=O)[O-])cc23)no1 ZINC000361262777 475311624 /nfs/dbraw/zinc/31/16/24/475311624.db2.gz PKCIJNIAJPELTD-YGRLFVJLSA-N 0 3 341.371 2.715 20 5 EFBDHN Cn1ccc(CCNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)n1 ZINC000354680556 475334985 /nfs/dbraw/zinc/33/49/85/475334985.db2.gz SLLSPWPRTXZKBL-UHFFFAOYSA-N 0 3 326.356 2.921 20 5 EFBDHN C[C@H](NC(=O)NCCN1CCC[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000296495496 475341743 /nfs/dbraw/zinc/34/17/43/475341743.db2.gz YIHBLOLHPDVJIY-KGLIPLIRSA-N 0 3 334.420 2.687 20 5 EFBDHN CCO[C@@H]1C[C@@H](N[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C12CCC2 ZINC000296504701 475346366 /nfs/dbraw/zinc/34/63/66/475346366.db2.gz ZIEOBKUZROULPS-DAXOMENPSA-N 0 3 347.415 2.859 20 5 EFBDHN C[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccc([N+](=O)[O-])cc1 ZINC000296531144 475358349 /nfs/dbraw/zinc/35/83/49/475358349.db2.gz DCEJVLKPSHLDKP-ZBEGNZNMSA-N 0 3 331.328 2.887 20 5 EFBDHN CCOc1ccc(C(=O)N(CCN(C)C)C2CCCC2)cc1[N+](=O)[O-] ZINC000348107909 475395225 /nfs/dbraw/zinc/39/52/25/475395225.db2.gz QUOMYIHYTNONPV-UHFFFAOYSA-N 0 3 349.431 2.940 20 5 EFBDHN Cc1cc(F)c(NC(=O)N2CC[C@]3(CCN(C)C3)C2)cc1[N+](=O)[O-] ZINC000296667427 475421047 /nfs/dbraw/zinc/42/10/47/475421047.db2.gz HCNAMLQSXKRIPJ-INIZCTEOSA-N 0 3 336.367 2.602 20 5 EFBDHN Cc1cc(F)c(NC(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000296685662 475429118 /nfs/dbraw/zinc/42/91/18/475429118.db2.gz IZJRCEOSYUVQKX-VXGBXAGGSA-N 0 3 338.383 2.989 20 5 EFBDHN Cc1cc(F)c(NC(=O)N2CC[C@@H]3CCN(C)C[C@@H]32)cc1[N+](=O)[O-] ZINC000296685699 475429949 /nfs/dbraw/zinc/42/99/49/475429949.db2.gz JACPPDDIISDMGW-NHYWBVRUSA-N 0 3 336.367 2.600 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC1(CN(C)C)CCC1 ZINC000341955746 475448165 /nfs/dbraw/zinc/44/81/65/475448165.db2.gz ZGRFDASUNWFHCP-HNNXBMFYSA-N 0 3 333.432 2.764 20 5 EFBDHN COc1cc(C(=O)NC[C@H](C)N2CCCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000337999766 475495254 /nfs/dbraw/zinc/49/52/54/475495254.db2.gz LDKKEASVESTYGB-STQMWFEESA-N 0 3 335.404 2.596 20 5 EFBDHN C[C@H](NC[C@H](O)COCc1ccccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000296866109 475512508 /nfs/dbraw/zinc/51/25/08/475512508.db2.gz ZEHNVQYEBVMRNE-GUYCJALGSA-N 0 3 348.374 2.962 20 5 EFBDHN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](N2CCCC2)C1 ZINC000332119858 475519719 /nfs/dbraw/zinc/51/97/19/475519719.db2.gz BXZKPQSMPCEUSM-OAHLLOKOSA-N 0 3 349.456 2.774 20 5 EFBDHN CN1CC[C@]2(CCN(C(=O)Nc3cccc([N+](=O)[O-])c3Cl)C2)C1 ZINC000296894255 475524601 /nfs/dbraw/zinc/52/46/01/475524601.db2.gz XKAOHFCRTXPMBD-HNNXBMFYSA-N 0 3 338.795 2.808 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC[C@H]2CN(C)CC[C@H]21 ZINC000332184045 475547143 /nfs/dbraw/zinc/54/71/43/475547143.db2.gz ATXJKJVFTFAMPI-GOEBONIOSA-N 0 3 331.416 2.768 20 5 EFBDHN COC(=O)[C@]12CN(Cc3cc([N+](=O)[O-])ccc3OC)C[C@H]1CCCC2 ZINC000342158900 475565565 /nfs/dbraw/zinc/56/55/65/475565565.db2.gz RXMJTFYLODAGPJ-RDTXWAMCSA-N 0 3 348.399 2.769 20 5 EFBDHN Cc1c(CNC(=O)NCC(C)(C)N2CCCCC2)cccc1[N+](=O)[O-] ZINC000358291673 475566179 /nfs/dbraw/zinc/56/61/79/475566179.db2.gz OEFVDMFZFWCEIA-UHFFFAOYSA-N 0 3 348.447 2.967 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@H]2CCOC[C@@H]2OCC)cc1[N+](=O)[O-] ZINC000354968415 475566955 /nfs/dbraw/zinc/56/69/55/475566955.db2.gz AIGXEPQBBPYCTB-JDFRZJQESA-N 0 3 338.404 2.838 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@@H](C)C2)c1 ZINC000346253134 475577619 /nfs/dbraw/zinc/57/76/19/475577619.db2.gz ZTOLBCMLXKUKEX-JKIFEVAISA-N 0 3 331.416 2.706 20 5 EFBDHN Cc1c(CN[C@H](C)c2ccc(-n3cnnn3)cc2)cccc1[N+](=O)[O-] ZINC000358320085 475588838 /nfs/dbraw/zinc/58/88/38/475588838.db2.gz GIJLQJLVPNFKPX-CYBMUJFWSA-N 0 3 338.371 2.730 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN[C@H](CCO)C1CCCCC1 ZINC000355018528 475600352 /nfs/dbraw/zinc/60/03/52/475600352.db2.gz XPCIYFBXTOKZRB-OAHLLOKOSA-N 0 3 349.431 2.763 20 5 EFBDHN CCOc1ccc([C@H](C)NCCc2ncc(C)cn2)cc1[N+](=O)[O-] ZINC000358360362 475618535 /nfs/dbraw/zinc/61/85/35/475618535.db2.gz AFWRHHVHWJUOFY-ZDUSSCGKSA-N 0 3 330.388 2.985 20 5 EFBDHN C[C@H]1CSC[C@H]1NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000352789291 475628119 /nfs/dbraw/zinc/62/81/19/475628119.db2.gz BQUVZMPWGYCBCK-QPUJVOFHSA-N 0 3 329.809 2.528 20 5 EFBDHN COc1ccc(-c2ccc(CN3C[C@H](CO)[C@H](C)C3)o2)c([N+](=O)[O-])c1 ZINC000361659684 475640078 /nfs/dbraw/zinc/64/00/78/475640078.db2.gz IQAVMGBAYMGFEF-CHWSQXEVSA-N 0 3 346.383 2.924 20 5 EFBDHN C[C@H]1CCC[C@H](C)N1CCNC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000358416590 475662543 /nfs/dbraw/zinc/66/25/43/475662543.db2.gz CTQHFZVSSOMEEV-STQMWFEESA-N 0 3 337.395 2.656 20 5 EFBDHN C[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)N(C)C ZINC000355113025 475675487 /nfs/dbraw/zinc/67/54/87/475675487.db2.gz IYYOZHDHRNRDHA-QMMMGPOBSA-N 0 3 334.298 2.685 20 5 EFBDHN CC(C)CN1CCN(Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000342997705 475684515 /nfs/dbraw/zinc/68/45/15/475684515.db2.gz GMZBPHIEBDZEHK-UHFFFAOYSA-N 0 3 343.374 2.970 20 5 EFBDHN CCOC[C@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)C ZINC000348477877 475688729 /nfs/dbraw/zinc/68/87/29/475688729.db2.gz KTNVHUOUGHNYRH-AWEZNQCLSA-N 0 3 343.811 2.837 20 5 EFBDHN CC(C)(C(=O)N1CCC[C@H](N2CCCC2)C1)c1ccccc1[N+](=O)[O-] ZINC000340041406 475708801 /nfs/dbraw/zinc/70/88/01/475708801.db2.gz QOCZHNDHQFTTEC-HNNXBMFYSA-N 0 3 345.443 2.959 20 5 EFBDHN C[C@H](N[C@H]1CCC[C@H]1OC(F)F)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000348538569 475736764 /nfs/dbraw/zinc/73/67/64/475736764.db2.gz UBYYALIDHHSYEB-TVYUQYBPSA-N 0 3 343.330 2.672 20 5 EFBDHN C[C@H](CNC(=O)CCNc1ccccc1[N+](=O)[O-])N1CCCC[C@@H]1C ZINC000343068388 475739484 /nfs/dbraw/zinc/73/94/84/475739484.db2.gz TZAGZYWOFDKVFN-LSDHHAIUSA-N 0 3 348.447 2.776 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN[C@@H]3CCC[C@H]3OC(F)F)nc2c1 ZINC000348540238 475740363 /nfs/dbraw/zinc/74/03/63/475740363.db2.gz UYPDZYIIVKNBCV-ZYHUDNBSSA-N 0 3 326.303 2.721 20 5 EFBDHN Cc1c(CNC(=O)NC[C@@H](C)N2CCCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000358548139 475762448 /nfs/dbraw/zinc/76/24/48/475762448.db2.gz TUNBVAQDMBGHAE-UONOGXRCSA-N 0 3 348.447 2.965 20 5 EFBDHN C[C@@H](Cc1ccc(O)cc1)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000353226306 475785615 /nfs/dbraw/zinc/78/56/15/475785615.db2.gz GIRNLLAEABAIDD-NSHDSACASA-N 0 3 326.356 2.898 20 5 EFBDHN C[C@H](CN(C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000340181446 475832915 /nfs/dbraw/zinc/83/29/15/475832915.db2.gz RDRCTTIQXDTRNQ-CYBMUJFWSA-N 0 3 327.384 2.929 20 5 EFBDHN Cc1nc(N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000297667683 475849483 /nfs/dbraw/zinc/84/94/83/475849483.db2.gz ZQIHCOJZHOACJH-SWLSCSKDSA-N 0 3 327.388 2.768 20 5 EFBDHN O=[N+]([O-])c1ccc(CCN[C@@H](c2cccs2)c2nnc[nH]2)cc1 ZINC000340227715 475869857 /nfs/dbraw/zinc/86/98/57/475869857.db2.gz BELFSQHPMVDICG-AWEZNQCLSA-N 0 3 329.385 2.696 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2N(C)CCCC2(C)C)c1 ZINC000338461197 475927892 /nfs/dbraw/zinc/92/78/92/475927892.db2.gz HHQPWYOBUUPGOR-INIZCTEOSA-N 0 3 349.431 2.844 20 5 EFBDHN CC(C)N(C)C(=O)C1CCN(CCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000343313722 475941792 /nfs/dbraw/zinc/94/17/92/475941792.db2.gz JWKJPJZTYPACCQ-UHFFFAOYSA-N 0 3 349.431 2.552 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)[C@H](CN)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000358813937 475960827 /nfs/dbraw/zinc/96/08/27/475960827.db2.gz OFLCNRTYNVPQMA-BLLLJJGKSA-N 0 3 345.374 2.962 20 5 EFBDHN C[C@H]1CCN(C)CCN1Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000353458358 475987738 /nfs/dbraw/zinc/98/77/38/475987738.db2.gz CDDBCWDLVBTFRF-NSHDSACASA-N 0 3 329.347 2.722 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NCCN2[C@@H](C)CCC[C@@H]2C)c1 ZINC000338535917 475991882 /nfs/dbraw/zinc/99/18/82/475991882.db2.gz LAPXWGRVVQORCS-KBPBESRZSA-N 0 3 349.431 2.986 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)CN2CCCCCC2)c1 ZINC000338539269 475994723 /nfs/dbraw/zinc/99/47/23/475994723.db2.gz FYIBEHZSVIHZKY-AWEZNQCLSA-N 0 3 349.431 2.988 20 5 EFBDHN CC[C@@H](NCc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CCOCC1 ZINC000343400611 476028119 /nfs/dbraw/zinc/02/81/19/476028119.db2.gz IBBHYBOKTSDQQJ-OAHLLOKOSA-N 0 3 346.387 2.940 20 5 EFBDHN CC[C@@H](NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCOCC1 ZINC000343402001 476030505 /nfs/dbraw/zinc/03/05/05/476030505.db2.gz KORFHDKNVRFBFY-OAHLLOKOSA-N 0 3 346.387 2.940 20 5 EFBDHN O=[N+]([O-])c1ccc(CNCCNc2ccc(-c3ccccc3)nn2)cc1 ZINC000340447158 476039780 /nfs/dbraw/zinc/03/97/80/476039780.db2.gz TUVCHFSQEIRUAG-UHFFFAOYSA-N 0 3 349.394 2.675 20 5 EFBDHN O=C(NCCN1CCCCCC1)c1ccc([N+](=O)[O-])cc1Cl ZINC000298301263 476049292 /nfs/dbraw/zinc/04/92/92/476049292.db2.gz BHUIITFOTVFLDT-UHFFFAOYSA-N 0 3 325.796 2.854 20 5 EFBDHN CCc1ccc([C@@H](CNC(=O)c2ccc([N+](=O)[O-])[nH]2)N(C)C)cc1 ZINC000340467516 476052502 /nfs/dbraw/zinc/05/25/02/476052502.db2.gz PUKLJLCJBCMIQG-OAHLLOKOSA-N 0 3 330.388 2.518 20 5 EFBDHN C[C@H]1[C@@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCCN1C ZINC000343425358 476053642 /nfs/dbraw/zinc/05/36/42/476053642.db2.gz YQCZJEDZQSTKNN-ZANVPECISA-N 0 3 345.321 2.826 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCN1C ZINC000334086691 476108264 /nfs/dbraw/zinc/10/82/64/476108264.db2.gz GIKWNQXQXGPSLV-JOYOIKCWSA-N 0 3 345.321 2.826 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@H]2CCO[C@]3(CCSC3)C2)c(F)c1 ZINC000350311731 476128711 /nfs/dbraw/zinc/12/87/11/476128711.db2.gz KCRIGXBFNJGKDO-SWLSCSKDSA-N 0 3 326.393 2.878 20 5 EFBDHN CCc1nn(C)c(N[C@H]2CN(Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000302186733 476190846 /nfs/dbraw/zinc/19/08/46/476190846.db2.gz VTOJENHMZXZMCB-CJNGLKHVSA-N 0 3 343.431 2.823 20 5 EFBDHN O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC[C@H]1CN1CCCCC1 ZINC000344273524 476205000 /nfs/dbraw/zinc/20/50/00/476205000.db2.gz KAYUTXBZBLNOOV-HNNXBMFYSA-N 0 3 335.379 2.824 20 5 EFBDHN CCCN(CCN(C)C)C(=O)c1cccc(SC)c1[N+](=O)[O-] ZINC000362404452 476225852 /nfs/dbraw/zinc/22/58/52/476225852.db2.gz SASOKNOBGWRZNB-UHFFFAOYSA-N 0 3 325.434 2.731 20 5 EFBDHN COC(=O)COc1ccc(CN[C@@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000353756758 476248937 /nfs/dbraw/zinc/24/89/37/476248937.db2.gz GYKYVRCLZBVTCV-ZDUSSCGKSA-N 0 3 344.367 2.997 20 5 EFBDHN COC(=O)COc1ccc(CNCc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000353765804 476256934 /nfs/dbraw/zinc/25/69/34/476256934.db2.gz IVXDKUUDRGOIHD-UHFFFAOYSA-N 0 3 344.367 2.745 20 5 EFBDHN COC[C@@H](O)CNCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000304241119 476271868 /nfs/dbraw/zinc/27/18/68/476271868.db2.gz SGBKVHXWYKZXPI-NSHDSACASA-N 0 3 340.763 2.605 20 5 EFBDHN C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CCN1Cc1ccccc1 ZINC000362487383 476279089 /nfs/dbraw/zinc/27/90/89/476279089.db2.gz UOORWGDMCXHYTQ-AWEZNQCLSA-N 0 3 342.399 2.660 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@@H]2CCc3c[nH]nc3C2)cc1[N+](=O)[O-] ZINC000360059900 476287626 /nfs/dbraw/zinc/28/76/26/476287626.db2.gz RALJXCUOBPWOPO-SMDDNHRTSA-N 0 3 330.388 2.925 20 5 EFBDHN CCN1CCC(N(C)C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000357290262 476318175 /nfs/dbraw/zinc/31/81/75/476318175.db2.gz BIVFHYWACBHXPZ-UHFFFAOYSA-N 0 3 331.372 2.897 20 5 EFBDHN CN1CCC2(CCCN2C(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000374295437 476467211 /nfs/dbraw/zinc/46/72/11/476467211.db2.gz MMLKBOFBTWLSLZ-UHFFFAOYSA-N 0 3 337.807 2.949 20 5 EFBDHN COc1ccc(CCN2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc1 ZINC000369695338 476482106 /nfs/dbraw/zinc/48/21/06/476482106.db2.gz WMYPHCDZEMGTRJ-UHFFFAOYSA-N 0 3 330.388 2.680 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC1CCN(CC)CC1 ZINC000360930414 476484794 /nfs/dbraw/zinc/48/47/94/476484794.db2.gz IKIZAFCGWZHOIZ-HNNXBMFYSA-N 0 3 333.432 2.764 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC1CCN(CC)CC1 ZINC000360930416 476484970 /nfs/dbraw/zinc/48/49/70/476484970.db2.gz IKIZAFCGWZHOIZ-OAHLLOKOSA-N 0 3 333.432 2.764 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000360940527 476490546 /nfs/dbraw/zinc/49/05/46/476490546.db2.gz ZWMSDMLNMZELFJ-GDBMZVCRSA-N 0 3 345.443 2.930 20 5 EFBDHN CN(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CCN(CCO)CC1 ZINC000357614389 476490720 /nfs/dbraw/zinc/49/07/20/476490720.db2.gz PXLVGHWGQCHZIL-UHFFFAOYSA-N 0 3 347.337 2.507 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCC1=CCN(C)CC1 ZINC000360945353 476494060 /nfs/dbraw/zinc/49/40/60/476494060.db2.gz RJBAGTGQQWHAEK-MRXNPFEDSA-N 0 3 331.416 2.542 20 5 EFBDHN O=C1CCCCN1[C@@H]1CCCN(CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000377660845 476505717 /nfs/dbraw/zinc/50/57/17/476505717.db2.gz AELYJWMONLSOQL-QGZVFWFLSA-N 0 3 331.416 2.614 20 5 EFBDHN CN(CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)[C@H]1CCCOC1 ZINC000352230139 476569002 /nfs/dbraw/zinc/56/90/02/476569002.db2.gz IFLFCWHYXZHFLF-HNNXBMFYSA-N 0 3 331.372 2.903 20 5 EFBDHN CCCN(CC)C[C@H](C)Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000357773329 476593015 /nfs/dbraw/zinc/59/30/15/476593015.db2.gz GCNIMLIGRJYRRO-JTQLQIEISA-N 0 3 349.478 2.592 20 5 EFBDHN O=[N+]([O-])c1ccn(C2CCN(CCc3ccc(F)c(F)c3)CC2)n1 ZINC000365504032 476595432 /nfs/dbraw/zinc/59/54/32/476595432.db2.gz AIVWBZWZZYUMMM-UHFFFAOYSA-N 0 3 336.342 2.949 20 5 EFBDHN CCCN1CCC[C@H]1CNC(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000354379126 476623547 /nfs/dbraw/zinc/62/35/47/476623547.db2.gz GPTMHRDYYRDSQT-AWEZNQCLSA-N 0 3 333.432 2.863 20 5 EFBDHN CNc1c(C(=O)NC[C@@H](C)N2CCCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000361144939 476633543 /nfs/dbraw/zinc/63/35/43/476633543.db2.gz MJLBFHSCHVJBPX-QWHCGFSZSA-N 0 3 334.420 2.629 20 5 EFBDHN CNc1c(C(=O)NCc2cccc(CN(C)C)c2)cccc1[N+](=O)[O-] ZINC000361144967 476634450 /nfs/dbraw/zinc/63/44/50/476634450.db2.gz MWJIHFOOHVWUPD-UHFFFAOYSA-N 0 3 342.399 2.628 20 5 EFBDHN COc1ccc(C[C@H]2CCCN(CCn3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000365727148 476681135 /nfs/dbraw/zinc/68/11/35/476681135.db2.gz XLXPFIDGEPPWEO-MRXNPFEDSA-N 0 3 344.415 2.755 20 5 EFBDHN CC(C)Oc1cc(C(=O)N[C@H](C)C2=CCN(C)CC2)ccc1[N+](=O)[O-] ZINC000413739374 476714224 /nfs/dbraw/zinc/71/42/24/476714224.db2.gz ZGBFLKMUINALNF-CYBMUJFWSA-N 0 3 347.415 2.762 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H](C)[C@@H](N)c1ccccc1 ZINC000429966122 476725797 /nfs/dbraw/zinc/72/57/97/476725797.db2.gz DVUGZIHUBHXSHB-YVEFUNNKSA-N 0 3 343.383 2.556 20 5 EFBDHN C[C@H]1N(Cc2cc([N+](=O)[O-])cc3c2OCOC3)CCC12CCOCC2 ZINC000375242763 476735989 /nfs/dbraw/zinc/73/59/89/476735989.db2.gz QFAGJSGAGXSHMX-CYBMUJFWSA-N 0 3 348.399 2.852 20 5 EFBDHN CC(C)Oc1cc(C(=O)NC(C)(C)CN2CCCC2)ccc1[N+](=O)[O-] ZINC000413859756 476767537 /nfs/dbraw/zinc/76/75/37/476767537.db2.gz LENQKRZSUCKSRQ-UHFFFAOYSA-N 0 3 349.431 2.986 20 5 EFBDHN O=C(CCN1CCC[C@@H](OCC2CC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000375316651 476774367 /nfs/dbraw/zinc/77/43/67/476774367.db2.gz YJTWFTTZMYYDMN-QGZVFWFLSA-N 0 3 347.415 2.814 20 5 EFBDHN CCO[C@@H]1CCC[C@H]1N[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000452024925 476779184 /nfs/dbraw/zinc/77/91/84/476779184.db2.gz ZRNWCSQAMLQMIV-XNRPHZJLSA-N 0 3 335.404 2.777 20 5 EFBDHN COC(=O)[C@H]1CCCC[C@@]1(C)NCc1ccc([N+](=O)[O-])cc1OC ZINC000430199036 476779607 /nfs/dbraw/zinc/77/96/07/476779607.db2.gz AVTYLFINGRKMKL-RHSMWYFYSA-N 0 3 336.388 2.815 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1CN[C@@H](CC(N)=O)C1CCCCC1 ZINC000430225917 476786218 /nfs/dbraw/zinc/78/62/18/476786218.db2.gz ZMCLELRZVHLEBP-HNNXBMFYSA-N 0 3 335.404 2.517 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@@H](N)c1ccccc1 ZINC000422807776 476787379 /nfs/dbraw/zinc/78/73/79/476787379.db2.gz PMVYLRJZIKEUCZ-OAHLLOKOSA-N 0 3 327.384 2.950 20 5 EFBDHN CCO[C@@H]1CCCC[C@H]1N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000452038807 476788222 /nfs/dbraw/zinc/78/82/22/476788222.db2.gz YLMFXBWKDGKXCI-DAXOMENPSA-N 0 3 335.404 2.859 20 5 EFBDHN C[NH+](C)CCOc1ccc([N-]C(=O)c2ccc([N+](=O)[O-])o2)c(F)c1 ZINC000413924408 476793522 /nfs/dbraw/zinc/79/35/22/476793522.db2.gz SCSGYMWPTRXXAT-UHFFFAOYSA-N 0 3 337.307 2.520 20 5 EFBDHN C[C@]12CN(Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C[C@@H]1[C@@H]1CC[C@H]2C1 ZINC000452053915 476797952 /nfs/dbraw/zinc/79/79/52/476797952.db2.gz PUEDZFLTGSLSJX-DQADVMEASA-N 0 3 329.400 2.562 20 5 EFBDHN CC(C)N1CC[C@H](N(C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000452118653 476836458 /nfs/dbraw/zinc/83/64/58/476836458.db2.gz PCQZUWNUISTADC-HNNXBMFYSA-N 0 3 345.403 2.559 20 5 EFBDHN CN(C)C[C@H]1CN(C(=O)c2ccccc2[N+](=O)[O-])c2ccccc2O1 ZINC000370502204 476842502 /nfs/dbraw/zinc/84/25/02/476842502.db2.gz AVGJBDLCBBDWKP-ZDUSSCGKSA-N 0 3 341.367 2.564 20 5 EFBDHN C[C@H](C(=O)NCCN1CCCC1(C)C)c1ccc([N+](=O)[O-])cc1F ZINC000457051353 476847396 /nfs/dbraw/zinc/84/73/96/476847396.db2.gz HZNCBJTXQHBZKU-LBPRGKRZSA-N 0 3 337.395 2.828 20 5 EFBDHN CC1(C)CCCN1CCNC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000457065584 476855243 /nfs/dbraw/zinc/85/52/43/476855243.db2.gz YFHHIZQKMNTKRT-UHFFFAOYSA-N 0 3 342.399 2.747 20 5 EFBDHN COc1ccc(CN[C@H](C)c2ccc(CN)nc2C)cc1[N+](=O)[O-] ZINC000422949324 476860813 /nfs/dbraw/zinc/86/08/13/476860813.db2.gz VABSCDAPZKRCMJ-LLVKDONJSA-N 0 3 330.388 2.616 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CCN(C(C)C)C2)c1 ZINC000457084250 476865513 /nfs/dbraw/zinc/86/55/13/476865513.db2.gz GFPOUAPXBXCIJX-CYBMUJFWSA-N 0 3 335.404 2.548 20 5 EFBDHN CC(C)N1CC[C@H](N(C)C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000457093757 476871539 /nfs/dbraw/zinc/87/15/39/476871539.db2.gz OFNLEBRWKSAKBG-HNNXBMFYSA-N 0 3 344.415 2.560 20 5 EFBDHN CC(C)N1CC[C@@H](N(C)C(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000457096608 476873637 /nfs/dbraw/zinc/87/36/37/476873637.db2.gz RAXDLLGTTCJGDC-GXTWGEPZSA-N 0 3 337.395 2.779 20 5 EFBDHN CC(C)N1CC[C@@H](N(C)C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C1 ZINC000457102432 476874354 /nfs/dbraw/zinc/87/43/54/476874354.db2.gz ZXHDUEOMNHQWKW-GFCCVEGCSA-N 0 3 330.388 2.631 20 5 EFBDHN CC(C)(CCN[C@H]1CCCc2ccc([N+](=O)[O-])cc21)S(C)(=O)=O ZINC000414272190 476877319 /nfs/dbraw/zinc/87/73/19/476877319.db2.gz XRFJIXLRUAEXHA-HNNXBMFYSA-N 0 3 340.445 2.775 20 5 EFBDHN COc1ccc(CNC(=O)[C@H](N)CC2CCCCC2)cc1[N+](=O)[O-] ZINC000423056128 476908655 /nfs/dbraw/zinc/90/86/55/476908655.db2.gz FBORBUQBWNOFMT-CQSZACIVSA-N 0 3 335.404 2.517 20 5 EFBDHN Cc1cc(NC(=O)N2C[C@@H](c3ccccc3)[C@H](N)C2)ccc1[N+](=O)[O-] ZINC000415414909 476922143 /nfs/dbraw/zinc/92/21/43/476922143.db2.gz GQSRBQVVDZJVFR-JKSUJKDBSA-N 0 3 340.383 2.862 20 5 EFBDHN O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2NCc2cccc3c2OCO3)n1 ZINC000447541983 477007933 /nfs/dbraw/zinc/00/79/33/477007933.db2.gz NMGNSZLLSXRWMI-ZIAGYGMSSA-N 0 3 344.371 2.794 20 5 EFBDHN CCC[C@@H](C)C(=O)NCCNc1cc(C)nc2ccc([N+](=O)[O-])cc21 ZINC000431493037 477039522 /nfs/dbraw/zinc/03/95/22/477039522.db2.gz ABCRLCGKCIDXQB-GFCCVEGCSA-N 0 3 344.415 2.838 20 5 EFBDHN CCN1CCC(Nc2c(Cl)cc([N+](=O)[O-])cc2C(=O)OC)CC1 ZINC000447807489 477062860 /nfs/dbraw/zinc/06/28/60/477062860.db2.gz RWWIPXXCMITETJ-UHFFFAOYSA-N 0 3 341.795 2.931 20 5 EFBDHN C[C@H]1C[C@H](N2CCCC2)CN1C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000375903509 477072997 /nfs/dbraw/zinc/07/29/97/477072997.db2.gz SFAOZMTZHICJBD-NHYWBVRUSA-N 0 3 337.807 2.947 20 5 EFBDHN CN(C)CCN(Cc1ccsc1)C(=O)c1ccccc1[N+](=O)[O-] ZINC000411108536 477116069 /nfs/dbraw/zinc/11/60/69/477116069.db2.gz DKUZGKYXJKHYBI-UHFFFAOYSA-N 0 3 333.413 2.860 20 5 EFBDHN O=C(C1CN(C2CCCCC2)C1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000457640074 477120506 /nfs/dbraw/zinc/12/05/06/477120506.db2.gz YLRPQQXYCVLIII-UHFFFAOYSA-N 0 3 343.427 2.744 20 5 EFBDHN CCCn1nc(C)c(CN2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1C ZINC000376034871 477141776 /nfs/dbraw/zinc/14/17/76/477141776.db2.gz NQTPDDOUIUQSNU-UHFFFAOYSA-N 0 3 346.435 2.852 20 5 EFBDHN COc1ccc(NC(=O)C2CN(C3CCCCC3)C2)cc1[N+](=O)[O-] ZINC000457708211 477155925 /nfs/dbraw/zinc/15/59/25/477155925.db2.gz YUYAIEGCKIXMRN-UHFFFAOYSA-N 0 3 333.388 2.806 20 5 EFBDHN O=[N+]([O-])c1ccc(S(=O)(=O)CCN[C@@H](C2CC2)C2CCC2)cc1 ZINC000453192123 477188540 /nfs/dbraw/zinc/18/85/40/477188540.db2.gz ITNYOVPEGYKYEN-MRXNPFEDSA-N 0 3 338.429 2.537 20 5 EFBDHN COCCN1CCC(Nc2ccnc3c2cccc3[N+](=O)[O-])CC1 ZINC000432339579 477197973 /nfs/dbraw/zinc/19/79/73/477197973.db2.gz SYTQZOYMKGCHSZ-UHFFFAOYSA-N 0 3 330.388 2.666 20 5 EFBDHN CCN1CCN([C@@H](C)CNc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000432339193 477197989 /nfs/dbraw/zinc/19/79/89/477197989.db2.gz ZRVWZRURLCSBRU-LBPRGKRZSA-N 0 3 326.828 2.686 20 5 EFBDHN COc1nccc(CN[C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)n1 ZINC000453245586 477198358 /nfs/dbraw/zinc/19/83/58/477198358.db2.gz IEZZYQFYVYUDGX-HNNXBMFYSA-N 0 3 328.372 2.504 20 5 EFBDHN CCN1CCC(NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC1 ZINC000448600228 477208915 /nfs/dbraw/zinc/20/89/15/477208915.db2.gz DYPUSLQNXHEHRJ-UHFFFAOYSA-N 0 3 345.321 2.828 20 5 EFBDHN CCOc1ccc([C@H](C)NCCN2C[C@H]3CC[C@@H](C2)O3)cc1[N+](=O)[O-] ZINC000453365909 477214436 /nfs/dbraw/zinc/21/44/36/477214436.db2.gz WQCSQBWTAIGUDC-CWRNSKLLSA-N 0 3 349.431 2.507 20 5 EFBDHN CC(C)N1CC[C@H](N(C)C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000457843627 477227844 /nfs/dbraw/zinc/22/78/44/477227844.db2.gz BKJRACINQLKBJE-BBRMVZONSA-N 0 3 334.420 2.780 20 5 EFBDHN C[C@@H](CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCC[C@H](C)C1 ZINC000411417143 477228210 /nfs/dbraw/zinc/22/82/10/477228210.db2.gz DXBUAVODJKEPFS-DFEHZGFQSA-N 0 3 345.443 2.935 20 5 EFBDHN CC(C)Oc1cc(C(=O)NCCN2CCC(C)CC2)ccc1[N+](=O)[O-] ZINC000411426129 477231266 /nfs/dbraw/zinc/23/12/66/477231266.db2.gz MJMGIGHCKLPEOJ-UHFFFAOYSA-N 0 3 349.431 2.844 20 5 EFBDHN CCc1ccccc1[C@H](N)CNC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000423958570 477234009 /nfs/dbraw/zinc/23/40/09/477234009.db2.gz DRLARDMWECTUQP-GOSISDBHSA-N 0 3 341.411 2.906 20 5 EFBDHN CCOc1ccc([C@H](C)NC[C@@H]2CN3CCC[C@@H]3CO2)cc1[N+](=O)[O-] ZINC000371316311 477237451 /nfs/dbraw/zinc/23/74/51/477237451.db2.gz CRHFGLANERJBGN-NUEKZKHPSA-N 0 3 349.431 2.507 20 5 EFBDHN CCc1ccccc1[C@H](N)CNC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000423969856 477237853 /nfs/dbraw/zinc/23/78/53/477237853.db2.gz FGFOYFYWAHTLMH-MRXNPFEDSA-N 0 3 327.384 2.516 20 5 EFBDHN Cc1ccc(C(=O)N2C[C@@H](c3cccc(F)c3)[C@H](N)C2)cc1[N+](=O)[O-] ZINC000424013738 477261174 /nfs/dbraw/zinc/26/11/74/477261174.db2.gz SAUCYRJNMTXOOZ-JKSUJKDBSA-N 0 3 343.358 2.609 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](c3cccc(F)c3)[C@H](N)C2)c1 ZINC000424014012 477261632 /nfs/dbraw/zinc/26/16/32/477261632.db2.gz SQVMXTYGMYAPNQ-JKSUJKDBSA-N 0 3 343.358 2.609 20 5 EFBDHN COc1cc(NCCCN2CCCO[C@H](C)C2)c(F)cc1[N+](=O)[O-] ZINC000432863416 477280698 /nfs/dbraw/zinc/28/06/98/477280698.db2.gz DGVLNYMMCBPSSW-GFCCVEGCSA-N 0 3 341.383 2.655 20 5 EFBDHN CC(C)N1C[C@@H](N[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1=O ZINC000433280892 477320566 /nfs/dbraw/zinc/32/05/66/477320566.db2.gz GIXAEPOPNSPNEA-BLLLJJGKSA-N 0 3 331.416 2.916 20 5 EFBDHN Cc1cc(NC(=O)COc2ccccc2[N+](=O)[O-])ccc1CN(C)C ZINC000458311038 477346737 /nfs/dbraw/zinc/34/67/37/477346737.db2.gz GXRIQTGLBAIYSV-UHFFFAOYSA-N 0 3 343.383 2.982 20 5 EFBDHN O=[N+]([O-])c1cnc(NC[C@@H]2CCCN(Cc3ccccc3)C2)s1 ZINC000367157968 477369443 /nfs/dbraw/zinc/36/94/43/477369443.db2.gz GQNMWSAROXRGGS-AWEZNQCLSA-N 0 3 332.429 2.797 20 5 EFBDHN CN(C)[C@@H](CNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)C1CC1 ZINC000436060439 477414026 /nfs/dbraw/zinc/41/40/26/477414026.db2.gz NNWBGGQFGGAOQX-IBGZPJMESA-N 0 3 349.434 2.751 20 5 EFBDHN CC(C)Oc1cc(C(=O)N(C)[C@H]2CCN(C(C)C)C2)ccc1[N+](=O)[O-] ZINC000412408194 477422442 /nfs/dbraw/zinc/42/24/42/477422442.db2.gz GWRYCEGXCGIDBF-HNNXBMFYSA-N 0 3 349.431 2.937 20 5 EFBDHN CNC(=O)c1cccc(CN[C@H](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000449075752 477423825 /nfs/dbraw/zinc/42/38/25/477423825.db2.gz WADBOBRXTCBGJV-CYBMUJFWSA-N 0 3 327.384 2.675 20 5 EFBDHN C[C@H](CNCc1ccccc1[N+](=O)[O-])c1ccc(S(C)(=O)=O)cc1 ZINC000449093204 477434114 /nfs/dbraw/zinc/43/41/14/477434114.db2.gz WQINKXSTBHWKAS-CYBMUJFWSA-N 0 3 348.424 2.892 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N[C@@H]1CC(=O)N(c2ccccc2)C1 ZINC000449108015 477441781 /nfs/dbraw/zinc/44/17/81/477441781.db2.gz RVJRQWJBBGFQPH-GDBMZVCRSA-N 0 3 339.395 2.921 20 5 EFBDHN O=c1ccn(Cc2cccc(CN3CCCCC3)c2)cc1[N+](=O)[O-] ZINC000413001011 477468929 /nfs/dbraw/zinc/46/89/29/477468929.db2.gz QHWVVQCMGAYTEI-UHFFFAOYSA-N 0 3 327.384 2.791 20 5 EFBDHN COCCN1CCC(Nc2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413087701 477509739 /nfs/dbraw/zinc/50/97/39/477509739.db2.gz VMKPUDSXVYNOTB-UHFFFAOYSA-N 0 3 330.388 2.666 20 5 EFBDHN Cc1c(CNC(=O)N2CC[C@@]3(C2)CCCN(C)C3)cccc1[N+](=O)[O-] ZINC000458688395 477548748 /nfs/dbraw/zinc/54/87/48/477548748.db2.gz JEMVAQPAVSEAHC-SFHVURJKSA-N 0 3 346.431 2.531 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2nnc(CNC3(C4CC4)CCOCC3)o2)cc1 ZINC000367567082 477577719 /nfs/dbraw/zinc/57/77/19/477577719.db2.gz UCGIPMAJKMUKKW-UHFFFAOYSA-N 0 3 344.371 2.694 20 5 EFBDHN C[C@@H](CCN1CCN(C)CC1)Nc1ccc([N+](=O)[O-])c2ncccc12 ZINC000413223965 477578044 /nfs/dbraw/zinc/57/80/44/477578044.db2.gz DXTLXQKCXVMZDC-AWEZNQCLSA-N 0 3 343.431 2.581 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1NC[C@H]1CCCN1CCCO ZINC000450599664 477649374 /nfs/dbraw/zinc/64/93/74/477649374.db2.gz TYTAIAMONFUAHO-GFCCVEGCSA-N 0 3 347.337 2.872 20 5 EFBDHN O=[N+]([O-])c1cccc(Cl)c1NC1CCN([C@@H]2CCOC2)CC1 ZINC000367774489 477684251 /nfs/dbraw/zinc/68/42/51/477684251.db2.gz ZZODHRUEMPZZMB-GFCCVEGCSA-N 0 3 325.796 2.913 20 5 EFBDHN CN(CCN(C)C1CC1)C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000450702191 477690080 /nfs/dbraw/zinc/69/00/80/477690080.db2.gz QFIVCOHZBZSGTC-UHFFFAOYSA-N 0 3 345.321 2.780 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)CN1C[C@@H](C)C[C@H](C)C1 ZINC000426915781 477759792 /nfs/dbraw/zinc/75/97/92/477759792.db2.gz HIDSECLTVURSMD-MELADBBJSA-N 0 3 349.431 2.700 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)CCN1C ZINC000437984753 477783232 /nfs/dbraw/zinc/78/32/32/477783232.db2.gz KCPWOWHGLLFHAD-ZFWWWQNUSA-N 0 3 346.431 2.752 20 5 EFBDHN CC(C)c1ccc(CN2CCN(CC(C)(C)O)C[C@H]2C)cc1[N+](=O)[O-] ZINC000438253484 477812599 /nfs/dbraw/zinc/81/25/99/477812599.db2.gz DWZZZGKSRDIFBG-OAHLLOKOSA-N 0 3 349.475 2.995 20 5 EFBDHN CC(C)[C@@H](CN[C@H]1CCc2c1cccc2[N+](=O)[O-])N1CCOCC1 ZINC000515501034 477833722 /nfs/dbraw/zinc/83/37/22/477833722.db2.gz YSZQNDGAZXCICN-FUHWJXTLSA-N 0 3 333.432 2.529 20 5 EFBDHN CN1CC[C@H]2[C@@H](CCCN2c2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000428177777 477834220 /nfs/dbraw/zinc/83/42/20/477834220.db2.gz RJMIOQYFTHAKNK-ZFWWWQNUSA-N 0 3 343.387 2.565 20 5 EFBDHN CC[C@@H]1CN(Cc2c(Cl)cccc2[N+](=O)[O-])CCN1C[C@@H](C)O ZINC000493819329 477841651 /nfs/dbraw/zinc/84/16/51/477841651.db2.gz MQESFAODTAYTGG-CHWSQXEVSA-N 0 3 341.839 2.525 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCC1(N(C)C)CCC1 ZINC000438524870 477858321 /nfs/dbraw/zinc/85/83/21/477858321.db2.gz WUKCZAQXXVGPGS-UHFFFAOYSA-N 0 3 337.445 2.921 20 5 EFBDHN Cc1ccccc1CCN(C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000451168527 477858571 /nfs/dbraw/zinc/85/85/71/477858571.db2.gz VWVYOQBRXYRTGO-QGZVFWFLSA-N 0 3 344.411 2.817 20 5 EFBDHN Cc1ccccc1CCN(C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000451173520 477859383 /nfs/dbraw/zinc/85/93/83/477859383.db2.gz ZJVGRSKMWWHFCX-GOSISDBHSA-N 0 3 344.411 2.817 20 5 EFBDHN Cc1ccccc1CCN(C)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000451173521 477859909 /nfs/dbraw/zinc/85/99/09/477859909.db2.gz ZJVGRSKMWWHFCX-SFHVURJKSA-N 0 3 344.411 2.817 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1C[C@H](N2CCOCC2)C[C@@H]1C ZINC000558411623 477863573 /nfs/dbraw/zinc/86/35/73/477863573.db2.gz JWQHBSUVKJUHAU-IPJVVFLOSA-N 0 3 345.443 2.793 20 5 EFBDHN CC(C)c1ccc(CNCCN2C[C@H]3CC[C@@H](C2)O3)cc1[N+](=O)[O-] ZINC000451223147 477887033 /nfs/dbraw/zinc/88/70/33/477887033.db2.gz PWHMQOGSSPFYEU-IYBDPMFKSA-N 0 3 333.432 2.671 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2cnc(CCN3CC[C@]34CCOC4)o2)c1 ZINC000421011327 477898064 /nfs/dbraw/zinc/89/80/64/477898064.db2.gz DKNVSWPNOVNPJJ-QGZVFWFLSA-N 0 3 329.356 2.657 20 5 EFBDHN C[C@H]1[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2)CCN1Cc1ccccc1 ZINC000494070149 477916202 /nfs/dbraw/zinc/91/62/02/477916202.db2.gz VGKSWBVMKXZVBB-KSSFIOAISA-N 0 3 339.395 2.988 20 5 EFBDHN O=[N+]([O-])c1ccccc1CNC[C@@]1(CO)C[C@@H]1c1ccc(F)cc1 ZINC000428533366 477922089 /nfs/dbraw/zinc/92/20/89/477922089.db2.gz GXDSZEFHRFVDDF-SJLPKXTDSA-N 0 3 330.359 2.990 20 5 EFBDHN CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N[C@@H]1CCN(C)[C@H](C)C1 ZINC000462895566 477923825 /nfs/dbraw/zinc/92/38/25/477923825.db2.gz QUUZCHKYXRLESQ-GHMZBOCLSA-N 0 3 339.367 2.805 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN[C@@H](c2ccccc2)C2(CO)CCCC2)n1 ZINC000459520756 477951792 /nfs/dbraw/zinc/95/17/92/477951792.db2.gz DWNBRJXFXAOGJQ-KRWDZBQOSA-N 0 3 344.415 2.675 20 5 EFBDHN CN1CCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000559649485 477995425 /nfs/dbraw/zinc/99/54/25/477995425.db2.gz GHTUEFPMCIFRFY-JTQLQIEISA-N 0 3 345.321 2.685 20 5 EFBDHN C[C@@H]1CCCC[C@@]1(C)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000459615506 478011287 /nfs/dbraw/zinc/01/12/87/478011287.db2.gz PDNNYINCHKCHNL-CZUORRHYSA-N 0 3 340.445 2.927 20 5 EFBDHN C[C@H]1CCCC[C@@]1(C)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000459615508 478011757 /nfs/dbraw/zinc/01/17/57/478011757.db2.gz PDNNYINCHKCHNL-XJKSGUPXSA-N 0 3 340.445 2.927 20 5 EFBDHN C[C@H](N[C@@H]1[C@@H]2CCCO[C@H]2C1(C)C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000439650012 478013857 /nfs/dbraw/zinc/01/38/57/478013857.db2.gz REXSYVFHTJSHKM-DANNLKNASA-N 0 3 347.415 2.715 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN[C@@H]1[C@H]2CCCO[C@@H]2C1(C)C ZINC000451474149 478035515 /nfs/dbraw/zinc/03/55/15/478035515.db2.gz ADSFIHMYGJUBFZ-JLZZUVOBSA-N 0 3 347.415 2.635 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCN(C)[C@H](C)C1 ZINC000439875314 478041928 /nfs/dbraw/zinc/04/19/28/478041928.db2.gz RZIXGNBBZOGOFL-NEPJUHHUSA-N 0 3 336.392 2.598 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCCN(CC)C1CC1 ZINC000439893949 478045359 /nfs/dbraw/zinc/04/53/59/478045359.db2.gz ZBPFNRWMIVCFQS-UHFFFAOYSA-N 0 3 336.392 2.599 20 5 EFBDHN CO[C@@H]1C[C@H](NCC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC000451490468 478047992 /nfs/dbraw/zinc/04/79/92/478047992.db2.gz IBNDXISRDBHVHD-QWHCGFSZSA-N 0 3 341.795 2.590 20 5 EFBDHN COc1cc(CN[C@@H]2C[C@H](OC)C23CCC3)c([N+](=O)[O-])cc1OC ZINC000459728093 478061616 /nfs/dbraw/zinc/06/16/16/478061616.db2.gz CRQMRXLSQUCBHT-CVEARBPZSA-N 0 3 336.388 2.659 20 5 EFBDHN COc1ccc([C@@H](CO)CNCc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000459749338 478072173 /nfs/dbraw/zinc/07/21/73/478072173.db2.gz MGTUSUGHBFJYIR-MRXNPFEDSA-N 0 3 330.384 2.778 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC[C@@H](N2CCOCC2)C1 ZINC000517245060 478072580 /nfs/dbraw/zinc/07/25/80/478072580.db2.gz QQZIZCHLVISDRQ-DOTOQJQBSA-N 0 3 333.432 2.761 20 5 EFBDHN CC(C)OCC[C@H](O)CN1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451543194 478077780 /nfs/dbraw/zinc/07/77/80/478077780.db2.gz BGGMGNQEUSWRSW-WMZOPIPTSA-N 0 3 336.432 2.950 20 5 EFBDHN CC(C)OCC[C@@H](O)CN1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451543192 478078910 /nfs/dbraw/zinc/07/89/10/478078910.db2.gz BGGMGNQEUSWRSW-FUHWJXTLSA-N 0 3 336.432 2.950 20 5 EFBDHN COc1ccc(NC(=O)[C@@H](C)N[C@H]2CCC[C@@H]3C[C@@H]32)c([N+](=O)[O-])c1 ZINC000459794692 478096840 /nfs/dbraw/zinc/09/68/40/478096840.db2.gz WUULNVJUDDGKQL-RFHZTLPTSA-N 0 3 333.388 2.709 20 5 EFBDHN COc1cc(CN[C@@H]2CCC[C@H]2OC)c([N+](=O)[O-])cc1OC(F)F ZINC000451623373 478129559 /nfs/dbraw/zinc/12/95/59/478129559.db2.gz LPMNGTIFBSKRTB-ZYHUDNBSSA-N 0 3 346.330 2.862 20 5 EFBDHN CO[C@@H]1CCC[C@H]1N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000451632295 478134263 /nfs/dbraw/zinc/13/42/63/478134263.db2.gz NUVLGXGIBKNXLJ-OWYVNGRQSA-N 0 3 341.795 2.732 20 5 EFBDHN Cn1cc([C@@H]2CN(CCOc3cccc([N+](=O)[O-])c3)CC2(C)C)cn1 ZINC000518062733 478142569 /nfs/dbraw/zinc/14/25/69/478142569.db2.gz HWTSTQHPNFXTAB-KRWDZBQOSA-N 0 3 344.415 2.833 20 5 EFBDHN Cc1cc([N+](=O)[O-])cc(Cl)c1NCCN1CCN(C)C(C)(C)C1 ZINC000440681307 478150325 /nfs/dbraw/zinc/15/03/25/478150325.db2.gz TZMJXPITPDPZPB-UHFFFAOYSA-N 0 3 340.855 2.995 20 5 EFBDHN Cc1cccc2c1CN(C[C@@H](O)COc1ccccc1[N+](=O)[O-])CC2 ZINC000429584921 478160325 /nfs/dbraw/zinc/16/03/25/478160325.db2.gz HKUILMKVZKQLNR-MRXNPFEDSA-N 0 3 342.395 2.701 20 5 EFBDHN CCOc1cc(CN2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)ccc1[N+](=O)[O-] ZINC000451698761 478163086 /nfs/dbraw/zinc/16/30/86/478163086.db2.gz JVPHSECOXSCSJK-BZUAXINKSA-N 0 3 334.416 2.976 20 5 EFBDHN CCOC(=O)N1CCC[C@@H]([C@H](C)NCc2ccccc2[N+](=O)[O-])C1 ZINC000495544972 478225208 /nfs/dbraw/zinc/22/52/08/478225208.db2.gz WHVAGIJZFOSNJP-DZGCQCFKSA-N 0 3 335.404 2.941 20 5 EFBDHN C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCCc2c[nH]nc21 ZINC000536843483 478277471 /nfs/dbraw/zinc/27/74/71/478277471.db2.gz CXOPJDGZGPJUMZ-IAQYHMDHSA-N 0 3 343.387 2.702 20 5 EFBDHN CC(C)(CNCc1cc2c(cc1[N+](=O)[O-])OCCO2)c1ccccn1 ZINC000590655120 478277594 /nfs/dbraw/zinc/27/75/94/478277594.db2.gz NBIOYFOSIBVJNS-UHFFFAOYSA-N 0 3 343.383 2.828 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCCC(C)(C)S(C)(=O)=O ZINC000579448380 478298629 /nfs/dbraw/zinc/29/86/29/478298629.db2.gz WCDVPOOTMHCJOW-LBPRGKRZSA-N 0 3 328.434 2.767 20 5 EFBDHN CCC(C)(C)N1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2C)CC1 ZINC000594242840 478298885 /nfs/dbraw/zinc/29/88/85/478298885.db2.gz VVHPAMQEAGALAL-UHFFFAOYSA-N 0 3 348.447 2.919 20 5 EFBDHN COC(=O)N1CCC(CNCc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000495750798 478300442 /nfs/dbraw/zinc/30/04/42/478300442.db2.gz SDHACLUSFBXCGQ-UHFFFAOYSA-N 0 3 341.795 2.816 20 5 EFBDHN CC1(C)CCN(CC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)C1 ZINC000570176247 478303080 /nfs/dbraw/zinc/30/30/80/478303080.db2.gz QMEQLYXQPSMIHY-UHFFFAOYSA-N 0 3 331.416 2.818 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1CCCN2CCCC[C@@H]12 ZINC000594281055 478317421 /nfs/dbraw/zinc/31/74/21/478317421.db2.gz BDLRWTFUCSAYCO-WBVHZDCISA-N 0 3 346.431 2.753 20 5 EFBDHN O=[N+]([O-])c1ccc2oc(CN[C@@H]([C@H](CO)C3CC3)C3CC3)nc2c1 ZINC000590758052 478322378 /nfs/dbraw/zinc/32/23/78/478322378.db2.gz BSWXLPFZROUYTQ-CXAGYDPISA-N 0 3 331.372 2.623 20 5 EFBDHN O=[N+]([O-])c1ccc2oc(CN[C@H]([C@H](CO)C3CC3)C3CC3)nc2c1 ZINC000590758053 478322484 /nfs/dbraw/zinc/32/24/84/478322484.db2.gz BSWXLPFZROUYTQ-DYVFJYSZSA-N 0 3 331.372 2.623 20 5 EFBDHN Cc1c([C@H](C)N[C@H]2CCC[C@H](S(C)(=O)=O)C2)cccc1[N+](=O)[O-] ZINC000537981483 478342050 /nfs/dbraw/zinc/34/20/50/478342050.db2.gz NMVCJWUTBIFQIE-IHRRRGAJSA-N 0 3 340.445 2.910 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCCC(=O)Nc1ccccn1 ZINC000538614534 478365905 /nfs/dbraw/zinc/36/59/05/478365905.db2.gz NJJVTSSSMYSVTD-ZDUSSCGKSA-N 0 3 328.372 2.978 20 5 EFBDHN O=C(N[C@@H]1CCCN2CCCC[C@H]12)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000594422338 478377108 /nfs/dbraw/zinc/37/71/08/478377108.db2.gz XVUPHKVOSUHIMN-NVXWUHKLSA-N 0 3 342.399 2.823 20 5 EFBDHN COC(C)(C)CN(C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000538828022 478388178 /nfs/dbraw/zinc/38/81/78/478388178.db2.gz GKWCTMBMWMGVJJ-UHFFFAOYSA-N 0 3 332.404 2.852 20 5 EFBDHN CC(C)[C@H](N[C@@H]1CCc2c1cccc2[N+](=O)[O-])C(=O)N1CCCC1 ZINC000594500691 478413925 /nfs/dbraw/zinc/41/39/25/478413925.db2.gz ASBYTECOPKWUSH-WBVHZDCISA-N 0 3 331.416 2.819 20 5 EFBDHN COc1cc(C[NH2+]CCc2ncc(C)cc2C)c([N+](=O)[O-])cc1[O-] ZINC000594523687 478426076 /nfs/dbraw/zinc/42/60/76/478426076.db2.gz ZACJSQLKKLZWFD-UHFFFAOYSA-N 0 3 331.372 2.653 20 5 EFBDHN O=C(Nc1ccc([N+](=O)[O-])cc1F)N[C@@H]1CCCN2CCCC[C@@H]12 ZINC000594524854 478426574 /nfs/dbraw/zinc/42/65/74/478426574.db2.gz MCWHJAIWOFKHIK-CABCVRRESA-N 0 3 336.367 2.872 20 5 EFBDHN CC[C@@H]1CN(C)CCCN1C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000597604150 478428629 /nfs/dbraw/zinc/42/86/29/478428629.db2.gz GTHAJXVPZAQKDA-GFCCVEGCSA-N 0 3 330.388 2.632 20 5 EFBDHN CC[C@H]1CN(C)CCCN1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000597604500 478429087 /nfs/dbraw/zinc/42/90/87/478429087.db2.gz JDNDRYOVYDZZRY-BHYGNILZSA-N 0 3 331.416 2.641 20 5 EFBDHN CC[C@@H]1CN(C)CCCN1C(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000597605703 478430455 /nfs/dbraw/zinc/43/04/55/478430455.db2.gz SBIHMZOIBDLODA-CHWSQXEVSA-N 0 3 337.395 2.780 20 5 EFBDHN CC[C@H]1CN(C)CCCN1C(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000597605706 478430759 /nfs/dbraw/zinc/43/07/59/478430759.db2.gz SBIHMZOIBDLODA-STQMWFEESA-N 0 3 337.395 2.780 20 5 EFBDHN CC(C)Oc1nc(N2CC[C@H](N3CCCCC3)C2)ccc1[N+](=O)[O-] ZINC000594550162 478432957 /nfs/dbraw/zinc/43/29/57/478432957.db2.gz LLHXRBKXXBAINC-AWEZNQCLSA-N 0 3 334.420 2.842 20 5 EFBDHN C[C@H](N[C@H]1CCCN2CCCC[C@H]12)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000594554083 478435147 /nfs/dbraw/zinc/43/51/47/478435147.db2.gz KJRUPRDWGMYSPC-OFQRWUPVSA-N 0 3 346.431 2.528 20 5 EFBDHN CC(C)Oc1cc(C(=O)N[C@H]2CCN(CC3CC3)C2)ccc1[N+](=O)[O-] ZINC000591056195 478444392 /nfs/dbraw/zinc/44/43/92/478444392.db2.gz XEZBSLVNLCVPMR-HNNXBMFYSA-N 0 3 347.415 2.596 20 5 EFBDHN O=C1[C@@H](N2CC[C@@H](C3CCC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000591062981 478446655 /nfs/dbraw/zinc/44/66/55/478446655.db2.gz DSZANTDWTBOAMK-PBHICJAKSA-N 0 3 329.400 2.822 20 5 EFBDHN O=[N+]([O-])c1ccc2ncnc(N[C@H]3CCCN4CCCC[C@@H]34)c2c1 ZINC000594596603 478455871 /nfs/dbraw/zinc/45/58/71/478455871.db2.gz AUHVPCMWJXPXMX-HOTGVXAUSA-N 0 3 327.388 2.967 20 5 EFBDHN CCOC(=O)c1ccnc(N[C@@H]2CCCN3CCCC[C@H]23)c1[N+](=O)[O-] ZINC000594604043 478461842 /nfs/dbraw/zinc/46/18/42/478461842.db2.gz XCTKGUUZLAYVDH-ZIAGYGMSSA-N 0 3 348.403 2.595 20 5 EFBDHN O=C1CCc2cc([N+](=O)[O-])c(N[C@@H]3CCCN4CCCC[C@@H]34)cc2N1 ZINC000594604579 478462448 /nfs/dbraw/zinc/46/24/48/478462448.db2.gz ZZLPHLIYOSVCQF-CJNGLKHVSA-N 0 3 344.415 2.908 20 5 EFBDHN O=[N+]([O-])c1cccc2ncnc(N[C@H]3CCCN4CCCC[C@H]34)c21 ZINC000594603320 478463040 /nfs/dbraw/zinc/46/30/40/478463040.db2.gz UCORFUDUILPVLA-GXTWGEPZSA-N 0 3 327.388 2.967 20 5 EFBDHN O=[N+]([O-])c1cccc2ncnc(N[C@H]3CCCN4CCCC[C@@H]34)c21 ZINC000594603321 478463193 /nfs/dbraw/zinc/46/31/93/478463193.db2.gz UCORFUDUILPVLA-JSGCOSHPSA-N 0 3 327.388 2.967 20 5 EFBDHN COc1cc(C(=O)N2CCNC3(CCCCC3)C2)cc([N+](=O)[O-])c1C ZINC000594628760 478473783 /nfs/dbraw/zinc/47/37/83/478473783.db2.gz IIURVJYFVZGGNQ-UHFFFAOYSA-N 0 3 347.415 2.660 20 5 EFBDHN CCc1ccc(C(=O)N2CCNC3(CCCCC3)C2)cc1[N+](=O)[O-] ZINC000594628840 478473810 /nfs/dbraw/zinc/47/38/10/478473810.db2.gz LOURXPXLIUJMDX-UHFFFAOYSA-N 0 3 331.416 2.906 20 5 EFBDHN CN1CC[C@]2(C1)CCCN(C(=O)c1c(Cl)cccc1[N+](=O)[O-])C2 ZINC000597711442 478474664 /nfs/dbraw/zinc/47/46/64/478474664.db2.gz RVDQYBKERQINSD-INIZCTEOSA-N 0 3 337.807 2.806 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCNC1(c2ccc3c(c2)OCO3)CC1 ZINC000540433834 478475652 /nfs/dbraw/zinc/47/56/52/478475652.db2.gz XLWSPNRNCPIYTC-UHFFFAOYSA-N 0 3 342.351 2.981 20 5 EFBDHN NCc1cccc2c1N(CCOc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000600722493 478487606 /nfs/dbraw/zinc/48/76/06/478487606.db2.gz QOTGJIGXNNHGGT-UHFFFAOYSA-N 0 3 327.384 2.885 20 5 EFBDHN COc1ccc(-c2ccc(CNC[C@@H]3C[C@H](F)CN3)o2)c([N+](=O)[O-])c1 ZINC000591281573 478509749 /nfs/dbraw/zinc/50/97/49/478509749.db2.gz ACZDZIZKCZWFAL-RYUDHWBXSA-N 0 3 349.362 2.653 20 5 EFBDHN O=C1[C@H](NCCc2ccc([N+](=O)[O-])cc2)CCN1c1ccc(F)cc1 ZINC000591372951 478539180 /nfs/dbraw/zinc/53/91/80/478539180.db2.gz CVRVSYUOAYZJEF-QGZVFWFLSA-N 0 3 343.358 2.672 20 5 EFBDHN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N1CC[C@H](N2CCCCC2)C1 ZINC000491561133 478587806 /nfs/dbraw/zinc/58/78/06/478587806.db2.gz INUMWBIUOQZDGF-SKHCZCESSA-N 0 3 329.400 2.695 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1cnc2c(c1)CNCC2 ZINC000591681398 478605397 /nfs/dbraw/zinc/60/53/97/478605397.db2.gz POVUTZOTWDLQLA-UHFFFAOYSA-N 0 3 326.356 2.505 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@H]2C[C@H]2c2cccc(F)c2)c1 ZINC000591728967 478613654 /nfs/dbraw/zinc/61/36/54/478613654.db2.gz LUIWXBFYUGFEON-NJAFHUGGSA-N 0 3 346.358 2.619 20 5 EFBDHN C[C@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000601014020 478614013 /nfs/dbraw/zinc/61/40/13/478614013.db2.gz SQNAMWLLYBAPEI-FRRDWIJNSA-N 0 3 337.395 2.830 20 5 EFBDHN COc1cc(CN[C@@H]2CC[N@@H+](C3CCCCC3)C2)c([N+](=O)[O-])cc1[O-] ZINC000594978611 478615455 /nfs/dbraw/zinc/61/54/55/478615455.db2.gz SUTBIVNREFDFBA-CQSZACIVSA-N 0 3 349.431 2.806 20 5 EFBDHN COc1cc(CN[C@@H]2CC[N@H+](C3CCCCC3)C2)c([N+](=O)[O-])cc1[O-] ZINC000594978611 478615462 /nfs/dbraw/zinc/61/54/62/478615462.db2.gz SUTBIVNREFDFBA-CQSZACIVSA-N 0 3 349.431 2.806 20 5 EFBDHN COc1cc(CNCCCOC(C)(C)C)c([N+](=O)[O-])cc1OC ZINC000594978046 478616315 /nfs/dbraw/zinc/61/63/15/478616315.db2.gz WDOUIIYNQBATGL-UHFFFAOYSA-N 0 3 326.393 2.907 20 5 EFBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CNC[C@H](CO)CC2CC2)c1 ZINC000594981813 478617171 /nfs/dbraw/zinc/61/71/71/478617171.db2.gz AMHOFQJSOCSCEJ-LLVKDONJSA-N 0 3 330.331 2.694 20 5 EFBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CNC[C@@H](CO)CC2CC2)c1 ZINC000594981814 478617811 /nfs/dbraw/zinc/61/78/11/478617811.db2.gz AMHOFQJSOCSCEJ-NSHDSACASA-N 0 3 330.331 2.694 20 5 EFBDHN C[C@]1(c2ccccc2)C[C@H]1NC[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000591744334 478618697 /nfs/dbraw/zinc/61/86/97/478618697.db2.gz UFMLVEMMLUQWQF-QXAKKESOSA-N 0 3 342.395 2.654 20 5 EFBDHN COc1cc(CNC[C@@H](OC)C2CCCC2)c([N+](=O)[O-])cc1OC ZINC000594993404 478620259 /nfs/dbraw/zinc/62/02/59/478620259.db2.gz FDKADUQJRBTMJY-QGZVFWFLSA-N 0 3 338.404 2.907 20 5 EFBDHN CCCN1CC[C@@H](NCc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000594992420 478621010 /nfs/dbraw/zinc/62/10/10/478621010.db2.gz RCQCTWWAKKECAC-GFCCVEGCSA-N 0 3 329.347 2.770 20 5 EFBDHN CO[C@H](CNCc1cc2c(cc1[N+](=O)[O-])OCCO2)C1CCCC1 ZINC000594993003 478621032 /nfs/dbraw/zinc/62/10/32/478621032.db2.gz AXZXKBOOXBNPPB-QGZVFWFLSA-N 0 3 336.388 2.661 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@@H]1CC(=O)N(C(C)(C)C)C1 ZINC000594993368 478621234 /nfs/dbraw/zinc/62/12/34/478621234.db2.gz PQJJHQCNZJFPPD-ZDUSSCGKSA-N 0 3 349.431 2.730 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@H](CO)Cc1ccccc1 ZINC000595008663 478628213 /nfs/dbraw/zinc/62/82/13/478628213.db2.gz POUKSMWUCTXGEV-ZFWWWQNUSA-N 0 3 330.384 2.858 20 5 EFBDHN CN(C(=O)/C=C\c1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CCN(C2CC2)C1 ZINC000491684097 478631398 /nfs/dbraw/zinc/63/13/98/478631398.db2.gz CQXAVMNBQWMIPC-NMNMAYGDSA-N 0 3 349.818 2.957 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H]1CCN(c2ccccn2)C1 ZINC000595035192 478637451 /nfs/dbraw/zinc/63/74/51/478637451.db2.gz HPGCHYAXBIGFSO-UONOGXRCSA-N 0 3 342.399 2.928 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)N[C@@H](C)C1(OC)CCOCC1 ZINC000595044280 478638954 /nfs/dbraw/zinc/63/89/54/478638954.db2.gz KSHZSBWMOWKGHT-OLZOCXBDSA-N 0 3 338.404 2.838 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H](C)C1(OC)CCOCC1 ZINC000595044282 478638966 /nfs/dbraw/zinc/63/89/66/478638966.db2.gz KSHZSBWMOWKGHT-STQMWFEESA-N 0 3 338.404 2.838 20 5 EFBDHN O=[N+]([O-])c1ccc(OC[C@@]2(O)CCN(Cc3ccccc3)C2)c(F)c1 ZINC000601068557 478639888 /nfs/dbraw/zinc/63/98/88/478639888.db2.gz HCMAWZXFCSGMLT-GOSISDBHSA-N 0 3 346.358 2.750 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H]1CCC[C@H]([S@@](C)=O)C1 ZINC000595059726 478644870 /nfs/dbraw/zinc/64/48/70/478644870.db2.gz JRRJQLBKEALCGM-ODKKQSOXSA-N 0 3 340.445 2.944 20 5 EFBDHN Cn1ncc(C2CC2)c1CN[C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000595079843 478653513 /nfs/dbraw/zinc/65/35/13/478653513.db2.gz ZOMOBDJZGRJBBV-GJZGRUSLSA-N 0 3 344.419 2.676 20 5 EFBDHN CC(C)(CN[C@@H]1CCc2c1cccc2[N+](=O)[O-])[C@]1(O)CCCOC1 ZINC000595095646 478657836 /nfs/dbraw/zinc/65/78/36/478657836.db2.gz SCVLXYAPDJUTEU-QAPCUYQASA-N 0 3 334.416 2.739 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C\CNC[C@H](n1cncn1)C(F)(F)F ZINC000601144176 478684022 /nfs/dbraw/zinc/68/40/22/478684022.db2.gz FYTKTCOBJQMFOE-DXTPNHAXSA-N 0 3 341.293 2.593 20 5 EFBDHN CCCN(C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)[C@@H]1CCN(C)C1 ZINC000591925660 478709964 /nfs/dbraw/zinc/70/99/64/478709964.db2.gz KEZMBJZSDAKINS-XJKSGUPXSA-N 0 3 334.420 2.782 20 5 EFBDHN CCOC(=O)Cc1ccc(N[C@H]2C[C@H](C)N(C3CC3)C2)c([N+](=O)[O-])c1 ZINC000591926908 478710790 /nfs/dbraw/zinc/71/07/90/478710790.db2.gz WUVWKYWFDCYLSN-JSGCOSHPSA-N 0 3 347.415 2.738 20 5 EFBDHN O=C(N[C@@H]1CCN(C2CCCCC2)C1)c1ccc(F)cc1[N+](=O)[O-] ZINC000598220483 478711907 /nfs/dbraw/zinc/71/19/07/478711907.db2.gz PSWPRLPJLJMUNQ-CYBMUJFWSA-N 0 3 335.379 2.871 20 5 EFBDHN Cc1c(CC(=O)N[C@H](C)CN2CCC(C)CC2)cccc1[N+](=O)[O-] ZINC000598261513 478729940 /nfs/dbraw/zinc/72/99/40/478729940.db2.gz GAJMOHQNKZQXGD-CQSZACIVSA-N 0 3 333.432 2.682 20 5 EFBDHN C[C@@H]1C[C@H](N(C)C(=O)/C=C\c2ccc(F)cc2[N+](=O)[O-])CCN1C ZINC000491933954 478745323 /nfs/dbraw/zinc/74/53/23/478745323.db2.gz CSDZZNNSSDMMRR-SQWULWQPSA-N 0 3 335.379 2.688 20 5 EFBDHN C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)N[C@@H]1C[C@H]1C(F)(F)F ZINC000601306714 478776280 /nfs/dbraw/zinc/77/62/80/478776280.db2.gz PCDIRHDIYZHHOP-GGZOMVNGSA-N 0 3 331.294 2.852 20 5 EFBDHN CCN(Cc1onc(C)c1[N+](=O)[O-])[C@H]1CCN(Cc2ccccc2)C1 ZINC000595438378 478782457 /nfs/dbraw/zinc/78/24/57/478782457.db2.gz OQGWYVVRZABOSL-INIZCTEOSA-N 0 3 344.415 2.988 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C/CN[C@@H](CO)Cc1ccc(F)cc1 ZINC000500229150 478790125 /nfs/dbraw/zinc/79/01/25/478790125.db2.gz NFEDVRRTHNVOGB-NJELEJDNSA-N 0 3 330.359 2.940 20 5 EFBDHN CCc1ccc([C@@H](CO)NCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000543836157 478791671 /nfs/dbraw/zinc/79/16/71/478791671.db2.gz JJTJIRVGFXIZLG-GOSISDBHSA-N 0 3 330.384 2.859 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)N1C[C@@H](N)Cc2ccccc21 ZINC000583258427 478804948 /nfs/dbraw/zinc/80/49/48/478804948.db2.gz UHPPNAVGGQSOLP-ZDUSSCGKSA-N 0 3 341.367 2.524 20 5 EFBDHN C[C@@H](CN1CCC(C)CC1)NC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000595478140 478809250 /nfs/dbraw/zinc/80/92/50/478809250.db2.gz XYIIGROMZZXAOI-AWEZNQCLSA-N 0 3 334.420 2.514 20 5 EFBDHN C[C@H]1CC2(CN1Cc1cc([N+](=O)[O-])cc3c1OCOC3)CCOCC2 ZINC000592181814 478815982 /nfs/dbraw/zinc/81/59/82/478815982.db2.gz IAOZACBHENSACZ-ZDUSSCGKSA-N 0 3 348.399 2.852 20 5 EFBDHN Cc1ccccc1[C@H](CO)NCCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000583308681 478818622 /nfs/dbraw/zinc/81/86/22/478818622.db2.gz TVGXYMPRONZKMI-INIZCTEOSA-N 0 3 343.383 2.555 20 5 EFBDHN CCN1CCCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)C1 ZINC000595535408 478838970 /nfs/dbraw/zinc/83/89/70/478838970.db2.gz OEPBGSORGSYHQA-ZDUSSCGKSA-N 0 3 345.403 2.561 20 5 EFBDHN CCCN(C(=O)Nc1ccc(OC)c([N+](=O)[O-])c1)[C@H]1CCN(C)C1 ZINC000592244237 478838975 /nfs/dbraw/zinc/83/89/75/478838975.db2.gz FUIGWSNNDRJPFQ-ZDUSSCGKSA-N 0 3 336.392 2.551 20 5 EFBDHN CCN1CCCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H](C)C1 ZINC000595535288 478839159 /nfs/dbraw/zinc/83/91/59/478839159.db2.gz MDKPIAREOLDHIL-ZDUSSCGKSA-N 0 3 345.403 2.561 20 5 EFBDHN CCCN1CC[C@@H](NC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000595544224 478844983 /nfs/dbraw/zinc/84/49/83/478844983.db2.gz NJNRSKZWHQRTKN-UKRRQHHQSA-N 0 3 334.420 2.748 20 5 EFBDHN CC(C)(C)N1CCCN(c2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])CC1 ZINC000583458921 478857437 /nfs/dbraw/zinc/85/74/37/478857437.db2.gz CPAJLPQMWLJZPZ-UHFFFAOYSA-N 0 3 345.403 2.554 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1NC[C@H]1CCCN(C)C1 ZINC000583480206 478859775 /nfs/dbraw/zinc/85/97/75/478859775.db2.gz VJRSFMAMEWKWSO-SNVBAGLBSA-N 0 3 341.795 2.789 20 5 EFBDHN C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)NCc1ccc(CO)cc1 ZINC000592393164 478882052 /nfs/dbraw/zinc/88/20/52/478882052.db2.gz PRSVADOCNXDUJF-ZDUSSCGKSA-N 0 3 343.383 2.594 20 5 EFBDHN CCCCN(C)CCNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000545150257 478888972 /nfs/dbraw/zinc/88/89/72/478888972.db2.gz PYNQKDAPQMHAKD-UHFFFAOYSA-N 0 3 339.411 2.860 20 5 EFBDHN COC[C@H](NCCOc1ccc([N+](=O)[O-])cc1)c1cccc(OC)c1 ZINC000595685683 478935508 /nfs/dbraw/zinc/93/55/08/478935508.db2.gz YUFJFPGYHGYRLA-SFHVURJKSA-N 0 3 346.383 2.960 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CC[C@@]2(CCN(C)C2)C1 ZINC000583863650 478957632 /nfs/dbraw/zinc/95/76/32/478957632.db2.gz WPBUEGIDJMAQCO-GOSISDBHSA-N 0 3 331.416 2.688 20 5 EFBDHN C[C@@H](CN1CCC(C)CC1)NC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000595787408 478999164 /nfs/dbraw/zinc/99/91/64/478999164.db2.gz OXWBYHIAOPOMKG-HNNXBMFYSA-N 0 3 348.447 2.857 20 5 EFBDHN CCc1ccccc1CNC[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000565417399 479002836 /nfs/dbraw/zinc/00/28/36/479002836.db2.gz SAMWQMITXIOGGW-KRWDZBQOSA-N 0 3 330.384 2.687 20 5 EFBDHN O=C(Nc1ccc([N+](=O)[O-])cc1)C(C[C@H]1COCCO1)C(F)(F)F ZINC000598804287 479030534 /nfs/dbraw/zinc/03/05/34/479030534.db2.gz ZMBYXYLTAGOHJG-RYUDHWBXSA-N 0 3 348.277 2.517 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CCC3(C=Cc4ccccc4O3)CC2)c1 ZINC000595879920 479047188 /nfs/dbraw/zinc/04/71/88/479047188.db2.gz XGHFFDQUENSICF-UHFFFAOYSA-N 0 3 340.383 2.732 20 5 EFBDHN CCCN(C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[C@H]1CCN(C)C1 ZINC000592828355 479062461 /nfs/dbraw/zinc/06/24/61/479062461.db2.gz HOJLNHDGBOYWQU-HNNXBMFYSA-N 0 3 344.415 2.561 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H]1CCCN(c2ccnn2C)C1 ZINC000584271636 479071753 /nfs/dbraw/zinc/07/17/53/479071753.db2.gz COPZDWYQMGTPJL-LSDHHAIUSA-N 0 3 343.431 2.956 20 5 EFBDHN O=C(/C=C/c1cccc([N+](=O)[O-])c1)NC[C@@H]1CCCCN1C1CC1 ZINC000493615058 479082971 /nfs/dbraw/zinc/08/29/71/479082971.db2.gz FMQDNRDNWRBYMW-JEJOPICUSA-N 0 3 329.400 2.741 20 5 EFBDHN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)NC[C@H]1CCCCN1C1CC1 ZINC000493635955 479092596 /nfs/dbraw/zinc/09/25/96/479092596.db2.gz XGANYNLFNBHGDP-ACAQERRYSA-N 0 3 329.400 2.741 20 5 EFBDHN CC(C)N1CC[C@@H](N(C)C(=O)/C=C\c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000493671823 479108689 /nfs/dbraw/zinc/10/86/89/479108689.db2.gz COWHIXGLVNLLHB-ZQMJAJRESA-N 0 3 335.379 2.688 20 5 EFBDHN NC(=O)c1cc(NC[C@@H](c2ccco2)N2CCCC2)ccc1[N+](=O)[O-] ZINC000596055594 479111506 /nfs/dbraw/zinc/11/15/06/479111506.db2.gz SERXCEJATDUMII-HNNXBMFYSA-N 0 3 344.371 2.536 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@H]1CCCN1CC(F)F ZINC000598988315 479116550 /nfs/dbraw/zinc/11/65/50/479116550.db2.gz OFHXEEJCJFFBIN-CQSZACIVSA-N 0 3 343.374 2.813 20 5 EFBDHN COCCN1CCC[C@H](Nc2ccc3cnccc3c2[N+](=O)[O-])C1 ZINC000599039477 479135161 /nfs/dbraw/zinc/13/51/61/479135161.db2.gz IXIDBTUIHCQKEG-AWEZNQCLSA-N 0 3 330.388 2.666 20 5 EFBDHN COCCN1CCC[C@@H](Nc2ccc3cnccc3c2[N+](=O)[O-])C1 ZINC000599039478 479135253 /nfs/dbraw/zinc/13/52/53/479135253.db2.gz IXIDBTUIHCQKEG-CQSZACIVSA-N 0 3 330.388 2.666 20 5 EFBDHN Cc1ccc([C@@H](CNc2cc[nH]c(=O)c2[N+](=O)[O-])N2CCCC2)o1 ZINC000596108387 479142647 /nfs/dbraw/zinc/14/26/47/479142647.db2.gz BMEJHDUGCUDUQF-CYBMUJFWSA-N 0 3 332.360 2.846 20 5 EFBDHN O=c1[n-]ccc(N2CCC[C@H](C[NH+]3CCCCCC3)C2)c1[N+](=O)[O-] ZINC000596112322 479144901 /nfs/dbraw/zinc/14/49/01/479144901.db2.gz NSDWZXKGBFZKMU-CQSZACIVSA-N 0 3 334.420 2.788 20 5 EFBDHN CN1CCC[C@@]2(CCN(C(=O)/C=C\c3ccc(F)cc3[N+](=O)[O-])C2)C1 ZINC000493751575 479145031 /nfs/dbraw/zinc/14/50/31/479145031.db2.gz VMFPWURZCUXHOK-WLPBJKJWSA-N 0 3 347.390 2.691 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2NC[C@H]1CCCN1CC(F)F ZINC000599067239 479146633 /nfs/dbraw/zinc/14/66/33/479146633.db2.gz ZFKJNRAXTVLRFU-RISCZKNCSA-N 0 3 325.359 2.901 20 5 EFBDHN O=c1ccc([C@@H]2OCC[C@H]2N[C@H]2CCc3c2cccc3[N+](=O)[O-])c[nH]1 ZINC000599078872 479152426 /nfs/dbraw/zinc/15/24/26/479152426.db2.gz GOMXZQHTXAHXHW-DAYGRLMNSA-N 0 3 341.367 2.803 20 5 EFBDHN CCOc1ccc([C@H](C)NCCN(C)CC(F)F)cc1[N+](=O)[O-] ZINC000599095107 479159541 /nfs/dbraw/zinc/15/95/41/479159541.db2.gz RLKXDMATNSDJAB-NSHDSACASA-N 0 3 331.363 2.841 20 5 EFBDHN COc1cc(NC[C@]2(N(C)C)CCSC2)c([N+](=O)[O-])cc1C ZINC000596148466 479163820 /nfs/dbraw/zinc/16/38/20/479163820.db2.gz ASJZNKVYXISKPY-OAHLLOKOSA-N 0 3 325.434 2.761 20 5 EFBDHN CN(c1cc[n-]c(=O)c1[N+](=O)[O-])[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000596148159 479163909 /nfs/dbraw/zinc/16/39/09/479163909.db2.gz YUDIVKYDVQMJHP-HNNXBMFYSA-N 0 3 342.399 2.796 20 5 EFBDHN CN(c1cc[n-]c(=O)c1[N+](=O)[O-])[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000596148159 479163915 /nfs/dbraw/zinc/16/39/15/479163915.db2.gz YUDIVKYDVQMJHP-HNNXBMFYSA-N 0 3 342.399 2.796 20 5 EFBDHN Cc1nc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000593088010 479165436 /nfs/dbraw/zinc/16/54/36/479165436.db2.gz ZZAIKHLIUNVFPC-NXEZZACHSA-N 0 3 347.293 2.984 20 5 EFBDHN CC(C)[C@@H]1CN(c2c([N+](=O)[O-])ncn2C)CCN1Cc1ccccc1 ZINC000599143036 479178814 /nfs/dbraw/zinc/17/88/14/479178814.db2.gz NXFIWCWACKNXFW-INIZCTEOSA-N 0 3 343.431 2.675 20 5 EFBDHN COc1ccc(OCCN2CC[C@@H](c3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000573931337 479179102 /nfs/dbraw/zinc/17/91/02/479179102.db2.gz RTLROVWHFRJSNC-OAHLLOKOSA-N 0 3 343.383 2.867 20 5 EFBDHN COc1cc(CN(C)CCN2CCCCC2)c([N+](=O)[O-])cc1F ZINC000593111173 479180605 /nfs/dbraw/zinc/18/06/05/479180605.db2.gz FCOUYBXBPWEMJC-UHFFFAOYSA-N 0 3 325.384 2.660 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCC(C)(F)CC1 ZINC000602993214 479184736 /nfs/dbraw/zinc/18/47/36/479184736.db2.gz UKIRRXVVAVZJDM-UHFFFAOYSA-N 0 3 339.367 2.756 20 5 EFBDHN CS[C@H]1CN(c2cc(C)sc2[N+](=O)[O-])C[C@H]1N1CCCC1 ZINC000596195870 479191715 /nfs/dbraw/zinc/19/17/15/479191715.db2.gz PEERCRARTFJUKQ-OLZOCXBDSA-N 0 3 327.475 2.981 20 5 EFBDHN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)[C@@H]1CCN1C1CCCC1 ZINC000602150336 479203995 /nfs/dbraw/zinc/20/39/95/479203995.db2.gz HCJXYDMCOKBWDD-KRWDZBQOSA-N 0 3 331.416 2.613 20 5 EFBDHN C[C@H](Nc1ccc([N+](=O)[O-])c(C(N)=O)c1)[C@@H](c1ccccc1)N(C)C ZINC000596216734 479205618 /nfs/dbraw/zinc/20/56/18/479205618.db2.gz LKKNWEYFCFSWER-SJCJKPOMSA-N 0 3 342.399 2.797 20 5 EFBDHN O=[N+]([O-])c1cnc(NC[C@@H]2CCN(C3CC3)C2)c(C(F)(F)F)c1 ZINC000556842659 479222309 /nfs/dbraw/zinc/22/23/09/479222309.db2.gz IZRMYLZDYUTPFM-VIFPVBQESA-N 0 3 330.310 2.905 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)N(C)CCN1CCCCC1 ZINC000593182433 479225842 /nfs/dbraw/zinc/22/58/42/479225842.db2.gz NMWIXIWFNLCHIS-UHFFFAOYSA-N 0 3 336.392 2.553 20 5 EFBDHN CN(CCCN(C)C(=O)c1ccc([N+](=O)[O-])cc1)Cc1ccncc1 ZINC000556933597 479238713 /nfs/dbraw/zinc/23/87/13/479238713.db2.gz IDVRGDPJFZUSAA-UHFFFAOYSA-N 0 3 342.399 2.584 20 5 EFBDHN Cc1cccc(C(=O)N2CCCN(c3ccncc3)CC2)c1[N+](=O)[O-] ZINC000603083389 479238984 /nfs/dbraw/zinc/23/89/84/479238984.db2.gz LTEPBGLTONKAGH-UHFFFAOYSA-N 0 3 340.383 2.651 20 5 EFBDHN Cc1c(Cn2cc(CCN3CCCCC3)nn2)cccc1[N+](=O)[O-] ZINC000603196417 479298039 /nfs/dbraw/zinc/29/80/39/479298039.db2.gz JZGZJQDZAOXSLZ-UHFFFAOYSA-N 0 3 329.404 2.571 20 5 EFBDHN C[C@@H](CN1CCC(C)CC1)Nc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000596487589 479314727 /nfs/dbraw/zinc/31/47/27/479314727.db2.gz IICKTNWVBWMCQC-LBPRGKRZSA-N 0 3 345.403 2.776 20 5 EFBDHN C[C@@H]1CN(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H](C)C1(F)F ZINC000599511848 479317590 /nfs/dbraw/zinc/31/75/90/479317590.db2.gz BYXNIOVYEBYQFN-MBNYWOFBSA-N 0 3 344.358 2.558 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C\CN1CCCN(C[C@H]2CCCO2)CC1 ZINC000611254049 479324291 /nfs/dbraw/zinc/32/42/91/479324291.db2.gz KFXRYXCSIAKSTJ-BKSIFSGMSA-N 0 3 345.443 2.795 20 5 EFBDHN O=[N+]([O-])c1ccc2ncnc(NC[C@@H]3CCN3Cc3ccccc3)c2c1 ZINC000596556318 479338473 /nfs/dbraw/zinc/33/84/73/479338473.db2.gz AMQVJGMHNRRVJI-INIZCTEOSA-N 0 3 349.394 2.646 20 5 EFBDHN Cc1c(CN[C@@H]2CCO[C@H]2c2ccc(=O)[nH]c2)cccc1[N+](=O)[O-] ZINC000599630925 479360531 /nfs/dbraw/zinc/36/05/31/479360531.db2.gz VDYGGTVFGDGRKV-PBHICJAKSA-N 0 3 329.356 2.624 20 5 EFBDHN C[C@@H]1[C@H](C)N(Cc2ccccc2)[C@@H](C)CN1c1c([N+](=O)[O-])ncn1C ZINC000593483852 479361335 /nfs/dbraw/zinc/36/13/35/479361335.db2.gz JVDGSEMIMIMNQD-SOUVJXGZSA-N 0 3 343.431 2.816 20 5 EFBDHN C[C@H](NC[C@@H](O)CN(C)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000611383427 479363333 /nfs/dbraw/zinc/36/33/33/479363333.db2.gz KHIWOZKOOAOOIQ-HNAYVOBHSA-N 0 3 343.427 2.738 20 5 EFBDHN O=[N+]([O-])c1ccsc1NC[C@@]1(O)CCN(Cc2ccccc2)C1 ZINC000611413145 479372221 /nfs/dbraw/zinc/37/22/21/479372221.db2.gz UNUXTDMONQDAJC-INIZCTEOSA-N 0 3 333.413 2.705 20 5 EFBDHN CCN1CCC[C@H]1CNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602510133 479374990 /nfs/dbraw/zinc/37/49/90/479374990.db2.gz QZSCTPRAUORFKV-VIFPVBQESA-N 0 3 348.266 2.993 20 5 EFBDHN CCNC(=O)c1cccc(CNCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000602520663 479378651 /nfs/dbraw/zinc/37/86/51/479378651.db2.gz LAANRSMWVBUCMR-UHFFFAOYSA-N 0 3 327.384 2.677 20 5 EFBDHN CCN(Cc1ccccc1)C(=O)CNCCc1ccc([N+](=O)[O-])cc1 ZINC000602531611 479383857 /nfs/dbraw/zinc/38/38/57/479383857.db2.gz YLJBWXGEXWEMTR-UHFFFAOYSA-N 0 3 341.411 2.776 20 5 EFBDHN COc1ccc(C(=O)N2CCCc3cccc(CN)c32)cc1[N+](=O)[O-] ZINC000602539477 479387492 /nfs/dbraw/zinc/38/74/92/479387492.db2.gz GOFOVUCIEXCUKG-UHFFFAOYSA-N 0 3 341.367 2.655 20 5 EFBDHN COC(=O)c1csc(CNCCOc2ccc([N+](=O)[O-])cc2)c1 ZINC000602540552 479388719 /nfs/dbraw/zinc/38/87/19/479388719.db2.gz PNUPFOPXNAQPIR-UHFFFAOYSA-N 0 3 336.369 2.612 20 5 EFBDHN COc1cc(N2CCN(C)[C@@H](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000588053688 479388796 /nfs/dbraw/zinc/38/87/96/479388796.db2.gz ZIDXQARGXDVMBK-KRWDZBQOSA-N 0 3 341.411 2.967 20 5 EFBDHN Cc1c(CC(=O)N2CCCc3cccc(CN)c32)cccc1[N+](=O)[O-] ZINC000602540807 479389172 /nfs/dbraw/zinc/38/91/72/479389172.db2.gz UCHANJOLUUGFNS-UHFFFAOYSA-N 0 3 339.395 2.884 20 5 EFBDHN O=[N+]([O-])c1sc(CNCC2(O)CCCC2)cc1Br ZINC000602547077 479391428 /nfs/dbraw/zinc/39/14/28/479391428.db2.gz PNFRGYUDJKKXFY-UHFFFAOYSA-N 0 3 335.223 2.814 20 5 EFBDHN CSC[C@](C)(O)CNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602550673 479392722 /nfs/dbraw/zinc/39/27/22/479392722.db2.gz MKGLHDLUWRSUIV-GFCCVEGCSA-N 0 3 338.351 2.817 20 5 EFBDHN C[C@@H](O)C[C@@H](C)CNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602557771 479397202 /nfs/dbraw/zinc/39/72/02/479397202.db2.gz ILKUPTNOTDRITE-HTQZYQBOSA-N 0 3 337.239 2.915 20 5 EFBDHN CN1CC=C(CNCc2cc(Br)c([N+](=O)[O-])s2)CC1 ZINC000602580158 479408869 /nfs/dbraw/zinc/40/88/69/479408869.db2.gz DLKXKMGHRCJQJF-UHFFFAOYSA-N 0 3 346.250 2.770 20 5 EFBDHN O=[N+]([O-])c1sc(CN[C@@H](CO)CC2CC2)cc1Br ZINC000602583466 479409930 /nfs/dbraw/zinc/40/99/30/479409930.db2.gz WYPJBNQDQFBPNX-MRVPVSSYSA-N 0 3 335.223 2.669 20 5 EFBDHN COc1ccc(CN(C)C)cc1NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000603589771 479410406 /nfs/dbraw/zinc/41/04/06/479410406.db2.gz AJKDBEUBDOXTCI-UHFFFAOYSA-N 0 3 335.385 2.979 20 5 EFBDHN O=[N+]([O-])c1sc(CNC2(CO)CCCC2)cc1Br ZINC000602587467 479412492 /nfs/dbraw/zinc/41/24/92/479412492.db2.gz HMRLZIAWWCIRIR-UHFFFAOYSA-N 0 3 335.223 2.814 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNCCN1CCSCC1 ZINC000602595584 479416541 /nfs/dbraw/zinc/41/65/41/479416541.db2.gz ZKTWHEOIBWYKNU-UHFFFAOYSA-N 0 3 349.378 2.752 20 5 EFBDHN COc1ccc(OCCN(C)CCOc2cccc([N+](=O)[O-])c2)cc1 ZINC000603661576 479417434 /nfs/dbraw/zinc/41/74/34/479417434.db2.gz FMFOAHRJYYBTBA-UHFFFAOYSA-N 0 3 346.383 2.993 20 5 EFBDHN CCN1C[C@H](CNCc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1=O ZINC000593684803 479422586 /nfs/dbraw/zinc/42/25/86/479422586.db2.gz BBOHPPWXEVXODK-ZDUSSCGKSA-N 0 3 343.383 2.813 20 5 EFBDHN CCN1C[C@@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1=O ZINC000593684792 479422982 /nfs/dbraw/zinc/42/29/82/479422982.db2.gz AZUBTZAZEHNQBV-CYBMUJFWSA-N 0 3 343.383 2.813 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2ccc(CNCC[C@]3(O)CCCOC3)o2)c1 ZINC000593691033 479424439 /nfs/dbraw/zinc/42/44/39/479424439.db2.gz JNEYANZUJIYSHT-GOSISDBHSA-N 0 3 346.383 2.876 20 5 EFBDHN C[C@H]1CN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])CCN(C2CCC2)C1 ZINC000593722118 479433881 /nfs/dbraw/zinc/43/38/81/479433881.db2.gz UFSVIXQUNQRRRZ-CYBMUJFWSA-N 0 3 349.406 2.609 20 5 EFBDHN CC1(C)C[C@H](NCC[C@]2(O)CCCOC2)c2cc([N+](=O)[O-])ccc21 ZINC000593719549 479434045 /nfs/dbraw/zinc/43/40/45/479434045.db2.gz FIORSQBHJQLCHZ-FUHWJXTLSA-N 0 3 334.416 2.838 20 5 EFBDHN CCOc1ccc([C@@H](C)NCC[C@]2(O)CCCOC2)cc1[N+](=O)[O-] ZINC000593720957 479434261 /nfs/dbraw/zinc/43/42/61/479434261.db2.gz NMXWLSFFWNCOEM-CXAGYDPISA-N 0 3 338.404 2.576 20 5 EFBDHN Cc1c(CN2CCCN(C[C@H]3CCCO3)CC2)cccc1[N+](=O)[O-] ZINC000603848826 479438218 /nfs/dbraw/zinc/43/82/18/479438218.db2.gz XONJFUQQSGDGCD-QGZVFWFLSA-N 0 3 333.432 2.590 20 5 EFBDHN CO[C@H](CNCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@H]1CCOC1 ZINC000602641483 479442809 /nfs/dbraw/zinc/44/28/09/479442809.db2.gz SCFBGFRBQQLJGK-SMDDNHRTSA-N 0 3 348.321 2.755 20 5 EFBDHN Cc1cc(CNCCc2ccc([N+](=O)[O-])cc2)nc(N2CCCC2)n1 ZINC000602673219 479467614 /nfs/dbraw/zinc/46/76/14/479467614.db2.gz PXYGEVBOMNRTDR-UHFFFAOYSA-N 0 3 341.415 2.626 20 5 EFBDHN O=[N+]([O-])c1sc(CN[C@H]2CC[C@@H](CO)C2)cc1Br ZINC000602675892 479468828 /nfs/dbraw/zinc/46/88/28/479468828.db2.gz AGSBDRMCJJKRJR-SFYZADRCSA-N 0 3 335.223 2.669 20 5 EFBDHN CCCN1CC[C@H](NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000596881138 479470384 /nfs/dbraw/zinc/47/03/84/479470384.db2.gz IORZRJYQAZRSLC-AWEZNQCLSA-N 0 3 334.420 2.613 20 5 EFBDHN CCn1cc([C@@H](C)NC2CCN(c3ccc([N+](=O)[O-])nc3)CC2)cn1 ZINC000602680199 479470558 /nfs/dbraw/zinc/47/05/58/479470558.db2.gz KAGFZQZBAJUSPM-CYBMUJFWSA-N 0 3 344.419 2.526 20 5 EFBDHN CCCN1CC[C@@H](NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)C1 ZINC000596882366 479470922 /nfs/dbraw/zinc/47/09/22/479470922.db2.gz QKZXUFOGMYVJNV-OAHLLOKOSA-N 0 3 346.431 2.753 20 5 EFBDHN CCC1(CNCc2cc(Br)c([N+](=O)[O-])s2)COC1 ZINC000602681516 479472160 /nfs/dbraw/zinc/47/21/60/479472160.db2.gz AZZUWJUEUQFURR-UHFFFAOYSA-N 0 3 335.223 2.935 20 5 EFBDHN CCN(C(=O)c1cc2cc([N+](=O)[O-])ccc2o1)C1CCN(C)CC1 ZINC000599985787 479487361 /nfs/dbraw/zinc/48/73/61/479487361.db2.gz IQYAXXBNQYPSFQ-UHFFFAOYSA-N 0 3 331.372 2.897 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CNCc1ccc(CC(N)=O)cc1 ZINC000589320772 479512331 /nfs/dbraw/zinc/51/23/31/479512331.db2.gz MGNQEZJHHFDACO-ZROIWOOFSA-N 0 3 339.395 2.816 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1ccc(CC(N)=O)cc1 ZINC000589344850 479516877 /nfs/dbraw/zinc/51/68/77/479516877.db2.gz QUMWLDVCZQSWKX-CYBMUJFWSA-N 0 3 327.384 2.782 20 5 EFBDHN COC1(CO)CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000618621280 479518327 /nfs/dbraw/zinc/51/83/27/479518327.db2.gz IHBFFVKWFPHCPP-UHFFFAOYSA-N 0 3 346.383 2.828 20 5 EFBDHN CNc1ccc(C(=O)N2CCCN(C(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000604491273 479526927 /nfs/dbraw/zinc/52/69/27/479526927.db2.gz DTYYHVYKSWKUNH-UHFFFAOYSA-N 0 3 334.420 2.583 20 5 EFBDHN CN(C)CCN(Cc1ccccn1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000594001630 479542331 /nfs/dbraw/zinc/54/23/31/479542331.db2.gz ZJHWRSCOKAUFRD-UHFFFAOYSA-N 0 3 332.379 2.693 20 5 EFBDHN COc1ccccc1[C@H]1CCN(CCn2c(C)ncc2[N+](=O)[O-])C1 ZINC000602781576 479547738 /nfs/dbraw/zinc/54/77/38/479547738.db2.gz TZPLVHOBCGWGEU-AWEZNQCLSA-N 0 3 330.388 2.598 20 5 EFBDHN O=[N+]([O-])c1ccn(C2CCN(Cc3cccc4n[nH]cc43)CC2)n1 ZINC000600157052 479550146 /nfs/dbraw/zinc/55/01/46/479550146.db2.gz YLVURUOHGRFJRQ-UHFFFAOYSA-N 0 3 326.360 2.505 20 5 EFBDHN CCC(C)(C)N1CCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000594021667 479554257 /nfs/dbraw/zinc/55/42/57/479554257.db2.gz YLCYUAHDBMHFSK-UHFFFAOYSA-N 0 3 349.431 2.768 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2NC[C@@H](O)COc1ccccc1 ZINC000576172091 479556364 /nfs/dbraw/zinc/55/63/64/479556364.db2.gz DBBXVXMFZPRJJU-CXAGYDPISA-N 0 3 328.368 2.612 20 5 EFBDHN O=C(CCN1CCC[C@H](OC2CCC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000594027602 479557371 /nfs/dbraw/zinc/55/73/71/479557371.db2.gz XAMFFBMADLCINF-KRWDZBQOSA-N 0 3 347.415 2.957 20 5 EFBDHN CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@]1(CO)CCOC1 ZINC000600178638 479566252 /nfs/dbraw/zinc/56/62/52/479566252.db2.gz NGMLNIJFBRTSGX-KRWDZBQOSA-N 0 3 348.424 2.907 20 5 EFBDHN COc1ccc(NC(=O)N[C@H]2CCCN3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC000594077866 479581447 /nfs/dbraw/zinc/58/14/47/479581447.db2.gz BAOFLUBHMMFOER-UONOGXRCSA-N 0 3 348.403 2.742 20 5 EFBDHN COC[C@H](NCCn1c(C)ncc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000602833297 479582646 /nfs/dbraw/zinc/58/26/46/479582646.db2.gz NMJOPOVSIKRUBW-AWEZNQCLSA-N 0 3 338.795 2.730 20 5 EFBDHN COc1ccc(CN[C@H]2CC[C@@](O)(C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000589939142 479583621 /nfs/dbraw/zinc/58/36/21/479583621.db2.gz ULUSQKAMMFWZLT-GWCFXTLKSA-N 0 3 334.294 2.539 20 5 EFBDHN COc1ccc(CN[C@H]2CC[C@](O)(C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000589939144 479583794 /nfs/dbraw/zinc/58/37/94/479583794.db2.gz ULUSQKAMMFWZLT-GXFFZTMASA-N 0 3 334.294 2.539 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN[C@@H](c1ccccc1)C1(CO)CCC1 ZINC000602841923 479586882 /nfs/dbraw/zinc/58/68/82/479586882.db2.gz UNMOMLWCGQCXSX-KRWDZBQOSA-N 0 3 344.415 2.593 20 5 EFBDHN CC1(C)CN(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)[C@@H]2CCC[C@@H]21 ZINC000590203730 479617171 /nfs/dbraw/zinc/61/71/71/479617171.db2.gz QPFJBCSMGLAYFW-DOTOQJQBSA-N 0 3 343.427 2.994 20 5 EFBDHN C[C@H](C(=O)N[C@@H]1CCCN2CCCC[C@H]12)c1cccc([N+](=O)[O-])c1 ZINC000594195424 479625330 /nfs/dbraw/zinc/62/53/30/479625330.db2.gz GYDAQJXKKPFOHM-IAOVAPTHSA-N 0 3 331.416 2.831 20 5 EFBDHN O=C(CCc1cccc([N+](=O)[O-])c1)N[C@H]1CCCN2CCCC[C@@H]12 ZINC000594198709 479629285 /nfs/dbraw/zinc/62/92/85/479629285.db2.gz VEJGFQKJQNUVCV-IRXDYDNUSA-N 0 3 331.416 2.661 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCCN2CCCC[C@H]12 ZINC000594199399 479629392 /nfs/dbraw/zinc/62/93/92/479629392.db2.gz YIOPHDNJWYONBB-ZIAGYGMSSA-N 0 3 347.415 2.740 20 5 EFBDHN O=C(CCNc1ccccc1[N+](=O)[O-])N[C@@H]1CCCN2CCCC[C@@H]12 ZINC000594204025 479631165 /nfs/dbraw/zinc/63/11/65/479631165.db2.gz WMONILSEJXTTID-CVEARBPZSA-N 0 3 346.431 2.530 20 5 EFBDHN CC[C@H]1CN(C)CCCN1C(=O)c1ccc(SC)c([N+](=O)[O-])c1 ZINC000590344427 479634032 /nfs/dbraw/zinc/63/40/32/479634032.db2.gz MBLKAEGGCJUTSR-ZDUSSCGKSA-N 0 3 337.445 2.873 20 5 EFBDHN CC(C)(CO)[C@H](NCCc1ccc([N+](=O)[O-])cc1)c1cccnc1 ZINC000590601156 479667001 /nfs/dbraw/zinc/66/70/01/479667001.db2.gz OURWFJMYTJYVJS-QGZVFWFLSA-N 0 3 329.400 2.882 20 5 EFBDHN Cc1c(CN2CCC([C@H]3NC(=O)C3(C)C)CC2)cccc1[N+](=O)[O-] ZINC000590601354 479667256 /nfs/dbraw/zinc/66/72/56/479667256.db2.gz SHXYIUNUGXFIBI-MRXNPFEDSA-N 0 3 331.416 2.640 20 5 EFBDHN COc1ccc(OCCN[C@@H](C)c2c(C)noc2C)c([N+](=O)[O-])c1 ZINC000612461815 479677240 /nfs/dbraw/zinc/67/72/40/479677240.db2.gz WYDHBSRQAOEXTH-JTQLQIEISA-N 0 3 335.360 2.938 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCC(F)(F)CC1 ZINC000619516189 479816304 /nfs/dbraw/zinc/81/63/04/479816304.db2.gz SREYQAULWKBEEV-UHFFFAOYSA-N 0 3 343.330 2.663 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1CN[C@@H](CO)[C@@H](C)c1ccccc1 ZINC000619532018 479820616 /nfs/dbraw/zinc/82/06/16/479820616.db2.gz XNRXCWQQFCJRAM-GUYCJALGSA-N 0 3 330.384 2.858 20 5 EFBDHN CC[C@H](CN1CCCC1)NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000609833688 480211294 /nfs/dbraw/zinc/21/12/94/480211294.db2.gz UOWUJPFSJQZGSK-CYBMUJFWSA-N 0 3 337.445 2.678 20 5 EFBDHN CN(C)[C@@H](CNc1ncnc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000609848395 480211709 /nfs/dbraw/zinc/21/17/09/480211709.db2.gz BAWPKRQQDXVVEC-KRWDZBQOSA-N 0 3 337.383 2.675 20 5 EFBDHN CC[C@H](CN1CCCC1)NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000609851249 480213009 /nfs/dbraw/zinc/21/30/09/480213009.db2.gz YXJJEERHMQDALJ-CQSZACIVSA-N 0 3 346.431 2.773 20 5 EFBDHN C[C@H]1CCCCC[C@@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000614191509 480221195 /nfs/dbraw/zinc/22/11/95/480221195.db2.gz HDAMIGQVZQGRIK-BBRMVZONSA-N 0 3 340.445 2.927 20 5 EFBDHN CSc1cccc(C(=O)N[C@H]2CCN(CC3CC3)C2)c1[N+](=O)[O-] ZINC000614445240 480309575 /nfs/dbraw/zinc/30/95/75/480309575.db2.gz PRHYSHRBFWRDQS-LBPRGKRZSA-N 0 3 335.429 2.531 20 5 EFBDHN CC[C@H](CN1CCCC1)NC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000610717236 480373304 /nfs/dbraw/zinc/37/33/04/480373304.db2.gz CVZIHAOVZARIJS-GFCCVEGCSA-N 0 3 336.392 2.599 20 5 EFBDHN C[C@@H](c1ccccc1)[C@H](CO)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000618306371 480614493 /nfs/dbraw/zinc/61/44/93/480614493.db2.gz AKRAMMUHMJOGPM-SJCJKPOMSA-N 0 3 340.383 2.725 20 5 EFBDHN C[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C(=O)N(C)C ZINC000191731609 533912376 /nfs/dbraw/zinc/91/23/76/533912376.db2.gz XGJPJJKUBOVOIW-NSHDSACASA-N 0 3 333.413 2.890 20 5 EFBDHN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CC[C@@H]2CC[C@H](C1)N2C ZINC000191345438 534055765 /nfs/dbraw/zinc/05/57/65/534055765.db2.gz ODIVEWSKFOHCGY-UONOGXRCSA-N 0 3 332.404 2.912 20 5 EFBDHN CC(C)(C)N1C[C@@H](N[C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1=O ZINC000090177809 518719093 /nfs/dbraw/zinc/71/90/93/518719093.db2.gz RSDAIHHNGZHDGS-JKSUJKDBSA-N 0 3 345.443 2.905 20 5 EFBDHN CC(C)[C@H](CCO)NCc1ccc(Br)cc1[N+](=O)[O-] ZINC000231072043 519813922 /nfs/dbraw/zinc/81/39/22/519813922.db2.gz QJWRPRUGLMUVAK-LBPRGKRZSA-N 0 3 331.210 2.854 20 5 EFBDHN CCCCN(C)CCNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000117801205 520403405 /nfs/dbraw/zinc/40/34/05/520403405.db2.gz VAAFXRHKODNPEJ-UHFFFAOYSA-N 0 3 327.812 2.639 20 5 EFBDHN CCOc1ccc(C(=O)NC[C@@H](C)N2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000067272582 520909394 /nfs/dbraw/zinc/90/93/94/520909394.db2.gz PXFUVWALDQFSKI-CQSZACIVSA-N 0 3 349.431 2.844 20 5 EFBDHN CCN1CCC(N(C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000157485512 521563780 /nfs/dbraw/zinc/56/37/80/521563780.db2.gz HCQUQIZHNJWNNA-UHFFFAOYSA-N 0 3 345.403 2.561 20 5 EFBDHN CN(C)[C@H]1Cc2ccccc2N(C(=O)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000067207702 522107819 /nfs/dbraw/zinc/10/78/19/522107819.db2.gz KSNNOFRALQQGQL-KRWDZBQOSA-N 0 3 339.395 2.657 20 5 EFBDHN COc1ccc(-c2ccc(CNCC3(C)COC3)o2)c([N+](=O)[O-])c1 ZINC000112711788 523131123 /nfs/dbraw/zinc/13/11/23/523131123.db2.gz YALTWYDFSGFVCV-UHFFFAOYSA-N 0 3 332.356 2.990 20 5 EFBDHN COc1ccc(C(=O)N(CCN(C)C)c2ccccc2)cc1[N+](=O)[O-] ZINC000063829599 523614285 /nfs/dbraw/zinc/61/42/85/523614285.db2.gz MHCNJSRXNUIYRK-UHFFFAOYSA-N 0 3 343.383 2.812 20 5 EFBDHN CN1CCC(N(Cc2ccco2)C(=O)c2ccc([N+](=O)[O-])o2)CC1 ZINC000078491146 523768649 /nfs/dbraw/zinc/76/86/49/523768649.db2.gz FGOHITJMNZZCDX-UHFFFAOYSA-N 0 3 333.344 2.517 20 5 EFBDHN CN(C)CCN(C(=O)Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000151081575 524058824 /nfs/dbraw/zinc/05/88/24/524058824.db2.gz NXLGYAPDOZKIPE-UHFFFAOYSA-N 0 3 345.374 2.871 20 5 EFBDHN CN(C)CCN(C)C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000080389878 524060475 /nfs/dbraw/zinc/06/04/75/524060475.db2.gz RCZVZRBXIYGMOD-UHFFFAOYSA-N 0 3 342.399 2.972 20 5 EFBDHN COc1ccc(CNC[C@@H](C)O)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000061011986 524071672 /nfs/dbraw/zinc/07/16/72/524071672.db2.gz RLQIIODIVBLAJA-CYBMUJFWSA-N 0 3 346.383 2.653 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)NCc2cccc(CN(C)C)c2)c1 ZINC000067793063 525448106 /nfs/dbraw/zinc/44/81/06/525448106.db2.gz IMRQBMYTVJVZFW-UHFFFAOYSA-N 0 3 343.383 2.595 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(CN(C)C)c2)c1 ZINC000067547826 525449339 /nfs/dbraw/zinc/44/93/39/525449339.db2.gz ZBZLFHMBBASGMF-UHFFFAOYSA-N 0 3 329.356 2.917 20 5 EFBDHN C[C@@H](NCCNC(=O)c1ccccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000178648774 525450170 /nfs/dbraw/zinc/45/01/70/525450170.db2.gz FJLPGZLPXAFORI-GFCCVEGCSA-N 0 3 331.347 2.815 20 5 EFBDHN Cc1c(CN2CCC[C@H](c3nnc4n3CCC4)C2)cccc1[N+](=O)[O-] ZINC000195520584 525706799 /nfs/dbraw/zinc/70/67/99/525706799.db2.gz JIWSAUPCQFNZOS-HNNXBMFYSA-N 0 3 341.415 2.821 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCN2CCSC3(CCOCC3)C2)c1 ZINC000186800056 534886152 /nfs/dbraw/zinc/88/61/52/534886152.db2.gz HAGGUNYQOZBDRG-UHFFFAOYSA-N 0 3 338.429 2.572 20 5 EFBDHN Cc1ccc([C@H](C)NC[C@@H](C(C)C)N2CCOCC2)cc1[N+](=O)[O-] ZINC000120077832 525923531 /nfs/dbraw/zinc/92/35/31/525923531.db2.gz LNGGTLOGANQLHV-YJBOKZPZSA-N 0 3 335.448 2.911 20 5 EFBDHN O=C(CCN1CCC[C@@H](c2cc[nH]n2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000193860457 526485492 /nfs/dbraw/zinc/48/54/92/526485492.db2.gz IBVCINXVUIPXQI-CYBMUJFWSA-N 0 3 343.387 2.526 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@@H]2CCN(CCOc3cccc(F)c3)C2)nc1 ZINC000118866346 527368219 /nfs/dbraw/zinc/36/82/19/527368219.db2.gz MWQVVMSZCDQEMS-CQSZACIVSA-N 0 3 346.362 2.694 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@H]2CCN(CCOc3cccc(F)c3)C2)nc1 ZINC000118866343 527368359 /nfs/dbraw/zinc/36/83/59/527368359.db2.gz MWQVVMSZCDQEMS-AWEZNQCLSA-N 0 3 346.362 2.694 20 5 EFBDHN Cn1cccc1[C@H]1CCCN1C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000193280123 527410475 /nfs/dbraw/zinc/41/04/75/527410475.db2.gz OTZKATLGKXCUDX-MAUKXSAKSA-N 0 3 345.399 2.510 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CCC(c3nc4ccccc4o3)CC2)c1 ZINC000157381597 527414349 /nfs/dbraw/zinc/41/43/49/527414349.db2.gz XJXCMGFDURQBQV-UHFFFAOYSA-N 0 3 341.371 2.812 20 5 EFBDHN CCOc1ccc([C@@H](C)N[C@H]2CCN(C(=O)CC)C2)cc1[N+](=O)[O-] ZINC000154265704 528598456 /nfs/dbraw/zinc/59/84/56/528598456.db2.gz ZWHWISMIWZZMLZ-OCCSQVGLSA-N 0 3 335.404 2.655 20 5 EFBDHN CC(C)Oc1cc(C(=O)N(C)C[C@@H]2CCCN2C)ccc1[N+](=O)[O-] ZINC000421710299 534941548 /nfs/dbraw/zinc/94/15/48/534941548.db2.gz JVIJWRRGKFJYMD-AWEZNQCLSA-N 0 3 335.404 2.548 20 5 EFBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCN(C)[C@H](C)C1 ZINC000341205071 535093530 /nfs/dbraw/zinc/09/35/30/535093530.db2.gz QKRJYXHMLNRHEQ-ZBFHGGJFSA-N 0 3 348.447 2.998 20 5 EFBDHN CCCCN(C)CCNC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000342652678 535222091 /nfs/dbraw/zinc/22/20/91/535222091.db2.gz JYRQVGIGELCDEZ-UHFFFAOYSA-N 0 3 342.827 2.779 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)CCOc1cc(C)ccc1[N+](=O)[O-] ZINC000344757949 535503993 /nfs/dbraw/zinc/50/39/93/535503993.db2.gz ITVONHFRJODVJR-HNNXBMFYSA-N 0 3 349.431 2.663 20 5 EFBDHN CCOCCCN1CC[C@H](Nc2ncc([N+](=O)[O-])s2)[C@H](C)C1 ZINC000192456747 535527309 /nfs/dbraw/zinc/52/73/09/535527309.db2.gz VGJHCGRPPOYSDY-NEPJUHHUSA-N 0 3 328.438 2.600 20 5 EFBDHN CN(C)CCOC1CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)CC1 ZINC000356228978 535892311 /nfs/dbraw/zinc/89/23/11/535892311.db2.gz UBHCZLVQOCZYGZ-UHFFFAOYSA-N 0 3 344.415 2.690 20 5 EFBDHN CN(C)CCOC1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000360016113 535893126 /nfs/dbraw/zinc/89/31/26/535893126.db2.gz LMFASSQWLQOUFO-UHFFFAOYSA-N 0 3 341.839 2.791 20 5 EFBDHN CC[C@H](NCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])[C@H]1CC1(C)C ZINC000419321814 535896010 /nfs/dbraw/zinc/89/60/10/535896010.db2.gz ROTOPSFQKIBKRO-OLZOCXBDSA-N 0 3 335.404 2.956 20 5 EFBDHN CC[C@H](NCC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)[C@@H]1CC1(C)C ZINC000419316900 535896462 /nfs/dbraw/zinc/89/64/62/535896462.db2.gz MEVZYCHSGUISJU-QWRGUYRKSA-N 0 3 349.387 2.676 20 5 EFBDHN CN(C)Cc1ccc(CNC(=O)c2cc(F)cc([N+](=O)[O-])c2)cc1 ZINC000342933543 536009958 /nfs/dbraw/zinc/00/99/58/536009958.db2.gz ZCSHYWBFJOFEDZ-UHFFFAOYSA-N 0 3 331.347 2.726 20 5 EFBDHN COc1cc(C(=O)N[C@H](C)CN2CCC[C@@H](C)C2)cc([N+](=O)[O-])c1C ZINC000253271716 536513751 /nfs/dbraw/zinc/51/37/51/536513751.db2.gz AQKIQGVULGVBQQ-CHWSQXEVSA-N 0 3 349.431 2.762 20 5 EFBDHN O=[N+]([O-])c1ccc([C@H](O)CNCc2ccc(-n3cccn3)cc2)cc1 ZINC000754251912 575411162 /nfs/dbraw/zinc/41/11/62/575411162.db2.gz YTDHMEYDNOJRRQ-GOSISDBHSA-N 0 3 338.367 2.604 20 5 EFBDHN C[C@H](N[C@@]1(C)CCO[C@@H]1C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000755170385 575555500 /nfs/dbraw/zinc/55/55/00/575555500.db2.gz QIIMIZPEBWOFSY-WMFXKJRFSA-N 0 3 341.795 2.732 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)CCN1C ZINC000756950059 575804525 /nfs/dbraw/zinc/80/45/25/575804525.db2.gz ASWNUONJCRJWID-JQWIXIFHSA-N 0 3 340.811 2.530 20 5 EFBDHN CN(C)CCN(Cc1ccccc1)c1nc2ccccn2c1[N+](=O)[O-] ZINC000759696101 575922155 /nfs/dbraw/zinc/92/21/55/575922155.db2.gz FKEBTTVSYXGNNL-UHFFFAOYSA-N 0 3 339.399 2.811 20 5 EFBDHN CN(C)CCN(Cc1cccs1)c1nc2ccccn2c1[N+](=O)[O-] ZINC000759700310 575922808 /nfs/dbraw/zinc/92/28/08/575922808.db2.gz OJALTGCFZSXDET-UHFFFAOYSA-N 0 3 345.428 2.872 20 5 EFBDHN C[C@H](NC[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc([S@](C)=O)cc1 ZINC000765848565 577082499 /nfs/dbraw/zinc/08/24/99/577082499.db2.gz HPJXZEDQXKGLCG-FPWDIPAHSA-N 0 3 348.424 2.716 20 5 EFBDHN COc1cccc2c1CC[C@H]2NC[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000765849338 577082605 /nfs/dbraw/zinc/08/26/05/577082605.db2.gz OQDQZLYETSIUNW-IAGOWNOFSA-N 0 3 328.368 2.914 20 5 EFBDHN CS[C@H]1CN(c2nc3ccc([N+](=O)[O-])cc3s2)C[C@H]1N(C)C ZINC000767292989 577203000 /nfs/dbraw/zinc/20/30/00/577203000.db2.gz WHTJVWREZAJDTO-YPMHNXCESA-N 0 3 338.458 2.686 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@@H]2CCN(Cc3ccc4c(c3)COC4)C2)nc1 ZINC000769464329 577364145 /nfs/dbraw/zinc/36/41/45/577364145.db2.gz VHKNTSBYUUSGQW-MRXNPFEDSA-N 0 3 340.383 2.706 20 5 EFBDHN C[C@H](N(C)CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O)C(C)(C)C ZINC000726584213 577374359 /nfs/dbraw/zinc/37/43/59/577374359.db2.gz CABCYGFMEMTKRD-LBPRGKRZSA-N 0 3 348.403 2.687 20 5 EFBDHN Cc1cc([N+](=O)[O-])cc(Cl)c1NC[C@H]1CN2CCC[C@H]2CO1 ZINC000770099890 577402071 /nfs/dbraw/zinc/40/20/71/577402071.db2.gz LLVSWYFAYAQYGL-AAEUAGOBSA-N 0 3 325.796 2.832 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)cnc1NC1CCN(C[C@@H]2CCCO2)CC1 ZINC000771916406 581258716 /nfs/dbraw/zinc/25/87/16/581258716.db2.gz OOAXRHNSUIYUEE-ZDUSSCGKSA-N 0 3 340.811 2.699 20 5 EFBDHN CCN(CC)CCOC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000772140646 581288116 /nfs/dbraw/zinc/28/81/16/581288116.db2.gz CIVRRJKXXLYETK-UHFFFAOYSA-N 0 3 345.193 2.856 20 5 EFBDHN CCn1cc(CNC2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cn1 ZINC000773000372 581386504 /nfs/dbraw/zinc/38/65/04/581386504.db2.gz OUWKIJVASONLOW-UHFFFAOYSA-N 0 3 329.404 2.570 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])NC1CN(C(=O)OC)C1 ZINC000773072184 581393721 /nfs/dbraw/zinc/39/37/21/581393721.db2.gz NXIMYGOPNJEHOM-LLVKDONJSA-N 0 3 339.417 2.506 20 5 EFBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])NC1CN(C(=O)OC)C1 ZINC000773072188 581393892 /nfs/dbraw/zinc/39/38/92/581393892.db2.gz NXIMYGOPNJEHOM-NSHDSACASA-N 0 3 339.417 2.506 20 5 EFBDHN CN1CCC2(CCN(Cc3cc(Cl)ccc3[N+](=O)[O-])CC2)C1=O ZINC000773921941 581473675 /nfs/dbraw/zinc/47/36/75/581473675.db2.gz CPZFKDSTNGSSQS-UHFFFAOYSA-N 0 3 337.807 2.693 20 5 EFBDHN O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2NCc2ccccc2[N+](=O)[O-])n1 ZINC000774224029 581487547 /nfs/dbraw/zinc/48/75/47/581487547.db2.gz GRRLFHZLBKYXAR-HIFRSBDPSA-N 0 3 345.359 2.973 20 5 EFBDHN CN(C[C@H]1CCCOC1)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774627686 581495592 /nfs/dbraw/zinc/49/55/92/581495592.db2.gz RLDKOAZVMFVECO-LLVKDONJSA-N 0 3 338.795 2.914 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCCCNc1ncccn1 ZINC000850439546 1250486208 /nfs/dbraw/zinc/48/62/08/1250486208.db2.gz LRUBTYYAHFINAE-GFCCVEGCSA-N 0 3 331.376 2.546 20 5 EFBDHN CC([C@H](OC(=O)Cn1cc(C2CC2)cn1)c1ccccc1F)[N+](=O)[O-] ZINC000851107933 1250799986 /nfs/dbraw/zinc/79/99/86/1250799986.db2.gz FRUSORKQRGHYOR-DIFFPNOSSA-N 0 3 347.346 2.849 20 5 EFBDHN CC([C@@H](OC(=O)c1c(Cl)cnn1C)c1ccccc1F)[N+](=O)[O-] ZINC000851107929 1250800048 /nfs/dbraw/zinc/80/00/48/1250800048.db2.gz FQJZUVJLZPNRAG-ISVAXAHUSA-N 0 3 341.726 2.776 20 5 EFBDHN CCCn1nccc1C(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000851108070 1250801851 /nfs/dbraw/zinc/80/18/51/1250801851.db2.gz IZDKCOZHJDXWII-XHDPSFHLSA-N 0 3 335.335 2.996 20 5 EFBDHN Cc1cccc(C(=O)NCCNCc2cccc([N+](=O)[O-])c2)c1F ZINC001127866403 1256808897 /nfs/dbraw/zinc/80/88/97/1256808897.db2.gz WJXOHRPOXQZOKP-UHFFFAOYSA-N 0 3 331.347 2.562 20 5 EFBDHN O=C(CCNCc1ccc(Cl)nc1)Nc1ccccc1[N+](=O)[O-] ZINC000799995342 1261016510 /nfs/dbraw/zinc/01/65/10/1261016510.db2.gz YXHNEWVRSMYBBP-UHFFFAOYSA-N 0 3 334.763 2.762 20 5 EFBDHN C[C@H](NC[C@H](O)COc1cccc(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000746049932 1271744706 /nfs/dbraw/zinc/74/47/06/1271744706.db2.gz YHAKMGHNCUFSST-LRDDRELGSA-N 0 3 334.347 2.824 20 5 EFBDHN O=[N+]([O-])C[C@@H]1CC[C@H](N2CCN(c3nsc4ccccc43)CC2)C1 ZINC001169010653 1272582798 /nfs/dbraw/zinc/58/27/98/1272582798.db2.gz FGMOSTOCFCORQV-KGLIPLIRSA-N 0 3 346.456 2.864 20 5 EFBDHN C[C@H]1CN([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)[C@@H](C)CN1C(=O)OC(C)(C)C ZINC001169035134 1272599250 /nfs/dbraw/zinc/59/92/50/1272599250.db2.gz AKSLWYWRZGGDBS-BYNSBNAKSA-N 0 3 341.452 2.762 20 5 EFBDHN CC(C)(C)OC(=O)N1CCN([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C(C)(C)C1 ZINC001169038131 1272606447 /nfs/dbraw/zinc/60/64/47/1272606447.db2.gz VWLYRGKNUBBRNH-ZIAGYGMSSA-N 0 3 341.452 2.763 20 5 EFBDHN O=[N+]([O-])C[C@@H]1CC[C@@H](N2C[C@@H]3C[C@H](C2)c2cc4nccnc4cc23)C1 ZINC001169040194 1272609770 /nfs/dbraw/zinc/60/97/70/1272609770.db2.gz YPNHLKUTBNONDZ-APIJFGDWSA-N 0 3 338.411 2.962 20 5 EFBDHN O=[N+]([O-])C[C@H]1CC[C@@H](N2CCN(c3ccc4ccccc4n3)CC2)C1 ZINC001169040010 1272610972 /nfs/dbraw/zinc/61/09/72/1272610972.db2.gz WXWHXFIPWLOFJV-DOTOQJQBSA-N 0 3 340.427 2.802 20 5 EFBDHN C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H](C)N1[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169047914 1272627331 /nfs/dbraw/zinc/62/73/31/1272627331.db2.gz SMQFMRJTCYXZEM-KBUPBQIOSA-N 0 3 341.452 2.762 20 5 EFBDHN CCCSc1nc(Cl)c([N+](=O)[O-])c(-n2ccc([C@H](C)N)n2)n1 ZINC001169228045 1272746436 /nfs/dbraw/zinc/74/64/36/1272746436.db2.gz KZOMIWHNOJLJSU-ZETCQYMHSA-N 0 3 342.812 2.746 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1N[C@@H]1CCc3ccccc3[C@H]1O)CNC2 ZINC001169619177 1273060050 /nfs/dbraw/zinc/06/00/50/1273060050.db2.gz HWQFSNRIRFWSAG-CRAIPNDOSA-N 0 3 325.368 2.658 20 5 EFBDHN CCC(=O)N1CCC2(CCN(Cc3cccc([N+](=O)[O-])c3)C2)CC1 ZINC001035147539 1273639861 /nfs/dbraw/zinc/63/98/61/1273639861.db2.gz YEUKFQMYEDALCC-UHFFFAOYSA-N 0 3 331.416 2.819 20 5 EFBDHN CCCN(C)CC(=O)N(C)CCCNc1ccc([N+](=O)[O-])c(C)c1 ZINC001109496511 1274343087 /nfs/dbraw/zinc/34/30/87/1274343087.db2.gz ZXQHDKORHNFKNU-UHFFFAOYSA-N 0 3 336.436 2.505 20 5 EFBDHN CCn1cc(CN(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C(C)C)cn1 ZINC000844422609 1278971212 /nfs/dbraw/zinc/97/12/12/1278971212.db2.gz HQKDQWBVNVRWIE-QGZVFWFLSA-N 0 3 332.404 2.755 20 5 EFBDHN CN1CCC[C@@H]2CN(c3nc(Cl)c(Cl)cc3[N+](=O)[O-])C[C@H]21 ZINC001157265271 1275858756 /nfs/dbraw/zinc/85/87/56/1275858756.db2.gz IKOVYZXZWQTZJE-LDYMZIIASA-N 0 3 331.203 2.827 20 5 EFBDHN COc1ccc(C[C@H](C)N[C@H]2CCCc3nccnc32)c([N+](=O)[O-])c1 ZINC001170323461 1279015516 /nfs/dbraw/zinc/01/55/16/1279015516.db2.gz KVTOUQDNUOKMIF-LRDDRELGSA-N 0 3 342.399 2.992 20 5 EFBDHN C[C@H](N[C@@H]1CCN(C(=O)C2CCCC2)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788634483 1276250115 /nfs/dbraw/zinc/25/01/15/1276250115.db2.gz ZGCPTTBWDRJLAY-SWLSCSKDSA-N 0 3 346.431 2.619 20 5 EFBDHN CCC(=O)Nc1cccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000818963117 1276551835 /nfs/dbraw/zinc/55/18/35/1276551835.db2.gz HAOSDIIVCNDCQH-KRWDZBQOSA-N 0 3 343.383 2.767 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CNCc2ccc3c(c2)OCCCO3)c1 ZINC000819008652 1276571100 /nfs/dbraw/zinc/57/11/00/1276571100.db2.gz XASANSHLXDTANA-MRXNPFEDSA-N 0 3 344.367 2.579 20 5 EFBDHN COc1ccc2c(c1)OCC[C@H]2NC[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000819104691 1276608795 /nfs/dbraw/zinc/60/87/95/1276608795.db2.gz RYGZGJCLSFDIPN-IAGOWNOFSA-N 0 3 344.367 2.750 20 5 EFBDHN CC(C)(C)Oc1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cn1 ZINC000819213639 1276690453 /nfs/dbraw/zinc/69/04/53/1276690453.db2.gz NUYWPOGCCIHMFY-MRXNPFEDSA-N 0 3 345.399 2.990 20 5 EFBDHN CCN(C(=O)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1)C1CCN(C)CC1 ZINC000821400820 1277536435 /nfs/dbraw/zinc/53/64/35/1277536435.db2.gz IENBEUIJEORPRX-IRXDYDNUSA-N 0 3 331.416 2.641 20 5 EFBDHN Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@H]2N(C)CCCC2(C)C)c1F ZINC000791045367 1277928092 /nfs/dbraw/zinc/92/80/92/1277928092.db2.gz VNCPPRVQOBGJJO-CQSZACIVSA-N 0 3 337.395 2.893 20 5 EFBDHN COc1ccc(C[C@@H](C)N2CCN(CC3CC3)CC2)c([N+](=O)[O-])c1 ZINC001170345430 1279049346 /nfs/dbraw/zinc/04/93/46/1279049346.db2.gz KJQTYYZKFLOYCP-CQSZACIVSA-N 0 3 333.432 2.562 20 5 EFBDHN C[C@@H](c1ccccc1)[C@H](CO)NCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792878745 1279232648 /nfs/dbraw/zinc/23/26/48/1279232648.db2.gz ZULMYCPBPHIGDO-LRDDRELGSA-N 0 3 345.355 2.757 20 5 EFBDHN CC(C)(CCC(=O)N[C@]1(C)CCN(Cc2ccccc2)C1)[N+](=O)[O-] ZINC000844964878 1279364514 /nfs/dbraw/zinc/36/45/14/1279364514.db2.gz PSPGTVSVPYQZTK-GOSISDBHSA-N 0 3 333.432 2.603 20 5 EFBDHN COc1ccc(CC(=O)OC[C@@H]2CCN2C(C)(C)C)cc1[N+](=O)[O-] ZINC000845734146 1279805438 /nfs/dbraw/zinc/80/54/38/1279805438.db2.gz FTMFAEKWPUUDJX-ZDUSSCGKSA-N 0 3 336.388 2.562 20 5 EFBDHN Cc1c(CCC(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])cnn1C ZINC000845873016 1279900555 /nfs/dbraw/zinc/90/05/55/1279900555.db2.gz BCZCKVITCZABOH-YVEFUNNKSA-N 0 3 349.362 2.750 20 5 EFBDHN CC(=O)c1cc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])n(C)c1 ZINC000845872898 1279900955 /nfs/dbraw/zinc/90/09/55/1279900955.db2.gz QQSPMPQCWPLFDH-HWPZZCPQSA-N 0 3 348.330 2.930 20 5 EFBDHN Cc1cc(C)n(CCC(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])n1 ZINC000845872234 1279901071 /nfs/dbraw/zinc/90/10/71/1279901071.db2.gz FEJUIXXQDPPYML-CXAGYDPISA-N 0 3 349.362 2.979 20 5 EFBDHN CC([C@H](OC(=O)/C=C\c1cnn(C)c1)c1ccccc1F)[N+](=O)[O-] ZINC000845872296 1279901241 /nfs/dbraw/zinc/90/12/41/1279901241.db2.gz GCWCHFIAMFJMSC-CNZFAKCFSA-N 0 3 333.319 2.522 20 5 EFBDHN CCc1nn(C)cc1C(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845874819 1279901877 /nfs/dbraw/zinc/90/18/77/1279901877.db2.gz ITZVZVRNLBPRCH-BMIGLBTASA-N 0 3 335.335 2.685 20 5 EFBDHN CC([C@H](OC(=O)C[C@@H](C)n1cccn1)c1ccccc1F)[N+](=O)[O-] ZINC000845875301 1279901957 /nfs/dbraw/zinc/90/19/57/1279901957.db2.gz BBRCGNIBRCORIM-HSMVNMDESA-N 0 3 335.335 2.923 20 5 EFBDHN CC([C@H](OC(=O)c1ccnc(N(C)C)c1)c1ccccc1F)[N+](=O)[O-] ZINC000845874611 1279902584 /nfs/dbraw/zinc/90/25/84/1279902584.db2.gz ICJIVEPKCMYXDM-BZNIZROVSA-N 0 3 347.346 2.850 20 5 EFBDHN COc1ccc(CC(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])nc1 ZINC000845877133 1279903205 /nfs/dbraw/zinc/90/32/05/1279903205.db2.gz FBCQOGATXIVKJJ-DIFFPNOSSA-N 0 3 348.330 2.722 20 5 EFBDHN CC([C@@H](OC(=O)CC[C@H]1CCOC1)c1ccccc1F)[N+](=O)[O-] ZINC000845878794 1279903545 /nfs/dbraw/zinc/90/35/45/1279903545.db2.gz SRZBXMUKJRZAGU-BFQNTYOBSA-N 0 3 325.336 2.892 20 5 EFBDHN COc1ccnc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])c1 ZINC000845882513 1279904387 /nfs/dbraw/zinc/90/43/87/1279904387.db2.gz UJYOHZWNDROKNX-ZUZCIYMTSA-N 0 3 334.303 2.793 20 5 EFBDHN CC([C@@H](OC(=O)C[C@@H](C)n1ccnc1)c1ccccc1F)[N+](=O)[O-] ZINC000845882335 1279904399 /nfs/dbraw/zinc/90/43/99/1279904399.db2.gz SRRJKLISPKCXFS-XHBSWPGZSA-N 0 3 335.335 2.923 20 5 EFBDHN COCC1(CC(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])CC1 ZINC000845881659 1279904572 /nfs/dbraw/zinc/90/45/72/1279904572.db2.gz MZFSFBAVOLEKOS-NHYWBVRUSA-N 0 3 325.336 2.892 20 5 EFBDHN COCCN(C)CCN[C@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872030616 1287405534 /nfs/dbraw/zinc/40/55/34/1287405534.db2.gz ITKULTRSXZQTMD-GFCCVEGCSA-N 0 3 327.450 2.546 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H]1CCc2nc(C)nn2C1 ZINC000872031988 1287406543 /nfs/dbraw/zinc/40/65/43/1287406543.db2.gz OSCRHGCAHIGKFY-PWSUYJOCSA-N 0 3 347.444 2.882 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCN1CCO[C@@H](C)C1 ZINC000872033981 1287407013 /nfs/dbraw/zinc/40/70/13/1287407013.db2.gz KUOFGJVFCHNJRJ-QWHCGFSZSA-N 0 3 339.461 2.688 20 5 EFBDHN COCCN1CC[C@H](N[C@H](C)c2cc([N+](=O)[O-])ccc2SC)C1 ZINC000872035314 1287407702 /nfs/dbraw/zinc/40/77/02/1287407702.db2.gz LTWSQXOIKMIOAT-OLZOCXBDSA-N 0 3 339.461 2.688 20 5 EFBDHN O=[N+]([O-])c1cc(CN[C@H](C2CC2)[C@]2(CO)CCCO2)ccc1Cl ZINC000815290624 1287414022 /nfs/dbraw/zinc/41/40/22/1287414022.db2.gz LPHSKYZRCCHSFL-HZPDHXFCSA-N 0 3 340.807 2.658 20 5 EFBDHN CO[C@]1(CN[C@H](C)c2cc([N+](=O)[O-])ccc2SC)CCOC1 ZINC000872062384 1287416414 /nfs/dbraw/zinc/41/64/14/1287416414.db2.gz MKPOGKSWFJNLKL-ABAIWWIYSA-N 0 3 326.418 2.773 20 5 EFBDHN CCOC1CC(O)(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2SC)C1 ZINC000872066715 1287418552 /nfs/dbraw/zinc/41/85/52/1287418552.db2.gz KRGNWHUJHSSRPW-XOMBGVMMSA-N 0 3 340.445 2.897 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCC1([S@@](C)=O)CC1 ZINC000872069056 1287418884 /nfs/dbraw/zinc/41/88/84/1287418884.db2.gz LMCXNSQJXOKNGR-CHNSCGDPSA-N 0 3 328.459 2.878 20 5 EFBDHN CN(CCN1CCCCC1)C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000846662229 1280404995 /nfs/dbraw/zinc/40/49/95/1280404995.db2.gz OHOXQHBGSYFUBZ-UHFFFAOYSA-N 0 3 325.796 2.806 20 5 EFBDHN CCCN(C)CC(=O)NC[C@H]1C[C@@H](Nc2cc(C)ccc2[N+](=O)[O-])C1 ZINC001091358989 1280429516 /nfs/dbraw/zinc/42/95/16/1280429516.db2.gz QSBKIJBPURSBKA-GASCZTMLSA-N 0 3 348.447 2.552 20 5 EFBDHN CCc1oc(C(=O)NCCNCc2ccc([N+](=O)[O-])cc2)cc1C ZINC001147583430 1281212356 /nfs/dbraw/zinc/21/23/56/1281212356.db2.gz DPQMQBOBNIDHLR-UHFFFAOYSA-N 0 3 331.372 2.578 20 5 EFBDHN CC(=O)c1ccc([N+](=O)[O-])cc1NCCCN1CCCO[C@H](C)C1 ZINC000808048941 1281521738 /nfs/dbraw/zinc/52/17/38/1281521738.db2.gz MUURMLZSAHUCRS-CYBMUJFWSA-N 0 3 335.404 2.710 20 5 EFBDHN Cc1nc(C(C)C)oc1C(=O)NCCNCc1cccc([N+](=O)[O-])c1 ZINC001135014755 1287504491 /nfs/dbraw/zinc/50/44/91/1287504491.db2.gz XIQRPTZISADRMW-UHFFFAOYSA-N 0 3 346.387 2.534 20 5 EFBDHN Cc1cc(F)ccc1C(=O)NCCNCc1ccc([N+](=O)[O-])cc1 ZINC001148511385 1281576624 /nfs/dbraw/zinc/57/66/24/1281576624.db2.gz KSONIZNOODLJFQ-UHFFFAOYSA-N 0 3 331.347 2.562 20 5 EFBDHN O=C(NCCNCc1cccc([N+](=O)[O-])c1)C1(C2CCC2)CCC1 ZINC001131941182 1282603823 /nfs/dbraw/zinc/60/38/23/1282603823.db2.gz XCZZYWUOTZBSLQ-UHFFFAOYSA-N 0 3 331.416 2.771 20 5 EFBDHN Cc1ccc(F)cc1C(=O)NCCNCc1ccc([N+](=O)[O-])cc1 ZINC001132020763 1282736780 /nfs/dbraw/zinc/73/67/80/1282736780.db2.gz QLGRVEIHOXCEGR-UHFFFAOYSA-N 0 3 331.347 2.562 20 5 EFBDHN C[C@@H](NCc1ccc(C[S@@](C)=O)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815625935 1287645511 /nfs/dbraw/zinc/64/55/11/1287645511.db2.gz QIDGXRIEKQGPJS-OIRASMEMSA-N 0 3 347.440 2.906 20 5 EFBDHN CC(C)c1[nH]ccc1C(=O)NCCNCc1ccc([N+](=O)[O-])cc1 ZINC001132697921 1284159944 /nfs/dbraw/zinc/15/99/44/1284159944.db2.gz WNTYXGIJIPANTM-UHFFFAOYSA-N 0 3 330.388 2.566 20 5 EFBDHN O=C(NCCNCc1cccc([N+](=O)[O-])c1)c1ccoc1C1CC1 ZINC001132934827 1284461125 /nfs/dbraw/zinc/46/11/25/1284461125.db2.gz BTMUARLXOOKGIF-UHFFFAOYSA-N 0 3 329.356 2.585 20 5 EFBDHN CCc1ccccc1C(=O)NCCNCc1ccc([N+](=O)[O-])cc1 ZINC001133029948 1284682016 /nfs/dbraw/zinc/68/20/16/1284682016.db2.gz JZYMMBZYUKODTD-UHFFFAOYSA-N 0 3 327.384 2.677 20 5 EFBDHN Cc1cc(C)cc(CC(=O)NCCNCc2ccc([N+](=O)[O-])cc2)c1 ZINC001133238880 1285064429 /nfs/dbraw/zinc/06/44/29/1285064429.db2.gz AKGUFWPLYRDGRI-UHFFFAOYSA-N 0 3 341.411 2.660 20 5 EFBDHN Cc1ccc(C)c(CC(=O)NCCNCc2ccc([N+](=O)[O-])cc2)c1 ZINC001133300165 1285150602 /nfs/dbraw/zinc/15/06/02/1285150602.db2.gz NJTWZPYRKFCOPZ-UHFFFAOYSA-N 0 3 341.411 2.660 20 5 EFBDHN COc1cc([N+](=O)[O-])cnc1-n1c(-c2ccccc2)cnc1[C@H](C)N ZINC001170678905 1285186867 /nfs/dbraw/zinc/18/68/67/1285186867.db2.gz ISZHJQAOCWRGOJ-NSHDSACASA-N 0 3 339.355 2.871 20 5 EFBDHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)OCC(C)[N+](=O)[O-] ZINC000813103305 1285654127 /nfs/dbraw/zinc/65/41/27/1285654127.db2.gz BUGKNZHTTJBJBJ-SNVBAGLBSA-N 0 3 332.360 2.712 20 5 EFBDHN Cc1nc(-c2cccs2)c(CC(=O)OCC(C)[N+](=O)[O-])s1 ZINC000813107035 1285676681 /nfs/dbraw/zinc/67/66/81/1285676681.db2.gz KQWXBEJPUBJWRL-MRVPVSSYSA-N 0 3 326.399 2.931 20 5 EFBDHN CC(COC(=O)CCc1nc(-c2ccc(Cl)cc2)no1)[N+](=O)[O-] ZINC000813106970 1285676708 /nfs/dbraw/zinc/67/67/08/1285676708.db2.gz JENYOVCFYJFXOR-VIFPVBQESA-N 0 3 339.735 2.531 20 5 EFBDHN Cc1noc(C)c1COc1ccc(CC(=O)OCC(C)[N+](=O)[O-])cc1 ZINC000813107618 1285678165 /nfs/dbraw/zinc/67/81/65/1285678165.db2.gz PGYYFYMIIJGZFI-LLVKDONJSA-N 0 3 348.355 2.621 20 5 EFBDHN CC(COC(=O)c1ccc(C(=O)N(C)c2ccccc2)cc1)[N+](=O)[O-] ZINC000813107932 1285678815 /nfs/dbraw/zinc/67/88/15/1285678815.db2.gz ZFKZFATUXCLJAG-ZDUSSCGKSA-N 0 3 342.351 2.785 20 5 EFBDHN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)OCC(C)[N+](=O)[O-] ZINC000813108415 1285680630 /nfs/dbraw/zinc/68/06/30/1285680630.db2.gz YGPFQAPRUYGJFX-VIFPVBQESA-N 0 3 328.346 2.917 20 5 EFBDHN CC(COC(=O)c1ccc(NC(=O)c2ccccc2)cc1)[N+](=O)[O-] ZINC000813110051 1285682027 /nfs/dbraw/zinc/68/20/27/1285682027.db2.gz RMSBIFLGLXUUBO-GFCCVEGCSA-N 0 3 328.324 2.761 20 5 EFBDHN CC(COC(=O)c1cncc(-c2ccc3c(c2)CCO3)c1)[N+](=O)[O-] ZINC000813110404 1285682745 /nfs/dbraw/zinc/68/27/45/1285682745.db2.gz ZUUDSRFUCZNLFO-LLVKDONJSA-N 0 3 328.324 2.506 20 5 EFBDHN CC(C)c1c(C(=O)OCC(C)[N+](=O)[O-])cnn1-c1ccc(F)cc1 ZINC000813109446 1285683188 /nfs/dbraw/zinc/68/31/88/1285683188.db2.gz SVVFMQLDQVJMHH-NSHDSACASA-N 0 3 335.335 2.957 20 5 EFBDHN COC(=O)c1ccccc1-c1ccccc1C(=O)OCC(C)[N+](=O)[O-] ZINC000813113149 1285683645 /nfs/dbraw/zinc/68/36/45/1285683645.db2.gz BMCIBUWLMAASCU-GFCCVEGCSA-N 0 3 343.335 2.962 20 5 EFBDHN CC(C)COc1cn(-c2ccccc2)nc1C(=O)OCC(C)[N+](=O)[O-] ZINC000813112677 1285683834 /nfs/dbraw/zinc/68/38/34/1285683834.db2.gz SRWWSRSXEWNOHK-ZDUSSCGKSA-N 0 3 347.371 2.729 20 5 EFBDHN CC(COC(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1)[N+](=O)[O-] ZINC000813111344 1285684579 /nfs/dbraw/zinc/68/45/79/1285684579.db2.gz GRERCCIDZLHLAG-JTQLQIEISA-N 0 3 333.344 2.679 20 5 EFBDHN C[C@@H]1CCN(CCNC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000813468144 1285936664 /nfs/dbraw/zinc/93/66/64/1285936664.db2.gz RXJHMYLUUKDZHG-SECBINFHSA-N 0 3 346.214 2.973 20 5 EFBDHN O=C(Cc1ccccc1Cl)NCCNCc1ccc([N+](=O)[O-])cc1 ZINC001150109200 1286341288 /nfs/dbraw/zinc/34/12/88/1286341288.db2.gz MJFMIHUXRYHLHX-UHFFFAOYSA-N 0 3 347.802 2.697 20 5 EFBDHN O=[N+]([O-])c1cc(F)c(N2CCC(NCc3cnoc3)CC2)c(F)c1 ZINC001173010866 1286383349 /nfs/dbraw/zinc/38/33/49/1286383349.db2.gz JQTNWGJVRLDZPG-UHFFFAOYSA-N 0 3 338.314 2.620 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)NCC(=O)C(C)(C)C)c1F ZINC001173175356 1286451134 /nfs/dbraw/zinc/45/11/34/1286451134.db2.gz ASZZZQFOWRZPPS-SNVBAGLBSA-N 0 3 326.368 2.878 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)NCc2ccncc2F)c1F ZINC001173175129 1286451479 /nfs/dbraw/zinc/45/14/79/1286451479.db2.gz AHAXUKJCNQVTIU-JTQLQIEISA-N 0 3 337.326 2.997 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)NC2(c3cnn(C)c3)CC2)c1F ZINC001173176525 1286452744 /nfs/dbraw/zinc/45/27/44/1286452744.db2.gz HRPBLVJXHMXFNM-NSHDSACASA-N 0 3 348.378 2.686 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)N2CC[C@@]3(CCOC3)C2)c1F ZINC001173180383 1286455240 /nfs/dbraw/zinc/45/52/40/1286455240.db2.gz KFZSBMPHEKVZBI-SJKOYZFVSA-N 0 3 338.379 2.786 20 5 EFBDHN COc1cccc(CN[C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])n1 ZINC001173182164 1286456864 /nfs/dbraw/zinc/45/68/64/1286456864.db2.gz IIFXAMDGAIHTQY-NSHDSACASA-N 0 3 349.362 2.867 20 5 EFBDHN C=Cc1ccc(C(=O)NCCNCc2ccc([N+](=O)[O-])cc2)cc1 ZINC001134198930 1286457027 /nfs/dbraw/zinc/45/70/27/1286457027.db2.gz LCUNFAQFMFQZPX-UHFFFAOYSA-N 0 3 325.368 2.757 20 5 EFBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CCCc2ccc(CN)nc21 ZINC001173236253 1286485182 /nfs/dbraw/zinc/48/51/82/1286485182.db2.gz ZHUTXKPADHHTGV-CYBMUJFWSA-N 0 3 326.400 2.832 20 5 EFBDHN Cc1cccn2c(CN[C@H](C)Cc3ccc([N+](=O)[O-])cc3)nnc12 ZINC001173209486 1286485888 /nfs/dbraw/zinc/48/58/88/1286485888.db2.gz CGSLDHXQUQMVFF-CYBMUJFWSA-N 0 3 325.372 2.667 20 5 EFBDHN CCOC(=O)NC1CCN([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173238598 1286496407 /nfs/dbraw/zinc/49/64/07/1286496407.db2.gz VYDTUXMNMUEFFY-ZDUSSCGKSA-N 0 3 335.404 2.736 20 5 EFBDHN CCC[C@H](C)C(=O)NCCNCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000816625538 1288214210 /nfs/dbraw/zinc/21/42/10/1288214210.db2.gz HDAKKVRLTKSQTQ-NSHDSACASA-N 0 3 327.812 2.890 20 5 EFBDHN C[C@H](N[C@@H]1CSC[C@@H]1C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000796402221 1299218547 /nfs/dbraw/zinc/21/85/47/1299218547.db2.gz HXLDSYQPEVFHJH-MWODSPESSA-N 0 3 343.836 2.916 20 5 EFBDHN CC[C@H](CNC(=O)CCC(C)(C)[N+](=O)[O-])N1CCc2ccccc2C1 ZINC000822457368 1288996789 /nfs/dbraw/zinc/99/67/89/1288996789.db2.gz JCSHKPUOGILRRP-QGZVFWFLSA-N 0 3 347.459 2.775 20 5 EFBDHN Cc1c(CNCCC(=O)NCc2ccccc2)cccc1[N+](=O)[O-] ZINC000873030222 1289529563 /nfs/dbraw/zinc/52/95/63/1289529563.db2.gz CGKURLRHNRIXFQ-UHFFFAOYSA-N 0 3 327.384 2.699 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1C(=O)N(C)CCN1CCCCC1 ZINC000824109313 1289545341 /nfs/dbraw/zinc/54/53/41/1289545341.db2.gz SVZLMWBNLFKQHC-UHFFFAOYSA-N 0 3 337.445 2.875 20 5 EFBDHN Cc1c(CN[C@H]2CCN(C(=O)C3CCCC3)C2)cccc1[N+](=O)[O-] ZINC000873077781 1289556667 /nfs/dbraw/zinc/55/66/67/1289556667.db2.gz FFMIVNQGURRCPN-INIZCTEOSA-N 0 3 331.416 2.784 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@H]1CCCN2CCCC[C@H]12 ZINC000824311334 1289601534 /nfs/dbraw/zinc/60/15/34/1289601534.db2.gz CHRKATKGQRWOLM-GOEBONIOSA-N 0 3 331.416 2.958 20 5 EFBDHN COc1ccc(OC)c([C@@H](O)[C@H](C)NCc2ccc([N+](=O)[O-])cc2)c1 ZINC000873195547 1289634009 /nfs/dbraw/zinc/63/40/09/1289634009.db2.gz NSKYTZOTCUHSCA-SGTLLEGYSA-N 0 3 346.383 2.824 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1Cc2ccccc2CN1 ZINC000873298440 1289711650 /nfs/dbraw/zinc/71/16/50/1289711650.db2.gz PEAXJHXLVSSMHD-OAHLLOKOSA-N 0 3 340.383 2.739 20 5 EFBDHN CC(C)C1(C(=O)NCCCNCc2csc([N+](=O)[O-])c2)CC1 ZINC001166262925 1312753372 /nfs/dbraw/zinc/75/33/72/1312753372.db2.gz LYCHNUKMKMDFDO-UHFFFAOYSA-N 0 3 325.434 2.688 20 5 EFBDHN Nc1ccc2n(C(=O)[C@H]3CN4CCC3CC4)c3ccccc3cc-2c1=O ZINC001182009538 1290057577 /nfs/dbraw/zinc/05/75/77/1290057577.db2.gz BXNQXWSMBOYBMB-INIZCTEOSA-N 0 3 347.418 2.671 20 5 EFBDHN C[C@H]1CCCN1CCNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000877153169 1291149353 /nfs/dbraw/zinc/14/93/53/1291149353.db2.gz FSOHBQNQEPPZIG-VIFPVBQESA-N 0 3 348.266 2.993 20 5 EFBDHN C[C@@](CO)(NCc1cc(Br)c([N+](=O)[O-])s1)C1CC1 ZINC000877159030 1291150398 /nfs/dbraw/zinc/15/03/98/1291150398.db2.gz RBASXEBCFSJCTE-NSHDSACASA-N 0 3 335.223 2.669 20 5 EFBDHN CC(F)(F)C1(C(=O)NCCCNCc2ccccc2[N+](=O)[O-])CC1 ZINC001166838266 1312850936 /nfs/dbraw/zinc/85/09/36/1312850936.db2.gz ACHYQCIGIMMVSS-UHFFFAOYSA-N 0 3 341.358 2.626 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN1CCC([C@H](O)c2ccccc2)CC1 ZINC000877927770 1291420222 /nfs/dbraw/zinc/42/02/22/1291420222.db2.gz DPFJPINNNFXKHF-GOSISDBHSA-N 0 3 344.415 2.545 20 5 EFBDHN COc1ncc([N+](=O)[O-])c(NC[C@H](c2ccccc2)N2CCCC2)n1 ZINC001166889142 1312860901 /nfs/dbraw/zinc/86/09/01/1312860901.db2.gz NWMCRJHJXMQOLR-CQSZACIVSA-N 0 3 343.387 2.642 20 5 EFBDHN C[C@H](CN(C)CCc1ccccc1[N+](=O)[O-])NC(=O)OC(C)(C)C ZINC000796114436 1291984956 /nfs/dbraw/zinc/98/49/56/1291984956.db2.gz RSKIYBUZVFCPHO-CYBMUJFWSA-N 0 3 337.420 2.982 20 5 EFBDHN COc1cccc([C@H]2CN(Cc3c(F)cccc3[N+](=O)[O-])CCN2)c1 ZINC000879524902 1292171953 /nfs/dbraw/zinc/17/19/53/1292171953.db2.gz DYCWRGVBBHWJAA-QGZVFWFLSA-N 0 3 345.374 2.889 20 5 EFBDHN COCCN(Cc1ccc(Cl)c([N+](=O)[O-])c1)C1CCOCC1 ZINC000879709564 1292239107 /nfs/dbraw/zinc/23/91/07/1292239107.db2.gz IJZHCDWDSWCNSO-UHFFFAOYSA-N 0 3 328.796 2.876 20 5 EFBDHN COc1ccc(C2(NC[C@@H](O)c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000775411343 1292314764 /nfs/dbraw/zinc/31/47/64/1292314764.db2.gz NWZALBSMZBWTFG-QGZVFWFLSA-N 0 3 328.368 2.916 20 5 EFBDHN Cc1ccc(C(=O)NCCCN(C)Cc2cccc([N+](=O)[O-])c2)o1 ZINC001233598055 1312964301 /nfs/dbraw/zinc/96/43/01/1312964301.db2.gz GIHFVZNZRZKKEU-UHFFFAOYSA-N 0 3 331.372 2.748 20 5 EFBDHN CN1CC[C@@H]2CN(c3cc(F)cc(Br)c3[N+](=O)[O-])C[C@@H]21 ZINC000882422565 1293197467 /nfs/dbraw/zinc/19/74/67/1293197467.db2.gz VJAMFSQXJYZXHU-PELKAZGASA-N 0 3 344.184 2.637 20 5 EFBDHN COc1cc(CN[C@@H](C)C[C@H](O)c2ccco2)c([N+](=O)[O-])cc1O ZINC000130636063 1293412131 /nfs/dbraw/zinc/41/21/31/1293412131.db2.gz BGGSSKSJMYBLMG-GWCFXTLKSA-N 0 3 336.344 2.504 20 5 EFBDHN Cc1cccc(OCCN(C)C[C@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000136869154 1294692002 /nfs/dbraw/zinc/69/20/02/1294692002.db2.gz JZEDEJZJKTYCEQ-SFHVURJKSA-N 0 3 330.384 2.947 20 5 EFBDHN CN(Cc1cccnc1[N+](=O)[O-])C1CCN(CCC(F)(F)F)CC1 ZINC000886238474 1294782767 /nfs/dbraw/zinc/78/27/67/1294782767.db2.gz APYJTSZOFWMCNT-UHFFFAOYSA-N 0 3 346.353 2.838 20 5 EFBDHN CCOC(=O)Cc1ccc([N+](=O)[O-])c(O[C@H]2CCCN(CC)C2)c1 ZINC001234409479 1313122204 /nfs/dbraw/zinc/12/22/04/1313122204.db2.gz AJBGLMPOROAWRI-AWEZNQCLSA-N 0 3 336.388 2.564 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1C[C@H](C)Oc1cccc2c1CCN(C)C2 ZINC001234425653 1313126057 /nfs/dbraw/zinc/12/60/57/1313126057.db2.gz XQNNSMWRFOBEHG-LBPRGKRZSA-N 0 3 330.388 2.555 20 5 EFBDHN C[NH+]1CCC(Oc2ccc(Nc3cc([O-])cc([N+](=O)[O-])c3)nc2)CC1 ZINC001199828893 1295766167 /nfs/dbraw/zinc/76/61/67/1295766167.db2.gz XTRWMIVKUIYMNN-UHFFFAOYSA-N 0 3 344.371 2.912 20 5 EFBDHN COc1c(O[C@H]2CCN(C)C2)c2nccc3c4ccccc4n(c32)c1=O ZINC001234718461 1313186055 /nfs/dbraw/zinc/18/60/55/1313186055.db2.gz LXMQJNZLMYSNMK-LBPRGKRZSA-N 0 3 349.390 2.530 20 5 EFBDHN NC(=O)[C@H](N)CCc1nc(-c2cc3ccccc3c3ccccc23)no1 ZINC001205871729 1313368858 /nfs/dbraw/zinc/36/88/58/1313368858.db2.gz YOJMAAWWXVSVQJ-QGZVFWFLSA-N 0 3 346.390 2.788 20 5 EFBDHN CC[C@H](CN1CCCC1)NC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000778284381 1297591433 /nfs/dbraw/zinc/59/14/33/1297591433.db2.gz STWLJSHAYRJAIR-CYBMUJFWSA-N 0 3 341.358 2.677 20 5 EFBDHN C[C@H]1CSC[C@H]1NCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000796401069 1299166169 /nfs/dbraw/zinc/16/61/69/1299166169.db2.gz CJBOBRDUUOEBQE-GZMMTYOYSA-N 0 3 329.809 2.528 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CNCc2cnccc2C(F)(F)F)c1 ZINC000853135146 1300020776 /nfs/dbraw/zinc/02/07/76/1300020776.db2.gz ZZIHPXRVZUDPJX-AWEZNQCLSA-N 0 3 341.289 2.832 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCN1CCC[C@@](O)(c2ccccc2)C1 ZINC000859583167 1301496630 /nfs/dbraw/zinc/49/66/30/1301496630.db2.gz BVKGGLWYLGSWEQ-IBGZPJMESA-N 0 3 342.395 2.957 20 5 EFBDHN CSc1cccc(C(=O)NC[C@H](C)N2CCCCC2)c1[N+](=O)[O-] ZINC000777129394 1301624705 /nfs/dbraw/zinc/62/47/05/1301624705.db2.gz YMYWEEJIKCHEHB-LBPRGKRZSA-N 0 3 337.445 2.921 20 5 EFBDHN CCO[C@H](C(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-])C1CC1 ZINC000860854847 1301942259 /nfs/dbraw/zinc/94/22/59/1301942259.db2.gz KPEZVZFDEKODEO-ONERCXAPSA-N 0 3 325.336 2.890 20 5 EFBDHN CC([C@@H](OC(=O)c1nn(C)cc1Cl)c1ccccc1F)[N+](=O)[O-] ZINC000860855396 1301942861 /nfs/dbraw/zinc/94/28/61/1301942861.db2.gz ZDJCCORRJZMTKN-AMIZOPFISA-N 0 3 341.726 2.776 20 5 EFBDHN C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])N[C@H]1CCN(C(C)(C)C)C1=O ZINC000866380875 1303617828 /nfs/dbraw/zinc/61/78/28/1303617828.db2.gz LUAFLQLKUUMANT-FZMZJTMJSA-N 0 3 337.395 2.654 20 5 EFBDHN O=C(Cc1cccc(F)c1[N+](=O)[O-])N1CCN(C2CCCCC2)CC1 ZINC000866717432 1303765360 /nfs/dbraw/zinc/76/53/60/1303765360.db2.gz FFYXREZKYJGCEF-UHFFFAOYSA-N 0 3 349.406 2.753 20 5 EFBDHN CC1(C)CCCN(CCNC(=O)Cc2cccc(F)c2[N+](=O)[O-])C1 ZINC000867841779 1303982378 /nfs/dbraw/zinc/98/23/78/1303982378.db2.gz PVNRPPVQIJDWHU-UHFFFAOYSA-N 0 3 337.395 2.515 20 5 EFBDHN CC([C@H](OC(=O)c1cnn(C(F)F)c1)c1ccccc1F)[N+](=O)[O-] ZINC000870454927 1305329405 /nfs/dbraw/zinc/32/94/05/1305329405.db2.gz ROQUKHCAWNFNHX-PELKAZGASA-N 0 3 343.261 2.981 20 5 EFBDHN CCC[C@H]1CN(Cc2ccc([N+](=O)[O-])c(F)c2)CCN1CCOC ZINC000801526477 1310466183 /nfs/dbraw/zinc/46/61/83/1310466183.db2.gz QXOOSUXEMRDHRT-HNNXBMFYSA-N 0 3 339.411 2.667 20 5 EFBDHN CC(F)(F)C(=O)NCC1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001222243016 1311104006 /nfs/dbraw/zinc/10/40/06/1311104006.db2.gz OHMVWVYMFAVDLU-UHFFFAOYSA-N 0 3 341.358 2.578 20 5 EFBDHN CCN(C)C(C)(C)C(=O)N(C)CCNc1ccc([N+](=O)[O-])c(C)c1 ZINC001101829937 1311264664 /nfs/dbraw/zinc/26/46/64/1311264664.db2.gz FOJPCJYWSKXTQI-UHFFFAOYSA-N 0 3 336.436 2.504 20 5 EFBDHN CC(=O)O[C@@H]1C[C@@H]2C[C@H](O[C@H](C)c3ccc([N+](=O)[O-])cc3)C[C@H]1N2C ZINC001224027129 1311333799 /nfs/dbraw/zinc/33/37/99/1311333799.db2.gz UPNDIMWPXFHSEF-QBFPWWHVSA-N 0 3 348.399 2.839 20 5 EFBDHN O=C(NCCCNCc1ccccc1[N+](=O)[O-])c1cc(F)ccc1F ZINC001159969390 1311619460 /nfs/dbraw/zinc/61/94/60/1311619460.db2.gz WOUUPDCXWSDJKT-UHFFFAOYSA-N 0 3 349.337 2.783 20 5 EFBDHN CCc1cccc(C(=O)NCCCNCc2csc([N+](=O)[O-])c2)n1 ZINC001160042089 1311632725 /nfs/dbraw/zinc/63/27/25/1311632725.db2.gz UWJQEHPTKQOXEK-UHFFFAOYSA-N 0 3 348.428 2.523 20 5 EFBDHN COCCCN1CCC(Oc2ccc([N+](=O)[O-])cc2C(C)=O)CC1 ZINC001226530654 1311683876 /nfs/dbraw/zinc/68/38/76/1311683876.db2.gz IONUVWVMYGVJMP-UHFFFAOYSA-N 0 3 336.388 2.677 20 5 EFBDHN NCc1ccc(Nc2nc(Cl)nc3ccc([N+](=O)[O-])cc32)cn1 ZINC001160402177 1311704010 /nfs/dbraw/zinc/70/40/10/1311704010.db2.gz MSDRUVUGPFBGTA-UHFFFAOYSA-N 0 3 330.735 2.789 20 5 EFBDHN COCCN1CCC(Oc2cc(F)c(Cl)cc2[N+](=O)[O-])CC1 ZINC001227157449 1311769791 /nfs/dbraw/zinc/76/97/91/1311769791.db2.gz LKHAXYPZJGPAOH-UHFFFAOYSA-N 0 3 332.759 2.877 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1Cl)ncnc2O[C@@H]1CN2CCC1CC2 ZINC001227365128 1311798407 /nfs/dbraw/zinc/79/84/07/1311798407.db2.gz ZPEVIICWHZDYFJ-CQSZACIVSA-N 0 3 334.763 2.664 20 5 EFBDHN CC(C)C[C@@H]1CN(C)CCN1Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000902543329 1311855214 /nfs/dbraw/zinc/85/52/14/1311855214.db2.gz QRJNAFUAIRLHSJ-MRXNPFEDSA-N 0 3 331.420 2.564 20 5 EFBDHN CN1CCN(CCCNc2ccc(C(F)(F)F)c([N+](=O)[O-])c2)CC1 ZINC001161708460 1311956506 /nfs/dbraw/zinc/95/65/06/1311956506.db2.gz LCAZTFUINWOODN-UHFFFAOYSA-N 0 3 346.353 2.663 20 5 EFBDHN CN1CCN(CCCNc2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC1 ZINC001161708937 1311957170 /nfs/dbraw/zinc/95/71/70/1311957170.db2.gz YPWQINHTPPXMKX-UHFFFAOYSA-N 0 3 346.353 2.663 20 5 EFBDHN CN(C)Cc1ccc(-c2noc(-c3ccncc3[N+](=O)[O-])n2)cc1 ZINC001213035888 1311972157 /nfs/dbraw/zinc/97/21/57/1311972157.db2.gz MDZADGVYTJYHKD-UHFFFAOYSA-N 0 3 325.328 2.768 20 5 EFBDHN C[C@@H]([C@H](Oc1ncncc1[N+](=O)[O-])c1ccccc1)N1CCCC1 ZINC001228657331 1311976337 /nfs/dbraw/zinc/97/63/37/1311976337.db2.gz NUGDFZNYXBCGCV-BBRMVZONSA-N 0 3 328.372 2.989 20 5 EFBDHN O=C(C1CCCC1)N1C[C@H]2CN(Cc3ccc([N+](=O)[O-])cc3)C[C@H]2C1 ZINC001048640801 1311996054 /nfs/dbraw/zinc/99/60/54/1311996054.db2.gz KVDQNXWBIQQLJE-CALCHBBNSA-N 0 3 343.427 2.675 20 5 EFBDHN Cc1cncc(C)c1C(=O)NCCCNCc1csc([N+](=O)[O-])c1 ZINC001162478918 1312110992 /nfs/dbraw/zinc/11/09/92/1312110992.db2.gz DUHNHZAEQCLNHA-UHFFFAOYSA-N 0 3 348.428 2.578 20 5 EFBDHN Cc1c(Cl)nc(-c2ccc([N+](=O)[O-])cc2)nc1-n1nccc1CN ZINC001162592375 1312131633 /nfs/dbraw/zinc/13/16/33/1312131633.db2.gz BELJYUAXRJCYGK-UHFFFAOYSA-N 0 3 344.762 2.658 20 5 EFBDHN CN1CC[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000902827435 1312138162 /nfs/dbraw/zinc/13/81/62/1312138162.db2.gz MJZTURJFYSDLJD-CMPLNLGQSA-N 0 3 338.795 2.949 20 5 EFBDHN CO[C@@H]1CCN(CCOc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC001229831991 1312146714 /nfs/dbraw/zinc/14/67/14/1312146714.db2.gz OTWUHWOHKPPGHA-GFCCVEGCSA-N 0 3 334.294 2.713 20 5 EFBDHN C[C@@H](N)c1nc2ccccc2n1-c1ncnc2sc([N+](=O)[O-])cc21 ZINC001162764356 1312171358 /nfs/dbraw/zinc/17/13/58/1312171358.db2.gz WXUJEBWAWIGLFF-MRVPVSSYSA-N 0 3 340.368 2.958 20 5 EFBDHN C[C@@H](N)c1nc2ccccc2n1-c1cc2c(c([N+](=O)[O-])c1)NN(C)C2 ZINC001162779161 1312174548 /nfs/dbraw/zinc/17/45/48/1312174548.db2.gz VOMROHREMVCDQY-SNVBAGLBSA-N 0 3 338.371 2.726 20 5 EFBDHN Cc1cnc(C(=O)NCCCNCc2ccccc2[N+](=O)[O-])cc1C ZINC001162974243 1312215740 /nfs/dbraw/zinc/21/57/40/1312215740.db2.gz AEKZPPJQLHGQPI-UHFFFAOYSA-N 0 3 342.399 2.516 20 5 EFBDHN O=C(NCCCNCc1ccccc1[N+](=O)[O-])c1occ2c1CCC2 ZINC001163339626 1312292967 /nfs/dbraw/zinc/29/29/67/1312292967.db2.gz VCLRDBGHUXHECW-UHFFFAOYSA-N 0 3 343.383 2.586 20 5 EFBDHN O=C(NCCC1(CNCc2csc([N+](=O)[O-])c2)CC1)c1ccc[nH]1 ZINC001163393855 1312303463 /nfs/dbraw/zinc/30/34/63/1312303463.db2.gz IXVCNMMRCHTBRN-UHFFFAOYSA-N 0 3 348.428 2.674 20 5 EFBDHN O=[N+]([O-])c1cc2cc[nH]c2c(N[C@H]2CCCC[C@@]23CNCCO3)c1 ZINC001163650404 1312354162 /nfs/dbraw/zinc/35/41/62/1312354162.db2.gz NVLAIODOJQFKAQ-DOTOQJQBSA-N 0 3 330.388 2.789 20 5 EFBDHN O=C(/C=C\C1CC1)NCCC1(CNCc2csc([N+](=O)[O-])c2)CC1 ZINC001163960419 1312414825 /nfs/dbraw/zinc/41/48/25/1312414825.db2.gz ZQDGHZKGBSKRMH-ARJAWSKDSA-N 0 3 349.456 2.999 20 5 EFBDHN CN(C)c1ccnc(CN[C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000903199488 1312455447 /nfs/dbraw/zinc/45/54/47/1312455447.db2.gz ZKRORKXNVZIHPZ-CVEARBPZSA-N 0 3 344.419 2.526 20 5 EFBDHN CN(C)c1ccnc(CN[C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000903199489 1312455733 /nfs/dbraw/zinc/45/57/33/1312455733.db2.gz ZKRORKXNVZIHPZ-HOTGVXAUSA-N 0 3 344.419 2.526 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCN1CCCOCC1 ZINC000903229243 1312481537 /nfs/dbraw/zinc/48/15/37/1312481537.db2.gz VXLPPWAEXXKPJT-CYBMUJFWSA-N 0 3 339.461 2.690 20 5 EFBDHN CC(C)(C(=O)NCCCNCc1csc([N+](=O)[O-])c1)C1CC1 ZINC001164366138 1312500974 /nfs/dbraw/zinc/50/09/74/1312500974.db2.gz JOBCFSMSXQCXPJ-UHFFFAOYSA-N 0 3 325.434 2.688 20 5 EFBDHN CCCc1[nH]ccc1C(=O)NCCCNCc1ccccc1[N+](=O)[O-] ZINC001164407278 1312509474 /nfs/dbraw/zinc/50/94/74/1312509474.db2.gz BRUBENDVQKPBAI-UHFFFAOYSA-N 0 3 344.415 2.785 20 5 EFBDHN O=[N+]([O-])c1cc(NCC2CN(Cc3ccccc3)C2)cn2ccnc12 ZINC001165453013 1312632914 /nfs/dbraw/zinc/63/29/14/1312632914.db2.gz DYTFKRUENASAHH-UHFFFAOYSA-N 0 3 337.383 2.786 20 5 EFBDHN O=[N+]([O-])c1cnc2ccc(NCC3CN(Cc4ccccc4)C3)cn21 ZINC001165455206 1312632925 /nfs/dbraw/zinc/63/29/25/1312632925.db2.gz VVTUPYKBQLDOSH-UHFFFAOYSA-N 0 3 337.383 2.786 20 5 EFBDHN O=C(N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1)c1ccc(F)cc1 ZINC001019939162 1314543118 /nfs/dbraw/zinc/54/31/18/1314543118.db2.gz RZISKXBVRKMVRC-WKILWMFISA-N 0 3 343.358 2.785 20 5 EFBDHN Cc1cc(C(=O)N[C@H]2C[C@H](NCc3ccccc3[N+](=O)[O-])C2)c(C)o1 ZINC001019981741 1314555588 /nfs/dbraw/zinc/55/55/88/1314555588.db2.gz NXHQWYHZLMNHAU-SHTZXODSSA-N 0 3 343.383 2.855 20 5 EFBDHN Cc1ccoc1C(=O)N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001019989928 1314559537 /nfs/dbraw/zinc/55/95/37/1314559537.db2.gz YJIOHCFATDLRDY-HDJSIYSDSA-N 0 3 329.356 2.547 20 5 EFBDHN N[C@@H]1CN([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCC1(F)F ZINC001246603478 1314656547 /nfs/dbraw/zinc/65/65/47/1314656547.db2.gz YUJZAXMPNCWMAQ-UKRRQHHQSA-N 0 3 325.359 2.511 20 5 EFBDHN NC(=O)[C@@H](N)CCc1nc(-c2cc3ccccc3c3ccccc23)no1 ZINC001249291890 1315046349 /nfs/dbraw/zinc/04/63/49/1315046349.db2.gz YOJMAAWWXVSVQJ-KRWDZBQOSA-N 0 3 346.390 2.788 20 5 EFBDHN O=[N+]([O-])c1ccc(O[C@@H]2CNCCC2(F)F)c(Br)c1 ZINC001218446920 1315196922 /nfs/dbraw/zinc/19/69/22/1315196922.db2.gz FICMGQNRTOQZQI-SNVBAGLBSA-N 0 3 337.120 2.733 20 5 EFBDHN O=[N+]([O-])c1cccc(C(F)(F)F)c1O[C@@H]1CNCCC1(F)F ZINC001218447275 1315197265 /nfs/dbraw/zinc/19/72/65/1315197265.db2.gz ILBMEHJYBCGFJX-SECBINFHSA-N 0 3 326.221 2.990 20 5 EFBDHN O=[N+]([O-])c1ccc(Br)cc1O[C@H]1CNCCC1(F)F ZINC001218449914 1315198303 /nfs/dbraw/zinc/19/83/03/1315198303.db2.gz XGMJQUOWUVTWOW-JTQLQIEISA-N 0 3 337.120 2.733 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])ccc1O[C@@H]1CNCc2ccccc21 ZINC001218489721 1315204607 /nfs/dbraw/zinc/20/46/07/1315204607.db2.gz QJCBMEMIJLIQOY-MRXNPFEDSA-N 0 3 328.324 2.605 20 5 EFBDHN C[C@@H]1CCN[C@H](C(=O)n2c3ccccc3cc3c(=O)c(N)ccc2-3)C1 ZINC001219254105 1315294960 /nfs/dbraw/zinc/29/49/60/1315294960.db2.gz UHDBERLXZLHKGD-WBMJQRKESA-N 0 3 335.407 2.717 20 5 EFBDHN Cc1nccn1-c1ccncc1NC(=O)c1ccc([N+](=O)[O-])s1 ZINC001251861948 1315382769 /nfs/dbraw/zinc/38/27/69/1315382769.db2.gz FYNIOKORACESKZ-UHFFFAOYSA-N 0 3 329.341 2.798 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N1CCC[C@@]2(CCCC(=O)N2)C1 ZINC001254557685 1315723478 /nfs/dbraw/zinc/72/34/78/1315723478.db2.gz QSILTBIWXPETHI-KDOFPFPSSA-N 0 3 331.416 2.661 20 5 EFBDHN CCOC(=O)C[C@H]1CCCN([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254592688 1315728227 /nfs/dbraw/zinc/72/82/27/1315728227.db2.gz FUKJGDWGQNNWIA-DYVFJYSZSA-N 0 3 332.400 2.727 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@@H](N1CC[C@@H](Oc3cccnc3)C1)C2 ZINC001254599939 1315729517 /nfs/dbraw/zinc/72/95/17/1315729517.db2.gz MZPRCEVRLDNYML-FUHWJXTLSA-N 0 3 325.368 2.610 20 5 EFBDHN Cc1ccc(O[C@@H]2CCN([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)nc1 ZINC001254605300 1315730487 /nfs/dbraw/zinc/73/04/87/1315730487.db2.gz BDEAFWZYXSWOQW-ZWKOTPCHSA-N 0 3 339.395 2.919 20 5 EFBDHN CCC(=O)N(CC)C1CCN([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254610359 1315731119 /nfs/dbraw/zinc/73/11/19/1315731119.db2.gz KDQWEEZJKJLHOI-SFHVURJKSA-N 0 3 345.443 2.785 20 5 EFBDHN Cc1cccc(O[C@@H]2CCN([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)n1 ZINC001254612089 1315731613 /nfs/dbraw/zinc/73/16/13/1315731613.db2.gz UYMZAMGOYCDCEN-QZTJIDSGSA-N 0 3 339.395 2.919 20 5 EFBDHN COc1cc(N2CCC(N[C@H](C)c3ccno3)CC2)ccc1[N+](=O)[O-] ZINC001256095023 1315904462 /nfs/dbraw/zinc/90/44/62/1315904462.db2.gz VKRIAWDNPPQNJJ-GFCCVEGCSA-N 0 3 346.387 2.911 20 5 EFBDHN CN1CCCC[C@@H]1CNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC001262652918 1316477607 /nfs/dbraw/zinc/47/76/07/1316477607.db2.gz UCAMABFZUQNJGR-SNVBAGLBSA-N 0 3 329.759 2.601 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)c2ncnc(N[C@@H]3CN4CCC3CC4)c2c1 ZINC001262712530 1316483481 /nfs/dbraw/zinc/48/34/81/1316483481.db2.gz IBPZRLXVOXCHBI-CYBMUJFWSA-N 0 3 333.779 2.698 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CCC[C@@H](c3nc4ccccc4[nH]3)C2)c1 ZINC001319388390 1328869625 /nfs/dbraw/zinc/86/96/25/1328869625.db2.gz GARAUSDFTKDBPV-CYBMUJFWSA-N 0 3 340.387 2.547 20 5 EFBDHN Cc1nn(CN2CCN(C(C)(C)C)CC2)c2cc([N+](=O)[O-])ccc12 ZINC001319557777 1328916281 /nfs/dbraw/zinc/91/62/81/1328916281.db2.gz JYJAMSOLHOXPKQ-UHFFFAOYSA-N 0 3 331.420 2.627 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@H](CCO)C2CC2)c(Br)c1 ZINC001320408496 1329126567 /nfs/dbraw/zinc/12/65/67/1329126567.db2.gz KLEUYTOSKICTBC-CYBMUJFWSA-N 0 3 329.194 2.608 20 5 EFBDHN O=C(c1ccccc1)N1CCC[C@@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001320525688 1329153841 /nfs/dbraw/zinc/15/38/41/1329153841.db2.gz CXHLBIQUGIQESR-QGZVFWFLSA-N 0 3 339.395 2.989 20 5 EFBDHN O=C(NC[C@H]1CCCCN1C1CC1)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001321161140 1329351388 /nfs/dbraw/zinc/35/13/88/1329351388.db2.gz HGJMPLZFRGSZQB-QGZVFWFLSA-N 0 3 344.415 2.637 20 5 EFBDHN Cc1cncc([N+](=O)[O-])c1NC[C@H]1CCCN1Cc1ccccc1 ZINC001322706200 1329481350 /nfs/dbraw/zinc/48/13/50/1329481350.db2.gz ODYRYYJQNQZKAS-MRXNPFEDSA-N 0 3 326.400 2.797 20 5 EFBDHN O=C(c1ccccc1)N1CCC[C@@H](NCc2ccc([N+](=O)[O-])cc2)C1 ZINC001323346020 1329537172 /nfs/dbraw/zinc/53/71/72/1329537172.db2.gz PYAJEOLFZYMWJU-QGZVFWFLSA-N 0 3 339.395 2.989 20 5 EFBDHN CN(CCC(N)=O)Cc1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001323780234 1329569960 /nfs/dbraw/zinc/56/99/60/1329569960.db2.gz GIABHRCRQRVPDW-UHFFFAOYSA-N 0 3 337.763 2.815 20 5 EFBDHN CN(C)[C@H]1CCCC[C@@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC001324400790 1329623890 /nfs/dbraw/zinc/62/38/90/1329623890.db2.gz VZKBZIRIPQXQCV-HOTGVXAUSA-N 0 3 347.415 2.547 20 5 EFBDHN CN(C)[C@@H]1CCCC[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC001324400791 1329624052 /nfs/dbraw/zinc/62/40/52/1329624052.db2.gz VZKBZIRIPQXQCV-HZPDHXFCSA-N 0 3 347.415 2.547 20 5 EFBDHN N[C@@H](C(=O)NCCCCc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC001326338938 1329748694 /nfs/dbraw/zinc/74/86/94/1329748694.db2.gz MKUQLAYCTRBGPX-QGZVFWFLSA-N 0 3 333.432 2.941 20 5 EFBDHN O=[N+]([O-])c1cnc(NC2CCN([C@H]3CCOC3)CC2)c2ccccc21 ZINC001331147398 1330798822 /nfs/dbraw/zinc/79/88/22/1330798822.db2.gz VMVXIHDPWKLOIT-AWEZNQCLSA-N 0 3 342.399 2.808 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CNCc2ccncc2C(F)(F)F)c1 ZINC001336827561 1331505940 /nfs/dbraw/zinc/50/59/40/1331505940.db2.gz YBGREEOIKHVTQT-AWEZNQCLSA-N 0 3 341.289 2.832 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CNCc2ccncc2C(F)(F)F)c1 ZINC001336827564 1331505980 /nfs/dbraw/zinc/50/59/80/1331505980.db2.gz YBGREEOIKHVTQT-CQSZACIVSA-N 0 3 341.289 2.832 20 5 EFBDHN Cc1cc(C[C@H](C)Nc2cc(C)nc3ccc([N+](=O)[O-])cc32)n[nH]1 ZINC001337900994 1331611213 /nfs/dbraw/zinc/61/12/13/1331611213.db2.gz CFQNRBFUWBQCHB-JTQLQIEISA-N 0 3 325.372 2.948 20 5 EFBDHN Cc1cc(C[C@H](C)Nc2cc(C)nc3ccc([N+](=O)[O-])cc32)[nH]n1 ZINC001337900994 1331611218 /nfs/dbraw/zinc/61/12/18/1331611218.db2.gz CFQNRBFUWBQCHB-JTQLQIEISA-N 0 3 325.372 2.948 20 5 EFBDHN CSc1ccc(OC[C@@H](O)CNCc2ccc([N+](=O)[O-])cc2)cc1 ZINC001338408238 1331705096 /nfs/dbraw/zinc/70/50/96/1331705096.db2.gz MZAXVQCEECGPKN-HNNXBMFYSA-N 0 3 348.424 2.846 20 5 EFBDHN CN1CCCC[C@H]1CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC001340857910 1332213214 /nfs/dbraw/zinc/21/32/14/1332213214.db2.gz OGCDGZYLRMYEIE-ZDUSSCGKSA-N 0 3 337.395 2.612 20 5 EFBDHN Cc1nn(C)cc1CCC(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC001343829416 1332384536 /nfs/dbraw/zinc/38/45/36/1332384536.db2.gz HLHZOXDSFVBAQN-YVEFUNNKSA-N 0 3 349.362 2.750 20 5 EFBDHN CC([C@H](OC(=O)c1c2c(nn1C)CCC2)c1ccccc1F)[N+](=O)[O-] ZINC001345207382 1332521950 /nfs/dbraw/zinc/52/19/50/1332521950.db2.gz KTIFKXUFTXDGQA-HWPZZCPQSA-N 0 3 347.346 2.611 20 5 EFBDHN CN1CCCC[C@@H]1CNC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC001351666922 1333265933 /nfs/dbraw/zinc/26/59/33/1333265933.db2.gz RIJZQVHVRHXGQF-MRXNPFEDSA-N 0 3 346.431 2.753 20 5 EFBDHN O=C(N[C@H]1CCCN2CCCC[C@H]12)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000847254009 1333447378 /nfs/dbraw/zinc/44/73/78/1333447378.db2.gz CHTWNNCEYVIEMF-UONOGXRCSA-N 0 3 339.342 2.620 20 5 EFBDHN O=C(N[C@@H]1CCCN2CCCC[C@@H]12)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000847256727 1333451782 /nfs/dbraw/zinc/45/17/82/1333451782.db2.gz RJBWLVOCENORSP-HIFRSBDPSA-N 0 3 337.807 2.995 20 5 EFBDHN Cc1cc([N+](=O)[O-])cc(C(=O)N[C@H]2CCCN3CCCC[C@@H]23)c1F ZINC000847257730 1333452965 /nfs/dbraw/zinc/45/29/65/1333452965.db2.gz YVWMGCCSGGBNGH-GJZGRUSLSA-N 0 3 335.379 2.789 20 5 EFBDHN C[C@@H](NCc1cc([N+](=O)[O-])ccc1Br)[C@H]1CCOC1 ZINC001354604403 1334404445 /nfs/dbraw/zinc/40/44/45/1334404445.db2.gz RPGIOQXLBDMQEH-ZJUUUORDSA-N 0 3 329.194 2.872 20 5 EFBDHN C[C@@H](NCc1cc([N+](=O)[O-])ccc1Br)[C@@H]1CCOC1 ZINC001354604400 1334404576 /nfs/dbraw/zinc/40/45/76/1334404576.db2.gz RPGIOQXLBDMQEH-NXEZZACHSA-N 0 3 329.194 2.872 20 5 EFBDHN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCCN2CCCC[C@@H]12 ZINC000848352218 1334685746 /nfs/dbraw/zinc/68/57/46/1334685746.db2.gz NLBOFJLYZGLKGW-KGLIPLIRSA-N 0 3 335.379 2.789 20 5 EFBDHN C[C@@H](O)C[C@@H]1CCCN1Cn1cc(-c2ccccc2[N+](=O)[O-])cn1 ZINC000848483113 1334739582 /nfs/dbraw/zinc/73/95/82/1334739582.db2.gz YRQCAVSNCZNPSY-HIFRSBDPSA-N 0 3 330.388 2.651 20 5 EFBDHN Cc1cc(F)cc(C(=O)N2CCNC3(CCCCC3)C2)c1[N+](=O)[O-] ZINC000848942073 1334999335 /nfs/dbraw/zinc/99/93/35/1334999335.db2.gz VPUSBXYKNLUJNG-UHFFFAOYSA-N 0 3 335.379 2.791 20 5 EFBDHN COc1cccc2c1OCC[C@@H]2NC[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001356534368 1335049916 /nfs/dbraw/zinc/04/99/16/1335049916.db2.gz LZVSSLDQXZEKCA-HOTGVXAUSA-N 0 3 344.367 2.750 20 5 EFBDHN O=[N+]([O-])c1ccc(S(=O)(=O)CCN[C@@H]2CC23CCCCC3)cc1 ZINC001356609502 1335063008 /nfs/dbraw/zinc/06/30/08/1335063008.db2.gz PIEMNQIOXBJWQL-OAHLLOKOSA-N 0 3 338.429 2.681 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)NC[C@H]2CCCCN2C)cc1[N+](=O)[O-] ZINC001357291338 1335297116 /nfs/dbraw/zinc/29/71/16/1335297116.db2.gz KRUSNTLQRUKEGT-UKRRQHHQSA-N 0 3 334.420 2.748 20 5 EFBDHN O=C(N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1)C1(C2CC2)CCC1 ZINC001020440752 713007688 /nfs/dbraw/zinc/00/76/88/713007688.db2.gz QFIQYYVNZUSMKF-WKILWMFISA-N 0 3 343.427 2.912 20 5 EFBDHN O=C(N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1)c1ccc(Cl)o1 ZINC001021842459 714553599 /nfs/dbraw/zinc/55/35/99/714553599.db2.gz BMRBHMBCESRDHV-TXEJJXNPSA-N 0 3 349.774 2.892 20 5 EFBDHN Cn1ncc([N+](=O)[O-])c1NCC(C)(C)N1CCc2ccccc2C1 ZINC000891735686 714984344 /nfs/dbraw/zinc/98/43/44/714984344.db2.gz LWMGKMAYWYTCQJ-UHFFFAOYSA-N 0 3 329.404 2.577 20 5 EFBDHN C[C@H](CNC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])N1CCCC[C@@H]1C ZINC000727708862 724390014 /nfs/dbraw/zinc/39/00/14/724390014.db2.gz MZVJCRRQTJNKQL-WDEREUQCSA-N 0 3 341.358 2.866 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CN(C2CC2)C[C@H]1C ZINC000934574377 715685543 /nfs/dbraw/zinc/68/55/43/715685543.db2.gz GIHRQOHATVUPAF-QMTHXVAHSA-N 0 3 335.429 2.529 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]C[C@H]2COc3ccccc3C2)c1[N+](=O)[O-] ZINC000892402436 717048216 /nfs/dbraw/zinc/04/82/16/717048216.db2.gz PCOVOXHXZAGSKR-LBPRGKRZSA-N 0 3 344.367 2.650 20 5 EFBDHN C[C@H]1CN(c2cc([N+](=O)[O-])cc3c(Cl)ncnc32)[C@@H](C)CN1C ZINC001164638494 719256546 /nfs/dbraw/zinc/25/65/46/719256546.db2.gz ZZBJMTKPQZGBGA-UWVGGRQHSA-N 0 3 335.795 2.720 20 5 EFBDHN O=C(CC1CCCC1)N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001019954561 719416130 /nfs/dbraw/zinc/41/61/30/719416130.db2.gz YWEGEHUIAGVTTC-WKILWMFISA-N 0 3 331.416 2.912 20 5 EFBDHN CC(COC(=O)C1=Cc2ccccc2O[C@H]1C(F)(F)F)[N+](=O)[O-] ZINC000893045568 719527952 /nfs/dbraw/zinc/52/79/52/719527952.db2.gz XXRJMGVIAFVTSM-PRHODGIISA-N 0 3 331.246 2.602 20 5 EFBDHN O=[N+]([O-])c1c(NC[C@@H]2NCCc3ccccc32)nc2sccn21 ZINC000261810835 721713875 /nfs/dbraw/zinc/71/38/75/721713875.db2.gz GNGBRTZPDRORAH-LBPRGKRZSA-N 0 3 329.385 2.603 20 5 EFBDHN Cc1ccc(C(=O)N[C@H]2C[C@H](CNCc3csc([N+](=O)[O-])c3)C2)o1 ZINC000983083463 721793333 /nfs/dbraw/zinc/79/33/33/721793333.db2.gz HLNUWDOTWITHOF-AULYBMBSSA-N 0 3 349.412 2.856 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]CCCc2cccc(C)n2)c1[N+](=O)[O-] ZINC000894390689 722687458 /nfs/dbraw/zinc/68/74/58/722687458.db2.gz MEGZZCQZTPPJTL-UHFFFAOYSA-N 0 3 331.372 2.735 20 5 EFBDHN COc1c([O-])ccc(C[N@@H+]2CCCCC[C@H]2C[C@H](C)O)c1[N+](=O)[O-] ZINC000894412211 722719586 /nfs/dbraw/zinc/71/95/86/722719586.db2.gz ILFKRBVISLJIME-JSGCOSHPSA-N 0 3 338.404 2.825 20 5 EFBDHN COc1c([O-])ccc(C[N@H+]2CCCCC[C@H]2C[C@H](C)O)c1[N+](=O)[O-] ZINC000894412211 722719587 /nfs/dbraw/zinc/71/95/87/722719587.db2.gz ILFKRBVISLJIME-JSGCOSHPSA-N 0 3 338.404 2.825 20 5 EFBDHN COCC(C)(C)CCC[NH2+]Cc1ccc([O-])c(OC)c1[N+](=O)[O-] ZINC000894508453 722762445 /nfs/dbraw/zinc/76/24/45/722762445.db2.gz LLQYRTHWBZHVAP-UHFFFAOYSA-N 0 3 326.393 2.851 20 5 EFBDHN COc1c(O)ccc(CN[C@@H]2COc3c(C)cccc3C2)c1[N+](=O)[O-] ZINC000894555065 722781423 /nfs/dbraw/zinc/78/14/23/722781423.db2.gz PMZRFOZXTKNDOK-AWEZNQCLSA-N 0 3 344.367 2.711 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H](N3CCCCC3)C2)c1C ZINC000896260660 723221244 /nfs/dbraw/zinc/22/12/44/723221244.db2.gz ULEPRGWRTPVNHW-OAHLLOKOSA-N 0 3 331.416 2.912 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H](N3CCCCC3)C2)c1C ZINC000896260659 723221303 /nfs/dbraw/zinc/22/13/03/723221303.db2.gz ULEPRGWRTPVNHW-HNNXBMFYSA-N 0 3 331.416 2.912 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C1CCN(C(=O)/C=C/C2CC2)CC1 ZINC000985358584 724166388 /nfs/dbraw/zinc/16/63/88/724166388.db2.gz ZOBIWQAPGIEPBA-CMDGGOBGSA-N 0 3 343.427 2.984 20 5 EFBDHN CC(C)CN(CCN(C)C)C(=O)N[C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000925224057 724906641 /nfs/dbraw/zinc/90/66/41/724906641.db2.gz DHCIAIXLPOXQLL-CQSZACIVSA-N 0 3 336.436 2.885 20 5 EFBDHN C[C@@H](CN1CCCCC1)NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000152627257 726199306 /nfs/dbraw/zinc/19/93/06/726199306.db2.gz JJGAKHRYWWECFU-NSHDSACASA-N 0 3 325.796 2.852 20 5 EFBDHN CCN1CCCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)[C@@H](C)C1 ZINC000910282793 727427188 /nfs/dbraw/zinc/42/71/88/727427188.db2.gz IWGYHMNLZNCOFP-ZDUSSCGKSA-N 0 3 342.399 2.699 20 5 EFBDHN CCN1CCCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000910293805 727430982 /nfs/dbraw/zinc/43/09/82/727430982.db2.gz APYYNIBKPLXQPW-ZDUSSCGKSA-N 0 3 346.431 2.725 20 5 EFBDHN C[C@H]1CCN(Cc2ccccc2)C[C@H]1NC(=O)CCC(C)(C)[N+](=O)[O-] ZINC000913098179 727781246 /nfs/dbraw/zinc/78/12/46/727781246.db2.gz ZVAKLUROEKYTGW-DOTOQJQBSA-N 0 3 347.459 2.849 20 5 EFBDHN C[C@@H]1CCCN(CCNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000129613073 727951400 /nfs/dbraw/zinc/95/14/00/727951400.db2.gz GILGTGAIPCLWDY-LLVKDONJSA-N 0 3 325.796 2.710 20 5 EFBDHN Cc1cc(C(=O)N2CCC(NCc3csc([N+](=O)[O-])c3)CC2)co1 ZINC000991678887 728257913 /nfs/dbraw/zinc/25/79/13/728257913.db2.gz GMNOQCUBACQIDX-UHFFFAOYSA-N 0 3 349.412 2.952 20 5 EFBDHN CN(C)[C@@H](CNc1nc2ccccn2c1[N+](=O)[O-])c1ccccc1 ZINC000070790023 728407402 /nfs/dbraw/zinc/40/74/02/728407402.db2.gz LIESUTDRFWGHAT-AWEZNQCLSA-N 0 3 325.372 2.957 20 5 EFBDHN CN(Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)C(C1CC1)C1CC1 ZINC000172899666 728609671 /nfs/dbraw/zinc/60/96/71/728609671.db2.gz RUEKTYNTNBSPFV-UHFFFAOYSA-N 0 3 327.388 2.931 20 5 EFBDHN CC(C)[C@@H](CCO)NCc1cccc([N+](=O)[O-])c1Br ZINC000231078069 728612975 /nfs/dbraw/zinc/61/29/75/728612975.db2.gz UMHYAQRDTZBHIC-LLVKDONJSA-N 0 3 331.210 2.854 20 5 EFBDHN O=C(Nc1nccc2c1cccc2[N+](=O)[O-])c1ccc2c(c1)CNC2 ZINC001580800083 1091014083 /nfs/dbraw/zinc/01/40/83/1091014083.db2.gz RYYWZLLWBDIXPZ-UHFFFAOYSA-N 0 3 334.335 2.999 20 5 EFBDHN CC(C)(C)[C@@H]1CCC[N@@H+]1Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001589104068 1093033073 /nfs/dbraw/zinc/03/30/73/1093033073.db2.gz YPOKRUUXEAEKGK-AWEZNQCLSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)(C)[C@@H]1CCC[N@H+]1Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001589104068 1093033077 /nfs/dbraw/zinc/03/30/77/1093033077.db2.gz YPOKRUUXEAEKGK-AWEZNQCLSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)(C)[C@@H]1CCC[N@@H+]1Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001589104068 1093033081 /nfs/dbraw/zinc/03/30/81/1093033081.db2.gz YPOKRUUXEAEKGK-AWEZNQCLSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)(C)[C@@H]1CCC[N@H+]1Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001589104068 1093033087 /nfs/dbraw/zinc/03/30/87/1093033087.db2.gz YPOKRUUXEAEKGK-AWEZNQCLSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)C[C@H]1CC[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001589573739 1093110830 /nfs/dbraw/zinc/11/08/30/1093110830.db2.gz ZSSHLUHWMRJCSK-GFCCVEGCSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)C[C@H]1CC[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001589573739 1093110832 /nfs/dbraw/zinc/11/08/32/1093110832.db2.gz ZSSHLUHWMRJCSK-GFCCVEGCSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)C[C@H]1CC[N@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001589573739 1093110833 /nfs/dbraw/zinc/11/08/33/1093110833.db2.gz ZSSHLUHWMRJCSK-GFCCVEGCSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)C[C@H]1CC[N@@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001589573739 1093110835 /nfs/dbraw/zinc/11/08/35/1093110835.db2.gz ZSSHLUHWMRJCSK-GFCCVEGCSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)CC[N@H+](Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])C1CC1 ZINC001589600840 1093113792 /nfs/dbraw/zinc/11/37/92/1093113792.db2.gz YXNONNORHCGVRR-UHFFFAOYSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)CC[N@@H+](Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])C1CC1 ZINC001589600840 1093113797 /nfs/dbraw/zinc/11/37/97/1093113797.db2.gz YXNONNORHCGVRR-UHFFFAOYSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)CC[N@H+](Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])C1CC1 ZINC001589600840 1093113808 /nfs/dbraw/zinc/11/38/08/1093113808.db2.gz YXNONNORHCGVRR-UHFFFAOYSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)CC[N@@H+](Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])C1CC1 ZINC001589600840 1093113816 /nfs/dbraw/zinc/11/38/16/1093113816.db2.gz YXNONNORHCGVRR-UHFFFAOYSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@H]1CCC[C@@H]([N@H+](C)Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590245592 1093336427 /nfs/dbraw/zinc/33/64/27/1093336427.db2.gz XQPGRAFFGGDGAB-NWDGAFQWSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@H]1CCC[C@@H]([N@@H+](C)Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590245592 1093336435 /nfs/dbraw/zinc/33/64/35/1093336435.db2.gz XQPGRAFFGGDGAB-NWDGAFQWSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@H]1CCC[C@@H]([N@H+](C)Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590245592 1093336443 /nfs/dbraw/zinc/33/64/43/1093336443.db2.gz XQPGRAFFGGDGAB-NWDGAFQWSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@H]1CCC[C@@H]([N@@H+](C)Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590245592 1093336453 /nfs/dbraw/zinc/33/64/53/1093336453.db2.gz XQPGRAFFGGDGAB-NWDGAFQWSA-N 0 3 330.392 2.785 20 5 EFBDHN CC[NH+](CC)CC[C@H](C)Nc1cc(C)c([N+](=O)[O-])cc1-c1nnn[n-]1 ZINC001590686782 1093547894 /nfs/dbraw/zinc/54/78/94/1093547894.db2.gz JUFVWOCNJDWHRH-LBPRGKRZSA-N 0 3 347.423 2.616 20 5 EFBDHN CC[NH+](CC)CC[C@H](C)Nc1cc(C)c([N+](=O)[O-])cc1-c1nn[n-]n1 ZINC001590686782 1093547898 /nfs/dbraw/zinc/54/78/98/1093547898.db2.gz JUFVWOCNJDWHRH-LBPRGKRZSA-N 0 3 347.423 2.616 20 5 EFBDHN CC[NH+](CC)CCC[C@H](C)Nc1cc(-c2nnn[n-]2)ccc1[N+](=O)[O-] ZINC001590688028 1093550285 /nfs/dbraw/zinc/55/02/85/1093550285.db2.gz TVLANPSBIWDTTA-LBPRGKRZSA-N 0 3 347.423 2.697 20 5 EFBDHN CC[NH+](CC)CCC[C@H](C)Nc1cc(-c2nn[n-]n2)ccc1[N+](=O)[O-] ZINC001590688028 1093550292 /nfs/dbraw/zinc/55/02/92/1093550292.db2.gz TVLANPSBIWDTTA-LBPRGKRZSA-N 0 3 347.423 2.697 20 5 EFBDHN NCc1nn(-c2ccc(-c3cccc([N+](=O)[O-])c3)nn2)c2ccccc12 ZINC001167697298 1095970803 /nfs/dbraw/zinc/97/08/03/1095970803.db2.gz RWOJRWSBYXYGNL-UHFFFAOYSA-N 0 3 346.350 2.849 20 5 EFBDHN CC(C)[C@H]1CCC[N@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001603245717 1096484660 /nfs/dbraw/zinc/48/46/60/1096484660.db2.gz LMHCMHACCOFLSZ-ZDUSSCGKSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)[C@H]1CCC[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001603245717 1096484663 /nfs/dbraw/zinc/48/46/63/1096484663.db2.gz LMHCMHACCOFLSZ-ZDUSSCGKSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)[C@H]1CCC[N@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001603245717 1096484667 /nfs/dbraw/zinc/48/46/67/1096484667.db2.gz LMHCMHACCOFLSZ-ZDUSSCGKSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)[C@H]1CCC[N@@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001603245717 1096484669 /nfs/dbraw/zinc/48/46/69/1096484669.db2.gz LMHCMHACCOFLSZ-ZDUSSCGKSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)C[C@@H]1CCC[N@@H+]1Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001603270571 1096491362 /nfs/dbraw/zinc/49/13/62/1096491362.db2.gz SIMSKJCENFAXKT-AWEZNQCLSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)C[C@@H]1CCC[N@H+]1Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001603270571 1096491366 /nfs/dbraw/zinc/49/13/66/1096491366.db2.gz SIMSKJCENFAXKT-AWEZNQCLSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)C[C@@H]1CCC[N@@H+]1Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001603270571 1096491373 /nfs/dbraw/zinc/49/13/73/1096491373.db2.gz SIMSKJCENFAXKT-AWEZNQCLSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)C[C@@H]1CCC[N@H+]1Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001603270571 1096491378 /nfs/dbraw/zinc/49/13/78/1096491378.db2.gz SIMSKJCENFAXKT-AWEZNQCLSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@H]([NH2+]Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])C1CCC(F)CC1 ZINC001603665551 1096583760 /nfs/dbraw/zinc/58/37/60/1096583760.db2.gz QPUFNDWDSIGGQS-IFQILLTASA-N 0 3 348.382 2.781 20 5 EFBDHN C[C@H]([NH2+]Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])C1CCC(F)CC1 ZINC001603665551 1096583768 /nfs/dbraw/zinc/58/37/68/1096583768.db2.gz QPUFNDWDSIGGQS-IFQILLTASA-N 0 3 348.382 2.781 20 5 EFBDHN CC[C@@H]([NH2+]Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])[C@@H]1CC1(C)C ZINC001604061203 1096715536 /nfs/dbraw/zinc/71/55/36/1096715536.db2.gz KRYORILXIVPNSW-QWHCGFSZSA-N 0 3 330.392 2.689 20 5 EFBDHN CC[C@@H]([NH2+]Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])[C@@H]1CC1(C)C ZINC001604061203 1096715541 /nfs/dbraw/zinc/71/55/41/1096715541.db2.gz KRYORILXIVPNSW-QWHCGFSZSA-N 0 3 330.392 2.689 20 5 EFBDHN CC[NH+](CC)CCC[C@H](C)Nc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001604284273 1096794663 /nfs/dbraw/zinc/79/46/63/1096794663.db2.gz DAOZDARRNNNPPY-LBPRGKRZSA-N 0 3 347.423 2.697 20 5 EFBDHN CC[NH+](CC)CCC[C@H](C)Nc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001604284273 1096794670 /nfs/dbraw/zinc/79/46/70/1096794670.db2.gz DAOZDARRNNNPPY-LBPRGKRZSA-N 0 3 347.423 2.697 20 5 EFBDHN C[N@H+](Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])[C@@H]1CCC(C)(C)C1 ZINC001604794823 1096956664 /nfs/dbraw/zinc/95/66/64/1096956664.db2.gz IXWGIGKIHWUQSC-LLVKDONJSA-N 0 3 330.392 2.785 20 5 EFBDHN C[N@@H+](Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])[C@@H]1CCC(C)(C)C1 ZINC001604794823 1096956674 /nfs/dbraw/zinc/95/66/74/1096956674.db2.gz IXWGIGKIHWUQSC-LLVKDONJSA-N 0 3 330.392 2.785 20 5 EFBDHN C[N@H+](Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])[C@@H]1CCC(C)(C)C1 ZINC001604794823 1096956681 /nfs/dbraw/zinc/95/66/81/1096956681.db2.gz IXWGIGKIHWUQSC-LLVKDONJSA-N 0 3 330.392 2.785 20 5 EFBDHN C[N@@H+](Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])[C@@H]1CCC(C)(C)C1 ZINC001604794823 1096956686 /nfs/dbraw/zinc/95/66/86/1096956686.db2.gz IXWGIGKIHWUQSC-LLVKDONJSA-N 0 3 330.392 2.785 20 5 EFBDHN CN1C[C@H]2C[C@@H](C1)N(C(=O)c1ccnc3c1ccc1cccnc13)C2 ZINC001269224201 1097959897 /nfs/dbraw/zinc/95/98/97/1097959897.db2.gz GVFIIEPMDHEFNV-HIFRSBDPSA-N 0 3 332.407 2.559 20 5 EFBDHN CC(C)C[C@@H]1CCC[N@@H+]1Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001609093981 1098142038 /nfs/dbraw/zinc/14/20/38/1098142038.db2.gz ZGRZKYQPISXCSA-LBPRGKRZSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)C[C@@H]1CCC[N@H+]1Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001609093981 1098142042 /nfs/dbraw/zinc/14/20/42/1098142042.db2.gz ZGRZKYQPISXCSA-LBPRGKRZSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)C[C@@H]1CCC[N@@H+]1Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001609093981 1098142047 /nfs/dbraw/zinc/14/20/47/1098142047.db2.gz ZGRZKYQPISXCSA-LBPRGKRZSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)C[C@@H]1CCC[N@H+]1Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001609093981 1098142052 /nfs/dbraw/zinc/14/20/52/1098142052.db2.gz ZGRZKYQPISXCSA-LBPRGKRZSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@H](C)[N@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001609162709 1098176500 /nfs/dbraw/zinc/17/65/00/1098176500.db2.gz IJSQQQNKDFWBKZ-NEPJUHHUSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@H](C)[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001609162709 1098176503 /nfs/dbraw/zinc/17/65/03/1098176503.db2.gz IJSQQQNKDFWBKZ-NEPJUHHUSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@H](C)[N@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001609162709 1098176511 /nfs/dbraw/zinc/17/65/11/1098176511.db2.gz IJSQQQNKDFWBKZ-NEPJUHHUSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@H](C)[N@@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001609162709 1098176516 /nfs/dbraw/zinc/17/65/16/1098176516.db2.gz IJSQQQNKDFWBKZ-NEPJUHHUSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])[C@@H]1C ZINC001609164018 1098178014 /nfs/dbraw/zinc/17/80/14/1098178014.db2.gz KFUGCUCCENGYCB-JTNHKYCSSA-N 0 3 330.392 2.689 20 5 EFBDHN C[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])[C@@H]1C ZINC001609164018 1098178017 /nfs/dbraw/zinc/17/80/17/1098178017.db2.gz KFUGCUCCENGYCB-JTNHKYCSSA-N 0 3 330.392 2.689 20 5 EFBDHN CC[NH+](CC)CCCCNc1cc(C)c([N+](=O)[O-])cc1-c1nnn[n-]1 ZINC001609223164 1098210827 /nfs/dbraw/zinc/21/08/27/1098210827.db2.gz WROAWGLCROFGOX-UHFFFAOYSA-N 0 3 347.423 2.617 20 5 EFBDHN CC[NH+](CC)CCCCNc1cc(C)c([N+](=O)[O-])cc1-c1nn[n-]n1 ZINC001609223164 1098210832 /nfs/dbraw/zinc/21/08/32/1098210832.db2.gz WROAWGLCROFGOX-UHFFFAOYSA-N 0 3 347.423 2.617 20 5 EFBDHN Cc1ccc(F)c(C(=O)NCCCNCc2ccccc2[N+](=O)[O-])c1 ZINC001167320378 1102575027 /nfs/dbraw/zinc/57/50/27/1102575027.db2.gz ZAQJOXOPAMHKBE-UHFFFAOYSA-N 0 3 345.374 2.952 20 5 EFBDHN COC(=O)N1CCC[C@@H](NCc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000783609587 1102692824 /nfs/dbraw/zinc/69/28/24/1102692824.db2.gz ZREMSGGLLMOMQO-LLVKDONJSA-N 0 3 327.768 2.569 20 5 EFBDHN COc1cc(CNCCc2cccnc2C)c([N+](=O)[O-])cc1OC ZINC000898257398 1106307734 /nfs/dbraw/zinc/30/77/34/1106307734.db2.gz UKWKPMYWFJNZMQ-UHFFFAOYSA-N 0 3 331.372 2.648 20 5 EFBDHN O=C(NCCCNCc1ccccc1[N+](=O)[O-])c1cncc(Cl)c1 ZINC001168342797 1107326028 /nfs/dbraw/zinc/32/60/28/1107326028.db2.gz VMFNYASVLZWBLZ-UHFFFAOYSA-N 0 3 348.790 2.553 20 5 EFBDHN CN(C)Cc1ccc(-c2noc(-c3cccc([N+](=O)[O-])c3N)n2)cc1 ZINC000904627811 1108068836 /nfs/dbraw/zinc/06/88/36/1108068836.db2.gz VGOKTVIWGPDPMO-UHFFFAOYSA-N 0 3 339.355 2.956 20 5 EFBDHN CC1(C)[C@H](O)C[C@@H]1NCc1ccc(Br)c([N+](=O)[O-])c1 ZINC000128098576 1108634775 /nfs/dbraw/zinc/63/47/75/1108634775.db2.gz GTPRJMAKAADKTP-NWDGAFQWSA-N 0 3 329.194 2.606 20 5 EFBDHN CC1(C)[C@H](NCc2ccc(Br)c([N+](=O)[O-])c2)C[C@@H]1O ZINC000128097957 1108634923 /nfs/dbraw/zinc/63/49/23/1108634923.db2.gz GTPRJMAKAADKTP-NEPJUHHUSA-N 0 3 329.194 2.606 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCCO[C@@H]1CCOC1 ZINC000927082653 1108822088 /nfs/dbraw/zinc/82/20/88/1108822088.db2.gz GZOFBEIDTRSVEC-WCQYABFASA-N 0 3 326.418 2.773 20 5 EFBDHN O=[N+]([O-])CCNC[C@@H](c1ccccc1)N1CCc2sccc2C1 ZINC000899872245 1109533288 /nfs/dbraw/zinc/53/32/88/1109533288.db2.gz YARLHCLAFVAERA-INIZCTEOSA-N 0 3 331.441 2.714 20 5 EFBDHN O=[N+]([O-])c1cncc(Br)c1N[C@@H]1CCN2CCCC[C@H]12 ZINC000300185727 1111868777 /nfs/dbraw/zinc/86/87/77/1111868777.db2.gz QNCSRJDWYMNZSW-GHMZBOCLSA-N 0 3 341.209 2.791 20 5 EFBDHN COc1ccc(C(=O)N[C@H](C)CN2C[C@@H](C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000055748527 214340030 /nfs/dbraw/zinc/34/00/30/214340030.db2.gz SYJSCJPMOSPWHZ-MELADBBJSA-N 0 3 349.431 2.700 20 5 EFBDHN CC[C@H](NCCn1cc([N+](=O)[O-])ccc1=O)c1ccc(F)cc1F ZINC000179619209 529609314 /nfs/dbraw/zinc/60/93/14/529609314.db2.gz OCPTZMQBLQQMQY-HNNXBMFYSA-N 0 3 337.326 2.776 20 5 EFBDHN CN1CC[C@H]2[C@H](CCCN2C(=O)c2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000164088546 529808832 /nfs/dbraw/zinc/80/88/32/529808832.db2.gz HZIHBVUPYCMUJN-ABAIWWIYSA-N 0 3 337.807 2.805 20 5 EFBDHN CNC(=O)CCCN(C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000131826907 529852116 /nfs/dbraw/zinc/85/21/16/529852116.db2.gz VZIPUYGAUBGESL-UHFFFAOYSA-N 0 3 331.372 2.813 20 5 EFBDHN CN(CCCNC(=O)Nc1ccncc1[N+](=O)[O-])Cc1ccccc1 ZINC000183547449 529890958 /nfs/dbraw/zinc/89/09/58/529890958.db2.gz CYOXHURUKIRWMS-UHFFFAOYSA-N 0 3 343.387 2.633 20 5 EFBDHN CN(CCCNC(=O)c1ccc(F)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000160166344 529891593 /nfs/dbraw/zinc/89/15/93/529891593.db2.gz HWJFLVMFVHHRLO-UHFFFAOYSA-N 0 3 345.374 2.986 20 5 EFBDHN Cc1cccc(CN(CCN(C)C)C(=O)c2ccc([N+](=O)[O-])o2)c1 ZINC000103114316 219257577 /nfs/dbraw/zinc/25/75/77/219257577.db2.gz AITOZMQULIGWJP-UHFFFAOYSA-N 0 3 331.372 2.700 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN2CCC[C@@H](OCCO)C2)o1 ZINC000179574925 233176952 /nfs/dbraw/zinc/17/69/52/233176952.db2.gz GPVUGDUEKGRSBG-CQSZACIVSA-N 0 3 346.383 2.828 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CNC2(c3cccc(F)c3)CC2)c1 ZINC000179692337 233327173 /nfs/dbraw/zinc/32/71/73/233327173.db2.gz NWNXBANLVDZHDJ-INIZCTEOSA-N 0 3 346.358 2.753 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN[C@@H](C)c1ccccn1 ZINC000181807975 234330212 /nfs/dbraw/zinc/33/02/12/234330212.db2.gz NLNJFKKBROMOGJ-ZDUSSCGKSA-N 0 3 328.372 2.978 20 5 EFBDHN C[C@H](CNC(=O)Nc1ccncc1[N+](=O)[O-])N(C)Cc1ccccc1 ZINC000183594279 235155407 /nfs/dbraw/zinc/15/54/07/235155407.db2.gz GPNVGPUMXZBKRV-CYBMUJFWSA-N 0 3 343.387 2.632 20 5 EFBDHN CCCN(CCN1CCCC1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000352890217 283243472 /nfs/dbraw/zinc/24/34/72/283243472.db2.gz XDXASFJPQBRNEE-UHFFFAOYSA-N 0 3 331.420 2.779 20 5 EFBDHN CN(C)C1(CN(C)C(=O)c2ccc([N+](=O)[O-])cc2Cl)CCC1 ZINC000187888916 236329180 /nfs/dbraw/zinc/32/91/80/236329180.db2.gz JLALCHGCUSCMCS-UHFFFAOYSA-N 0 3 325.796 2.805 20 5 EFBDHN C[C@H]1CN(Cc2ccc(Cl)c([N+](=O)[O-])c2)CCN1CC(C)(C)O ZINC000189915415 237395757 /nfs/dbraw/zinc/39/57/57/237395757.db2.gz OEGVURQTSGCJRR-LBPRGKRZSA-N 0 3 341.839 2.525 20 5 EFBDHN CN(C)[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000129281352 223039633 /nfs/dbraw/zinc/03/96/33/223039633.db2.gz UUDQVUURSBHNNH-LBPRGKRZSA-N 0 3 345.321 2.780 20 5 EFBDHN C[C@H](CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N(C)C1CC1 ZINC000129458902 223057177 /nfs/dbraw/zinc/05/71/77/223057177.db2.gz YHYKZEFRMMNKRX-SECBINFHSA-N 0 3 345.321 2.826 20 5 EFBDHN Cc1c(CC(=O)N(CCN(C)C)Cc2ccco2)cccc1[N+](=O)[O-] ZINC000129544933 223067595 /nfs/dbraw/zinc/06/75/95/223067595.db2.gz UUXQNPRYXQTSKQ-UHFFFAOYSA-N 0 3 345.399 2.629 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CC[C@H](OCCCc3ccccc3)C2)n1 ZINC000175959386 239294498 /nfs/dbraw/zinc/29/44/98/239294498.db2.gz TZBZOZVIUOCZSX-KRWDZBQOSA-N 0 3 344.415 2.515 20 5 EFBDHN CN(CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)C1CCCCC1 ZINC000023695263 212390188 /nfs/dbraw/zinc/39/01/88/212390188.db2.gz BVSVPBSLGQOHDO-UHFFFAOYSA-N 0 3 335.360 2.527 20 5 EFBDHN C[C@@H]1CCNC(=O)[C@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000193700829 240272114 /nfs/dbraw/zinc/27/21/14/240272114.db2.gz KVRMFXVSDWSICS-BZNIZROVSA-N 0 3 345.424 2.938 20 5 EFBDHN CC1CCC(N(C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC1 ZINC000198964917 241037709 /nfs/dbraw/zinc/03/77/09/241037709.db2.gz BWKSDGUIOWTGRT-UHFFFAOYSA-N 0 3 331.416 2.994 20 5 EFBDHN COC(=O)[C@@H]1CCN(Cc2cc(=O)oc3ccc4ccccc4c23)C1 ZINC000298774486 241158489 /nfs/dbraw/zinc/15/84/89/241158489.db2.gz BVOFFSNKNINTJQ-CQSZACIVSA-N 0 3 337.375 2.941 20 5 EFBDHN CCCCOCCNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000236832595 242374748 /nfs/dbraw/zinc/37/47/48/242374748.db2.gz URRDWLHMTMPFGA-UHFFFAOYSA-N 0 3 332.404 2.902 20 5 EFBDHN C[C@H](C(=O)NCCc1ccccc1[N+](=O)[O-])[C@@H](N)c1ccccc1 ZINC000237439660 242640469 /nfs/dbraw/zinc/64/04/69/242640469.db2.gz SBAZXBUPAUTNPC-SUMWQHHRSA-N 0 3 327.384 2.590 20 5 EFBDHN O=C1CCCN1[C@@H]1CCCN(CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000412052355 243100795 /nfs/dbraw/zinc/10/07/95/243100795.db2.gz CJFQNOFSVFXISA-MRXNPFEDSA-N 0 3 331.416 2.614 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC[C@@H](Cn2cncn2)C1 ZINC000245517565 243119930 /nfs/dbraw/zinc/11/99/30/243119930.db2.gz GXPSBBMWUJAUTP-HUUCEWRRSA-N 0 3 329.404 2.968 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412180752 243187075 /nfs/dbraw/zinc/18/70/75/243187075.db2.gz PJDQYEHYTXANSM-LAVFITLUSA-N 0 3 343.427 2.784 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCCN(CC2CCC2)CC1 ZINC000412309128 243259977 /nfs/dbraw/zinc/25/99/77/243259977.db2.gz BNTCMDGRJIYSMV-UHFFFAOYSA-N 0 3 347.415 2.551 20 5 EFBDHN C[C@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CCN(C2CC2)C1 ZINC000412364837 243290110 /nfs/dbraw/zinc/29/01/10/243290110.db2.gz JOXPGZSEWSPJHX-JEBQAFNWSA-N 0 3 343.427 2.641 20 5 EFBDHN CSc1ccc(C(=O)N(C)[C@@H]2CCN(C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000247200785 243389415 /nfs/dbraw/zinc/38/94/15/243389415.db2.gz BVLSUTJQPYCFHE-DGCLKSJQSA-N 0 3 337.445 2.729 20 5 EFBDHN C[C@@H]1CC[C@@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000248524409 243579704 /nfs/dbraw/zinc/57/97/04/243579704.db2.gz TUWVYDRLGKFGAL-DVOMOZLQSA-N 0 3 340.445 2.783 20 5 EFBDHN C[C@H](CNc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-])N1CCC[C@H](C)C1 ZINC000253619860 244039227 /nfs/dbraw/zinc/03/92/27/244039227.db2.gz GOJIEPNTZQJVCW-NWDGAFQWSA-N 0 3 345.403 2.776 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2ccc(CN[C@H](CO)[C@H]3CCCOC3)o2)c1 ZINC000414562894 244234071 /nfs/dbraw/zinc/23/40/71/244234071.db2.gz UCGJPIMTHCXAKF-WMLDXEAASA-N 0 3 346.383 2.732 20 5 EFBDHN Cc1c(NC(=O)NC[C@@H]2NCCc3ccccc32)cccc1[N+](=O)[O-] ZINC000414705971 244299900 /nfs/dbraw/zinc/29/99/00/244299900.db2.gz NXIGGXGIHCMIQK-INIZCTEOSA-N 0 3 340.383 2.912 20 5 EFBDHN CC(C)c1ccc([C@H](N)CNC(=O)c2cccc([N+](=O)[O-])c2N)cc1 ZINC000262539062 245023412 /nfs/dbraw/zinc/02/34/12/245023412.db2.gz DOZINFACBARQEK-OAHLLOKOSA-N 0 3 342.399 2.730 20 5 EFBDHN CC(C)c1ccc([C@@H](N)CNC(=O)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000262493861 245003959 /nfs/dbraw/zinc/00/39/59/245003959.db2.gz BDUXDMLPQZNQQW-INIZCTEOSA-N 0 3 342.399 2.730 20 5 EFBDHN CC[C@@H](NCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])[C@@H]1CC1(C)C ZINC000419321817 245376020 /nfs/dbraw/zinc/37/60/20/245376020.db2.gz ROTOPSFQKIBKRO-QWHCGFSZSA-N 0 3 335.404 2.956 20 5 EFBDHN CC[C@@H]1CCCN(C(C)(C)CNC(=O)c2cc([N+](=O)[O-])cnc2C)C1 ZINC000110976586 220085376 /nfs/dbraw/zinc/08/53/76/220085376.db2.gz DEYVWVUHLMMOFA-CQSZACIVSA-N 0 3 348.447 2.929 20 5 EFBDHN CON1CCC(NCc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000421394313 245960759 /nfs/dbraw/zinc/96/07/59/245960759.db2.gz GEEYIEBYUPIXPS-UHFFFAOYSA-N 0 3 331.372 2.970 20 5 EFBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CCCN1C ZINC000264146035 246106300 /nfs/dbraw/zinc/10/63/00/246106300.db2.gz YLSFTWOCZFUMHD-MRXNPFEDSA-N 0 3 334.420 2.609 20 5 EFBDHN CC[C@H]1CCCCN1CCNc1ccc(C(=O)NC)cc1[N+](=O)[O-] ZINC000264995355 247120618 /nfs/dbraw/zinc/12/06/18/247120618.db2.gz UMBSUIXNXTUIFM-AWEZNQCLSA-N 0 3 334.420 2.631 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@H]2CN(C)C[C@H]21 ZINC000425674172 247163530 /nfs/dbraw/zinc/16/35/30/247163530.db2.gz OTVTUIPECFBGCV-SWLSCSKDSA-N 0 3 348.403 2.551 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)N2CCC[C@H]3CN(C)C[C@H]32)cc1[N+](=O)[O-] ZINC000425694690 247170873 /nfs/dbraw/zinc/17/08/73/247170873.db2.gz XJVXOYMOQLKZPX-UKPHBRMFSA-N 0 3 346.431 2.700 20 5 EFBDHN CC(C)[C@@H]1N(C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC12CCC2 ZINC000427179957 247328391 /nfs/dbraw/zinc/32/83/91/247328391.db2.gz WSRYNNQVBWYQGV-RDJZCZTQSA-N 0 3 334.416 2.845 20 5 EFBDHN Cc1nn(C)c(NC[C@@H](c2cccs2)N2CCCC2)c1[N+](=O)[O-] ZINC000265221168 247311616 /nfs/dbraw/zinc/31/16/16/247311616.db2.gz GJJFGEZODGEIKB-LBPRGKRZSA-N 0 3 335.433 2.947 20 5 EFBDHN CN(C[C@H]1CCCN(C)C1)C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000265259964 247347277 /nfs/dbraw/zinc/34/72/77/247347277.db2.gz DKOMXZLRLUUAPY-HNNXBMFYSA-N 0 3 348.447 2.587 20 5 EFBDHN CN(CCOc1ccc([N+](=O)[O-])cc1)C[C@@H](O)Cc1ccccc1 ZINC000433052361 248008077 /nfs/dbraw/zinc/00/80/77/248008077.db2.gz MASYLKGXBLQDCU-KRWDZBQOSA-N 0 3 330.384 2.509 20 5 EFBDHN O=C1CCC[C@@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)N1 ZINC000433202939 248028106 /nfs/dbraw/zinc/02/81/06/248028106.db2.gz VGCACGMRBMJMQC-ZDUSSCGKSA-N 0 3 329.356 2.613 20 5 EFBDHN COCCN(Cc1ccc([N+](=O)[O-])c(OC)c1)[C@@H]1CCCSC1 ZINC000433204293 248028995 /nfs/dbraw/zinc/02/89/95/248028995.db2.gz ASVJOCJCZLDDMU-CQSZACIVSA-N 0 3 340.445 2.947 20 5 EFBDHN COCCN(Cc1ccc([N+](=O)[O-])c(OC)c1)[C@H]1CCCSC1 ZINC000433204291 248030220 /nfs/dbraw/zinc/03/02/20/248030220.db2.gz ASVJOCJCZLDDMU-AWEZNQCLSA-N 0 3 340.445 2.947 20 5 EFBDHN CN(C/C=C\c1ccccc1[N+](=O)[O-])CCN1CCOC(C)(C)C1 ZINC000435051459 248206751 /nfs/dbraw/zinc/20/67/51/248206751.db2.gz ZAEHWFUMOSKYCJ-VURMDHGXSA-N 0 3 333.432 2.651 20 5 EFBDHN O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCN2CCC[C@@H]2C1 ZINC000266314907 248242470 /nfs/dbraw/zinc/24/24/70/248242470.db2.gz GXCFVPPTTWSRKY-LLVKDONJSA-N 0 3 343.305 2.534 20 5 EFBDHN CC(C)c1ccc(CNCC2(N3CCOCC3)CC2)cc1[N+](=O)[O-] ZINC000434789263 248189644 /nfs/dbraw/zinc/18/96/44/248189644.db2.gz XCQPVIDFPLWOPI-UHFFFAOYSA-N 0 3 333.432 2.673 20 5 EFBDHN CCO[C@@H]1C[C@@H](O)C12CCN([C@@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000266505846 248335440 /nfs/dbraw/zinc/33/54/40/248335440.db2.gz BWSBXMGKQMMSJL-IAOVAPTHSA-N 0 3 334.416 2.908 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCN(CC2CCOCC2)CC1 ZINC000266541416 248351869 /nfs/dbraw/zinc/35/18/69/248351869.db2.gz QBLORVRHASJIJW-OAHLLOKOSA-N 0 3 333.432 2.700 20 5 EFBDHN COc1ccc(OCCN(C)[C@@H](CO)c2ccccc2)c([N+](=O)[O-])c1 ZINC000266544272 248353463 /nfs/dbraw/zinc/35/34/63/248353463.db2.gz RAQQMPAADRDPJK-KRWDZBQOSA-N 0 3 346.383 2.648 20 5 EFBDHN CCc1ccc(C(=O)N2CC[C@H](N3CCCCC3)C2)cc1[N+](=O)[O-] ZINC000266955016 248524140 /nfs/dbraw/zinc/52/41/40/248524140.db2.gz SMEQAXURRBGRMS-INIZCTEOSA-N 0 3 331.416 2.858 20 5 EFBDHN Cc1c(C(=O)NC[C@H](c2ccccc2)N(C)C)cccc1[N+](=O)[O-] ZINC000010017721 211141046 /nfs/dbraw/zinc/14/10/46/211141046.db2.gz NOOKFAFDHNMCFP-QGZVFWFLSA-N 0 3 327.384 2.936 20 5 EFBDHN C[C@H](O)C[C@H]1CCCN1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000093482094 218229199 /nfs/dbraw/zinc/22/91/99/218229199.db2.gz QCVCYSWWUJDLID-SUMWQHHRSA-N 0 3 344.415 2.731 20 5 EFBDHN C[C@H]1CCN(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@H](C)C1 ZINC000443642990 250215189 /nfs/dbraw/zinc/21/51/89/250215189.db2.gz QDGLIIKNVDUWBI-UONOGXRCSA-N 0 3 331.416 2.852 20 5 EFBDHN COc1cccc(C(=O)Nc2ccc(CN(C)C)cc2)c1[N+](=O)[O-] ZINC000443917445 250236990 /nfs/dbraw/zinc/23/69/90/250236990.db2.gz QSZKZXAYHDXUSR-UHFFFAOYSA-N 0 3 329.356 2.917 20 5 EFBDHN C[C@@H]1C[C@H](NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CCN1C ZINC000444077668 250256033 /nfs/dbraw/zinc/25/60/33/250256033.db2.gz UISPJOONVUZXBB-UKRRQHHQSA-N 0 3 349.434 2.894 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CCN1C ZINC000444077670 250256636 /nfs/dbraw/zinc/25/66/36/250256636.db2.gz UISPJOONVUZXBB-ZFWWWQNUSA-N 0 3 349.434 2.894 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CCN1C ZINC000444077662 250256739 /nfs/dbraw/zinc/25/67/39/250256739.db2.gz UISPJOONVUZXBB-DZGCQCFKSA-N 0 3 349.434 2.894 20 5 EFBDHN CCC[C@]1(CO)CCCN1CCOc1ccc(OC)cc1[N+](=O)[O-] ZINC000444772104 250343480 /nfs/dbraw/zinc/34/34/80/250343480.db2.gz TVXGPWYCRBGJDW-QGZVFWFLSA-N 0 3 338.404 2.609 20 5 EFBDHN Cc1cc(CN(C)C[C@@H](O)COc2ccccc2[N+](=O)[O-])ccc1F ZINC000444731803 250337700 /nfs/dbraw/zinc/33/77/00/250337700.db2.gz HMPVGBVVCRXVEB-OAHLLOKOSA-N 0 3 348.374 2.914 20 5 EFBDHN CC1(C)CCCN(CCNC(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000445227237 250396344 /nfs/dbraw/zinc/39/63/44/250396344.db2.gz WCZGJHJOACYVLS-UHFFFAOYSA-N 0 3 348.447 2.559 20 5 EFBDHN O=C1C[C@H](N[C@H]2CCCc3ccc([N+](=O)[O-])cc32)[C@@H]2CCCCN12 ZINC000367203080 284844467 /nfs/dbraw/zinc/84/44/67/284844467.db2.gz BPZFEAPNFGLJHF-ULQDDVLXSA-N 0 3 329.400 2.715 20 5 EFBDHN CC(C)c1ccc(CNC[C@H]2CCCN2CCCO)cc1[N+](=O)[O-] ZINC000449387644 251006209 /nfs/dbraw/zinc/00/62/09/251006209.db2.gz MJJPEVCEFVFXTR-MRXNPFEDSA-N 0 3 335.448 2.655 20 5 EFBDHN COC[C@@]1(C(=O)OC)CCN(C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000449458632 251032757 /nfs/dbraw/zinc/03/27/57/251032757.db2.gz WLRNTXNVDTTXPH-GIIHOQTISA-N 0 3 348.399 2.510 20 5 EFBDHN C[C@@H](NCc1ccc(NS(C)(=O)=O)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000267417959 251039618 /nfs/dbraw/zinc/03/96/18/251039618.db2.gz JTWCFVQJOFMWSV-GFCCVEGCSA-N 0 3 349.412 2.817 20 5 EFBDHN COCCn1cc(CN2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000449503107 251044665 /nfs/dbraw/zinc/04/46/65/251044665.db2.gz STPFHSXOGFMPNY-QGZVFWFLSA-N 0 3 344.415 2.817 20 5 EFBDHN COC[C@]1(CO)CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000449695932 251120809 /nfs/dbraw/zinc/12/08/09/251120809.db2.gz JMWWMEMRCLWHNR-GOSISDBHSA-N 0 3 346.383 2.686 20 5 EFBDHN COCC1(CNCc2cc(OC)c(OC)cc2[N+](=O)[O-])CCCC1 ZINC000449739010 251136056 /nfs/dbraw/zinc/13/60/56/251136056.db2.gz HWOHTWVKCMYUTE-UHFFFAOYSA-N 0 3 338.404 2.908 20 5 EFBDHN COC(=O)[C@H]1CN(Cc2cccc([N+](=O)[O-])c2)C[C@@H]1c1ccccc1 ZINC000449754162 251143359 /nfs/dbraw/zinc/14/33/59/251143359.db2.gz KYYCRNQAJXCLDC-MSOLQXFVSA-N 0 3 340.379 2.983 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000267732071 251296265 /nfs/dbraw/zinc/29/62/65/251296265.db2.gz UJZZPFCVYCRIFU-KGLIPLIRSA-N 0 3 342.399 2.775 20 5 EFBDHN CCO[C@@H]1CCC[C@H]1N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000452024919 251758209 /nfs/dbraw/zinc/75/82/09/251758209.db2.gz ZRNWCSQAMLQMIV-JGGQBBKZSA-N 0 3 335.404 2.777 20 5 EFBDHN C[C@H](N[C@@H]1COC[C@H]1O)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000453331230 252034367 /nfs/dbraw/zinc/03/43/67/252034367.db2.gz FCQISLUFLYJETD-ZKYQVNSYSA-N 0 3 334.397 2.734 20 5 EFBDHN COc1cc(OC)cc([C@H](O)CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000131057541 533086293 /nfs/dbraw/zinc/08/62/93/533086293.db2.gz VFSAHLYBZYYSCW-KPZWWZAWSA-N 0 3 346.383 2.996 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)CCN[C@H](C)c1ccccn1 ZINC000181777933 533138499 /nfs/dbraw/zinc/13/84/99/533138499.db2.gz YJWAEGGXEMLSGW-GFCCVEGCSA-N 0 3 344.371 2.678 20 5 EFBDHN CN(CC1CCN(C)CC1)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000117789738 221089494 /nfs/dbraw/zinc/08/94/94/221089494.db2.gz GRFREVPCDXEJSD-UHFFFAOYSA-N 0 3 339.823 2.591 20 5 EFBDHN Cc1c(NC(=O)CCN(C)Cc2cccnc2)cccc1[N+](=O)[O-] ZINC000119043933 221231061 /nfs/dbraw/zinc/23/10/61/221231061.db2.gz JOYQNNMICBGNJK-UHFFFAOYSA-N 0 3 328.372 2.759 20 5 EFBDHN Cc1c(CC(=O)N2CCC[C@H]2CN2CCCCC2)cccc1[N+](=O)[O-] ZINC000119689858 221378310 /nfs/dbraw/zinc/37/83/10/221378310.db2.gz JXPWKWFWODJORA-KRWDZBQOSA-N 0 3 345.443 2.923 20 5 EFBDHN Cc1cccc(C(=O)N2CCCN(CC3CCC3)CC2)c1[N+](=O)[O-] ZINC000328590034 258044171 /nfs/dbraw/zinc/04/41/71/258044171.db2.gz XIIQMPBRBTVZQH-UHFFFAOYSA-N 0 3 331.416 2.851 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN(C)[C@H](C)CN1CCOCC1 ZINC000435056648 533383604 /nfs/dbraw/zinc/38/36/04/533383604.db2.gz NAUGUSUIENBJQG-UVQBRAAOSA-N 0 3 333.432 2.651 20 5 EFBDHN C[C@@H]([NH2+]CCCNC(=O)c1cccc([O-])c1)c1ccc([N+](=O)[O-])cc1 ZINC000155081533 533384894 /nfs/dbraw/zinc/38/48/94/533384894.db2.gz VWDYWMZBPURPCN-CYBMUJFWSA-N 0 3 343.383 2.771 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN(C)[C@@H](C)CN1CCOCC1 ZINC000435056647 533407445 /nfs/dbraw/zinc/40/74/45/533407445.db2.gz NAUGUSUIENBJQG-SFKKXYGYSA-N 0 3 333.432 2.651 20 5 EFBDHN CC(C)CN(CCN(C)C)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000344470941 142022963 /nfs/dbraw/zinc/02/29/63/142022963.db2.gz AZOLWMWJHFEDCS-UHFFFAOYSA-N 0 3 341.839 2.837 20 5 EFBDHN CO[C@@H]1[C@H](C)[C@@H](N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1(C)C ZINC000344487105 142026404 /nfs/dbraw/zinc/02/64/04/142026404.db2.gz UNGBAMPMAYFOCT-YIKOMLBNSA-N 0 3 335.404 2.571 20 5 EFBDHN CCOC[C@H](O)CNCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000344529519 142035307 /nfs/dbraw/zinc/03/53/07/142035307.db2.gz IZZNFLJJUPTXTQ-GFCCVEGCSA-N 0 3 336.413 2.810 20 5 EFBDHN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)CN(C)C ZINC000346213704 142168645 /nfs/dbraw/zinc/16/86/45/142168645.db2.gz YTDSAPGQCVQXDS-NSHDSACASA-N 0 3 325.434 2.777 20 5 EFBDHN Cc1c(CC(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000346221977 142170660 /nfs/dbraw/zinc/17/06/60/142170660.db2.gz LAHPAPOOLPLSSH-SUNYJGFJSA-N 0 3 345.443 2.634 20 5 EFBDHN CCc1ccc(C(=O)N2CCN([C@@H]3C[C@H]3C)C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000346260400 142178283 /nfs/dbraw/zinc/17/82/83/142178283.db2.gz LHGIEJLCNMAVMT-CKEIUWERSA-N 0 3 345.443 2.960 20 5 EFBDHN Cc1ccc(NCCCNC(=O)CN2[C@@H](C)CC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000346400905 142199724 /nfs/dbraw/zinc/19/97/24/142199724.db2.gz YDSVMKRGGYCYOP-GJZGRUSLSA-N 0 3 348.447 2.694 20 5 EFBDHN Cc1ccc(NCCCNC(=O)CN2[C@H](C)CC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000346400904 142199918 /nfs/dbraw/zinc/19/99/18/142199918.db2.gz YDSVMKRGGYCYOP-GASCZTMLSA-N 0 3 348.447 2.694 20 5 EFBDHN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CNC2 ZINC000347529947 142231358 /nfs/dbraw/zinc/23/13/58/142231358.db2.gz UIKXOKPSGLESGZ-UHFFFAOYSA-N 0 3 339.395 2.951 20 5 EFBDHN CCCCN(C)CCNC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000347923659 142293719 /nfs/dbraw/zinc/29/37/19/142293719.db2.gz PMPAYCQEADAMAK-GFCCVEGCSA-N 0 3 325.384 2.686 20 5 EFBDHN C[C@@H]1CC(NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000349664509 142345035 /nfs/dbraw/zinc/34/50/35/142345035.db2.gz MBFWLVTZEFUVSG-STQMWFEESA-N 0 3 340.445 2.783 20 5 EFBDHN C[C@@H](c1ccccc1)N1CCC(NC(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 ZINC000341381852 145042571 /nfs/dbraw/zinc/04/25/71/145042571.db2.gz FLORIMKXMAGUAF-ZDUSSCGKSA-N 0 3 342.399 2.878 20 5 EFBDHN CCCN(CCN1CCCC1)C(=O)c1cccc([N+](=O)[O-])c1OC ZINC000342177548 145075614 /nfs/dbraw/zinc/07/56/14/145075614.db2.gz IJXPAFVUZQLIFL-UHFFFAOYSA-N 0 3 335.404 2.551 20 5 EFBDHN COc1cc(CNC[C@@H]2CCC[C@H](CO)C2)c([N+](=O)[O-])cc1OC ZINC000342243288 145086509 /nfs/dbraw/zinc/08/65/09/145086509.db2.gz ITKWAUNCTDJRJS-OLZOCXBDSA-N 0 3 338.404 2.500 20 5 EFBDHN CCCN(CCN1CCCCC1)C(=O)c1cccc(OC)c1[N+](=O)[O-] ZINC000342787530 145192882 /nfs/dbraw/zinc/19/28/82/145192882.db2.gz UQPAJEIOSZMDIR-UHFFFAOYSA-N 0 3 349.431 2.942 20 5 EFBDHN O=C(NC[C@H]1CCN(C2CC2)C1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000342887947 145215550 /nfs/dbraw/zinc/21/55/50/145215550.db2.gz BREHEMYGDWIGCT-LLVKDONJSA-N 0 3 329.356 2.555 20 5 EFBDHN CCCN1CCC[C@@H]1CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000343556191 145237110 /nfs/dbraw/zinc/23/71/10/145237110.db2.gz BMTJAWIGHFBDHL-OAHLLOKOSA-N 0 3 346.431 2.773 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN1CC[C@@H]1Cc1ccccc1 ZINC000343563512 145239233 /nfs/dbraw/zinc/23/92/33/145239233.db2.gz ZMSCVGHZUXCLPN-SJORKVTESA-N 0 3 342.395 2.652 20 5 EFBDHN CS[C@H]1CN(Cc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1N(C)C ZINC000343567078 145240184 /nfs/dbraw/zinc/24/01/84/145240184.db2.gz VPERCANMMKJSNE-KGLIPLIRSA-N 0 3 329.853 2.726 20 5 EFBDHN CCCN1CCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000343583291 145244528 /nfs/dbraw/zinc/24/45/28/145244528.db2.gz YHMPVMBIPSPYLZ-GFCCVEGCSA-N 0 3 325.796 2.852 20 5 EFBDHN CCCN1CCC[C@H]1CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000343584597 145245278 /nfs/dbraw/zinc/24/52/78/145245278.db2.gz ZYZKAPCTAWQGIR-LBPRGKRZSA-N 0 3 325.796 2.852 20 5 EFBDHN Cc1ccc(NC(=O)CCN[C@@H](C)c2cccc([N+](=O)[O-])c2)nc1 ZINC000343972112 145336143 /nfs/dbraw/zinc/33/61/43/145336143.db2.gz FWYLTYGFQNODJX-ZDUSSCGKSA-N 0 3 328.372 2.978 20 5 EFBDHN CCCN(CCN1CCN(CC)CC1)Cc1cccc([N+](=O)[O-])c1C ZINC000344148531 145379668 /nfs/dbraw/zinc/37/96/68/145379668.db2.gz RPDSGUWHXOYFCB-UHFFFAOYSA-N 0 3 348.491 2.753 20 5 EFBDHN C[C@@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000344215646 145394563 /nfs/dbraw/zinc/39/45/63/145394563.db2.gz QBUIDVCQRYBJGC-UPJWGTAASA-N 0 3 337.395 2.830 20 5 EFBDHN CN(CCNC(=O)c1cc(F)cc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000344215537 145394857 /nfs/dbraw/zinc/39/48/57/145394857.db2.gz OYCLYBLJZVSVSC-UHFFFAOYSA-N 0 3 331.347 2.596 20 5 EFBDHN CNC(=O)[C@H]1CCC[C@H]1NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000345824531 145629194 /nfs/dbraw/zinc/62/91/94/145629194.db2.gz WZUBHVANKLAKAK-JKSUJKDBSA-N 0 3 343.383 2.859 20 5 EFBDHN CN(CCC(N)=O)Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000348839556 146011278 /nfs/dbraw/zinc/01/12/78/146011278.db2.gz WUUFSBCMHXFJEJ-UHFFFAOYSA-N 0 3 342.399 2.670 20 5 EFBDHN COc1cc(CN(CCN(C)C)CC(C)C)c([N+](=O)[O-])cc1OC ZINC000348892359 146020693 /nfs/dbraw/zinc/02/06/93/146020693.db2.gz INJKDZHRNBVUCI-UHFFFAOYSA-N 0 3 339.436 2.632 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](NC[C@H](O)[C@H]2CCOC2)c2ccccc2)c1 ZINC000352846542 146331960 /nfs/dbraw/zinc/33/19/60/146331960.db2.gz ABWVWFQSFBPIFN-YTQUADARSA-N 0 3 342.395 2.671 20 5 EFBDHN C[C@H](O)C[C@@H]1CCCCCN1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000352892204 146342743 /nfs/dbraw/zinc/34/27/43/146342743.db2.gz ISXBVRJXQHBNCZ-YOEHRIQHSA-N 0 3 349.431 2.573 20 5 EFBDHN CCC[N@H+](CC)C[C@H](C)NCc1cc(OC)c([O-])cc1[N+](=O)[O-] ZINC000353061179 146388746 /nfs/dbraw/zinc/38/87/46/146388746.db2.gz MNEHTZUTTWTPQJ-LBPRGKRZSA-N 0 3 325.409 2.519 20 5 EFBDHN CCC[N@@H+](CC)C[C@H](C)NCc1cc(OC)c([O-])cc1[N+](=O)[O-] ZINC000353061179 146388748 /nfs/dbraw/zinc/38/87/48/146388748.db2.gz MNEHTZUTTWTPQJ-LBPRGKRZSA-N 0 3 325.409 2.519 20 5 EFBDHN COC(=O)COc1ccc(CN2C[C@@H](C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000355597901 147008306 /nfs/dbraw/zinc/00/83/06/147008306.db2.gz FTHJXZZEYPZFPB-STQMWFEESA-N 0 3 336.388 2.625 20 5 EFBDHN COC(=O)COc1ccc(CN2CCC[C@@H]2C2CCC2)cc1[N+](=O)[O-] ZINC000355748501 147052025 /nfs/dbraw/zinc/05/20/25/147052025.db2.gz RIXYJCHAHPWNSZ-OAHLLOKOSA-N 0 3 348.399 2.911 20 5 EFBDHN COC(=O)COc1ccc(CN2CCC[C@H]2C2CCC2)cc1[N+](=O)[O-] ZINC000355748492 147052139 /nfs/dbraw/zinc/05/21/39/147052139.db2.gz RIXYJCHAHPWNSZ-HNNXBMFYSA-N 0 3 348.399 2.911 20 5 EFBDHN CC[C@@H]1CCCCN1CCNC(=O)c1cccc([N+](=O)[O-])c1OC ZINC000356085380 147142498 /nfs/dbraw/zinc/14/24/98/147142498.db2.gz AQKHKZUOLQLXHG-CYBMUJFWSA-N 0 3 335.404 2.598 20 5 EFBDHN CCNc1ccc(C(=O)N2C[C@@H](N3CCCC3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000356285925 147200462 /nfs/dbraw/zinc/20/04/62/147200462.db2.gz VOBXRFQUMBEPOR-ZFWWWQNUSA-N 0 3 346.431 2.725 20 5 EFBDHN C[NH+](C)CCOc1cccc(-c2noc(-c3cc([N+](=O)[O-])c[n-]3)n2)c1 ZINC000356531906 147269677 /nfs/dbraw/zinc/26/96/77/147269677.db2.gz HMVZYXHJYKMBGL-UHFFFAOYSA-N 0 3 343.343 2.580 20 5 EFBDHN CN(C)CCOc1cccc(-c2noc(-c3cc([N+](=O)[O-])c[nH]3)n2)c1 ZINC000356531906 147269678 /nfs/dbraw/zinc/26/96/78/147269678.db2.gz HMVZYXHJYKMBGL-UHFFFAOYSA-N 0 3 343.343 2.580 20 5 EFBDHN Cc1cc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000356749198 147326420 /nfs/dbraw/zinc/32/64/20/147326420.db2.gz WVQLTJHSMACJHK-IBGZPJMESA-N 0 3 341.411 2.952 20 5 EFBDHN C[C@@H](C(=O)N(C)CCc1ccccc1[N+](=O)[O-])N1[C@H](C)CC[C@@H]1C ZINC000359128279 148003474 /nfs/dbraw/zinc/00/34/74/148003474.db2.gz HIXCDBDUUTXIMA-ZNMIVQPWSA-N 0 3 333.432 2.857 20 5 EFBDHN CNc1c(C(=O)N[C@H](C)CN2CCCCCC2)cccc1[N+](=O)[O-] ZINC000359314634 148053739 /nfs/dbraw/zinc/05/37/39/148053739.db2.gz CQPMFLALDRXYKQ-CYBMUJFWSA-N 0 3 334.420 2.631 20 5 EFBDHN C[C@H]1[C@H](NC(=O)c2cccc([N+](=O)[O-])c2)CCN1Cc1ccccc1 ZINC000359832150 148201566 /nfs/dbraw/zinc/20/15/66/148201566.db2.gz LJGJLLKFSJBKIZ-KBXCAEBGSA-N 0 3 339.395 2.988 20 5 EFBDHN COCCN(C)CCNc1cc(C)c([N+](=O)[O-])cc1C(F)(F)F ZINC000359909422 148220991 /nfs/dbraw/zinc/22/09/91/148220991.db2.gz IHQIJXBPSYDTHQ-UHFFFAOYSA-N 0 3 335.326 2.912 20 5 EFBDHN Cc1cc(NCCOCCN(C)C)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000360067296 148264032 /nfs/dbraw/zinc/26/40/32/148264032.db2.gz WAACAMIUZRFGSP-UHFFFAOYSA-N 0 3 335.326 2.912 20 5 EFBDHN CS[C@H]1CN(Cc2ccc([N+](=O)[O-])cc2Cl)C[C@H]1N(C)C ZINC000360200388 148297249 /nfs/dbraw/zinc/29/72/49/148297249.db2.gz RDEDECWGPAVTMM-KGLIPLIRSA-N 0 3 329.853 2.726 20 5 EFBDHN Cc1cc(N2CC[C@H](N3CCN(C(C)C)CC3)C2)ccc1[N+](=O)[O-] ZINC000364071128 149061097 /nfs/dbraw/zinc/06/10/97/149061097.db2.gz KXTWMURCJIQZBX-KRWDZBQOSA-N 0 3 332.448 2.508 20 5 EFBDHN COc1ccc(OCCN2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc1 ZINC000373239469 151139471 /nfs/dbraw/zinc/13/94/71/151139471.db2.gz AQQZUAJZZWXVHA-UHFFFAOYSA-N 0 3 346.387 2.516 20 5 EFBDHN CC(=O)Nc1cccc(CN2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1 ZINC000373280046 151145683 /nfs/dbraw/zinc/14/56/83/151145683.db2.gz VRPFDZNUPNIFGY-UHFFFAOYSA-N 0 3 343.387 2.587 20 5 EFBDHN CC[C@H](N[C@H]1CCN(c2cnn(C)c2)C1)c1cccc([N+](=O)[O-])c1 ZINC000378170441 152025076 /nfs/dbraw/zinc/02/50/76/152025076.db2.gz SCOKGWWOOAAOQC-YOEHRIQHSA-N 0 3 329.404 2.648 20 5 EFBDHN CC(C)N(CCN1C[C@H]2CC[C@@H](C1)O2)Cc1ccc([N+](=O)[O-])cc1 ZINC000378444572 152086672 /nfs/dbraw/zinc/08/66/72/152086672.db2.gz NTIBQJCZXDGXLQ-HDICACEKSA-N 0 3 333.432 2.668 20 5 EFBDHN O=C([C@H]1CCCN1C1CCCC1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000408420858 152189051 /nfs/dbraw/zinc/18/90/51/152189051.db2.gz AYEVQVAKPKUVCD-GOSISDBHSA-N 0 3 343.427 2.887 20 5 EFBDHN C[C@H](Cc1ccc(Cl)cc1)N(C)CCn1cc([N+](=O)[O-])ccc1=O ZINC000159836125 225287173 /nfs/dbraw/zinc/28/71/73/225287173.db2.gz YNLGRAPPZVCDBX-CYBMUJFWSA-N 0 3 349.818 2.973 20 5 EFBDHN C[C@H](CN1CCCCC1)NC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000123117199 222218266 /nfs/dbraw/zinc/21/82/66/222218266.db2.gz OXWDHUHZUOLDIS-CYBMUJFWSA-N 0 3 342.399 2.747 20 5 EFBDHN CC[C@H]1CCCCN1CCNC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000122968885 222191796 /nfs/dbraw/zinc/19/17/96/222191796.db2.gz KNPWHVJHQZFODZ-INIZCTEOSA-N 0 3 333.432 2.826 20 5 EFBDHN C[C@@H]1C[C@@H](N(C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CCN1C ZINC000124001330 222363561 /nfs/dbraw/zinc/36/35/61/222363561.db2.gz XEXWIJKZNXFSDE-DOMZBBRYSA-N 0 3 345.403 2.559 20 5 EFBDHN C[C@H]1C[C@@H](N(C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CCN1C ZINC000124001548 222363825 /nfs/dbraw/zinc/36/38/25/222363825.db2.gz XEXWIJKZNXFSDE-WFASDCNBSA-N 0 3 345.403 2.559 20 5 EFBDHN C[C@H](CNC(=O)c1csc([N+](=O)[O-])c1)N(C)Cc1ccccc1 ZINC000171881156 227333690 /nfs/dbraw/zinc/33/36/90/227333690.db2.gz UYYRBPIBVYRXSE-GFCCVEGCSA-N 0 3 333.413 2.907 20 5 EFBDHN COC(=O)N1CCC([C@@H](C)NCc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000186418804 265065339 /nfs/dbraw/zinc/06/53/39/265065339.db2.gz QROAMCQDLPIQJR-LLVKDONJSA-N 0 3 339.367 2.690 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@H](CO)Cc1ccccc1C ZINC000188925098 265163574 /nfs/dbraw/zinc/16/35/74/265163574.db2.gz HANXVXGDRJDPCO-KRWDZBQOSA-N 0 3 344.411 2.995 20 5 EFBDHN COC(=O)[C@@](C)(CNCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000191586437 265269730 /nfs/dbraw/zinc/26/97/30/265269730.db2.gz VHTZZYBTGDVSCP-SFHVURJKSA-N 0 3 328.368 2.815 20 5 EFBDHN C[C@@H](NCCN1CCc2ccccc2C1=O)c1cccc([N+](=O)[O-])c1 ZINC000191622028 265271532 /nfs/dbraw/zinc/27/15/32/265271532.db2.gz QNIVRCPKEMYUDD-CQSZACIVSA-N 0 3 339.395 2.944 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])N(C)CC(C)(C)CN1CCOCC1 ZINC000269850507 265565903 /nfs/dbraw/zinc/56/59/03/265565903.db2.gz XLVSETKQPBSLBD-OAHLLOKOSA-N 0 3 335.448 2.946 20 5 EFBDHN CCOc1ccc([C@@H](C)NCCSCCCO)cc1[N+](=O)[O-] ZINC000271170373 265906066 /nfs/dbraw/zinc/90/60/66/265906066.db2.gz UCXHQXAIDCLLJT-GFCCVEGCSA-N 0 3 328.434 2.760 20 5 EFBDHN Cc1ccc([C@H](C)N[C@H]2CCC[C@@H](S(C)(=O)=O)C2)cc1[N+](=O)[O-] ZINC000271559433 266007930 /nfs/dbraw/zinc/00/79/30/266007930.db2.gz XHVPADQUTLYDKS-AEGPPILISA-N 0 3 340.445 2.910 20 5 EFBDHN COc1cccc(C2(NC[C@H](O)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000271665992 266036733 /nfs/dbraw/zinc/03/67/33/266036733.db2.gz BPWZYHKNWPIKSZ-KRWDZBQOSA-N 0 3 328.368 2.916 20 5 EFBDHN CN1CC=C(CNCc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000271869097 266083932 /nfs/dbraw/zinc/08/39/32/266083932.db2.gz KDBCTABUEQJOKI-UHFFFAOYSA-N 0 3 327.331 2.548 20 5 EFBDHN COc1cc(C[NH2+][C@@H]2CCO[C@H](CC(C)C)C2)c([N+](=O)[O-])cc1[O-] ZINC000272045924 266134593 /nfs/dbraw/zinc/13/45/93/266134593.db2.gz WXJWPWBQXDUEPX-ZIAGYGMSSA-N 0 3 338.404 2.992 20 5 EFBDHN Cc1cc([C@H](NCCn2cc([N+](=O)[O-])ccc2=O)C2CC2)ccc1F ZINC000272084548 266147680 /nfs/dbraw/zinc/14/76/80/266147680.db2.gz MCPXIYQIAJMVSB-GOSISDBHSA-N 0 3 345.374 2.945 20 5 EFBDHN COc1cc(CNC2CCOCC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000272353672 266240037 /nfs/dbraw/zinc/24/00/37/266240037.db2.gz DPVUBLYFOHTUSB-UHFFFAOYSA-N 0 3 346.330 2.516 20 5 EFBDHN C[NH+](C)C1(C[N-]C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CCCC1 ZINC000272404196 266254834 /nfs/dbraw/zinc/25/48/34/266254834.db2.gz AYDNRBSZFWZNAL-UHFFFAOYSA-N 0 3 341.358 2.677 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[C@H]2CCN(C)C[C@@H]21 ZINC000272413093 266257807 /nfs/dbraw/zinc/25/78/07/266257807.db2.gz LDVACMUYANMAAF-HIFRSBDPSA-N 0 3 332.404 2.770 20 5 EFBDHN COC[C@H](C)CNCc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000272504539 266286983 /nfs/dbraw/zinc/28/69/83/266286983.db2.gz WDEXZKNDIXHCHK-SNVBAGLBSA-N 0 3 348.346 2.619 20 5 EFBDHN C[N@H+](CC[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC000272601143 266322617 /nfs/dbraw/zinc/32/26/17/266322617.db2.gz VCJXQGKTFAPQOD-UHFFFAOYSA-N 0 3 341.358 2.677 20 5 EFBDHN C[N@@H+](CC[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC000272601143 266322621 /nfs/dbraw/zinc/32/26/21/266322621.db2.gz VCJXQGKTFAPQOD-UHFFFAOYSA-N 0 3 341.358 2.677 20 5 EFBDHN CC[C@H](C)[N@H+](C)CC[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272627050 266332266 /nfs/dbraw/zinc/33/22/66/266332266.db2.gz ZEOPGUATOPJHCC-NSHDSACASA-N 0 3 329.347 2.533 20 5 EFBDHN CC[C@H](C)[N@@H+](C)CC[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272627050 266332271 /nfs/dbraw/zinc/33/22/71/266332271.db2.gz ZEOPGUATOPJHCC-NSHDSACASA-N 0 3 329.347 2.533 20 5 EFBDHN C[C@H](NC(=O)CCCNc1ccc([N+](=O)[O-])cc1)C1=CCN(C)CC1 ZINC000272656198 266341014 /nfs/dbraw/zinc/34/10/14/266341014.db2.gz BFXFPBOFWAJLIJ-AWEZNQCLSA-N 0 3 346.431 2.554 20 5 EFBDHN CN1CCC[C@@H](CNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000108433676 273009871 /nfs/dbraw/zinc/00/98/71/273009871.db2.gz LPZHGMLYZYVWJU-JTQLQIEISA-N 0 3 326.784 2.712 20 5 EFBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])N[C@H](C)C(=O)N(C)CC ZINC000276578806 267017374 /nfs/dbraw/zinc/01/73/74/267017374.db2.gz HVRDOHMLBKRGPR-OLZOCXBDSA-N 0 3 339.461 2.922 20 5 EFBDHN CCO[C@H]1C[C@@H](NCc2cccc([N+](=O)[O-])c2C)C12CCOCC2 ZINC000276911580 267074430 /nfs/dbraw/zinc/07/44/30/267074430.db2.gz PEKWHGLYKLIPQB-SJORKVTESA-N 0 3 334.416 2.967 20 5 EFBDHN O=[N+]([O-])c1cccnc1NC[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000276933770 267080805 /nfs/dbraw/zinc/08/08/05/267080805.db2.gz ACTCBDUTOZDCOL-INIZCTEOSA-N 0 3 342.399 2.693 20 5 EFBDHN CO[C@@H]1CCCC[C@@H]1NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000276940775 267082300 /nfs/dbraw/zinc/08/23/00/267082300.db2.gz JVOQZVFDDTZHHE-GXTWGEPZSA-N 0 3 341.795 2.734 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@@H]1CN1CCCCC1 ZINC000276977130 267090585 /nfs/dbraw/zinc/09/05/85/267090585.db2.gz AVUJINAAUSYWQR-OAHLLOKOSA-N 0 3 347.415 2.694 20 5 EFBDHN O=C(NC[C@H]1CCCCN1C1CC1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000277564310 267198958 /nfs/dbraw/zinc/19/89/58/267198958.db2.gz PTDWKHRPBXMHAJ-CYBMUJFWSA-N 0 3 337.807 2.995 20 5 EFBDHN CC(=O)c1ccc(NCCCN2CCCO[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000277854691 267280605 /nfs/dbraw/zinc/28/06/05/267280605.db2.gz CPJCCMQLMNSLMP-ZDUSSCGKSA-N 0 3 335.404 2.710 20 5 EFBDHN O=C(CCc1cccc([N+](=O)[O-])c1)NC[C@@H]1CCCCN1C1CC1 ZINC000277947795 267305132 /nfs/dbraw/zinc/30/51/32/267305132.db2.gz OSYPMSWUBWZSEG-KRWDZBQOSA-N 0 3 331.416 2.661 20 5 EFBDHN C[C@@H]1CN(CCCNc2ncc([N+](=O)[O-])cc2Cl)CCCO1 ZINC000278017977 267321857 /nfs/dbraw/zinc/32/18/57/267321857.db2.gz MMUQOUVLASHVLS-LLVKDONJSA-N 0 3 328.800 2.556 20 5 EFBDHN C[C@@H](CNCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000278510936 267463829 /nfs/dbraw/zinc/46/38/29/267463829.db2.gz PWYBDOCISIECQB-AWEZNQCLSA-N 0 3 348.424 2.762 20 5 EFBDHN C[C@H](N[C@@H]1CCCN(c2ccnn2C)C1)c1cccc([N+](=O)[O-])c1 ZINC000278537005 267474577 /nfs/dbraw/zinc/47/45/77/267474577.db2.gz URNMZADBGOOWSY-DZGCQCFKSA-N 0 3 329.404 2.648 20 5 EFBDHN CCOc1ccc([C@@H](C)NCCN(C)CCCOC)cc1[N+](=O)[O-] ZINC000271128507 273100184 /nfs/dbraw/zinc/10/01/84/273100184.db2.gz LFODWQYQZADPGF-CQSZACIVSA-N 0 3 339.436 2.612 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@H]2CCN(Cc3ccccc3)C[C@H]2CO)cc1 ZINC000271565190 273105325 /nfs/dbraw/zinc/10/53/25/273105325.db2.gz APAIDXOBNRDHGO-LPHOPBHVSA-N 0 3 341.411 2.890 20 5 EFBDHN COc1cccc([C@H](CNc2ncc([N+](=O)[O-])cn2)N2CCCC2)c1 ZINC000273661312 273117287 /nfs/dbraw/zinc/11/72/87/273117287.db2.gz WCXGCSISOXKUEE-INIZCTEOSA-N 0 3 343.387 2.642 20 5 EFBDHN COc1cccc([C@@H](CNc2ncc([N+](=O)[O-])cn2)N2CCCC2)c1 ZINC000273661314 273117312 /nfs/dbraw/zinc/11/73/12/273117312.db2.gz WCXGCSISOXKUEE-MRXNPFEDSA-N 0 3 343.387 2.642 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[C@H]2CCN(C)C[C@H]21 ZINC000274268709 273128646 /nfs/dbraw/zinc/12/86/46/273128646.db2.gz MEGDPUDSHFDLIF-CZUORRHYSA-N 0 3 332.404 2.770 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2nc(CN[C@@H]3CCC[C@@H]3CCO)co2)cc1 ZINC000279254123 273193659 /nfs/dbraw/zinc/19/36/59/273193659.db2.gz LKZAIKIDHZRHPG-MLGOLLRUSA-N 0 3 331.372 2.891 20 5 EFBDHN O=[N+]([O-])c1ccc(Cl)cc1N1CCC(CN2CCOCC2)CC1 ZINC000279476770 273219694 /nfs/dbraw/zinc/21/96/94/273219694.db2.gz NNUSJYYSVYENEG-UHFFFAOYSA-N 0 3 339.823 2.797 20 5 EFBDHN CCC(=O)c1ccc(NCCCN2CCN(CC)CC2)c([N+](=O)[O-])c1 ZINC000280114825 273292325 /nfs/dbraw/zinc/29/23/25/273292325.db2.gz VYQMMIKHCKSQBX-UHFFFAOYSA-N 0 3 348.447 2.627 20 5 EFBDHN COC(=O)C[C@@H]1CC[C@H](NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@H]1C ZINC000280604872 273346009 /nfs/dbraw/zinc/34/60/09/273346009.db2.gz OITDCCKTFNAGJW-GVXVVHGQSA-N 0 3 346.387 2.539 20 5 EFBDHN CCOc1ccc([C@H](C)NCC2([S@](C)=O)CCC2)cc1[N+](=O)[O-] ZINC000280884543 273377536 /nfs/dbraw/zinc/37/75/36/273377536.db2.gz BDHTVOAEHOVVKL-MYODQAERSA-N 0 3 340.445 2.945 20 5 EFBDHN CSc1ccc([C@H](C)NCCn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC000281413302 273432995 /nfs/dbraw/zinc/43/29/95/273432995.db2.gz OGHZEQWXJGSGTR-LBPRGKRZSA-N 0 3 333.413 2.829 20 5 EFBDHN CCS(=O)(=O)CCCN[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000414332408 273710420 /nfs/dbraw/zinc/71/04/20/273710420.db2.gz DRZOIJUISCCNAZ-HNNXBMFYSA-N 0 3 340.445 2.732 20 5 EFBDHN COc1ccc([C@@H](CN(C)C)NC(=O)c2ccc([N+](=O)[O-])s2)cc1 ZINC000284108203 273798067 /nfs/dbraw/zinc/79/80/67/273798067.db2.gz CCXKBOFFJRDDNM-CYBMUJFWSA-N 0 3 349.412 2.698 20 5 EFBDHN CCn1cc(CCN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cn1 ZINC000285134382 273947824 /nfs/dbraw/zinc/94/78/24/273947824.db2.gz SMZSGULAPCQDST-UHFFFAOYSA-N 0 3 344.415 2.897 20 5 EFBDHN CNC(=O)[C@@H]1CCC[C@@H]1NCc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339125413 273951923 /nfs/dbraw/zinc/95/19/23/273951923.db2.gz VJWGUTJUSSMBKK-YPMHNXCESA-N 0 3 345.321 2.618 20 5 EFBDHN CCc1ccc([C@H](O)CNCc2cc(OC)c(O)cc2[N+](=O)[O-])cc1 ZINC000285545717 274022461 /nfs/dbraw/zinc/02/24/61/274022461.db2.gz QHUGTZYIJFDZBY-QGZVFWFLSA-N 0 3 346.383 2.695 20 5 EFBDHN COCCN1[C@H](C)CN(c2ccc3cc([N+](=O)[O-])ccc3n2)C[C@@H]1C ZINC000131912387 274035026 /nfs/dbraw/zinc/03/50/26/274035026.db2.gz CKZIGIFBXBJWHG-OKILXGFUSA-N 0 3 344.415 2.688 20 5 EFBDHN CN(CCCN(C)C[C@@H](O)c1cccc([N+](=O)[O-])c1)Cc1ccco1 ZINC000285685528 274052686 /nfs/dbraw/zinc/05/26/86/274052686.db2.gz OEXDVMCGQFZSJP-GOSISDBHSA-N 0 3 347.415 2.675 20 5 EFBDHN COc1cc(C(=O)N2C[C@@H](N3CCCC3)C[C@@H]2C)cc([N+](=O)[O-])c1C ZINC000285792306 274076130 /nfs/dbraw/zinc/07/61/30/274076130.db2.gz MISZPRPAYYJAGS-WFASDCNBSA-N 0 3 347.415 2.611 20 5 EFBDHN C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000285985156 274112290 /nfs/dbraw/zinc/11/22/90/274112290.db2.gz XKQAOISHKHXRNW-DZGCQCFKSA-N 0 3 349.456 2.772 20 5 EFBDHN CCCN(CCN1CCCCC1)C(=O)c1csc([N+](=O)[O-])c1 ZINC000286112835 274135865 /nfs/dbraw/zinc/13/58/65/274135865.db2.gz GAYOZNYAGDOZLX-UHFFFAOYSA-N 0 3 325.434 2.994 20 5 EFBDHN O=[N+]([O-])c1cc2c(ncnc2N2CC[C@H](N3CCCCC3)C2)s1 ZINC000286412901 274195868 /nfs/dbraw/zinc/19/58/68/274195868.db2.gz AWNMZNSHTMPEID-NSHDSACASA-N 0 3 333.417 2.664 20 5 EFBDHN CN(C)CCOc1cc(CNc2c(F)cccc2[N+](=O)[O-])ccn1 ZINC000286631178 274239408 /nfs/dbraw/zinc/23/94/08/274239408.db2.gz WPBXVMLANVDOBV-UHFFFAOYSA-N 0 3 334.351 2.681 20 5 EFBDHN C[C@@H](O)CN(Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CCCCC1 ZINC000444612289 274267105 /nfs/dbraw/zinc/26/71/05/274267105.db2.gz SYWLVEGQFRKSMY-GFCCVEGCSA-N 0 3 332.404 2.987 20 5 EFBDHN Cc1cc(NC(=O)N2C[C@H](N3CCCC3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000286985206 274315370 /nfs/dbraw/zinc/31/53/70/274315370.db2.gz DMUZUKAUJUQPAI-UKRRQHHQSA-N 0 3 332.404 2.994 20 5 EFBDHN C[C@@H]1CN(C)CC[C@H]1N(C)c1ncc([N+](=O)[O-])cc1Br ZINC000268162489 274335211 /nfs/dbraw/zinc/33/52/11/274335211.db2.gz OUWKYCCWVAKXPE-BXKDBHETSA-N 0 3 343.225 2.529 20 5 EFBDHN C[C@H]1[C@H](N2CCCC2)CCN1C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000287244605 274376877 /nfs/dbraw/zinc/37/68/77/274376877.db2.gz RFGQAMFZOKDMPZ-XJKSGUPXSA-N 0 3 349.456 2.772 20 5 EFBDHN C[C@@H]1C[C@@H](N(C)C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CCN1C ZINC000266047790 274386702 /nfs/dbraw/zinc/38/67/02/274386702.db2.gz FKXOBBPIROENKJ-NEPJUHHUSA-N 0 3 330.388 2.631 20 5 EFBDHN C[C@@H]1C[C@@H](c2ccccc2)CN1CCn1cc([N+](=O)[O-])ccc1=O ZINC000132069943 274396094 /nfs/dbraw/zinc/39/60/94/274396094.db2.gz VVVWNQZUEFBRMX-GDBMZVCRSA-N 0 3 327.384 2.635 20 5 EFBDHN CN(C)CCN(Cc1ccco1)c1ncnc2sc([N+](=O)[O-])cc21 ZINC000287826203 274491626 /nfs/dbraw/zinc/49/16/26/274491626.db2.gz LBOVPCKTHHVQDU-UHFFFAOYSA-N 0 3 347.400 2.761 20 5 EFBDHN CCn1c(C)nc([N+](=O)[O-])c1N(CCN(C)C)Cc1cccs1 ZINC000288909671 274677768 /nfs/dbraw/zinc/67/77/68/274677768.db2.gz ONPGQACETBIUKD-UHFFFAOYSA-N 0 3 337.449 2.749 20 5 EFBDHN Cc1cc(NC[C@H](O)CN2CCC(C)CC2)c(F)cc1[N+](=O)[O-] ZINC000360066031 274719049 /nfs/dbraw/zinc/71/90/49/274719049.db2.gz MSMVDHCEFAAAFW-ZDUSSCGKSA-N 0 3 325.384 2.547 20 5 EFBDHN CCN(CCNC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000079996113 276130324 /nfs/dbraw/zinc/13/03/24/276130324.db2.gz IBCKVPMHBSDOJJ-UHFFFAOYSA-N 0 3 345.321 2.828 20 5 EFBDHN CCN1CCC[C@H]1CN(C)C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000177037387 276181666 /nfs/dbraw/zinc/18/16/66/276181666.db2.gz MCJKMICNWILQTE-LBPRGKRZSA-N 0 3 325.796 2.805 20 5 EFBDHN CCc1ccccc1[C@@H](N)CNC(=O)c1cc(C)ccc1[N+](=O)[O-] ZINC000423986080 276680166 /nfs/dbraw/zinc/68/01/66/276680166.db2.gz VOXXCRNLDNXDGU-INIZCTEOSA-N 0 3 327.384 2.895 20 5 EFBDHN CN(C)[C@H]1Cc2ccccc2N(C(=O)c2csc([N+](=O)[O-])c2)C1 ZINC000171752112 276878589 /nfs/dbraw/zinc/87/85/89/276878589.db2.gz UKHIOLJMTHFCSE-ZDUSSCGKSA-N 0 3 331.397 2.789 20 5 EFBDHN CN1CC[C@H]2[C@H](CCCN2C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C1 ZINC000269115731 277182540 /nfs/dbraw/zinc/18/25/40/277182540.db2.gz NGGKYAMNTZQLSU-PXAZEXFGSA-N 0 3 342.399 2.632 20 5 EFBDHN COC(=O)[C@H]1CCN(c2cc(C)nc3ccc([N+](=O)[O-])cc32)[C@H]1C ZINC000344981179 277396720 /nfs/dbraw/zinc/39/67/20/277396720.db2.gz HMMOTPZQXHEYLI-AAEUAGOBSA-N 0 3 329.356 2.839 20 5 EFBDHN CC(C)c1ccc(CN(C)[C@H](C)CN2CCOCC2)cc1[N+](=O)[O-] ZINC000435058069 278035280 /nfs/dbraw/zinc/03/52/80/278035280.db2.gz SGJDILIBBIDUCG-OAHLLOKOSA-N 0 3 335.448 2.871 20 5 EFBDHN C[C@@H](CN(C)Cc1ccccc1)NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000182098573 278240817 /nfs/dbraw/zinc/24/08/17/278240817.db2.gz DVKUFYRVPVFJRY-HNNXBMFYSA-N 0 3 341.411 2.774 20 5 EFBDHN C[C@@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000246435007 278267043 /nfs/dbraw/zinc/26/70/43/278267043.db2.gz DAJIIBXEGKLXQP-XQQFMLRXSA-N 0 3 337.395 2.830 20 5 EFBDHN C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccncc1[N+](=O)[O-] ZINC000183626438 279282283 /nfs/dbraw/zinc/28/22/83/279282283.db2.gz VMDVPTPMQGIKMY-CYBMUJFWSA-N 0 3 343.387 2.632 20 5 EFBDHN Cc1ccc(NC(=O)CCN[C@@H](C)c2ccccc2[N+](=O)[O-])nc1 ZINC000343969947 280894834 /nfs/dbraw/zinc/89/48/34/280894834.db2.gz CVROEGGURLEHKE-ZDUSSCGKSA-N 0 3 328.372 2.978 20 5 EFBDHN CC[C@H]1CCCCN1CCNC(=O)c1cccc(OC)c1[N+](=O)[O-] ZINC000192571388 281058272 /nfs/dbraw/zinc/05/82/72/281058272.db2.gz NGXBZPCWKJFOCW-ZDUSSCGKSA-N 0 3 335.404 2.598 20 5 EFBDHN CN(C)C1(CN(C)C(=O)c2cc(Cl)ccc2[N+](=O)[O-])CCC1 ZINC000187889068 289042510 /nfs/dbraw/zinc/04/25/10/289042510.db2.gz YELNNKTXYCLNIY-UHFFFAOYSA-N 0 3 325.796 2.805 20 5 EFBDHN CN(C)CCN(Cc1ccccc1)C(=O)c1ccccc1[N+](=O)[O-] ZINC000072729557 292719761 /nfs/dbraw/zinc/71/97/61/292719761.db2.gz LDCXUIZGFYWLQA-UHFFFAOYSA-N 0 3 327.384 2.799 20 5 EFBDHN C[C@H](CN(C)C)NC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000350674783 289519295 /nfs/dbraw/zinc/51/92/95/289519295.db2.gz CSQHICSXNSCUIO-MRVPVSSYSA-N 0 3 334.298 2.685 20 5 EFBDHN CC(C)C[C@@H](CN[C@H](C)c1ccc([N+](=O)[O-])cc1)N1CCOCC1 ZINC000122140621 292958808 /nfs/dbraw/zinc/95/88/08/292958808.db2.gz JGYJHRGJRLUMNV-QAPCUYQASA-N 0 3 335.448 2.992 20 5 EFBDHN O=C(NCCN1CCCCC1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000125918784 293020567 /nfs/dbraw/zinc/02/05/67/293020567.db2.gz QVNWAXTZXDUPIS-UHFFFAOYSA-N 0 3 345.321 2.829 20 5 EFBDHN C[C@@H]1C[C@H](NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)CN1C1CC1 ZINC000130367995 293163284 /nfs/dbraw/zinc/16/32/84/293163284.db2.gz FPDADWFUYDDANY-OCCSQVGLSA-N 0 3 346.431 2.754 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCCN(CC)C1CC1 ZINC000130790171 293178211 /nfs/dbraw/zinc/17/82/11/293178211.db2.gz CNAVXSJIDQYUDK-UHFFFAOYSA-N 0 3 337.445 2.921 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCN2CC[C@H](Oc3ccncc3)C2)cc1 ZINC000131888533 293212254 /nfs/dbraw/zinc/21/22/54/293212254.db2.gz YFNWSUJBSZQKBF-KRWDZBQOSA-N 0 3 329.356 2.522 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](C)N(C)C1CC1 ZINC000132324739 293223795 /nfs/dbraw/zinc/22/37/95/293223795.db2.gz MILFLDMESFWNGG-LLVKDONJSA-N 0 3 337.445 2.919 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)CCN1CCCC1 ZINC000134083418 293277248 /nfs/dbraw/zinc/27/72/48/293277248.db2.gz HGXYRGFEMPALET-UHFFFAOYSA-N 0 3 337.445 2.875 20 5 EFBDHN C[C@H]1CCCN1C(=O)CCN(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000153292676 293369284 /nfs/dbraw/zinc/36/92/84/293369284.db2.gz JJCNFEWWGYVGPB-AWEZNQCLSA-N 0 3 331.416 2.960 20 5 EFBDHN COc1cc(C(=O)Nc2cccc(CN(C)C)c2)ccc1[N+](=O)[O-] ZINC000154059983 293407450 /nfs/dbraw/zinc/40/74/50/293407450.db2.gz LZGZEEDUOJSEME-UHFFFAOYSA-N 0 3 329.356 2.917 20 5 EFBDHN CCCN(CCN(C)C)C(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000155890208 293490815 /nfs/dbraw/zinc/49/08/15/293490815.db2.gz UJQLGNKXAZHSGQ-UHFFFAOYSA-N 0 3 330.388 2.557 20 5 EFBDHN CC[C@H](N[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C)[C@@H]1CCCO1 ZINC000248589708 293748811 /nfs/dbraw/zinc/74/88/11/293748811.db2.gz KQCHZXKOQSXQQC-WWGRRREGSA-N 0 3 335.404 2.777 20 5 EFBDHN COc1ccc(CNC[C@@]2(CO)C[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000289997714 293970040 /nfs/dbraw/zinc/97/00/40/293970040.db2.gz XWOGIMZCNBEBLN-VQIMIIECSA-N 0 3 342.395 2.859 20 5 EFBDHN Cc1cc([N+](=O)[O-])cc(C(=O)N2C[C@H](N3CCCC3)C[C@H]2C)c1F ZINC000290060014 293989001 /nfs/dbraw/zinc/98/90/01/293989001.db2.gz YDUXNRMHDQATDT-TZMCWYRMSA-N 0 3 335.379 2.741 20 5 EFBDHN CN(C)C[C@@H](NC(=O)c1csc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000290427264 294084232 /nfs/dbraw/zinc/08/42/32/294084232.db2.gz JXQQGQHTJJLKBO-CYBMUJFWSA-N 0 3 337.376 2.828 20 5 EFBDHN CCOC1CC(N(C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000290548863 294117077 /nfs/dbraw/zinc/11/70/77/294117077.db2.gz RRNNPLMAKTYMNO-UHFFFAOYSA-N 0 3 344.415 2.995 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CN2CC3(CCC3)[C@@H]2C2CC2)c1 ZINC000290830679 294197377 /nfs/dbraw/zinc/19/73/77/294197377.db2.gz UNFICRGEONFRCH-WBVHZDCISA-N 0 3 332.400 2.599 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CN2CC3(CCC3)[C@H]2C2CC2)c1 ZINC000290830670 294197483 /nfs/dbraw/zinc/19/74/83/294197483.db2.gz UNFICRGEONFRCH-DOTOQJQBSA-N 0 3 332.400 2.599 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN1CC2(CCC2)[C@@H]1C1CC1 ZINC000290851339 294202960 /nfs/dbraw/zinc/20/29/60/294202960.db2.gz XJMBZEUBIYFJAT-YOEHRIQHSA-N 0 3 332.400 2.599 20 5 EFBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNC[C@H](O)C1CCOCC1 ZINC000290925975 294221956 /nfs/dbraw/zinc/22/19/56/294221956.db2.gz RDRHFOICTUKWMQ-ZDUSSCGKSA-N 0 3 349.214 2.779 20 5 EFBDHN CCc1ccc(C(=O)Nc2ccc3c(c2)CNCCO3)cc1[N+](=O)[O-] ZINC000291120648 294281703 /nfs/dbraw/zinc/28/17/03/294281703.db2.gz UWFVUOGDXJEOBF-UHFFFAOYSA-N 0 3 341.367 2.892 20 5 EFBDHN COc1cc(CN[C@@H](C2CC2)C(C)(C)CO)c([N+](=O)[O-])cc1F ZINC000293241526 294917937 /nfs/dbraw/zinc/91/79/37/294917937.db2.gz YZAXRTTUHCWJSF-HNNXBMFYSA-N 0 3 326.368 2.629 20 5 EFBDHN C[C@@H]1C[C@H](NC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])CN1C1CC1 ZINC000293587919 295005376 /nfs/dbraw/zinc/00/53/76/295005376.db2.gz XEUQXUKILJJSKT-OLZOCXBDSA-N 0 3 346.431 2.754 20 5 EFBDHN CN(CCc1ccccc1[N+](=O)[O-])C[C@@H](O)Cc1ccc(F)cc1 ZINC000293614386 295011794 /nfs/dbraw/zinc/01/17/94/295011794.db2.gz PWZUTEUUKAINDC-KRWDZBQOSA-N 0 3 332.375 2.812 20 5 EFBDHN CN1CCC[C@@]2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3Cl)C2)C1 ZINC000294226174 295131259 /nfs/dbraw/zinc/13/12/59/295131259.db2.gz RIJRPLNKFAGXIZ-MRXNPFEDSA-N 0 3 337.807 2.806 20 5 EFBDHN CCc1ccc([C@H](CNC(=O)CCC(C)(C)[N+](=O)[O-])N(C)C)cc1 ZINC000294239611 295133466 /nfs/dbraw/zinc/13/34/66/295133466.db2.gz CECVQKSYGBTMQP-INIZCTEOSA-N 0 3 335.448 2.803 20 5 EFBDHN CN(CCc1cccc([N+](=O)[O-])c1)C[C@@H](O)Cc1ccc(F)cc1 ZINC000294263464 295137524 /nfs/dbraw/zinc/13/75/24/295137524.db2.gz VEJBUNRSGKEKOT-SFHVURJKSA-N 0 3 332.375 2.812 20 5 EFBDHN CC(C)(CCC(=O)NC1CCN(CCc2ccccc2)CC1)[N+](=O)[O-] ZINC000294488254 295175003 /nfs/dbraw/zinc/17/50/03/295175003.db2.gz NDZATDZERKHHLT-UHFFFAOYSA-N 0 3 347.459 2.645 20 5 EFBDHN C[C@@H](CN1CCCCC1)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000294599359 295192211 /nfs/dbraw/zinc/19/22/11/295192211.db2.gz UYFCFPYQSSIEGW-AWEZNQCLSA-N 0 3 347.415 2.548 20 5 EFBDHN CCN(CCNC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C1CC1 ZINC000294665592 295203554 /nfs/dbraw/zinc/20/35/54/295203554.db2.gz SFTZJJHGGCXAQP-UHFFFAOYSA-N 0 3 345.321 2.828 20 5 EFBDHN COc1cc(C[NH2+]CC(C)(C)c2ccccn2)c([N+](=O)[O-])cc1[O-] ZINC000294840265 295235354 /nfs/dbraw/zinc/23/53/54/295235354.db2.gz QZVXSLATWBARRF-UHFFFAOYSA-N 0 3 331.372 2.771 20 5 EFBDHN Cc1ccc(CN2C[C@H]3C[C@@H](C2)Cn2c(=O)cccc23)cc1[N+](=O)[O-] ZINC000294917870 295245611 /nfs/dbraw/zinc/24/56/11/295245611.db2.gz YNBCSSSKJHAROR-JKSUJKDBSA-N 0 3 339.395 2.684 20 5 EFBDHN C[C@@H]1CC[C@@H](C)[C@@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000294928955 295247058 /nfs/dbraw/zinc/24/70/58/295247058.db2.gz BYJXVYCWDZCVKA-IOASZLSFSA-N 0 3 340.445 2.783 20 5 EFBDHN CCOc1cc(CN2CCN(C3CC3)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000294950723 295250093 /nfs/dbraw/zinc/25/00/93/295250093.db2.gz ASSWXNGUPLCOGC-CQSZACIVSA-N 0 3 333.432 2.910 20 5 EFBDHN C[C@@H]1C[C@H](NC(=O)CCC(C)(C)[N+](=O)[O-])CN1Cc1ccccc1 ZINC000295121769 295270881 /nfs/dbraw/zinc/27/08/81/295270881.db2.gz MKZFNYVNOQSRTG-ZBFHGGJFSA-N 0 3 333.432 2.601 20 5 EFBDHN Cc1cc(Cl)c(C(=O)N[C@@H]2CN(C3CC3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000295136984 295273064 /nfs/dbraw/zinc/27/30/64/295273064.db2.gz OCUPNOZFXMRLOO-QMTHXVAHSA-N 0 3 337.807 2.769 20 5 EFBDHN CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2NCc1ccccc1[N+](=O)[O-] ZINC000295137009 295273133 /nfs/dbraw/zinc/27/31/33/295273133.db2.gz PGYCAWCUSZQFQK-NHAGDIPZSA-N 0 3 333.388 2.550 20 5 EFBDHN Cc1cc(Cl)c(C(=O)N[C@H]2CN(C3CC3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000295136982 295273246 /nfs/dbraw/zinc/27/32/46/295273246.db2.gz OCUPNOZFXMRLOO-HZMBPMFUSA-N 0 3 337.807 2.769 20 5 EFBDHN Cc1nc(NC2CCN(Cc3ccccc3)CC2)ncc1[N+](=O)[O-] ZINC000295241052 295286597 /nfs/dbraw/zinc/28/65/97/295286597.db2.gz GBJBASXLMIHAFE-UHFFFAOYSA-N 0 3 327.388 2.770 20 5 EFBDHN C[C@@H]1CCN(C(=O)CCC(C)(C)[N+](=O)[O-])CCN1Cc1ccccc1 ZINC000295260043 295289136 /nfs/dbraw/zinc/28/91/36/295289136.db2.gz KUMFQODXFULJKV-MRXNPFEDSA-N 0 3 347.459 2.945 20 5 EFBDHN Cc1cc(Cl)c(C(=O)N2CC[C@@]3(CCN(C)C3)C2)cc1[N+](=O)[O-] ZINC000295300478 295296091 /nfs/dbraw/zinc/29/60/91/295296091.db2.gz KDUVFJTYGMGDGN-MRXNPFEDSA-N 0 3 337.807 2.724 20 5 EFBDHN COc1cccc([C@H]2CCCN2CCn2cc([N+](=O)[O-])ccc2=O)c1 ZINC000159692023 295327672 /nfs/dbraw/zinc/32/76/72/295327672.db2.gz PTBAJZDGJIBGEM-QGZVFWFLSA-N 0 3 343.383 2.602 20 5 EFBDHN CO[C@]1(C)C[C@@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1(C)C ZINC000295821604 295381157 /nfs/dbraw/zinc/38/11/57/295381157.db2.gz BXMCCRJYDLXSQC-RHSMWYFYSA-N 0 3 335.404 2.635 20 5 EFBDHN C[C@@H](c1ccc(N)c([N+](=O)[O-])c1)N1CCC[C@H](CC(C)(C)C(N)=O)C1 ZINC000295836784 295383402 /nfs/dbraw/zinc/38/34/02/295383402.db2.gz AGANHCALYUOJTP-QWHCGFSZSA-N 0 3 348.447 2.852 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCC[C@H]2CN2CCCCC2)c([N+](=O)[O-])c1 ZINC000160433799 304803099 /nfs/dbraw/zinc/80/30/99/304803099.db2.gz CYEDKBNYOAPOHG-AWEZNQCLSA-N 0 3 334.376 2.958 20 5 EFBDHN CSc1ccc(C(=O)N(CCN(C)C)CC(C)C)cc1[N+](=O)[O-] ZINC000171565114 310749385 /nfs/dbraw/zinc/74/93/85/310749385.db2.gz GPEXFWOETGYGOF-UHFFFAOYSA-N 0 3 339.461 2.977 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1cccc(CN(C)C)c1 ZINC000172616954 310762237 /nfs/dbraw/zinc/76/22/37/310762237.db2.gz NVVWGHCFQYZZDV-UHFFFAOYSA-N 0 3 343.383 2.595 20 5 EFBDHN CN(C)CCN(Cc1cccc(O)c1)C(=O)c1csc([N+](=O)[O-])c1 ZINC000179418012 310786940 /nfs/dbraw/zinc/78/69/40/310786940.db2.gz IXEWQVXDGIDINC-UHFFFAOYSA-N 0 3 349.412 2.566 20 5 EFBDHN CC(C)(NC[C@H](O)COc1cccc([N+](=O)[O-])c1)c1cccc(F)c1 ZINC000179572827 310788779 /nfs/dbraw/zinc/78/87/79/310788779.db2.gz NACGJGJFVVHAAO-INIZCTEOSA-N 0 3 348.374 2.999 20 5 EFBDHN C[C@H](NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1CCOCC1 ZINC000179875865 310792649 /nfs/dbraw/zinc/79/26/49/310792649.db2.gz ZRJUHHBNTQIGPL-JTQLQIEISA-N 0 3 341.795 2.591 20 5 EFBDHN CCN(Cc1ccc(CN(C)C)cc1)c1ncc([N+](=O)[O-])c(C)n1 ZINC000297267569 310873739 /nfs/dbraw/zinc/87/37/39/310873739.db2.gz WLWNKSLTNSUTSE-UHFFFAOYSA-N 0 3 329.404 2.781 20 5 EFBDHN CC(C)C[C@@H](CN1CCCC1)NC(=O)Nc1ccncc1[N+](=O)[O-] ZINC000297827426 310933120 /nfs/dbraw/zinc/93/31/20/310933120.db2.gz RCCMJPCYZFJHQY-ZDUSSCGKSA-N 0 3 335.408 2.622 20 5 EFBDHN C[C@@H]1CCCN(CCNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000298699679 311015673 /nfs/dbraw/zinc/01/56/73/311015673.db2.gz BPIGGDIPWHFYHH-GFCCVEGCSA-N 0 3 331.372 2.803 20 5 EFBDHN Cc1ccccc1CN1CCC(Nc2c([N+](=O)[O-])ncn2C)CC1 ZINC000298705082 311016109 /nfs/dbraw/zinc/01/61/09/311016109.db2.gz IIYRYYRGUZTOGO-UHFFFAOYSA-N 0 3 329.404 2.713 20 5 EFBDHN C[C@@H](NC(=O)N1CCN(C2CCCC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000298961926 311037980 /nfs/dbraw/zinc/03/79/80/311037980.db2.gz MWICIXXCYHDLRQ-CQSZACIVSA-N 0 3 346.431 2.926 20 5 EFBDHN C[C@@H](CN1CCCCC1)NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000299175415 311059097 /nfs/dbraw/zinc/05/90/97/311059097.db2.gz WXVXDWDXTDZTSM-LBPRGKRZSA-N 0 3 330.388 2.680 20 5 EFBDHN COCCN1CCC(Nc2ccc3cc([N+](=O)[O-])ccc3n2)CC1 ZINC000299237341 311064237 /nfs/dbraw/zinc/06/42/37/311064237.db2.gz KMNFWEGULVRVFD-UHFFFAOYSA-N 0 3 330.388 2.666 20 5 EFBDHN C[C@@H]1CN(C[C@H]2CCCN2Cc2cccc([N+](=O)[O-])c2)C[C@@H](C)O1 ZINC000299258320 311066256 /nfs/dbraw/zinc/06/62/56/311066256.db2.gz GKKAZPXVMQDRIG-IIDMSEBBSA-N 0 3 333.432 2.668 20 5 EFBDHN C[C@@H](CN1CCCCC1)NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000299274420 311068232 /nfs/dbraw/zinc/06/82/32/311068232.db2.gz KFEQEEVHEZBGRB-LBPRGKRZSA-N 0 3 330.388 2.680 20 5 EFBDHN O=C(CCN(Cc1ccncc1)C1CC1)Nc1ccccc1[N+](=O)[O-] ZINC000299728644 311114712 /nfs/dbraw/zinc/11/47/12/311114712.db2.gz VWCXSWRXWJRUON-UHFFFAOYSA-N 0 3 340.383 2.983 20 5 EFBDHN CN1CCN(Cc2ccc(CNc3ccc([N+](=O)[O-])cc3)cc2)CC1 ZINC000301070742 311117197 /nfs/dbraw/zinc/11/71/97/311117197.db2.gz GRIQPOMYQNPRTE-UHFFFAOYSA-N 0 3 340.427 2.954 20 5 EFBDHN CCN1CCCN(c2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000301215571 311124817 /nfs/dbraw/zinc/12/48/17/311124817.db2.gz ZNYSAPNCJGAJNM-UHFFFAOYSA-N 0 3 328.210 2.889 20 5 EFBDHN Cc1ccc(NC[C@H](O)CN2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000301509589 311141626 /nfs/dbraw/zinc/14/16/26/311141626.db2.gz HYQYKSHTENSYCP-KRWDZBQOSA-N 0 3 341.411 2.734 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(NCCN2CCCCC2)cc1Cl ZINC000301679656 311151856 /nfs/dbraw/zinc/15/18/56/311151856.db2.gz RMASMMHVJHJBEU-UHFFFAOYSA-N 0 3 341.795 2.933 20 5 EFBDHN CN(C[C@@H]1CCCN(C)C1)c1c(Br)cncc1[N+](=O)[O-] ZINC000301860937 311163278 /nfs/dbraw/zinc/16/32/78/311163278.db2.gz DOGWUUDHNRFQFF-SNVBAGLBSA-N 0 3 343.225 2.530 20 5 EFBDHN O=[N+]([O-])c1cc(F)ccc1NC[C@@H]1C[C@@H](O)CN1Cc1ccccc1 ZINC000301892010 311165305 /nfs/dbraw/zinc/16/53/05/311165305.db2.gz VGKACJPZKQEZEM-JKSUJKDBSA-N 0 3 345.374 2.781 20 5 EFBDHN O=[N+]([O-])c1cc(F)ccc1NC[C@@H]1C[C@H](O)CN1Cc1ccccc1 ZINC000301892009 311165329 /nfs/dbraw/zinc/16/53/29/311165329.db2.gz VGKACJPZKQEZEM-HOTGVXAUSA-N 0 3 345.374 2.781 20 5 EFBDHN COC1CCN(CCNc2cc(C)nc3c2cccc3[N+](=O)[O-])CC1 ZINC000302045837 311174557 /nfs/dbraw/zinc/17/45/57/311174557.db2.gz YDKHKVFATZXBSD-UHFFFAOYSA-N 0 3 344.415 2.974 20 5 EFBDHN CC(C)C1CCC(N2CCN(c3ncc([N+](=O)[O-])cn3)CC2)CC1 ZINC000302146505 311180503 /nfs/dbraw/zinc/18/05/03/311180503.db2.gz IFENVASAGVZWKF-UHFFFAOYSA-N 0 3 333.436 2.722 20 5 EFBDHN CN(CCN(C)C1CC1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000302234395 311186464 /nfs/dbraw/zinc/18/64/64/311186464.db2.gz DJLOVCDTTGUXCA-UHFFFAOYSA-N 0 3 328.210 2.888 20 5 EFBDHN Cc1cccc(NC[C@@H]2C[C@@H](O)CN2Cc2ccccc2)c1[N+](=O)[O-] ZINC000302494359 311191580 /nfs/dbraw/zinc/19/15/80/311191580.db2.gz LIEJVJRHJPDBSP-DLBZAZTESA-N 0 3 341.411 2.951 20 5 EFBDHN CCN1CCN([C@@H](C)CNc2c(C)cc([N+](=O)[O-])cc2Cl)CC1 ZINC000302632475 311194932 /nfs/dbraw/zinc/19/49/32/311194932.db2.gz CGSGMXGTCODLQC-ZDUSSCGKSA-N 0 3 340.855 2.995 20 5 EFBDHN COc1ccc(-c2ccc(CN3CCC[C@@H](O)C3)o2)c([N+](=O)[O-])c1 ZINC000305737823 311224878 /nfs/dbraw/zinc/22/48/78/311224878.db2.gz VKJOMEDCWTVVFR-GFCCVEGCSA-N 0 3 332.356 2.820 20 5 EFBDHN COc1ccc(CN2CCNC[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000313375671 311232294 /nfs/dbraw/zinc/23/22/94/311232294.db2.gz XMURVHIJLPFJLA-KRWDZBQOSA-N 0 3 327.384 2.750 20 5 EFBDHN Cc1cccc(OC[C@H](O)CNCc2cccc([N+](=O)[O-])c2C)c1 ZINC000326493124 311244130 /nfs/dbraw/zinc/24/41/30/311244130.db2.gz YGXVWQVQEJPQOE-MRXNPFEDSA-N 0 3 330.384 2.741 20 5 EFBDHN Cc1c(CNC[C@@H](O)COCc2ccccc2F)cccc1[N+](=O)[O-] ZINC000327501459 311245271 /nfs/dbraw/zinc/24/52/71/311245271.db2.gz GQGWMKUPTZYTRA-MRXNPFEDSA-N 0 3 348.374 2.710 20 5 EFBDHN CCc1cccc(OC[C@@H](O)CNCc2cccc([N+](=O)[O-])c2C)c1 ZINC000327880269 311245460 /nfs/dbraw/zinc/24/54/60/311245460.db2.gz SQPHOKOXLXAEEA-KRWDZBQOSA-N 0 3 344.411 2.995 20 5 EFBDHN Cc1c(CN2CCC[C@@H](CNC(=O)C(C)C)C2)cccc1[N+](=O)[O-] ZINC000330447524 311318326 /nfs/dbraw/zinc/31/83/26/311318326.db2.gz WCQSODFMHRIGCW-HNNXBMFYSA-N 0 3 333.432 2.887 20 5 EFBDHN CCN1C[C@H](C)N(CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C[C@H]1C ZINC000330581128 311322816 /nfs/dbraw/zinc/32/28/16/311322816.db2.gz QMSUFPOLBGHXCC-KGLIPLIRSA-N 0 3 348.447 2.646 20 5 EFBDHN C[C@@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000330597510 311323689 /nfs/dbraw/zinc/32/36/89/311323689.db2.gz VUYYCCVOWSVBCQ-UTUOFQBUSA-N 0 3 325.434 2.753 20 5 EFBDHN CCOc1ccc(C(=O)N(C)[C@@H](C)C2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000330724436 311330855 /nfs/dbraw/zinc/33/08/55/311330855.db2.gz DFTHGBZQHYWATO-ZDUSSCGKSA-N 0 3 349.431 2.796 20 5 EFBDHN CC(C)c1ccc(C(=O)N[C@H]2CN(C3CC3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000331483983 311381620 /nfs/dbraw/zinc/38/16/20/311381620.db2.gz JVMOPTSZNZFFJL-LRDDRELGSA-N 0 3 331.416 2.931 20 5 EFBDHN CC(C)N1C[C@@H](N[C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1=O ZINC000417304162 312206063 /nfs/dbraw/zinc/20/60/63/312206063.db2.gz BMNSDUYNAWMRLC-WMLDXEAASA-N 0 3 331.416 2.961 20 5 EFBDHN CS(=O)(=O)C1(CN[C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000417334652 312210504 /nfs/dbraw/zinc/21/05/04/312210504.db2.gz RKPOFUNBKMNKLB-OAHLLOKOSA-N 0 3 338.429 2.529 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](NCCN1C[C@H]3CC[C@@H](C1)O3)CCCC2 ZINC000417349019 312212324 /nfs/dbraw/zinc/21/23/24/312212324.db2.gz JZODDHLJLNCFCC-SCTDSRPQSA-N 0 3 345.443 2.815 20 5 EFBDHN C[C@@H](CN1CCCC1=O)N[C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417345390 312212362 /nfs/dbraw/zinc/21/23/62/312212362.db2.gz UHQSDYDLTLYDDQ-GUYCJALGSA-N 0 3 331.416 2.963 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@H]2CCN(CC(F)F)C2)cc1[N+](=O)[O-] ZINC000417397247 312218467 /nfs/dbraw/zinc/21/84/67/312218467.db2.gz XXJCPNNEKQNSDN-AAEUAGOBSA-N 0 3 343.374 2.984 20 5 EFBDHN CCCN1C[C@H](CNc2cc(C)nc3ccc([N+](=O)[O-])cc32)CC1=O ZINC000420651012 312379296 /nfs/dbraw/zinc/37/92/96/312379296.db2.gz JAXGOXPTXMBSER-ZDUSSCGKSA-N 0 3 342.399 2.544 20 5 EFBDHN Cc1cc(N)cc(CN[C@H](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000423489654 312423755 /nfs/dbraw/zinc/42/37/55/312423755.db2.gz WQZRTDQKDDVAOT-CYBMUJFWSA-N 0 3 342.399 2.992 20 5 EFBDHN CCc1ccccc1[C@H](N)CNC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000423976643 312493300 /nfs/dbraw/zinc/49/33/00/312493300.db2.gz MWGCICZIMPKUCO-QGZVFWFLSA-N 0 3 327.384 2.516 20 5 EFBDHN CS[C@@H]1CN(c2ccnc3c2cccc3[N+](=O)[O-])C[C@H]1N(C)C ZINC000432331677 312556866 /nfs/dbraw/zinc/55/68/66/312556866.db2.gz PIFSQGDPFOFLCF-HUUCEWRRSA-N 0 3 332.429 2.625 20 5 EFBDHN CN(C)C1(CN(C)C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)CCC1 ZINC000438599628 312621984 /nfs/dbraw/zinc/62/19/84/312621984.db2.gz MIBPQLUGYSXPPR-UHFFFAOYSA-N 0 3 330.388 2.632 20 5 EFBDHN CS[C@H]1CN(c2nccc3c2cccc3[N+](=O)[O-])C[C@@H]1N(C)C ZINC000450409083 312692718 /nfs/dbraw/zinc/69/27/18/312692718.db2.gz XANVNZWDGGKEEO-GJZGRUSLSA-N 0 3 332.429 2.625 20 5 EFBDHN CC[C@H](C)N1CCN(Cc2cc(OC)c(F)cc2[N+](=O)[O-])CC1 ZINC000451837810 312830179 /nfs/dbraw/zinc/83/01/79/312830179.db2.gz IAKZMCSLBMIHAS-LBPRGKRZSA-N 0 3 325.384 2.659 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@@H]1CC(=O)N(CC)C1 ZINC000453352627 312891717 /nfs/dbraw/zinc/89/17/17/312891717.db2.gz JYHWDFNRXLWJJH-CHWSQXEVSA-N 0 3 337.445 2.676 20 5 EFBDHN Cc1ncccc1NC(=O)[C@H](C)N[C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000453426443 312903034 /nfs/dbraw/zinc/90/30/34/312903034.db2.gz HFFGHBUOKICWJF-OCCSQVGLSA-N 0 3 342.399 2.846 20 5 EFBDHN CN(C)CCN(Cc1ccsc1)C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000458196336 313082398 /nfs/dbraw/zinc/08/23/98/313082398.db2.gz DRTIPWVKWKZJLM-UHFFFAOYSA-N 0 3 333.413 2.860 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCN(C[C@H]2CCOC2)CC1 ZINC000470184818 313130348 /nfs/dbraw/zinc/13/03/48/313130348.db2.gz XRBJDRWRDXFOLF-MUMAZLPKSA-N 0 3 345.443 2.652 20 5 EFBDHN C[C@H](C1CCN(C)CC1)N(C)C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000479546784 313270805 /nfs/dbraw/zinc/27/08/05/313270805.db2.gz NMHWQFDCPOFLPP-GFCCVEGCSA-N 0 3 344.415 2.878 20 5 EFBDHN CN1CCC(CC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000486984484 313355639 /nfs/dbraw/zinc/35/56/39/313355639.db2.gz FXYCOPVETBXWFY-UHFFFAOYSA-N 0 3 331.416 2.818 20 5 EFBDHN O=C(/C=C\c1ccc(F)cc1[N+](=O)[O-])N1CCN(C2CCCC2)CC1 ZINC000491320960 313731185 /nfs/dbraw/zinc/73/11/85/313731185.db2.gz OITPTKPJRPUORH-VURMDHGXSA-N 0 3 347.390 2.834 20 5 EFBDHN C[C@H]1CN(C(=O)/C=C\c2ccccc2[N+](=O)[O-])CCN(C2CCC2)C1 ZINC000492799583 314129879 /nfs/dbraw/zinc/12/98/79/314129879.db2.gz MUGJVSLOCWYOPV-FJVVXJACSA-N 0 3 343.427 2.941 20 5 EFBDHN CC[C@H](NC(=O)N1CCN(C)CC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000493046043 314222307 /nfs/dbraw/zinc/22/23/07/314222307.db2.gz DBLVTFSQKHBCFP-BBRMVZONSA-N 0 3 334.420 2.782 20 5 EFBDHN CN1CCC[C@@]2(CCN(C(=O)/C=C/c3cccc([N+](=O)[O-])c3)C2)C1 ZINC000493487202 314374311 /nfs/dbraw/zinc/37/43/11/314374311.db2.gz MHTFAJDYZSOVMU-IPLHWJFFSA-N 0 3 329.400 2.552 20 5 EFBDHN CC[C@H]1CN(CCN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)CCO1 ZINC000494459336 314591770 /nfs/dbraw/zinc/59/17/70/314591770.db2.gz XHNRJDPZJYMKRE-WMZOPIPTSA-N 0 3 333.432 2.673 20 5 EFBDHN CCOC(=O)N1CCC[C@@H]([C@@H](C)NCc2ccccc2[N+](=O)[O-])C1 ZINC000495544974 314751510 /nfs/dbraw/zinc/75/15/10/314751510.db2.gz WHVAGIJZFOSNJP-UKRRQHHQSA-N 0 3 335.404 2.941 20 5 EFBDHN CC(COC(=O)Cc1ccccc1NC(=O)OC(C)(C)C)[N+](=O)[O-] ZINC000496976238 315264028 /nfs/dbraw/zinc/26/40/28/315264028.db2.gz UZZKJEZLQSHTEN-LLVKDONJSA-N 0 3 338.360 2.785 20 5 EFBDHN C[C@@H](CC(N)=O)NCc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000498372062 315403211 /nfs/dbraw/zinc/40/32/11/315403211.db2.gz GYPLXJKFWHWRLQ-ZDUSSCGKSA-N 0 3 342.399 2.716 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C\CN[C@@H](CO)Cc1ccc(F)cc1 ZINC000500229149 315418351 /nfs/dbraw/zinc/41/83/51/315418351.db2.gz NFEDVRRTHNVOGB-MAVJXHJTSA-N 0 3 330.359 2.940 20 5 EFBDHN CC[C@@]1(C(C)C)C[C@@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000516276846 315668976 /nfs/dbraw/zinc/66/89/76/315668976.db2.gz OCUPQCUHTNCSBM-HOTGVXAUSA-N 0 3 340.445 2.783 20 5 EFBDHN CNc1ccc(C(=O)N(CCN(C)C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000521150524 316001492 /nfs/dbraw/zinc/00/14/92/316001492.db2.gz HETZLPIZHGKOQA-UHFFFAOYSA-N 0 3 348.447 2.973 20 5 EFBDHN C[C@H](CNC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCCC1 ZINC000525748454 316232740 /nfs/dbraw/zinc/23/27/40/316232740.db2.gz BBHHFRIYTWTHED-SNVBAGLBSA-N 0 3 345.321 2.828 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CCC(OCC3CCCCC3)CC2)c1 ZINC000530624186 317156540 /nfs/dbraw/zinc/15/65/40/317156540.db2.gz ZHEIAXGOSQEFOS-UHFFFAOYSA-N 0 3 336.436 2.853 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CCC(CCc3ccc(O)cc3)CC2)n1 ZINC000530665634 317162308 /nfs/dbraw/zinc/16/23/08/317162308.db2.gz PYRXRRODZLLJTR-UHFFFAOYSA-N 0 3 344.415 2.842 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H]1CN(CC(C)C)CCO1 ZINC000531931490 317334164 /nfs/dbraw/zinc/33/41/64/317334164.db2.gz OMUAXRBRAYHNPC-WBVHZDCISA-N 0 3 335.448 2.911 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H](O)COc1ccccc1 ZINC000532198686 317369054 /nfs/dbraw/zinc/36/90/54/317369054.db2.gz MQKBLYAPAAZHRO-HOCLYGCPSA-N 0 3 330.384 2.994 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H]1CCC[C@@H](S(C)(=O)=O)C1 ZINC000537985030 317686887 /nfs/dbraw/zinc/68/68/87/317686887.db2.gz QBERBCNFOFJBGY-KCQAQPDRSA-N 0 3 340.445 2.910 20 5 EFBDHN COCc1ccccc1CNCCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000548761128 318140892 /nfs/dbraw/zinc/14/08/92/318140892.db2.gz CLLBGYYEHOXYMC-UHFFFAOYSA-N 0 3 343.383 2.860 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@H]2CCN(C[C@H]3CCC4(CCCC4)O3)C2)nc1 ZINC000548921394 318157262 /nfs/dbraw/zinc/15/72/62/318157262.db2.gz VGMQWZAXZVGVMB-GOEBONIOSA-N 0 3 346.431 2.968 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2ccc(Cl)cc2)c1 ZINC000549696964 318179993 /nfs/dbraw/zinc/17/99/93/318179993.db2.gz WIBTWCFPRWDFTB-HNNXBMFYSA-N 0 3 336.775 2.778 20 5 EFBDHN CC(C)(C(=O)N1CC[C@@H](N2CCCC2)C1)c1ccccc1[N+](=O)[O-] ZINC000550505318 318194263 /nfs/dbraw/zinc/19/42/63/318194263.db2.gz ZFHJSQCVUFFMJT-CQSZACIVSA-N 0 3 331.416 2.569 20 5 EFBDHN CC(C)(C(=O)N1CC[C@H](N2CCCC2)C1)c1ccccc1[N+](=O)[O-] ZINC000550505317 318194279 /nfs/dbraw/zinc/19/42/79/318194279.db2.gz ZFHJSQCVUFFMJT-AWEZNQCLSA-N 0 3 331.416 2.569 20 5 EFBDHN C[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F)N1CCCC1 ZINC000550737867 318196735 /nfs/dbraw/zinc/19/67/35/318196735.db2.gz RNYNQZROTUDFPD-SNVBAGLBSA-N 0 3 345.321 2.828 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@H]2CCc3cc(F)ccc32)c1 ZINC000552030988 318238291 /nfs/dbraw/zinc/23/82/91/318238291.db2.gz ZAXAFDJHFNBOJG-QAPCUYQASA-N 0 3 346.358 2.751 20 5 EFBDHN COc1cc(C[NH2+][C@@H]2[C@H]3Cc4ccccc4[C@@H]23)c([N+](=O)[O-])cc1[O-] ZINC000558417939 318466245 /nfs/dbraw/zinc/46/62/45/318466245.db2.gz LSAKVIYXIDCHQB-MORSLUCNSA-N 0 3 326.352 2.737 20 5 EFBDHN CCc1nncn1CCN[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000562413089 318645357 /nfs/dbraw/zinc/64/53/57/318645357.db2.gz XGNKNUDOSIMSIA-HNNXBMFYSA-N 0 3 329.404 2.761 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1N[C@@H](CO)CN1CCCCC1 ZINC000564494185 318866082 /nfs/dbraw/zinc/86/60/82/318866082.db2.gz FBIPHCTXHYRLAJ-GFCCVEGCSA-N 0 3 347.337 2.872 20 5 EFBDHN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cccc2c1CCNC2 ZINC000565828328 319006533 /nfs/dbraw/zinc/00/65/33/319006533.db2.gz XZLWQGMROQQVKC-UHFFFAOYSA-N 0 3 325.368 2.812 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](NCCn1cnnc1C1CC1)CCC2 ZINC000565885650 319011497 /nfs/dbraw/zinc/01/14/97/319011497.db2.gz IYDLVNRWOYDAHQ-INIZCTEOSA-N 0 3 327.388 2.731 20 5 EFBDHN O=C(CCN1CC[C@H](c2cccnc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000565949394 319017728 /nfs/dbraw/zinc/01/77/28/319017728.db2.gz QZQNYYKXGACAGI-HNNXBMFYSA-N 0 3 340.383 2.808 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2NC[C@@H](O)COc1ccc(F)cc1 ZINC000566476044 319082072 /nfs/dbraw/zinc/08/20/72/319082072.db2.gz SGIZUQFWXPONFO-CXAGYDPISA-N 0 3 346.358 2.751 20 5 EFBDHN CC[C@@H](CC(F)(F)F)NC[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000567710595 319201641 /nfs/dbraw/zinc/20/16/41/319201641.db2.gz NOVQZUGVAAYVFF-QWRGUYRKSA-N 0 3 336.310 2.655 20 5 EFBDHN C[C@H](N[C@@H]1CCCC[C@@H]1N1CCOCC1)c1ccccc1[N+](=O)[O-] ZINC000568462481 319284746 /nfs/dbraw/zinc/28/47/46/319284746.db2.gz AJVGBVROAIWTHX-LESCRADOSA-N 0 3 333.432 2.889 20 5 EFBDHN CN(C)c1ccc(CN[C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cn1 ZINC000568589261 319297106 /nfs/dbraw/zinc/29/71/06/319297106.db2.gz CLCNOMZDWUXESN-HUUCEWRRSA-N 0 3 344.419 2.526 20 5 EFBDHN C[C@](O)(CNCCc1ccc(Cl)cc1[N+](=O)[O-])C(F)(F)F ZINC000573795901 319799185 /nfs/dbraw/zinc/79/91/85/319799185.db2.gz SWCUPUDCCHWTKD-NSHDSACASA-N 0 3 326.702 2.694 20 5 EFBDHN COc1ccc(CNC[C@H](O)[C@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000578725745 320232785 /nfs/dbraw/zinc/23/27/85/320232785.db2.gz VWOLWCVFKMEGQE-DYVFJYSZSA-N 0 3 330.384 2.858 20 5 EFBDHN Cc1ccc(CN(C)C[C@H](O)COc2ccccc2[N+](=O)[O-])s1 ZINC000181728439 323247063 /nfs/dbraw/zinc/24/70/63/323247063.db2.gz BUJWSPLAJPDNBX-ZDUSSCGKSA-N 0 3 336.413 2.836 20 5 EFBDHN Cc1ccc(CN(C)C[C@@H](O)COc2ccccc2[N+](=O)[O-])s1 ZINC000181728458 323247137 /nfs/dbraw/zinc/24/71/37/323247137.db2.gz BUJWSPLAJPDNBX-CYBMUJFWSA-N 0 3 336.413 2.836 20 5 EFBDHN CN(CCc1cccs1)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000181925338 323255541 /nfs/dbraw/zinc/25/55/41/323255541.db2.gz FXGANUNYNHSZGK-CYBMUJFWSA-N 0 3 336.413 2.571 20 5 EFBDHN Cc1ccc([C@H](C)NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC000182331219 323277406 /nfs/dbraw/zinc/27/74/06/323277406.db2.gz IGVUYDVNNPOHMI-WMLDXEAASA-N 0 3 330.384 2.994 20 5 EFBDHN C[C@H](C(=O)NCCN1CCC[C@H](C)C1)c1ccc([N+](=O)[O-])cc1F ZINC000185003609 323379822 /nfs/dbraw/zinc/37/98/22/323379822.db2.gz YVIIXTMWADLRPL-STQMWFEESA-N 0 3 337.395 2.686 20 5 EFBDHN CC(C)N(CCN(C)C)C(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000185108490 323382877 /nfs/dbraw/zinc/38/28/77/323382877.db2.gz VAKKWUXWLWZRMV-GFCCVEGCSA-N 0 3 325.384 2.636 20 5 EFBDHN C[C@H](C(=O)N1CCCC[C@H]1CN(C)C)c1ccc([N+](=O)[O-])cc1F ZINC000185129960 323384614 /nfs/dbraw/zinc/38/46/14/323384614.db2.gz PHHUUSLIGQEOJX-JSGCOSHPSA-N 0 3 337.395 2.780 20 5 EFBDHN COC(=O)COc1ccc(CN[C@@H]2CCC[C@@H](F)C2)cc1[N+](=O)[O-] ZINC000580193534 324118283 /nfs/dbraw/zinc/11/82/83/324118283.db2.gz HHVPVAFVTNKEMX-CHWSQXEVSA-N 0 3 340.351 2.517 20 5 EFBDHN CN(C)C(=O)C1(CN[C@H]2CCc3c2cccc3[N+](=O)[O-])CCCC1 ZINC000580328298 324143390 /nfs/dbraw/zinc/14/33/90/324143390.db2.gz QUDUBVXKADZNMJ-HNNXBMFYSA-N 0 3 331.416 2.820 20 5 EFBDHN C[C@@H]1CN(CCN[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CCO1 ZINC000580390671 324151578 /nfs/dbraw/zinc/15/15/78/324151578.db2.gz WCDMHQCNQSKTAP-CXAGYDPISA-N 0 3 333.432 2.628 20 5 EFBDHN O=C(CCN1CC[C@H](c2ccncc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000580511546 324174747 /nfs/dbraw/zinc/17/47/47/324174747.db2.gz GJAAKTLOTCIQDX-HNNXBMFYSA-N 0 3 340.383 2.808 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN[C@@H]1CCc2cc(F)ccc21 ZINC000580737432 324224135 /nfs/dbraw/zinc/22/41/35/324224135.db2.gz UCLZAHINEMEBDG-GOEBONIOSA-N 0 3 346.358 2.751 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CN[C@H]1CCCc2occc21 ZINC000580947294 324272890 /nfs/dbraw/zinc/27/28/90/324272890.db2.gz OVLSDNWITXTHFX-OCCSQVGLSA-N 0 3 332.356 2.595 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CN[C@@H]1CCCc2occc21 ZINC000580947295 324272965 /nfs/dbraw/zinc/27/29/65/324272965.db2.gz OVLSDNWITXTHFX-TZMCWYRMSA-N 0 3 332.356 2.595 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN[C@@H]1CCCc2occc21 ZINC000580947292 324272978 /nfs/dbraw/zinc/27/29/78/324272978.db2.gz OVLSDNWITXTHFX-GXTWGEPZSA-N 0 3 332.356 2.595 20 5 EFBDHN CC(C)O[C@@H]1CCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000581192228 324324750 /nfs/dbraw/zinc/32/47/50/324324750.db2.gz LGBZPKMJRFYZDH-QGZVFWFLSA-N 0 3 344.415 2.995 20 5 EFBDHN C[C@H](C(=O)N(CCN(C)C)Cc1ccco1)c1cccc([N+](=O)[O-])c1 ZINC000581463128 324382045 /nfs/dbraw/zinc/38/20/45/324382045.db2.gz SGKGJMHKPKFQPV-AWEZNQCLSA-N 0 3 345.399 2.882 20 5 EFBDHN COc1ccc([C@H](CO)CN[C@@H]2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000582370433 324580753 /nfs/dbraw/zinc/58/07/53/324580753.db2.gz PTICUFBMMRJHMA-KBXCAEBGSA-N 0 3 342.395 2.956 20 5 EFBDHN O=[N+]([O-])c1cnc(N2CC[C@@H](N3CCCC3)C2)c(C(F)(F)F)c1 ZINC000582951370 324705740 /nfs/dbraw/zinc/70/57/40/324705740.db2.gz XVYAEOZEYZASAB-SNVBAGLBSA-N 0 3 330.310 2.683 20 5 EFBDHN O=[N+]([O-])c1cnc(N2CC[C@H](N3CCCC3)C2)c(C(F)(F)F)c1 ZINC000582951369 324706003 /nfs/dbraw/zinc/70/60/03/324706003.db2.gz XVYAEOZEYZASAB-JTQLQIEISA-N 0 3 330.310 2.683 20 5 EFBDHN C[C@@H](C(=O)N1CCC[C@H]1CN1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000583787023 324869915 /nfs/dbraw/zinc/86/99/15/324869915.db2.gz SVKOSNPRKZCXBE-PBHICJAKSA-N 0 3 331.416 2.785 20 5 EFBDHN C[C@H](CNC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCCC1 ZINC000583792775 324871198 /nfs/dbraw/zinc/87/11/98/324871198.db2.gz QORAMEDAYYYZNE-SNVBAGLBSA-N 0 3 345.321 2.828 20 5 EFBDHN CC[C@H](NCc1cccc(OCC(N)=O)c1)c1cccc([N+](=O)[O-])c1 ZINC000128903099 472509207 /nfs/dbraw/zinc/50/92/07/472509207.db2.gz ULHQPZJGZCFMRN-KRWDZBQOSA-N 0 3 343.383 2.700 20 5 EFBDHN Cc1c(NC(=O)CCN[C@H](CO)c2ccccc2)cccc1[N+](=O)[O-] ZINC000095462553 473209247 /nfs/dbraw/zinc/20/92/47/473209247.db2.gz UXIVTAKOPLWSLD-MRXNPFEDSA-N 0 3 343.383 2.555 20 5 EFBDHN CCN(CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccn1 ZINC000161168191 473214196 /nfs/dbraw/zinc/21/41/96/473214196.db2.gz KEDGLOHOIOCQGT-UHFFFAOYSA-N 0 3 328.372 2.841 20 5 EFBDHN C[C@@H]1CN(C[C@@H]2CCCN2Cc2ccccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000139074571 473226481 /nfs/dbraw/zinc/22/64/81/473226481.db2.gz FJUMTTWTHWXPTR-UXLLHSPISA-N 0 3 333.432 2.668 20 5 EFBDHN O=C(NC[C@H]1CCCN(Cc2cccs2)C1)c1cc([N+](=O)[O-])c[nH]1 ZINC000140119271 473242147 /nfs/dbraw/zinc/24/21/47/473242147.db2.gz QMGRBGHGLKBEIQ-GFCCVEGCSA-N 0 3 348.428 2.626 20 5 EFBDHN Cn1cnc([N+](=O)[O-])c1NCC1CCN(Cc2cccs2)CC1 ZINC000141129384 473251851 /nfs/dbraw/zinc/25/18/51/473251851.db2.gz VNOYFKKFDFJKPC-UHFFFAOYSA-N 0 3 335.433 2.714 20 5 EFBDHN Cc1c(CC(=O)NC[C@@H](C)N2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000161682100 473252593 /nfs/dbraw/zinc/25/25/93/473252593.db2.gz WGNGESZVXYDEAA-UONOGXRCSA-N 0 3 333.432 2.682 20 5 EFBDHN CC1CC[NH+](CC[N-]c2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC000486935502 468013551 /nfs/dbraw/zinc/01/35/51/468013551.db2.gz JIEOJNLDZBLQGQ-UHFFFAOYSA-N 0 3 331.376 2.789 20 5 EFBDHN CC1CCN(CCNc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC000486935502 468013552 /nfs/dbraw/zinc/01/35/52/468013552.db2.gz JIEOJNLDZBLQGQ-UHFFFAOYSA-N 0 3 331.376 2.789 20 5 EFBDHN C[C@H](C(=O)NC1CCN(C2CC2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000184942928 473280329 /nfs/dbraw/zinc/28/03/29/473280329.db2.gz BDWPQSPECKPQDU-NSHDSACASA-N 0 3 335.379 2.580 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccn(C3CCN(C)CC3)n2)c1 ZINC000489996307 468184550 /nfs/dbraw/zinc/18/45/50/468184550.db2.gz VPXVSGRKJLCOTC-UHFFFAOYSA-N 0 3 343.387 2.619 20 5 EFBDHN CCN1CCC[C@@H]1CN(C)C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000177037372 473289874 /nfs/dbraw/zinc/28/98/74/473289874.db2.gz MCJKMICNWILQTE-GFCCVEGCSA-N 0 3 325.796 2.805 20 5 EFBDHN NC1(C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)CCCCC1 ZINC000161977675 473289482 /nfs/dbraw/zinc/28/94/82/473289482.db2.gz KHYOKAFYUMYYQJ-UHFFFAOYSA-N 0 3 347.415 2.626 20 5 EFBDHN COc1ccc(CN(CCO)CCc2ccccc2)cc1[N+](=O)[O-] ZINC000112698761 473296754 /nfs/dbraw/zinc/29/67/54/473296754.db2.gz VYJTTYYHJSDLKC-UHFFFAOYSA-N 0 3 330.384 2.640 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CN1C1CC1 ZINC000177100522 473306298 /nfs/dbraw/zinc/30/62/98/473306298.db2.gz GFPGHHXJIFDSQC-CMPLNLGQSA-N 0 3 337.807 2.532 20 5 EFBDHN CC1(C)CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC(C)(C)O1 ZINC000190539574 473311276 /nfs/dbraw/zinc/31/12/76/473311276.db2.gz NLNCPWPMSNNDDW-UHFFFAOYSA-N 0 3 335.404 2.813 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CN1C1CC1 ZINC000177186448 473326693 /nfs/dbraw/zinc/32/66/93/473326693.db2.gz LXQZNFCZYIJVNF-FZMZJTMJSA-N 0 3 344.415 2.524 20 5 EFBDHN CN(C)CCN(C(=O)CCOc1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000112915828 473330175 /nfs/dbraw/zinc/33/01/75/473330175.db2.gz XIPHMQBNFDXVLV-UHFFFAOYSA-N 0 3 349.431 2.697 20 5 EFBDHN C[C@@H]1C[C@@H](NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)CN1C1CC1 ZINC000177206246 473331361 /nfs/dbraw/zinc/33/13/61/473331361.db2.gz QQBPUMHFFXVEBA-UKRRQHHQSA-N 0 3 346.431 2.528 20 5 EFBDHN C[C@@H](C(=O)N1CC[C@@H](N2CCCC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000185170838 473351399 /nfs/dbraw/zinc/35/13/99/473351399.db2.gz FEWKSDJUTQJXHE-TZMCWYRMSA-N 0 3 335.379 2.534 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN[C@@H]1CCCC12CCOCC2 ZINC000619723171 479866431 /nfs/dbraw/zinc/86/64/31/479866431.db2.gz TVRBKSOGKYBSCU-OAHLLOKOSA-N 0 3 347.415 2.781 20 5 EFBDHN COc1cc(CN[C@@H](C)[C@@H]2CCOC2)c([N+](=O)[O-])cc1OC(F)F ZINC000162778560 473382445 /nfs/dbraw/zinc/38/24/45/473382445.db2.gz LAHRIRMRLMVGQM-VHSXEESVSA-N 0 3 346.330 2.719 20 5 EFBDHN Cn1c(CCNCc2cccc([N+](=O)[O-])c2)nc2c1cccc2F ZINC000113358744 473387784 /nfs/dbraw/zinc/38/77/84/473387784.db2.gz UUXRYZGKBVOHDK-UHFFFAOYSA-N 0 3 328.347 2.953 20 5 EFBDHN Cc1c(CN2CC[C@H]3[C@H](CCC(=O)N3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000125304993 473391116 /nfs/dbraw/zinc/39/11/16/473391116.db2.gz NVFFJICULGKUOK-QAPCUYQASA-N 0 3 343.427 2.879 20 5 EFBDHN CN(CCc1cccc([N+](=O)[O-])c1)C[C@H]1COc2ccccc2O1 ZINC000619785556 479885514 /nfs/dbraw/zinc/88/55/14/479885514.db2.gz LCVCTXASANOZFH-INIZCTEOSA-N 0 3 328.368 2.909 20 5 EFBDHN CC[C@H](CN1CCCC1)NC(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000616347365 479886063 /nfs/dbraw/zinc/88/60/63/479886063.db2.gz FFZMQBFNCRRPME-CQSZACIVSA-N 0 3 335.404 2.516 20 5 EFBDHN CN(C)CCOc1cccc(-c2noc(CCC(C)(C)[N+](=O)[O-])n2)c1 ZINC000297692309 475857025 /nfs/dbraw/zinc/85/70/25/475857025.db2.gz LYGXWWJNRZKASD-UHFFFAOYSA-N 0 3 348.403 2.665 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)CN1C[C@H](C)C[C@H](C)C1 ZINC000346954015 475986786 /nfs/dbraw/zinc/98/67/86/475986786.db2.gz MZERYEFBMOZZKK-VNHYZAJKSA-N 0 3 333.432 2.999 20 5 EFBDHN Cc1c(NC(=O)CCN2CC(C)(C)[C@@H]3COC[C@@H]32)cccc1[N+](=O)[O-] ZINC000452115008 476835339 /nfs/dbraw/zinc/83/53/39/476835339.db2.gz KCUXSQGKXZLBBU-CJNGLKHVSA-N 0 3 347.415 2.589 20 5 EFBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CNCCCC2(O)CCC2)c1 ZINC000421383567 478065852 /nfs/dbraw/zinc/06/58/52/478065852.db2.gz ZHXNIZOGJNHKIG-UHFFFAOYSA-N 0 3 330.331 2.981 20 5 EFBDHN CCOC(=O)[C@@H]1CCCC[C@@H]1NCc1cc([N+](=O)[O-])ccc1OC ZINC000451589714 478111136 /nfs/dbraw/zinc/11/11/36/478111136.db2.gz JKUIQIATOKGOHM-CABCVRRESA-N 0 3 336.388 2.815 20 5 EFBDHN COc1ccc(C(=O)N2CCCN(CC3CCC3)CC2)cc1[N+](=O)[O-] ZINC000619868443 479897954 /nfs/dbraw/zinc/89/79/54/479897954.db2.gz XRFUJQKOAWVXOL-UHFFFAOYSA-N 0 3 347.415 2.551 20 5 EFBDHN Cc1cc(N2C[C@@H](C)[S@](=O)[C@@H](C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000616394513 479898068 /nfs/dbraw/zinc/89/80/68/479898068.db2.gz AADZKPSGDCIGJB-DZTUZMMOSA-N 0 3 333.413 2.797 20 5 EFBDHN COc1ccc(C(=O)NCC(C)(C)N2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000054286922 472072894 /nfs/dbraw/zinc/07/28/94/472072894.db2.gz BFSGMJBTTIOTDF-CYBMUJFWSA-N 0 3 349.431 2.844 20 5 EFBDHN Cc1ncc([N+](=O)[O-])cc1C(=O)NCC(C)(C)N1CCC[C@@H](C)C1 ZINC000054286708 472072976 /nfs/dbraw/zinc/07/29/76/472072976.db2.gz XGFLFTIOVWLDOB-GFCCVEGCSA-N 0 3 334.420 2.539 20 5 EFBDHN C[C@@H]1CN(C[C@@H]2CCCN2Cc2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1 ZINC000067715156 472078052 /nfs/dbraw/zinc/07/80/52/472078052.db2.gz RCLKTGBCMQWZHI-RKVPGOIHSA-N 0 3 333.432 2.668 20 5 EFBDHN COc1ccc(CC(=O)NC[C@H](C)N2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000067813580 472092641 /nfs/dbraw/zinc/09/26/41/472092641.db2.gz MNFTWVLAPPHGFX-KBPBESRZSA-N 0 3 349.431 2.525 20 5 EFBDHN C[C@H]1CCC[C@@H](N(C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000026480161 472138349 /nfs/dbraw/zinc/13/83/49/472138349.db2.gz ADRGGEAYAOFZLO-DZGCQCFKSA-N 0 3 331.416 2.994 20 5 EFBDHN C[C@H]1CCC[C@H](N(C)CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000026473491 472139280 /nfs/dbraw/zinc/13/92/80/472139280.db2.gz HGAOXZYRGDGITK-RYUDHWBXSA-N 0 3 349.387 2.773 20 5 EFBDHN C[C@@H]1CCC[C@H](N(C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000026480168 472139319 /nfs/dbraw/zinc/13/93/19/472139319.db2.gz ADRGGEAYAOFZLO-HIFRSBDPSA-N 0 3 331.416 2.994 20 5 EFBDHN CN(Cc1cccc(F)c1)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000026712823 472145819 /nfs/dbraw/zinc/14/58/19/472145819.db2.gz LEOOWEJTNCJAMF-INIZCTEOSA-N 0 3 334.347 2.606 20 5 EFBDHN CN(C)CCN(Cc1cccs1)C(=O)c1ccccc1[N+](=O)[O-] ZINC000084251489 472160667 /nfs/dbraw/zinc/16/06/67/472160667.db2.gz SZYQGSLNKBPRKE-UHFFFAOYSA-N 0 3 333.413 2.860 20 5 EFBDHN C[C@@H](CNC(=O)CCOc1ccccc1[N+](=O)[O-])N1CCCC[C@@H]1C ZINC000055362649 472173270 /nfs/dbraw/zinc/17/32/70/472173270.db2.gz FEJSPPHWCZIMLV-GJZGRUSLSA-N 0 3 349.431 2.743 20 5 EFBDHN C[C@H](CN1CCCCC1)NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000027771862 472195751 /nfs/dbraw/zinc/19/57/51/472195751.db2.gz WTINYHRVYBSVFP-LLVKDONJSA-N 0 3 325.796 2.852 20 5 EFBDHN C[C@@H](CN1CCCCC1)NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000027771856 472195819 /nfs/dbraw/zinc/19/58/19/472195819.db2.gz WTINYHRVYBSVFP-NSHDSACASA-N 0 3 325.796 2.852 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)CN1C[C@H](C)C[C@@H](C)C1 ZINC000055749167 472233137 /nfs/dbraw/zinc/23/31/37/472233137.db2.gz PICYEPLVUWKUCX-MGPQQGTHSA-N 0 3 349.431 2.700 20 5 EFBDHN O=C(NCC1(N2CCSCC2)CCCC1)c1ccccc1[N+](=O)[O-] ZINC000029368529 472270742 /nfs/dbraw/zinc/27/07/42/472270742.db2.gz KYXUIXMDAVQWLU-UHFFFAOYSA-N 0 3 349.456 2.686 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)NCc1cccc(CN(C)C)c1 ZINC000043977655 472277456 /nfs/dbraw/zinc/27/74/56/472277456.db2.gz CFUUITPOGVMFKP-UHFFFAOYSA-N 0 3 343.383 2.595 20 5 EFBDHN CCOc1ccc(C(=O)N[C@H](C)CN2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000056240551 472297094 /nfs/dbraw/zinc/29/70/94/472297094.db2.gz FEOFPUIWRHJYDZ-UONOGXRCSA-N 0 3 349.431 2.844 20 5 EFBDHN CNc1ccc(C(=O)Nc2ccc(CN(C)C)cc2)cc1[N+](=O)[O-] ZINC000029952858 472307199 /nfs/dbraw/zinc/30/71/99/472307199.db2.gz OEORROKXWXEIKR-UHFFFAOYSA-N 0 3 328.372 2.950 20 5 EFBDHN C[C@H](CN1CCCCC1)NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000087133892 472309282 /nfs/dbraw/zinc/30/92/82/472309282.db2.gz VQTAKAPQCUYNEB-CQSZACIVSA-N 0 3 346.431 2.537 20 5 EFBDHN COc1ccc(CC(=O)NCC(C)(C)N2CCCCC2)cc1[N+](=O)[O-] ZINC000069365553 472330719 /nfs/dbraw/zinc/33/07/19/472330719.db2.gz ARDDVEBDMVBXRZ-UHFFFAOYSA-N 0 3 349.431 2.527 20 5 EFBDHN C[C@H](CN1CCC[C@@H](C)C1)NC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000056787828 472351958 /nfs/dbraw/zinc/35/19/58/472351958.db2.gz DOGNFRHJNUSRNZ-HUUCEWRRSA-N 0 3 348.447 2.857 20 5 EFBDHN C[C@@H](CNC(=O)NCc1ccc([N+](=O)[O-])cc1)N1CCC[C@H](C)C1 ZINC000057004843 472372990 /nfs/dbraw/zinc/37/29/90/472372990.db2.gz PGYBJYMDINXRQB-KBPBESRZSA-N 0 3 334.420 2.514 20 5 EFBDHN CN(CCn1ccc([N+](=O)[O-])n1)Cc1cccc(OC(F)(F)F)c1 ZINC000128098893 472400342 /nfs/dbraw/zinc/40/03/42/472400342.db2.gz LBWKGTZCILEYNL-UHFFFAOYSA-N 0 3 344.293 2.822 20 5 EFBDHN CN(C)Cc1ccc(C(=O)NCCc2cccc([N+](=O)[O-])c2)cc1 ZINC000089306286 472410495 /nfs/dbraw/zinc/41/04/95/472410495.db2.gz DTRZAQYXJVVZGT-UHFFFAOYSA-N 0 3 327.384 2.629 20 5 EFBDHN COc1ccc(C(=O)NC[C@H]2CCCCN2CC(C)C)cc1[N+](=O)[O-] ZINC000154330581 472419014 /nfs/dbraw/zinc/41/90/14/472419014.db2.gz GLXZNSQQAZWEHV-OAHLLOKOSA-N 0 3 349.431 2.844 20 5 EFBDHN CC(C)NC(=O)c1ccc(NCCN2CCCCC2)c([N+](=O)[O-])c1 ZINC000076921381 472424395 /nfs/dbraw/zinc/42/43/95/472424395.db2.gz FPOFZJZZISCYKH-UHFFFAOYSA-N 0 3 334.420 2.631 20 5 EFBDHN O=C1C[C@@H]([C@@H]2CCCCN2Cc2ccc([N+](=O)[O-])cc2Cl)CN1 ZINC000097082870 472436306 /nfs/dbraw/zinc/43/63/06/472436306.db2.gz IOAVQWGANKJWFZ-DOMZBBRYSA-N 0 3 337.807 2.739 20 5 EFBDHN CC(C)N1C[C@H](NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)[C@@H](C)C1 ZINC000154650863 472457399 /nfs/dbraw/zinc/45/73/99/472457399.db2.gz QYFSLOKWZODDBU-WFASDCNBSA-N 0 3 342.399 2.602 20 5 EFBDHN COc1ccc(C(=O)NC[C@@H](C)N2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000032732207 472458445 /nfs/dbraw/zinc/45/84/45/472458445.db2.gz VQQFTMFHGKAGNI-QWHCGFSZSA-N 0 3 335.404 2.596 20 5 EFBDHN CCc1ccc([C@H](CNC(=O)c2cc([N+](=O)[O-])cn2C)N(C)C)cc1 ZINC000032734197 472461768 /nfs/dbraw/zinc/46/17/68/472461768.db2.gz AHIGRWGCQUZYPT-KRWDZBQOSA-N 0 3 344.415 2.528 20 5 EFBDHN CCN(Cc1cccc(F)c1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000032771645 472465918 /nfs/dbraw/zinc/46/59/18/472465918.db2.gz RMLKFMJQDXCBER-QGZVFWFLSA-N 0 3 348.374 2.996 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)ccc1NC1CCN([C@@H]2CCOC2)CC1 ZINC000089602713 472468020 /nfs/dbraw/zinc/46/80/20/472468020.db2.gz PIVYTIYOIKCGLE-CYBMUJFWSA-N 0 3 325.796 2.913 20 5 EFBDHN CC(C)N(CCNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])C(C)C ZINC000089619498 472470767 /nfs/dbraw/zinc/47/07/67/472470767.db2.gz MIGODRPNKFJILG-UHFFFAOYSA-N 0 3 343.449 2.529 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC[C@H]1C[C@H](O)CN1Cc1ccccc1 ZINC000089643950 472476075 /nfs/dbraw/zinc/47/60/75/472476075.db2.gz QOEUEVYLKMTLPS-MSOLQXFVSA-N 0 3 341.411 2.951 20 5 EFBDHN O=[N+]([O-])c1ccc(CCN2CCC(c3nnc4n3CCC4)CC2)cc1 ZINC000058154130 472507388 /nfs/dbraw/zinc/50/73/88/472507388.db2.gz MEANDSHRLMDNKH-UHFFFAOYSA-N 0 3 341.415 2.555 20 5 EFBDHN COc1ccc([C@H](CNc2c([N+](=O)[O-])ncn2C)N2CCCC2)cc1 ZINC000070790741 472512113 /nfs/dbraw/zinc/51/21/13/472512113.db2.gz SVVXITWFSCYLPJ-HNNXBMFYSA-N 0 3 345.403 2.586 20 5 EFBDHN C[C@H](NCCC(=O)NCc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000129312874 472536570 /nfs/dbraw/zinc/53/65/70/472536570.db2.gz NTTBOUDHZQSTHI-AWEZNQCLSA-N 0 3 327.384 2.952 20 5 EFBDHN CN(CC1CCN(C)CC1)C(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000077563601 472556876 /nfs/dbraw/zinc/55/68/76/472556876.db2.gz VLVJBZGYVIRJGR-UHFFFAOYSA-N 0 3 325.796 2.662 20 5 EFBDHN O=[N+]([O-])c1cc(F)ccc1NC[C@@H](O)CN1CCc2ccccc2C1 ZINC000046479055 472562315 /nfs/dbraw/zinc/56/23/15/472562315.db2.gz URPLGGWHQDMGCU-MRXNPFEDSA-N 0 3 345.374 2.565 20 5 EFBDHN CN(C)CCOc1ccc(NC(=O)c2csc([N+](=O)[O-])c2)cc1 ZINC000046724066 472589528 /nfs/dbraw/zinc/58/95/28/472589528.db2.gz AMCKEZCWYARUJR-UHFFFAOYSA-N 0 3 335.385 2.849 20 5 EFBDHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1cccc([N+](=O)[O-])c1 ZINC000059001058 472620271 /nfs/dbraw/zinc/62/02/71/472620271.db2.gz HFHROZMBDSWDSF-UHFFFAOYSA-N 0 3 345.374 2.938 20 5 EFBDHN CCN(CCn1cc([N+](=O)[O-])ccc1=O)[C@H](C)c1cccc(OC)c1 ZINC000090519100 472628219 /nfs/dbraw/zinc/62/82/19/472628219.db2.gz PUWUEHVBHRETKM-CQSZACIVSA-N 0 3 345.399 2.848 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H](C(C)C)N1CCOCC1 ZINC000120092756 472629346 /nfs/dbraw/zinc/62/93/46/472629346.db2.gz JMHVACQSORKCQO-QAPCUYQASA-N 0 3 335.448 2.911 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCN1CCCC[C@H]1Cc1ccccc1 ZINC000090525168 472629709 /nfs/dbraw/zinc/62/97/09/472629709.db2.gz RXVMVBPTYZTORH-KRWDZBQOSA-N 0 3 341.411 2.854 20 5 EFBDHN CC[C@@H](NCCn1cc([N+](=O)[O-])cn1)c1ccc(OC)c(OC)c1 ZINC000090539200 472631446 /nfs/dbraw/zinc/63/14/46/472631446.db2.gz RWERDVRESIZFJS-CQSZACIVSA-N 0 3 334.376 2.549 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN[C@@H]2CC3(CCC3)Oc3ccccc32)c1 ZINC000090539960 472632113 /nfs/dbraw/zinc/63/21/13/472632113.db2.gz GMEHWGAYUKFHSU-OAHLLOKOSA-N 0 3 328.372 2.827 20 5 EFBDHN CC(C)(NCCn1cc([N+](=O)[O-])ccc1=O)c1ccc(Cl)cc1 ZINC000090554011 472634782 /nfs/dbraw/zinc/63/47/82/472634782.db2.gz NOHHOCYELOIHBO-UHFFFAOYSA-N 0 3 335.791 2.935 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[C@H]2CC[C@@H](C1)N2C ZINC000120175587 472643548 /nfs/dbraw/zinc/64/35/48/472643548.db2.gz BNNJERZWACVIHP-KGLIPLIRSA-N 0 3 332.404 2.912 20 5 EFBDHN C[C@@H]1CN(CC2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)C[C@@H](C)O1 ZINC000060368425 472648387 /nfs/dbraw/zinc/64/83/87/472648387.db2.gz PVLLLDFUULJZQQ-HZPDHXFCSA-N 0 3 347.459 2.916 20 5 EFBDHN CC1CCN(CCNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000047119926 472656934 /nfs/dbraw/zinc/65/69/34/472656934.db2.gz PXZVKDVHTYEZFD-UHFFFAOYSA-N 0 3 325.796 2.710 20 5 EFBDHN CCO[C@H]1CCCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000156058170 472661026 /nfs/dbraw/zinc/66/10/26/472661026.db2.gz NPFMCGIPKUWKDN-HNNXBMFYSA-N 0 3 335.404 2.733 20 5 EFBDHN C[C@H]1C[C@H](Nc2ncc(Br)cc2[N+](=O)[O-])CN1C1CC1 ZINC000131309925 472663141 /nfs/dbraw/zinc/66/31/41/472663141.db2.gz JUBZCYXPDBBQOE-WPRPVWTQSA-N 0 3 341.209 2.789 20 5 EFBDHN CN(CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H]1CCCO1 ZINC000104683392 472683665 /nfs/dbraw/zinc/68/36/65/472683665.db2.gz CGJLDKAEKGRHMB-OAHLLOKOSA-N 0 3 331.372 2.903 20 5 EFBDHN Cn1cnc([N+](=O)[O-])c1NC[C@@H]1CCCN(C)[C@@H]1c1cccs1 ZINC000078338063 472698853 /nfs/dbraw/zinc/69/88/53/472698853.db2.gz HTKSTDQPXAFBTP-AAEUAGOBSA-N 0 3 335.433 2.885 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCCN[C@]2(CO)CCc3ccccc32)cc1 ZINC000132524173 472738953 /nfs/dbraw/zinc/73/89/53/472738953.db2.gz OHGYHZMPYFHIIZ-IBGZPJMESA-N 0 3 342.395 2.787 20 5 EFBDHN CN(C[C@@H]1CCN(Cc2ccccc2)C1)c1ncccc1[N+](=O)[O-] ZINC000078674863 472752024 /nfs/dbraw/zinc/75/20/24/472752024.db2.gz AGAQDXXRNFEPCD-INIZCTEOSA-N 0 3 326.400 2.948 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(NC[C@@H]2CCCN(C)C2)cc1Cl ZINC000091482759 472772141 /nfs/dbraw/zinc/77/21/41/472772141.db2.gz ZZFYKOPDJPJXPT-JTQLQIEISA-N 0 3 341.795 2.789 20 5 EFBDHN CCN(CC)[C@H](CNc1c([N+](=O)[O-])ncn1C)c1cccc(OC)c1 ZINC000073109529 472773607 /nfs/dbraw/zinc/77/36/07/472773607.db2.gz BRRVJCDWFBYJLF-OAHLLOKOSA-N 0 3 347.419 2.832 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N(C)[C@H]2CCN(C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000120998936 472780371 /nfs/dbraw/zinc/78/03/71/472780371.db2.gz CSZIHUSJHDUTTI-DZKIICNBSA-N 0 3 348.447 2.946 20 5 EFBDHN Cc1c(CC(=O)N2CCN(C3CCCCC3)CC2)cccc1[N+](=O)[O-] ZINC000133269695 472786123 /nfs/dbraw/zinc/78/61/23/472786123.db2.gz TWIAPWKLXAAEEW-UHFFFAOYSA-N 0 3 345.443 2.923 20 5 EFBDHN NC(=O)[C@@H]1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000157135798 472789338 /nfs/dbraw/zinc/78/93/38/472789338.db2.gz NPPPSVZCPAEGIC-LLVKDONJSA-N 0 3 331.397 2.631 20 5 EFBDHN NC(=O)[C@H]1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000157135639 472789359 /nfs/dbraw/zinc/78/93/59/472789359.db2.gz NPPPSVZCPAEGIC-NSHDSACASA-N 0 3 331.397 2.631 20 5 EFBDHN CC(C)c1nc2n(n1)C[C@@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000105873924 472793589 /nfs/dbraw/zinc/79/35/89/472793589.db2.gz ZNHHKZHYCJUJMW-JSGCOSHPSA-N 0 3 329.404 2.975 20 5 EFBDHN CSc1ccc(C(=O)N2CCC[C@@H]3CN(C)CC[C@@H]32)cc1[N+](=O)[O-] ZINC000157203960 472795177 /nfs/dbraw/zinc/79/51/77/472795177.db2.gz PMRUSLNELAIKJD-KGLIPLIRSA-N 0 3 349.456 2.873 20 5 EFBDHN C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000121129761 472803666 /nfs/dbraw/zinc/80/36/66/472803666.db2.gz AKJQYBOTMCFGCB-HZMBPMFUSA-N 0 3 325.796 2.660 20 5 EFBDHN C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000121149063 472807148 /nfs/dbraw/zinc/80/71/48/472807148.db2.gz KYFPCEHUGADUFJ-MFKMUULPSA-N 0 3 325.796 2.660 20 5 EFBDHN C[C@@H](CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)N1CCC[C@H](C)C1 ZINC000063810620 472816236 /nfs/dbraw/zinc/81/62/36/472816236.db2.gz QRTCPZYGDUGHDH-STQMWFEESA-N 0 3 344.415 2.926 20 5 EFBDHN CN(C)Cc1ccccc1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000048169150 472824093 /nfs/dbraw/zinc/82/40/93/472824093.db2.gz IJGPMLSKHQCIED-UHFFFAOYSA-N 0 3 339.355 2.785 20 5 EFBDHN Cc1c(NC(=O)CCN(C)CCc2nccs2)cccc1[N+](=O)[O-] ZINC000158018640 472883217 /nfs/dbraw/zinc/88/32/17/472883217.db2.gz SRILLIZWTWORLU-UHFFFAOYSA-N 0 3 348.428 2.863 20 5 EFBDHN Cn1cnc([N+](=O)[O-])c1NC[C@H]1CCCN(Cc2ccccc2)C1 ZINC000065202172 472907226 /nfs/dbraw/zinc/90/72/26/472907226.db2.gz JXGMFBZJDNTMQX-OAHLLOKOSA-N 0 3 329.404 2.652 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CCCCC[C@@H]2C[C@H](O)c2ccco2)n1 ZINC000121842006 472927263 /nfs/dbraw/zinc/92/72/63/472927263.db2.gz PKLIWKHQQAJDEI-CABCVRRESA-N 0 3 348.403 2.753 20 5 EFBDHN C[C@H]1CCCN(CCNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C1 ZINC000079914682 472941458 /nfs/dbraw/zinc/94/14/58/472941458.db2.gz SGWOASITEXCXOV-ZDUSSCGKSA-N 0 3 346.431 2.631 20 5 EFBDHN Cc1ccc([C@H](CNC(=O)Cc2ccc([N+](=O)[O-])cc2)N(C)C)cc1 ZINC000049407639 472948459 /nfs/dbraw/zinc/94/84/59/472948459.db2.gz WSRMTCABTLSQEX-SFHVURJKSA-N 0 3 341.411 2.865 20 5 EFBDHN Cc1ccc([C@@H](CNC(=O)Cc2ccc([N+](=O)[O-])cc2)N(C)C)cc1 ZINC000049407637 472948828 /nfs/dbraw/zinc/94/88/28/472948828.db2.gz WSRMTCABTLSQEX-GOSISDBHSA-N 0 3 341.411 2.865 20 5 EFBDHN COc1ccc(C(=O)N(CC(C)C)C2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000074139637 472950463 /nfs/dbraw/zinc/95/04/63/472950463.db2.gz IUBWIOXCFGUJDO-UHFFFAOYSA-N 0 3 349.431 2.796 20 5 EFBDHN C[C@H](CN1CCCCC1)NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000079985121 472953471 /nfs/dbraw/zinc/95/34/71/472953471.db2.gz XHPIRSVEHAEHAI-ZIAGYGMSSA-N 0 3 334.420 2.829 20 5 EFBDHN CCOc1cc(N(CCN(C)C)Cc2ccccn2)ccc1[N+](=O)[O-] ZINC000092686578 472963563 /nfs/dbraw/zinc/96/35/63/472963563.db2.gz DHUFLITUBWPLDK-UHFFFAOYSA-N 0 3 344.415 2.957 20 5 EFBDHN CCCCN(C)CCNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000080138803 472982752 /nfs/dbraw/zinc/98/27/52/472982752.db2.gz BNBJIYCPJIDIKI-UHFFFAOYSA-N 0 3 336.436 2.861 20 5 EFBDHN CC(C)C[C@H](CN[C@@H](C)c1cccc([N+](=O)[O-])c1)N1CCOCC1 ZINC000122254003 472993500 /nfs/dbraw/zinc/99/35/00/472993500.db2.gz ZNUVCQUDOXDFRU-MAUKXSAKSA-N 0 3 335.448 2.992 20 5 EFBDHN CCc1nn(C)c(N2CCCN(Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000092827612 472994975 /nfs/dbraw/zinc/99/49/75/472994975.db2.gz LZSQVBOVDYLVBO-UHFFFAOYSA-N 0 3 343.431 2.603 20 5 EFBDHN C[C@@H]1C[C@@H](Nc2c([N+](=O)[O-])ncn2C)CCN1Cc1ccccc1 ZINC000080230977 472998710 /nfs/dbraw/zinc/99/87/10/472998710.db2.gz BYTALFDAEMGYCB-HIFRSBDPSA-N 0 3 329.404 2.793 20 5 EFBDHN COC1CCN(CCNc2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000080250785 473004195 /nfs/dbraw/zinc/00/41/95/473004195.db2.gz XXUBVYTXKZPMEY-UHFFFAOYSA-N 0 3 345.346 2.719 20 5 EFBDHN CCN(CC)Cc1cccc(NC(=O)CCn2cc([N+](=O)[O-])cn2)c1 ZINC000065777761 473008685 /nfs/dbraw/zinc/00/86/85/473008685.db2.gz QZCVTDIQKAIONB-UHFFFAOYSA-N 0 3 345.403 2.662 20 5 EFBDHN CN(C)[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000122610618 473036961 /nfs/dbraw/zinc/03/69/61/473036961.db2.gz TVCJPDHDOWJFDI-KRWDZBQOSA-N 0 3 345.374 2.696 20 5 EFBDHN O=C(NCCN1CCCC1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000051468365 473051571 /nfs/dbraw/zinc/05/15/71/473051571.db2.gz NQRDDBXLGSLNJR-UHFFFAOYSA-N 0 3 346.412 2.544 20 5 EFBDHN Cc1ccc(C[C@@H]2CCCN2CCn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC000159826074 473065099 /nfs/dbraw/zinc/06/50/99/473065099.db2.gz UWMWZMWBKZRKQH-KRWDZBQOSA-N 0 3 341.411 2.772 20 5 EFBDHN COc1ccc(OCCN2CCC[C@@H]2CSC)c([N+](=O)[O-])c1 ZINC000135449405 473074724 /nfs/dbraw/zinc/07/47/24/473074724.db2.gz FDCPQKGHDJZUIO-GFCCVEGCSA-N 0 3 326.418 2.810 20 5 EFBDHN Cc1cncc(CNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000123032710 473088883 /nfs/dbraw/zinc/08/88/83/473088883.db2.gz RBJHKRVESYRGTD-UHFFFAOYSA-N 0 3 337.383 2.989 20 5 EFBDHN CCC[C@H](N[C@H]1CCc2nc(C)nn2C1)c1cccc([N+](=O)[O-])c1 ZINC000160453494 473126895 /nfs/dbraw/zinc/12/68/95/473126895.db2.gz JUVAEAVXMQDAMZ-HOCLYGCPSA-N 0 3 329.404 2.941 20 5 EFBDHN CN(C)Cc1cccc(C(=O)NCCc2ccccc2[N+](=O)[O-])c1 ZINC000075158462 473141942 /nfs/dbraw/zinc/14/19/42/473141942.db2.gz UWEXUWYTOWVXAX-UHFFFAOYSA-N 0 3 327.384 2.629 20 5 EFBDHN C[C@H](CNC(=O)c1cccc([N+](=O)[O-])c1)N(C)Cc1ccccc1 ZINC000110350851 473152914 /nfs/dbraw/zinc/15/29/14/473152914.db2.gz SPZSTFQFCZIZHH-CQSZACIVSA-N 0 3 327.384 2.845 20 5 EFBDHN CN(Cc1ccccc1)[C@H]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000081125901 473153003 /nfs/dbraw/zinc/15/30/03/473153003.db2.gz BIGABNRLYKTHOC-SFHVURJKSA-N 0 3 339.395 2.941 20 5 EFBDHN C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1)N(C)Cc1ccccc1 ZINC000110355764 473154393 /nfs/dbraw/zinc/15/43/93/473154393.db2.gz HEJQQAUVOSQLSR-AWEZNQCLSA-N 0 3 327.384 2.845 20 5 EFBDHN Cn1cc(C[C@@H]2CCN(C/C=C/c3ccccc3[N+](=O)[O-])C2)cn1 ZINC000093869997 473154962 /nfs/dbraw/zinc/15/49/62/473154962.db2.gz FMDRCLSNFNMVES-DRDHIDPGSA-N 0 3 326.400 2.906 20 5 EFBDHN CCN1CCN(CCNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000160739558 473168484 /nfs/dbraw/zinc/16/84/84/473168484.db2.gz OAJQLAYVIAFRGC-UHFFFAOYSA-N 0 3 346.353 2.663 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCN(CC2CCCC2)C1 ZINC000081290100 473177383 /nfs/dbraw/zinc/17/73/83/473177383.db2.gz VYOPJFILIRSSJR-AWEZNQCLSA-N 0 3 347.415 2.598 20 5 EFBDHN CN(CCOc1ccc(F)cc1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136868040 473181710 /nfs/dbraw/zinc/18/17/10/473181710.db2.gz KDNFTQMPDNULEB-QGZVFWFLSA-N 0 3 334.347 2.778 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(F)c([N+](=O)[O-])cc1F ZINC000160878453 473186938 /nfs/dbraw/zinc/18/69/38/473186938.db2.gz RUZMJXDGTDNKBJ-MNOVXSKESA-N 0 3 339.342 2.572 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCN1CCN(C2CCCCC2)CC1 ZINC000163010514 473405427 /nfs/dbraw/zinc/40/54/27/473405427.db2.gz GORSALADZIBBEP-UHFFFAOYSA-N 0 3 333.432 2.924 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CN2CCCc3ccccc3C2)c1 ZINC000171595247 473417949 /nfs/dbraw/zinc/41/79/49/473417949.db2.gz JTEJQGHKZSLHJJ-SFHVURJKSA-N 0 3 342.395 2.783 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@H]1CCCN(C)C1 ZINC000185410429 473419713 /nfs/dbraw/zinc/41/97/13/473419713.db2.gz VKXDDXILFUTQLE-RDJZCZTQSA-N 0 3 333.432 2.716 20 5 EFBDHN C[C@@H](NC(=O)N(C)CC1CCN(C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000171743460 473449483 /nfs/dbraw/zinc/44/94/83/473449483.db2.gz FRYBKMZUBXVWEX-CYBMUJFWSA-N 0 3 334.420 2.639 20 5 EFBDHN O=C(NC[C@@H]1CCCN1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000114644711 473488759 /nfs/dbraw/zinc/48/87/59/473488759.db2.gz JMLLMYGQWSUSQM-SFHVURJKSA-N 0 3 339.395 2.989 20 5 EFBDHN C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000126100427 473489078 /nfs/dbraw/zinc/48/90/78/473489078.db2.gz FGEHPMZTDFKWJW-PBHICJAKSA-N 0 3 348.447 2.586 20 5 EFBDHN O=[N+]([O-])c1cc(CNC2CCC(O)(c3cccnc3)CC2)cs1 ZINC000185692772 473489675 /nfs/dbraw/zinc/48/96/75/473489675.db2.gz OXZOIOYKJPKUDC-UHFFFAOYSA-N 0 3 333.413 2.971 20 5 EFBDHN Cc1c([C@H](C)NC[C@@H]2CN(CC(C)C)CCO2)cccc1[N+](=O)[O-] ZINC000178330592 473492184 /nfs/dbraw/zinc/49/21/84/473492184.db2.gz MCVWTFANVXWQQF-JKSUJKDBSA-N 0 3 335.448 2.911 20 5 EFBDHN Cc1ccc([C@@H](C)NC[C@@H]2CN(CC(C)C)CCO2)cc1[N+](=O)[O-] ZINC000178329792 473492232 /nfs/dbraw/zinc/49/22/32/473492232.db2.gz LRDXTICJSQMVLE-NVXWUHKLSA-N 0 3 335.448 2.911 20 5 EFBDHN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)Nc1ccn(CCN(C)C)n1 ZINC000191356058 473530450 /nfs/dbraw/zinc/53/04/50/473530450.db2.gz VILWCUNJDWFKIW-UHFFFAOYSA-N 0 3 346.391 2.614 20 5 EFBDHN CCCCCN(CCO)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000126865136 473553374 /nfs/dbraw/zinc/55/33/74/473553374.db2.gz DSCJRFQXZSUEIX-UHFFFAOYSA-N 0 3 346.431 2.980 20 5 EFBDHN CC[C@@H]1CCCCN1CCNC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000172256521 473563274 /nfs/dbraw/zinc/56/32/74/473563274.db2.gz LDKRFQKNQGWVML-OAHLLOKOSA-N 0 3 334.420 2.659 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@@H](CO)Cc1ccccc1 ZINC000152688063 473589518 /nfs/dbraw/zinc/58/95/18/473589518.db2.gz VGAVTKGEILDDCA-MRXNPFEDSA-N 0 3 330.384 2.687 20 5 EFBDHN CCC[C@H](N[C@@H](C)CCS(C)(=O)=O)c1cccc([N+](=O)[O-])c1 ZINC000127307143 473598800 /nfs/dbraw/zinc/59/88/00/473598800.db2.gz MRRMGXQUKBYFCS-WFASDCNBSA-N 0 3 328.434 2.849 20 5 EFBDHN Cc1cccc(C(=O)N2CCCN(C3CCCC3)CC2)c1[N+](=O)[O-] ZINC000172416326 473604547 /nfs/dbraw/zinc/60/45/47/473604547.db2.gz RAAXRRPBORAGAI-UHFFFAOYSA-N 0 3 331.416 2.994 20 5 EFBDHN O=C1C[C@@H](CNCc2ccccc2[N+](=O)[O-])CN1Cc1ccccc1 ZINC000179050874 473618669 /nfs/dbraw/zinc/61/86/69/473618669.db2.gz MHFFHCRGTKVTSX-INIZCTEOSA-N 0 3 339.395 2.733 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC(Cn2cncn2)CC1 ZINC000186228618 473622472 /nfs/dbraw/zinc/62/24/72/473622472.db2.gz ZNRRGIIHBBDZIL-CQSZACIVSA-N 0 3 329.404 2.968 20 5 EFBDHN CC(C)C[C@H]1OCCC[C@H]1NCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000186340035 473654684 /nfs/dbraw/zinc/65/46/84/473654684.db2.gz RSTAYKLOAQVTEM-GDBMZVCRSA-N 0 3 335.404 2.717 20 5 EFBDHN CN(CCc1ccc(Cl)cc1)CCn1cc([N+](=O)[O-])ccc1=O ZINC000179214645 473655461 /nfs/dbraw/zinc/65/54/61/473655461.db2.gz GYZONJVIXYIVIP-UHFFFAOYSA-N 0 3 335.791 2.584 20 5 EFBDHN C[C@@H]1C[C@@H](N(C)C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)CCN1C ZINC000127871374 473659085 /nfs/dbraw/zinc/65/90/85/473659085.db2.gz HUALABBIGQRZSR-NEPJUHHUSA-N 0 3 330.388 2.631 20 5 EFBDHN CCO[C@@H]1C[C@](CO)(NC/C=C/c2ccccc2[N+](=O)[O-])C1(C)C ZINC000186580312 473693403 /nfs/dbraw/zinc/69/34/03/473693403.db2.gz GMWCLIUQZVIRAL-XPAKDJPHSA-N 0 3 334.416 2.764 20 5 EFBDHN C[C@@H]1CCCC[C@H]1N(C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000192632126 473697863 /nfs/dbraw/zinc/69/78/63/473697863.db2.gz NFFXHKXVLGHQKD-CZUORRHYSA-N 0 3 331.416 2.994 20 5 EFBDHN O=C(CCN[C@H]1CCCc2ccc([N+](=O)[O-])cc21)N1CCCCC1 ZINC000192693218 473705550 /nfs/dbraw/zinc/70/55/50/473705550.db2.gz UIEUVODQDKZQQT-KRWDZBQOSA-N 0 3 331.416 2.964 20 5 EFBDHN CC(C)(C(=O)NC[C@@H](N)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000269173562 473718354 /nfs/dbraw/zinc/71/83/54/473718354.db2.gz KMDVYJCIMKTODF-MRXNPFEDSA-N 0 3 327.384 2.689 20 5 EFBDHN COc1cccc([C@H](CNc2cc(N)ccc2[N+](=O)[O-])N(C)C)c1 ZINC000192765032 473720731 /nfs/dbraw/zinc/72/07/31/473720731.db2.gz UCFQBXIVMKNEAU-KRWDZBQOSA-N 0 3 330.388 2.900 20 5 EFBDHN CCOc1ccc([C@H](C)NCCC2(O)CCOCC2)cc1[N+](=O)[O-] ZINC000287654648 473725332 /nfs/dbraw/zinc/72/53/32/473725332.db2.gz VEDCRPAQNQDHSF-ZDUSSCGKSA-N 0 3 338.404 2.576 20 5 EFBDHN CC(=O)c1cc([N+](=O)[O-])ccc1NCCCN1CCCO[C@@H](C)C1 ZINC000287680547 473732001 /nfs/dbraw/zinc/73/20/01/473732001.db2.gz JLKMWMGPFQQSRR-ZDUSSCGKSA-N 0 3 335.404 2.710 20 5 EFBDHN Cc1cnc(COC(=O)C2CCN(C3CC3)CC2)c(C)c1[N+](=O)[O-] ZINC000192888683 473741861 /nfs/dbraw/zinc/74/18/61/473741861.db2.gz NSKQTGBZDWBOMC-UHFFFAOYSA-N 0 3 333.388 2.524 20 5 EFBDHN C[S@](=O)C1(CNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000281511780 473747239 /nfs/dbraw/zinc/74/72/39/473747239.db2.gz ABOQNGMQYSOAGE-QHCPKHFHSA-N 0 3 334.397 2.856 20 5 EFBDHN COc1ccc(CNC(=O)[C@@H](C)[C@H](N)c2ccccc2)cc1[N+](=O)[O-] ZINC000269259283 473752741 /nfs/dbraw/zinc/75/27/41/473752741.db2.gz QEEPLGPYINFIJE-SJCJKPOMSA-N 0 3 343.383 2.556 20 5 EFBDHN COc1ccc(CNC(=O)[C@H](C)[C@@H](N)c2ccccc2)cc1[N+](=O)[O-] ZINC000269259287 473753417 /nfs/dbraw/zinc/75/34/17/473753417.db2.gz QEEPLGPYINFIJE-SJKOYZFVSA-N 0 3 343.383 2.556 20 5 EFBDHN COc1cc(CN2CC[C@H](N3CCCCC3)C2)c([N+](=O)[O-])cc1F ZINC000274345890 473790640 /nfs/dbraw/zinc/79/06/40/473790640.db2.gz VUAURKHWXBRUJY-AWEZNQCLSA-N 0 3 337.395 2.803 20 5 EFBDHN Cc1ccccc1[C@H]1CCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000263691249 473806885 /nfs/dbraw/zinc/80/68/85/473806885.db2.gz JUTKZAFNDVFBLA-HNNXBMFYSA-N 0 3 339.395 2.992 20 5 EFBDHN Cc1ccccc1[C@@H]1CCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000263691255 473807409 /nfs/dbraw/zinc/80/74/09/473807409.db2.gz JUTKZAFNDVFBLA-OAHLLOKOSA-N 0 3 339.395 2.992 20 5 EFBDHN CN1C[C@@H](NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1=O ZINC000263741396 473829315 /nfs/dbraw/zinc/82/93/15/473829315.db2.gz NRAQFBQTQPIJAH-NSHDSACASA-N 0 3 331.397 2.644 20 5 EFBDHN CC(C)(O)CN(Cc1ccccc1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000180223645 473832469 /nfs/dbraw/zinc/83/24/69/473832469.db2.gz SBZNVEWOMGMEPD-SFHVURJKSA-N 0 3 344.411 2.901 20 5 EFBDHN CCN(CCNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000263770393 473842201 /nfs/dbraw/zinc/84/22/01/473842201.db2.gz SRBDINUHYPNKAL-UHFFFAOYSA-N 0 3 326.784 2.854 20 5 EFBDHN CCn1c(C)nc([N+](=O)[O-])c1NCc1ccc(OCCN(C)C)cc1 ZINC000288093321 473846001 /nfs/dbraw/zinc/84/60/01/473846001.db2.gz IYFRCQBNTUEQKN-UHFFFAOYSA-N 0 3 347.419 2.672 20 5 EFBDHN CCN1CCN(c2cccc(Nc3c([N+](=O)[O-])c(C)nn3C)c2)CC1 ZINC000274490151 473847857 /nfs/dbraw/zinc/84/78/57/473847857.db2.gz PTJCLKORDYXXPN-UHFFFAOYSA-N 0 3 344.419 2.522 20 5 EFBDHN COCCN(CCc1ccccc1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000269649126 473849758 /nfs/dbraw/zinc/84/97/58/473849758.db2.gz LRZURHBAEZOJPM-IBGZPJMESA-N 0 3 344.411 2.819 20 5 EFBDHN C[C@H](NC[C@@H](O)COc1ccccc1F)c1cccc([N+](=O)[O-])c1 ZINC000180393148 473865742 /nfs/dbraw/zinc/86/57/42/473865742.db2.gz AFGAAVKLGMIZLN-SWLSCSKDSA-N 0 3 334.347 2.824 20 5 EFBDHN CN(C)CCN(C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000187415353 473870032 /nfs/dbraw/zinc/87/00/32/473870032.db2.gz QMSGLJVUBKCHRD-UHFFFAOYSA-N 0 3 326.784 2.806 20 5 EFBDHN C[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)c1cccc([N+](=O)[O-])c1 ZINC000180426004 473875570 /nfs/dbraw/zinc/87/55/70/473875570.db2.gz KJUQWLHOMLAVRD-ZBEGNZNMSA-N 0 3 331.328 2.887 20 5 EFBDHN Cc1ccccc1OC[C@@H](O)CN[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180435918 473876488 /nfs/dbraw/zinc/87/64/88/473876488.db2.gz KIFOWHMDYUPPDD-YOEHRIQHSA-N 0 3 330.384 2.994 20 5 EFBDHN C[C@H](NC[C@H](O)COCc1ccccc1F)c1cccc([N+](=O)[O-])c1 ZINC000180443715 473879106 /nfs/dbraw/zinc/87/91/06/473879106.db2.gz FQTNOOAVONOHKR-GUYCJALGSA-N 0 3 348.374 2.962 20 5 EFBDHN CN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000246532619 473892777 /nfs/dbraw/zinc/89/27/77/473892777.db2.gz GEUIUSQJXSJESX-NHYWBVRUSA-N 0 3 337.807 2.805 20 5 EFBDHN CC(C)N1CCCN(C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CC1 ZINC000263908970 473902251 /nfs/dbraw/zinc/90/22/51/473902251.db2.gz IWZPCCUNVZUSNP-UHFFFAOYSA-N 0 3 330.388 2.632 20 5 EFBDHN CS[C@H]1CN(c2ncc(Cl)cc2[N+](=O)[O-])C[C@H]1N1CCCC1 ZINC000274634963 473904618 /nfs/dbraw/zinc/90/46/18/473904618.db2.gz CXIGUIKKXAKKFQ-OLZOCXBDSA-N 0 3 342.852 2.659 20 5 EFBDHN CS[C@H]1CN(c2ncc(Cl)cc2[N+](=O)[O-])C[C@@H]1N1CCCC1 ZINC000274634965 473905125 /nfs/dbraw/zinc/90/51/25/473905125.db2.gz CXIGUIKKXAKKFQ-STQMWFEESA-N 0 3 342.852 2.659 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CNC2(c3ccccc3)CC2)c1 ZINC000264006835 473936472 /nfs/dbraw/zinc/93/64/72/473936472.db2.gz QJNUTEBKESKRNP-MRXNPFEDSA-N 0 3 328.368 2.613 20 5 EFBDHN C[C@H]1Cc2ccccc2CN1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000246738471 473946576 /nfs/dbraw/zinc/94/65/76/473946576.db2.gz MNWLVIFHRQXYIN-KBXCAEBGSA-N 0 3 342.395 2.781 20 5 EFBDHN C[C@H]1C[C@H](N2CCCC2)CN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000288485874 473957144 /nfs/dbraw/zinc/95/71/44/473957144.db2.gz RFVLSGUNIYLELI-JSGCOSHPSA-N 0 3 342.399 2.775 20 5 EFBDHN CN(CCOCC(F)(F)C(F)F)CCc1cccc([N+](=O)[O-])c1 ZINC000282338792 474027956 /nfs/dbraw/zinc/02/79/56/474027956.db2.gz BRFPPXMRBUIXCG-UHFFFAOYSA-N 0 3 338.301 2.986 20 5 EFBDHN O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CC[C@@H](N2CCCCC2)C1 ZINC000264543945 474030940 /nfs/dbraw/zinc/03/09/40/474030940.db2.gz OBPDLIVBRFNLBR-ROJDOSBLSA-N 0 3 329.400 2.695 20 5 EFBDHN O=C1CCc2cc([N+](=O)[O-])c(N3CC[C@@H](N4CCCCC4)C3)cc2N1 ZINC000264543379 474031863 /nfs/dbraw/zinc/03/18/63/474031863.db2.gz BCZWMNPNJVDVJM-CQSZACIVSA-N 0 3 344.415 2.544 20 5 EFBDHN CN(CCc1cccc([N+](=O)[O-])c1)C[C@H](O)COc1ccccc1F ZINC000282381677 474043756 /nfs/dbraw/zinc/04/37/56/474043756.db2.gz GALPMIRPPQZCPT-INIZCTEOSA-N 0 3 348.374 2.648 20 5 EFBDHN C[C@@H](NC(=O)N1CC[C@H](N2CCCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000264584572 474048618 /nfs/dbraw/zinc/04/86/18/474048618.db2.gz KIKZMCOPFHDRSD-PBHICJAKSA-N 0 3 346.431 2.926 20 5 EFBDHN C[C@H](NC(=O)N1CC[C@H](N2CCCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000264584578 474048960 /nfs/dbraw/zinc/04/89/60/474048960.db2.gz KIKZMCOPFHDRSD-YOEHRIQHSA-N 0 3 346.431 2.926 20 5 EFBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[C@H](C(=O)NCC(F)(F)F)C1 ZINC000275141883 474084636 /nfs/dbraw/zinc/08/46/36/474084636.db2.gz VLXKHNFUHITFRM-QWRGUYRKSA-N 0 3 345.321 2.656 20 5 EFBDHN Cc1cc(CN(C)C)cc(NC(=O)COc2ccccc2[N+](=O)[O-])c1 ZINC000270370743 474094331 /nfs/dbraw/zinc/09/43/31/474094331.db2.gz JTMQYNBIDOECIJ-UHFFFAOYSA-N 0 3 343.383 2.982 20 5 EFBDHN O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000198152799 474104634 /nfs/dbraw/zinc/10/46/34/474104634.db2.gz AUQUJOFKIAIORX-KRWDZBQOSA-N 0 3 339.395 2.528 20 5 EFBDHN CN(CCc1cccc([N+](=O)[O-])c1)C[C@H](O)COc1ccccc1 ZINC000282549196 474107310 /nfs/dbraw/zinc/10/73/10/474107310.db2.gz XAUFUNMASSBYCQ-KRWDZBQOSA-N 0 3 330.384 2.509 20 5 EFBDHN CCC(CC)(CC)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000182188221 474119506 /nfs/dbraw/zinc/11/95/06/474119506.db2.gz GMMKMTXECXNDIZ-UHFFFAOYSA-N 0 3 328.434 2.927 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000264774860 474123144 /nfs/dbraw/zinc/12/31/44/474123144.db2.gz VSLRSAPPSIJHBR-GFCCVEGCSA-N 0 3 325.796 2.852 20 5 EFBDHN O=[N+]([O-])c1cc(CN[C@@H]2CCCC23CCOCC3)c2c(c1)COCO2 ZINC000282648122 474142647 /nfs/dbraw/zinc/14/26/47/474142647.db2.gz KXGQMUKCAWJLJD-MRXNPFEDSA-N 0 3 348.399 2.900 20 5 EFBDHN CN(CCc1ccc([N+](=O)[O-])cc1)C[C@H](O)COCc1ccccc1 ZINC000265017925 474164524 /nfs/dbraw/zinc/16/45/24/474164524.db2.gz IMFOAQSYIVOSGL-IBGZPJMESA-N 0 3 344.411 2.647 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000282733577 474172617 /nfs/dbraw/zinc/17/26/17/474172617.db2.gz LJFNCCXTPHOBLS-KRWDZBQOSA-N 0 3 348.447 2.653 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000282733580 474172703 /nfs/dbraw/zinc/17/27/03/474172703.db2.gz LJFNCCXTPHOBLS-QGZVFWFLSA-N 0 3 348.447 2.653 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CNC1(c2cccc(F)c2)CC1 ZINC000182430384 474174355 /nfs/dbraw/zinc/17/43/55/474174355.db2.gz FGIXZHDYAGOJAN-OAHLLOKOSA-N 0 3 346.358 2.753 20 5 EFBDHN CCN(CCOCCO)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000282754155 474179768 /nfs/dbraw/zinc/17/97/68/474179768.db2.gz OHXXQZSDEHBSSU-UHFFFAOYSA-N 0 3 334.372 2.686 20 5 EFBDHN COc1cc(C[NH2+][C@@H]2CCO[C@@H](C(C)(C)C)C2)c([N+](=O)[O-])cc1[O-] ZINC000270601115 474185638 /nfs/dbraw/zinc/18/56/38/474185638.db2.gz ARVNIZFQUSCLNG-MLGOLLRUSA-N 0 3 338.404 2.992 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2noc([C@@H]3CCCN3C3CCOCC3)n2)cc1 ZINC000275502497 474211742 /nfs/dbraw/zinc/21/17/42/474211742.db2.gz CCYCZTHRCQRIFE-HNNXBMFYSA-N 0 3 344.371 2.961 20 5 EFBDHN O=C(NCCN1CCCCCC1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175416799 474213264 /nfs/dbraw/zinc/21/32/64/474213264.db2.gz FTCWYTOUJLOMPQ-UHFFFAOYSA-N 0 3 325.796 2.854 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(N2C[C@@H](N3CCCC3)[C@@H](SC)C2)c1 ZINC000275516054 474218664 /nfs/dbraw/zinc/21/86/64/474218664.db2.gz VUIHYPOVNWYZFA-CVEARBPZSA-N 0 3 337.445 2.619 20 5 EFBDHN C[C@H](CN1CCCCC1)NC(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175467527 474228168 /nfs/dbraw/zinc/22/81/68/474228168.db2.gz DWMUHOZYVRJEIU-LLVKDONJSA-N 0 3 325.796 2.852 20 5 EFBDHN CN(C)CCN(Cc1ccccc1)C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000248027626 474248402 /nfs/dbraw/zinc/24/84/02/474248402.db2.gz SLBWAYGXSFZWAZ-UHFFFAOYSA-N 0 3 341.411 2.728 20 5 EFBDHN CN(C)C1(CNCc2cc([N+](=O)[O-])ccc2OC(F)F)CCC1 ZINC000275636581 474260700 /nfs/dbraw/zinc/26/07/00/474260700.db2.gz RKHTVYKQPUIYIH-UHFFFAOYSA-N 0 3 329.347 2.770 20 5 EFBDHN O=C(Nc1ccccc1)N1CC[C@H](NCc2cccc([N+](=O)[O-])c2)C1 ZINC000283035790 474281362 /nfs/dbraw/zinc/28/13/62/474281362.db2.gz QULGALLZUYXDSX-INIZCTEOSA-N 0 3 340.383 2.991 20 5 EFBDHN CC[C@@H](c1cccc(OC)c1)N(C)CCn1cc([N+](=O)[O-])ccc1=O ZINC000289510193 474302693 /nfs/dbraw/zinc/30/26/93/474302693.db2.gz VAVCPXSVDPUPOA-KRWDZBQOSA-N 0 3 345.399 2.848 20 5 EFBDHN CC(C)N1CCN(C2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC000270888852 474308393 /nfs/dbraw/zinc/30/83/93/474308393.db2.gz KYPCGNRHCPVBIW-UHFFFAOYSA-N 0 3 346.475 2.585 20 5 EFBDHN CNC(=O)CC[C@@H]1CCCCN1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000289532371 474310656 /nfs/dbraw/zinc/31/06/56/474310656.db2.gz HSHMPDSRWQPRRL-BVBGJJFLSA-N 0 3 331.416 2.989 20 5 EFBDHN COc1cc(CNC[C@H](O)c2cc(C)cc(C)c2)c([N+](=O)[O-])cc1O ZINC000283124823 474311386 /nfs/dbraw/zinc/31/13/86/474311386.db2.gz ZGHYKNJXMNXJQU-KRWDZBQOSA-N 0 3 346.383 2.749 20 5 EFBDHN CN1CC[C@H]2CCN(C(=O)Nc3cccc([N+](=O)[O-])c3Cl)[C@H]2C1 ZINC000289540482 474315407 /nfs/dbraw/zinc/31/54/07/474315407.db2.gz DNMNQBJUJXDWKQ-GWCFXTLKSA-N 0 3 338.795 2.806 20 5 EFBDHN COC[C@H](CCO)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000265750338 474321977 /nfs/dbraw/zinc/32/19/77/474321977.db2.gz HJVYPSDKOWYLKL-ZDUSSCGKSA-N 0 3 336.413 2.810 20 5 EFBDHN O=[N+]([O-])c1ccccc1N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO ZINC000265753904 474323007 /nfs/dbraw/zinc/32/30/07/474323007.db2.gz DDKOIYGHFDWNQO-DLBZAZTESA-N 0 3 341.411 2.890 20 5 EFBDHN CC[C@H](c1ccncc1)N(C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248450284 474328413 /nfs/dbraw/zinc/32/84/13/474328413.db2.gz IOHKXDGPZSCPAL-HZPDHXFCSA-N 0 3 345.399 2.813 20 5 EFBDHN C[S@](=O)C[C@@H](NCCOc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000183120144 474333639 /nfs/dbraw/zinc/33/36/39/474333639.db2.gz KTUGMBCEDJSHMU-MYYSRTQBSA-N 0 3 348.424 2.683 20 5 EFBDHN CN(C)C(=O)CCCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000237145157 474344362 /nfs/dbraw/zinc/34/43/62/474344362.db2.gz DLLJGZVCLYQBLF-UHFFFAOYSA-N 0 3 348.428 2.676 20 5 EFBDHN CN(C)CCc1ccccc1NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000275943920 474368404 /nfs/dbraw/zinc/36/84/04/474368404.db2.gz ZPCOBUYLCFVZGR-UHFFFAOYSA-N 0 3 343.383 2.716 20 5 EFBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])NCCNC(=O)C1CC1 ZINC000271022546 474371713 /nfs/dbraw/zinc/37/17/13/474371713.db2.gz ARLCFZRDZNCTDZ-ZDUSSCGKSA-N 0 3 337.445 2.581 20 5 EFBDHN C[C@@H](CNCc1cc([N+](=O)[O-])ccc1OC(F)F)Cn1ccnc1 ZINC000237358963 474387741 /nfs/dbraw/zinc/38/77/41/474387741.db2.gz OZGMDJYKBMXCPO-NSHDSACASA-N 0 3 340.330 2.819 20 5 EFBDHN C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000265941294 474395450 /nfs/dbraw/zinc/39/54/50/474395450.db2.gz HSUXNBNJJPUEOP-RISCZKNCSA-N 0 3 331.372 2.753 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCC1(N(C)C)CCC1 ZINC000276034525 474395352 /nfs/dbraw/zinc/39/53/52/474395352.db2.gz RVLLRWNQWAGVOA-GFCCVEGCSA-N 0 3 337.445 2.676 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)[C@@H](CN)c2ccccc2)cc1[N+](=O)[O-] ZINC000237426591 474401972 /nfs/dbraw/zinc/40/19/72/474401972.db2.gz RONSAWACUXLRDT-BBRMVZONSA-N 0 3 327.384 2.823 20 5 EFBDHN CCN1CCCN(C(=O)Nc2cccc([N+](=O)[O-])c2Cl)CC1 ZINC000289777006 474422457 /nfs/dbraw/zinc/42/24/57/474422457.db2.gz SPHBSGUYPUZRPI-UHFFFAOYSA-N 0 3 326.784 2.808 20 5 EFBDHN CCOc1ccc(C(=O)NC[C@@H](C)N2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000248750468 474425083 /nfs/dbraw/zinc/42/50/83/474425083.db2.gz GJRJROKHUMNAOK-ZIAGYGMSSA-N 0 3 349.431 2.844 20 5 EFBDHN COc1cc(CN2CC[C@H](N3CCCCC3)C2)c([N+](=O)[O-])cc1OC ZINC000271185357 474427936 /nfs/dbraw/zinc/42/79/36/474427936.db2.gz ZEONWYFHPGHCEL-HNNXBMFYSA-N 0 3 349.431 2.672 20 5 EFBDHN COc1cccc(CN(CCN(C)C)c2cc(C)c([N+](=O)[O-])cn2)c1 ZINC000189627863 474451538 /nfs/dbraw/zinc/45/15/38/474451538.db2.gz JWKSDZKNINXPCQ-UHFFFAOYSA-N 0 3 344.415 2.875 20 5 EFBDHN NC[C@H](C(=O)NCCCCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000237814738 474481486 /nfs/dbraw/zinc/48/14/86/474481486.db2.gz MILMVEVEBGGBKB-SFHVURJKSA-N 0 3 341.411 2.776 20 5 EFBDHN C[C@H](N[C@@H]1CCC[C@H](S(C)(=O)=O)C1)c1cccc([N+](=O)[O-])c1 ZINC000266792405 474483933 /nfs/dbraw/zinc/48/39/33/474483933.db2.gz PQPHDYXDOAKIJG-LNSITVRQSA-N 0 3 326.418 2.601 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000248941271 474487111 /nfs/dbraw/zinc/48/71/11/474487111.db2.gz YTURNJMEDXITEW-RDTXWAMCSA-N 0 3 339.395 2.845 20 5 EFBDHN CN(C(=O)c1ccc([N+](=O)[O-])[nH]1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000266824387 474493802 /nfs/dbraw/zinc/49/38/02/474493802.db2.gz WNPRSFJAMAMPCD-OAHLLOKOSA-N 0 3 342.399 2.660 20 5 EFBDHN CN(C[C@H]1CCCN(C)C1)C(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000176587046 474503834 /nfs/dbraw/zinc/50/38/34/474503834.db2.gz AHTMXZHRYHAADO-NSHDSACASA-N 0 3 325.796 2.662 20 5 EFBDHN CC[C@@H](NC(=O)N1CCC[C@H](N(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000176706342 474519287 /nfs/dbraw/zinc/51/92/87/474519287.db2.gz QFIKUDVCQOVBST-JKSUJKDBSA-N 0 3 334.420 2.782 20 5 EFBDHN COc1ccc(CNC[C@]2(CO)C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000289997712 474520044 /nfs/dbraw/zinc/52/00/44/474520044.db2.gz XWOGIMZCNBEBLN-LPHOPBHVSA-N 0 3 342.395 2.859 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)N(C)CC2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000176721168 474520621 /nfs/dbraw/zinc/52/06/21/474520621.db2.gz BFKDKKDNDRCAGI-CQSZACIVSA-N 0 3 348.447 2.947 20 5 EFBDHN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CC[C@@H]2CCN(C)C[C@@H]21 ZINC000276383638 474520937 /nfs/dbraw/zinc/52/09/37/474520937.db2.gz GXJOEEGBJVGYEF-BBRMVZONSA-N 0 3 332.404 2.770 20 5 EFBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CN[C@H]2CCC[C@H]2CCO)c1 ZINC000189974736 474524083 /nfs/dbraw/zinc/52/40/83/474524083.db2.gz WXWIJBOYIFERQB-GWCFXTLKSA-N 0 3 330.331 2.837 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CCC(c3ccc(F)c(F)c3)CC2)c1 ZINC000266916428 474529259 /nfs/dbraw/zinc/52/92/59/474529259.db2.gz NHWDXYXMZZDSLW-UHFFFAOYSA-N 0 3 336.342 2.949 20 5 EFBDHN Cc1cc([N+](=O)[O-])cc(C(=O)N2C[C@@H](N3CCCC3)C[C@@H]2C)c1F ZINC000290060009 474544052 /nfs/dbraw/zinc/54/40/52/474544052.db2.gz YDUXNRMHDQATDT-JSGCOSHPSA-N 0 3 335.379 2.741 20 5 EFBDHN Cc1nccn1CCCN(C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000284037560 474556460 /nfs/dbraw/zinc/55/64/60/474556460.db2.gz ISZBXDDIFORUOB-UHFFFAOYSA-N 0 3 333.348 2.530 20 5 EFBDHN COC(=O)C1CCN(CCCNc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000266984525 474556766 /nfs/dbraw/zinc/55/67/66/474556766.db2.gz RLSZPTGLKMPWNA-UHFFFAOYSA-N 0 3 335.404 2.590 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CCCN1CC ZINC000184653943 474575760 /nfs/dbraw/zinc/57/57/60/474575760.db2.gz SLBGTQHAOHJDMF-DOTOQJQBSA-N 0 3 333.432 2.764 20 5 EFBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CN[C@@H]2C[C@H]3OCCC[C@H]23)c1 ZINC000190349436 474583631 /nfs/dbraw/zinc/58/36/31/474583631.db2.gz CPKZRERIYMXTLU-YRGRVCCFSA-N 0 3 328.315 2.853 20 5 EFBDHN C[C@@H](NCCn1ccc([N+](=O)[O-])n1)c1ccccc1OC(F)F ZINC000271794923 474592589 /nfs/dbraw/zinc/59/25/89/474592589.db2.gz RDVPLMABKCQDEX-SNVBAGLBSA-N 0 3 326.303 2.744 20 5 EFBDHN COc1ccc([C@@H](CN(C)C)NCc2cccc([N+](=O)[O-])c2)cc1 ZINC000284209273 474596064 /nfs/dbraw/zinc/59/60/64/474596064.db2.gz ZKOFREDQILRROV-GOSISDBHSA-N 0 3 329.400 2.996 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H](N(C)C)C1 ZINC000184727862 474596398 /nfs/dbraw/zinc/59/63/98/474596398.db2.gz AHJAFGKIJNFOAH-WBVHZDCISA-N 0 3 333.432 2.716 20 5 EFBDHN CN(C)[C@]1(CNc2ccc([N+](=O)[O-])c3cccnc23)CCSC1 ZINC000267151400 474602537 /nfs/dbraw/zinc/60/25/37/474602537.db2.gz ZYJOLTHGHLPAPE-INIZCTEOSA-N 0 3 332.429 2.992 20 5 EFBDHN COc1ccc(NC(=O)N[C@H](C)CN2CCCCC2)cc1[N+](=O)[O-] ZINC000272874160 474630998 /nfs/dbraw/zinc/63/09/98/474630998.db2.gz VIJZKWWHJXORCN-GFCCVEGCSA-N 0 3 336.392 2.599 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)N[C@H](C)C2=CCN(C)CC2)cc1[N+](=O)[O-] ZINC000272885037 474634289 /nfs/dbraw/zinc/63/42/89/474634289.db2.gz YMCQDPKVXMBLKQ-ZIAGYGMSSA-N 0 3 346.431 2.914 20 5 EFBDHN C[C@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CCN(C2CCC2)C1 ZINC000291682874 474648521 /nfs/dbraw/zinc/64/85/21/474648521.db2.gz CMXLIGIBZSXGSI-CYBMUJFWSA-N 0 3 332.404 2.933 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@@H](CO)Cc2c[nH]c3ccccc23)cc1 ZINC000344340129 474664200 /nfs/dbraw/zinc/66/42/00/474664200.db2.gz KSWNHQLXMQYRKQ-OAHLLOKOSA-N 0 3 325.368 2.769 20 5 EFBDHN C[C@H]1CN(CCC2CCN(c3ncccc3[N+](=O)[O-])CC2)C[C@H](C)O1 ZINC000267434824 474670062 /nfs/dbraw/zinc/67/00/62/474670062.db2.gz XNPSTVWMXHAEOD-GJZGRUSLSA-N 0 3 348.447 2.706 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@@H](Cc2ccccc2)[C@@H](O)C(F)F)cc1 ZINC000344349218 474673145 /nfs/dbraw/zinc/67/31/45/474673145.db2.gz VODZLJRQTOOGLG-JKSUJKDBSA-N 0 3 336.338 2.922 20 5 EFBDHN COc1ccc(OCCN2CCC[C@H]2[C@H]2CCCO2)c([N+](=O)[O-])c1 ZINC000284663334 474711543 /nfs/dbraw/zinc/71/15/43/474711543.db2.gz GOHMJIIVAACFBR-GOEBONIOSA-N 0 3 336.388 2.626 20 5 EFBDHN CN(CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C[C@H]1CCCCO1 ZINC000273201231 474773807 /nfs/dbraw/zinc/77/38/07/474773807.db2.gz RMNHRZFYMHLIDI-CYBMUJFWSA-N 0 3 339.367 2.563 20 5 EFBDHN O=[N+]([O-])c1ncccc1NCc1ccc(CN2CCC(O)CC2)cc1 ZINC000609192648 480125226 /nfs/dbraw/zinc/12/52/26/480125226.db2.gz ZBGBGRIQEJYQII-UHFFFAOYSA-N 0 3 342.399 2.559 20 5 EFBDHN Cc1[nH]nc2ncc(CN(C)CCc3cccc([N+](=O)[O-])c3)cc12 ZINC000338957489 474776647 /nfs/dbraw/zinc/77/66/47/474776647.db2.gz GFTWFZGJPJVERD-UHFFFAOYSA-N 0 3 325.372 2.849 20 5 EFBDHN COC(=O)C1CCN(CCCNc2cc(C)ccc2[N+](=O)[O-])CC1 ZINC000268087805 474790125 /nfs/dbraw/zinc/79/01/25/474790125.db2.gz IEFFQXYJCJBEAY-UHFFFAOYSA-N 0 3 335.404 2.590 20 5 EFBDHN COc1ccc(-c2ccc(CNCCN3CCC3)o2)c([N+](=O)[O-])c1 ZINC000344834137 474798807 /nfs/dbraw/zinc/79/88/07/474798807.db2.gz FSGWHUWMUOEEHJ-UHFFFAOYSA-N 0 3 331.372 2.659 20 5 EFBDHN COc1cccc([C@H](C)NC[C@H](O)COc2ccccc2[N+](=O)[O-])c1 ZINC000273253629 474804778 /nfs/dbraw/zinc/80/47/78/474804778.db2.gz YPXXNPYLUKMFQS-ZFWWWQNUSA-N 0 3 346.383 2.694 20 5 EFBDHN CCN(CCNC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CC1 ZINC000293100342 474812650 /nfs/dbraw/zinc/81/26/50/474812650.db2.gz RWFJLJAZYATFAU-UHFFFAOYSA-N 0 3 345.321 2.828 20 5 EFBDHN CCOC(=O)c1cc(N(C)C[C@@H]2CCCN(C)C2)ccc1[N+](=O)[O-] ZINC000268131217 474817199 /nfs/dbraw/zinc/81/71/99/474817199.db2.gz AKOIBSUKBUKKLG-CYBMUJFWSA-N 0 3 335.404 2.550 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000255174376 474817526 /nfs/dbraw/zinc/81/75/26/474817526.db2.gz UUVMIBAUOXZGRQ-IJOJBTCESA-N 0 3 329.400 2.693 20 5 EFBDHN CCO[C@@H]1C[C@H](N[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)[C@]12CCCO2 ZINC000284897743 474817778 /nfs/dbraw/zinc/81/77/78/474817778.db2.gz CDAGXGOVMNMILS-IAOMBJDPSA-N 0 3 335.404 2.554 20 5 EFBDHN Cc1cc(C(=O)N(CCN(C)C)Cc2ccccn2)ccc1[N+](=O)[O-] ZINC000337250128 474825778 /nfs/dbraw/zinc/82/57/78/474825778.db2.gz MOSCQLINSHWXSO-UHFFFAOYSA-N 0 3 342.399 2.502 20 5 EFBDHN Cc1nn(C)c(NC[C@]2(C)CCN(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000310931469 474832380 /nfs/dbraw/zinc/83/23/80/474832380.db2.gz TZUZOTIZGVOZIW-SFHVURJKSA-N 0 3 343.431 2.961 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@H](COC)[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000278787053 474834859 /nfs/dbraw/zinc/83/48/59/474834859.db2.gz LZHFRVZJRFDBDC-JGGQBBKZSA-N 0 3 338.404 2.838 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@@H](COC)[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000278787049 474835993 /nfs/dbraw/zinc/83/59/93/474835993.db2.gz LZHFRVZJRFDBDC-DUVNUKRYSA-N 0 3 338.404 2.838 20 5 EFBDHN CCn1nccc1C1CCN(C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000278824716 474854878 /nfs/dbraw/zinc/85/48/78/474854878.db2.gz HUIWFKJALOFKIS-SFHVURJKSA-N 0 3 344.415 2.724 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@]2(CCN(C)C2)C1 ZINC000292146361 474873827 /nfs/dbraw/zinc/87/38/27/474873827.db2.gz JRJNCJFZWKHJCV-GUYCJALGSA-N 0 3 349.456 2.630 20 5 EFBDHN CCCC[C@H](CC)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000273388078 474874340 /nfs/dbraw/zinc/87/43/40/474874340.db2.gz DCRRUPRVZQSSCG-ZDUSSCGKSA-N 0 3 328.434 2.927 20 5 EFBDHN CCc1[nH]nc(C(=O)Nc2cc(C)cc(CN(C)C)c2)c1[N+](=O)[O-] ZINC000345083649 474874642 /nfs/dbraw/zinc/87/46/42/474874642.db2.gz LCXKFKOSJVIXFW-UHFFFAOYSA-N 0 3 331.376 2.503 20 5 EFBDHN C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CCN(C2CCC2)C1 ZINC000292161870 474880856 /nfs/dbraw/zinc/88/08/56/474880856.db2.gz DBUMRNRJGOAUIR-LBPRGKRZSA-N 0 3 334.376 2.814 20 5 EFBDHN CN(C/C=C\c1ccccc1[N+](=O)[O-])CC(C)(C)CN1CCOCC1 ZINC000255679614 474892545 /nfs/dbraw/zinc/89/25/45/474892545.db2.gz SUPBVOOWRUKROV-VURMDHGXSA-N 0 3 347.459 2.898 20 5 EFBDHN CC1(C)CCC(NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000273448046 474902425 /nfs/dbraw/zinc/90/24/25/474902425.db2.gz ODNBHZYZWJIWEJ-UHFFFAOYSA-N 0 3 340.445 2.927 20 5 EFBDHN Cc1c(CN2CCN(C3CCOCC3)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000278901494 474903943 /nfs/dbraw/zinc/90/39/43/474903943.db2.gz RUGVQPWRRGHRKL-AWEZNQCLSA-N 0 3 333.432 2.588 20 5 EFBDHN C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@H]2CCN(C)C[C@H]21 ZINC000273457666 474906690 /nfs/dbraw/zinc/90/66/90/474906690.db2.gz DXRAJGZKRUOVSK-HSYXRWIHSA-N 0 3 329.400 2.551 20 5 EFBDHN CN(CCOc1ccccc1[N+](=O)[O-])C[C@H](O)Cc1ccccc1 ZINC000293296011 474913945 /nfs/dbraw/zinc/91/39/45/474913945.db2.gz KNEVACYOEDOVLP-MRXNPFEDSA-N 0 3 330.384 2.509 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)/C=C\c1ccccc1[N+](=O)[O-] ZINC000255903726 474916931 /nfs/dbraw/zinc/91/69/31/474916931.db2.gz KIDRHDWFRHSDEZ-SELBCVKXSA-N 0 3 329.400 2.693 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C\CN1CCC[C@H](Cn2ccnn2)C1 ZINC000255908786 474919192 /nfs/dbraw/zinc/91/91/92/474919192.db2.gz KYYHAVVYMPWDRU-QZDDGCDVSA-N 0 3 327.388 2.612 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCN(C2CCC2)C[C@@H](C)C1 ZINC000292243452 474919895 /nfs/dbraw/zinc/91/98/95/474919895.db2.gz DESBTSGWNLAEKG-CYBMUJFWSA-N 0 3 347.415 2.550 20 5 EFBDHN CC[C@@H](NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)c1ccc(Cl)s1 ZINC000273513358 474939440 /nfs/dbraw/zinc/93/94/40/474939440.db2.gz PAVFPWOJPKXJRQ-WDEREUQCSA-N 0 3 344.824 2.608 20 5 EFBDHN C[C@H](CNC(=O)NC(C)(C)c1ccccc1[N+](=O)[O-])N(C)C1CC1 ZINC000292283378 474941422 /nfs/dbraw/zinc/94/14/22/474941422.db2.gz MMRHSVKSADXYJT-GFCCVEGCSA-N 0 3 334.420 2.612 20 5 EFBDHN Cc1c(CNC[C@H](O)COCc2cccs2)cccc1[N+](=O)[O-] ZINC000323037651 474943684 /nfs/dbraw/zinc/94/36/84/474943684.db2.gz AZYVYOUYIUFZCP-AWEZNQCLSA-N 0 3 336.413 2.632 20 5 EFBDHN CS[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)C[C@H]1N1CCCC1 ZINC000273523789 474945004 /nfs/dbraw/zinc/94/50/04/474945004.db2.gz PYNCDRNHTKDHSQ-CVEARBPZSA-N 0 3 349.456 2.555 20 5 EFBDHN Cc1c(CNC[C@@H](O)COCc2cccs2)cccc1[N+](=O)[O-] ZINC000323037652 474945695 /nfs/dbraw/zinc/94/56/95/474945695.db2.gz AZYVYOUYIUFZCP-CQSZACIVSA-N 0 3 336.413 2.632 20 5 EFBDHN CC(C)[C@@H](NCCn1cc([N+](=O)[O-])ccc1=O)c1ccc(F)cc1 ZINC000337380650 474959858 /nfs/dbraw/zinc/95/98/58/474959858.db2.gz CWEKHVLSOUWFAX-QGZVFWFLSA-N 0 3 333.363 2.883 20 5 EFBDHN O=[N+]([O-])c1cnc(NC[C@@H]2CCCN(Cc3cccs3)C2)nc1 ZINC000273580326 474974454 /nfs/dbraw/zinc/97/44/54/474974454.db2.gz FQIFFJYWOBPRHV-LBPRGKRZSA-N 0 3 333.417 2.770 20 5 EFBDHN C[C@H]1C[C@@H](N2CCCC2)CN1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000285355114 474985414 /nfs/dbraw/zinc/98/54/14/474985414.db2.gz ABOPNSMAMFVKOB-GXTWGEPZSA-N 0 3 330.388 2.795 20 5 EFBDHN Cc1c(CNC(=O)[C@H](C)[C@@H](N)c2ccccc2)cccc1[N+](=O)[O-] ZINC000261626395 475001197 /nfs/dbraw/zinc/00/11/97/475001197.db2.gz GUHVAVIFGKVRRL-CXAGYDPISA-N 0 3 327.384 2.856 20 5 EFBDHN CC(C)c1ccc(C(=O)N2CC[C@@]3(CCN(C)C3)C2)cc1[N+](=O)[O-] ZINC000292398566 475005053 /nfs/dbraw/zinc/00/50/53/475005053.db2.gz SWSYKAANHNHQIU-GOSISDBHSA-N 0 3 331.416 2.886 20 5 EFBDHN Cc1sc(C(=O)N2C[C@@H](c3ccccc3)[C@H](N)C2)cc1[N+](=O)[O-] ZINC000261655605 475013274 /nfs/dbraw/zinc/01/32/74/475013274.db2.gz GQUDOZAJYRJCSZ-QWHCGFSZSA-N 0 3 331.397 2.532 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1NCCc2ccccc21 ZINC000261678072 475022475 /nfs/dbraw/zinc/02/24/75/475022475.db2.gz MNNKIVYNPWFJFD-KRWDZBQOSA-N 0 3 325.368 2.520 20 5 EFBDHN CN1CC=C(CNc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)CC1 ZINC000273725767 475028811 /nfs/dbraw/zinc/02/88/11/475028811.db2.gz HFGVMVWEGSOURA-UHFFFAOYSA-N 0 3 344.415 2.505 20 5 EFBDHN Cc1ccc(C(=O)NC[C@H]2NCCc3ccccc32)cc1[N+](=O)[O-] ZINC000261711769 475035451 /nfs/dbraw/zinc/03/54/51/475035451.db2.gz PTDLIFYDKMKAHD-MRXNPFEDSA-N 0 3 325.368 2.520 20 5 EFBDHN C[C@H]1C[C@H](c2ccccc2)N(CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000285749799 475038022 /nfs/dbraw/zinc/03/80/22/475038022.db2.gz QUWBBHUFLQGEBJ-WMLDXEAASA-N 0 3 327.384 2.840 20 5 EFBDHN C[C@H]1C[C@@H](c2ccccc2)N(CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000285749803 475039167 /nfs/dbraw/zinc/03/91/67/475039167.db2.gz QUWBBHUFLQGEBJ-YOEHRIQHSA-N 0 3 327.384 2.840 20 5 EFBDHN C[C@H]1CN(C(=O)CCc2cccc([N+](=O)[O-])c2)CCN(C2CCC2)C1 ZINC000292483321 475049118 /nfs/dbraw/zinc/04/91/18/475049118.db2.gz WAWNQSMPPXPPAI-OAHLLOKOSA-N 0 3 345.443 2.860 20 5 EFBDHN CN(C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)[C@H]1CCCN(C)C1 ZINC000273826891 475068913 /nfs/dbraw/zinc/06/89/13/475068913.db2.gz GPRYNARPXHPLHA-ZDUSSCGKSA-N 0 3 337.395 2.564 20 5 EFBDHN O=C(CN(C1CCC1)C1CCC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000292550676 475084051 /nfs/dbraw/zinc/08/40/51/475084051.db2.gz YMGOORWVCIRXFU-UHFFFAOYSA-N 0 3 329.400 2.891 20 5 EFBDHN Cn1c(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)ccc1[N+](=O)[O-] ZINC000345312411 475085419 /nfs/dbraw/zinc/08/54/19/475085419.db2.gz ZBQYJNJCVMVVKK-INIZCTEOSA-N 0 3 342.399 2.500 20 5 EFBDHN CN(C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)C1CCN(C)CC1 ZINC000273944562 475130442 /nfs/dbraw/zinc/13/04/42/475130442.db2.gz KWDZADPIRJTGTL-UHFFFAOYSA-N 0 3 337.395 2.564 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)N1C[C@@H](N2CCCC2)C[C@H]1C ZINC000287415617 475138000 /nfs/dbraw/zinc/13/80/00/475138000.db2.gz DIDBMCMUECBHGY-OCCSQVGLSA-N 0 3 348.403 2.694 20 5 EFBDHN C[C@H](N[C@H]1CCC[C@@H](S(C)(=O)=O)C1)c1ccc([N+](=O)[O-])cc1 ZINC000295975956 475151430 /nfs/dbraw/zinc/15/14/30/475151430.db2.gz JAOMUNXUVIOPJM-CORIIIEPSA-N 0 3 326.418 2.601 20 5 EFBDHN CN(C)C[C@H](NC(=O)CCC(C)(C)[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000296182206 475217693 /nfs/dbraw/zinc/21/76/93/475217693.db2.gz VIFJOIPCEVONLX-AWEZNQCLSA-N 0 3 341.839 2.894 20 5 EFBDHN CCn1cc([C@@H](C)NCCC(=O)Nc2cccc([N+](=O)[O-])c2C)cn1 ZINC000296191706 475220029 /nfs/dbraw/zinc/22/00/29/475220029.db2.gz UWBIOYAXHWCEHW-CYBMUJFWSA-N 0 3 345.403 2.799 20 5 EFBDHN CN(CCCN1CCCC1)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000296209354 475223775 /nfs/dbraw/zinc/22/37/75/475223775.db2.gz NHJVGAYNINARPB-UHFFFAOYSA-N 0 3 347.415 2.502 20 5 EFBDHN CC(=O)NC[C@H]1CCCN(C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000347337132 475243261 /nfs/dbraw/zinc/24/32/61/475243261.db2.gz MCIIRPDZLGTNOS-RKCSUWQLSA-N 0 3 331.416 2.846 20 5 EFBDHN CC(=O)N(C)C1CCN(C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC1 ZINC000347357575 475262542 /nfs/dbraw/zinc/26/25/42/475262542.db2.gz JNPRKNONHFGFED-SDNWHVSQSA-N 0 3 331.416 2.941 20 5 EFBDHN CC(=O)N(C)C1CCN(C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC1 ZINC000347357574 475262692 /nfs/dbraw/zinc/26/26/92/475262692.db2.gz JNPRKNONHFGFED-KAMYIIQDSA-N 0 3 331.416 2.941 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(C)CC[C@@H]1C ZINC000361197755 475262939 /nfs/dbraw/zinc/26/29/39/475262939.db2.gz AHRLJDBZJRTNTA-HOCLYGCPSA-N 0 3 333.432 2.716 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC[C@]2(CNC(=O)C2)C1 ZINC000347367817 475271782 /nfs/dbraw/zinc/27/17/82/475271782.db2.gz MSSFVIMAYXHZCY-QKAYDNCFSA-N 0 3 329.400 2.600 20 5 EFBDHN CC(C)C[C@@H](CN1CCCC1)NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000296367358 475286099 /nfs/dbraw/zinc/28/60/99/475286099.db2.gz GOIRBYPUUIVEGI-INIZCTEOSA-N 0 3 333.432 2.764 20 5 EFBDHN CS[C@@H]1CN(c2ccc3ncccc3c2[N+](=O)[O-])C[C@H]1N(C)C ZINC000347772880 475342561 /nfs/dbraw/zinc/34/25/61/475342561.db2.gz YLOXCQXHKWPUQF-HUUCEWRRSA-N 0 3 332.429 2.625 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN[C@@H]1CC(=O)N2CCCC[C@@H]12 ZINC000337848342 475374341 /nfs/dbraw/zinc/37/43/41/475374341.db2.gz ILCVTXSAYJSAAK-BGXJKKHCSA-N 0 3 329.400 2.741 20 5 EFBDHN C[C@@H](NC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)C1=CCN(C)CC1 ZINC000358087237 475387605 /nfs/dbraw/zinc/38/76/05/475387605.db2.gz CUWVYGBNKJJIFS-CYBMUJFWSA-N 0 3 346.431 2.780 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)CCN1C ZINC000358094062 475394460 /nfs/dbraw/zinc/39/44/60/475394460.db2.gz MVYTYFPOESNGMY-RYUDHWBXSA-N 0 3 337.395 2.610 20 5 EFBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@H](C(=O)N2CCCC2)C1 ZINC000331732657 475396477 /nfs/dbraw/zinc/39/64/77/475396477.db2.gz QTSYPTGBFPJYQV-ZBFHGGJFSA-N 0 3 331.416 2.990 20 5 EFBDHN Cc1c(CN2CCC[C@@H](C(=O)N3CCCC3)C2)cccc1[N+](=O)[O-] ZINC000331732757 475396591 /nfs/dbraw/zinc/39/65/91/475396591.db2.gz QWABGQYASPICOB-MRXNPFEDSA-N 0 3 331.416 2.738 20 5 EFBDHN C[C@@H]1[C@@H](NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)CCCN1C ZINC000345740977 475410373 /nfs/dbraw/zinc/41/03/73/475410373.db2.gz HXTQSOYNRIATNU-CJNGLKHVSA-N 0 3 346.431 2.752 20 5 EFBDHN C[C@@H]1[C@@H](NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)CCCN1C ZINC000345763173 475429343 /nfs/dbraw/zinc/42/93/43/475429343.db2.gz XJBLDGLVTDSOAY-DYVFJYSZSA-N 0 3 346.431 2.752 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)ccc1CN[C@H](C1CC1)[C@@]1(CO)CCCO1 ZINC000339767944 475482535 /nfs/dbraw/zinc/48/25/35/475482535.db2.gz VDIWVHBHXFZFIX-CVEARBPZSA-N 0 3 340.807 2.658 20 5 EFBDHN CN1CCN(CCNc2nccc3cc([N+](=O)[O-])ccc32)CC1(C)C ZINC000296810272 475487204 /nfs/dbraw/zinc/48/72/04/475487204.db2.gz PYYMPWMTTIEPPN-UHFFFAOYSA-N 0 3 343.431 2.581 20 5 EFBDHN CNC(=O)[C@@H]1CCC[C@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000345834990 475492693 /nfs/dbraw/zinc/49/26/93/475492693.db2.gz BZCDSUAGZMJYTF-HZPDHXFCSA-N 0 3 343.383 2.859 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@H]2CCC[C@H]2C(=O)NC)cc1[N+](=O)[O-] ZINC000358231727 475512288 /nfs/dbraw/zinc/51/22/88/475512288.db2.gz ASKYEOBLFAVDHI-YUTCNCBUSA-N 0 3 335.404 2.559 20 5 EFBDHN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CCC[C@H](N2CCCC2)C1 ZINC000332119856 475520070 /nfs/dbraw/zinc/52/00/70/475520070.db2.gz BXZKPQSMPCEUSM-HNNXBMFYSA-N 0 3 349.456 2.774 20 5 EFBDHN COC(=O)COc1ccc(CN2CCCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000354924366 475524748 /nfs/dbraw/zinc/52/47/48/475524748.db2.gz OGCVAZDZUOCWDD-ZDUSSCGKSA-N 0 3 336.388 2.769 20 5 EFBDHN O=C(CN(CC1CC1)CC1CCC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000361558214 475546272 /nfs/dbraw/zinc/54/62/72/475546272.db2.gz VLGGTUAFSMEUBE-UHFFFAOYSA-N 0 3 343.427 2.996 20 5 EFBDHN C[C@@H](CN(C)C)NC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000346136941 475562019 /nfs/dbraw/zinc/56/20/19/475562019.db2.gz FHAJADJHRAGAAD-NSHDSACASA-N 0 3 341.386 2.500 20 5 EFBDHN CCCN1CCC[C@H]1CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000358287110 475562286 /nfs/dbraw/zinc/56/22/86/475562286.db2.gz CJKRPKAHJUUXKL-KRWDZBQOSA-N 0 3 346.431 2.537 20 5 EFBDHN C[C@H](CN(C)C)NC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000346136939 475562428 /nfs/dbraw/zinc/56/24/28/475562428.db2.gz FHAJADJHRAGAAD-LLVKDONJSA-N 0 3 341.386 2.500 20 5 EFBDHN Cc1nc(N2CC[C@H](C)N(Cc3ccccc3)CC2)ncc1[N+](=O)[O-] ZINC000296985451 475564376 /nfs/dbraw/zinc/56/43/76/475564376.db2.gz FADHEPZBTKZSOU-AWEZNQCLSA-N 0 3 341.415 2.794 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@@H]2CCOC[C@@H]2OCC)cc1[N+](=O)[O-] ZINC000354968419 475567074 /nfs/dbraw/zinc/56/70/74/475567074.db2.gz AIGXEPQBBPYCTB-QEORTHHSSA-N 0 3 338.404 2.838 20 5 EFBDHN CC(C)c1ccc(CN2CCO[C@H]3CCN(C)C[C@@H]32)cc1[N+](=O)[O-] ZINC000332320513 475599889 /nfs/dbraw/zinc/59/98/89/475599889.db2.gz RFLFLQZZCZOJGR-ROUUACIJSA-N 0 3 333.432 2.623 20 5 EFBDHN C[C@@H]1C[C@@H](NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])CN1C1CC1 ZINC000342592925 475616777 /nfs/dbraw/zinc/61/67/77/475616777.db2.gz JMBXWHOKXQPQKH-CHWSQXEVSA-N 0 3 331.416 2.614 20 5 EFBDHN CCOc1ccc([C@@H](C)NCCc2ncc(C)cn2)cc1[N+](=O)[O-] ZINC000358360361 475618384 /nfs/dbraw/zinc/61/83/84/475618384.db2.gz AFWRHHVHWJUOFY-CYBMUJFWSA-N 0 3 330.388 2.985 20 5 EFBDHN C[C@H](CN1CCCCC1)NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000342924284 475657649 /nfs/dbraw/zinc/65/76/49/475657649.db2.gz HUOCYDCZVCUATM-GFCCVEGCSA-N 0 3 330.388 2.680 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1N(C)CCCC1(C)C ZINC000348466379 475684990 /nfs/dbraw/zinc/68/49/90/475684990.db2.gz SQAKWUSNGPWCOU-HNNXBMFYSA-N 0 3 349.431 2.844 20 5 EFBDHN CCS[C@@H]1CCC[C@H]1N[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000348471368 475685637 /nfs/dbraw/zinc/68/56/37/475685637.db2.gz UKUGBFYMZJMXFX-BZUAXINKSA-N 0 3 349.456 2.964 20 5 EFBDHN O=[N+]([O-])c1cc(CN2CCC(CCN3CCOCC3)CC2)cs1 ZINC000338221342 475686004 /nfs/dbraw/zinc/68/60/04/475686004.db2.gz MXGWXAYMTJSRGZ-UHFFFAOYSA-N 0 3 339.461 2.591 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000358447837 475686631 /nfs/dbraw/zinc/68/66/31/475686631.db2.gz QZXZJEZDMVBBIO-OAHLLOKOSA-N 0 3 334.420 2.577 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nc(CNC[C@@H](CO)C3CC3)cs2)c1 ZINC000353126081 475700025 /nfs/dbraw/zinc/70/00/25/475700025.db2.gz RMLLAMNNMRZSPZ-ZDUSSCGKSA-N 0 3 333.413 2.826 20 5 EFBDHN CC(C)(C)[C@@H]1NC(=O)CC[C@@H]1NC/C=C\c1ccccc1[N+](=O)[O-] ZINC000353147428 475719077 /nfs/dbraw/zinc/71/90/77/475719077.db2.gz YQXSVXLKEORFMY-HFNVYPAOSA-N 0 3 331.416 2.891 20 5 EFBDHN C[C@H](N[C@@H]1CCC[C@H]1OC(F)F)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000348531972 475731995 /nfs/dbraw/zinc/73/19/95/475731995.db2.gz MXJUWPRMHLQHGA-ZWKOPEQDSA-N 0 3 343.330 2.672 20 5 EFBDHN C[C@H](CNC(=O)NCCc1cccc([N+](=O)[O-])c1)N1CCC[C@H](C)C1 ZINC000340093034 475752719 /nfs/dbraw/zinc/75/27/19/475752719.db2.gz IFRSTZDLFRWGBA-LSDHHAIUSA-N 0 3 348.447 2.557 20 5 EFBDHN Cc1c(CNC(=O)N[C@H](C)CN2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000358584029 475786528 /nfs/dbraw/zinc/78/65/28/475786528.db2.gz PTLWRXLVPCQYIP-ZIAGYGMSSA-N 0 3 348.447 2.823 20 5 EFBDHN CCCCN1CCCC[C@@H]1CNC(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000355281253 475796764 /nfs/dbraw/zinc/79/67/64/475796764.db2.gz GRXXYUYYZOTEFB-OAHLLOKOSA-N 0 3 349.431 2.988 20 5 EFBDHN C[C@H](C(=O)N(C)CCc1cccc([N+](=O)[O-])c1)N1[C@H](C)CC[C@@H]1C ZINC000338334933 475798497 /nfs/dbraw/zinc/79/84/97/475798497.db2.gz UCGHKKGJRRQIOF-QLFBSQMISA-N 0 3 333.432 2.857 20 5 EFBDHN C[C@H](NC(=O)N(C)[C@@H]1CCN(C)C[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000297544070 475800788 /nfs/dbraw/zinc/80/07/88/475800788.db2.gz JCZOLLYUXZDMGR-DVOMOZLQSA-N 0 3 334.420 2.637 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000297554692 475804873 /nfs/dbraw/zinc/80/48/73/475804873.db2.gz KBDQWWKHZWKDGP-LXZKKBNFSA-N 0 3 346.431 2.924 20 5 EFBDHN COCC[C@H](NCC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000338344323 475807523 /nfs/dbraw/zinc/80/75/23/475807523.db2.gz AOAOGDNNYHFGFS-HNNXBMFYSA-N 0 3 337.420 2.598 20 5 EFBDHN COc1ccc2c(c1)C[C@@H](NCc1ccc(OC)c([N+](=O)[O-])c1)CO2 ZINC000297646314 475841721 /nfs/dbraw/zinc/84/17/21/475841721.db2.gz JZRBVBOYWUJNHM-CQSZACIVSA-N 0 3 344.367 2.705 20 5 EFBDHN Cc1c(NC(=O)[C@H](C)N[C@H](C)[C@@H]2CCCOC2)cccc1[N+](=O)[O-] ZINC000355341433 475843527 /nfs/dbraw/zinc/84/35/27/475843527.db2.gz JRPJECJLTAESSV-HZSPNIEDSA-N 0 3 335.404 2.635 20 5 EFBDHN Cc1ncc(C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])c(=O)[n-]1 ZINC000346812362 475878703 /nfs/dbraw/zinc/87/87/03/475878703.db2.gz WMBSXFBFBVFNNB-BBRMVZONSA-N 0 3 342.399 2.900 20 5 EFBDHN COc1ccc(-c2ccc(CN(C)C3CC(O)C3)o2)c([N+](=O)[O-])c1 ZINC000355374258 475882111 /nfs/dbraw/zinc/88/21/11/475882111.db2.gz YDHHPKDVTHBQCK-UHFFFAOYSA-N 0 3 332.356 2.819 20 5 EFBDHN CC[C@H]1CCCCN1CCNC(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000358768332 475919495 /nfs/dbraw/zinc/91/94/95/475919495.db2.gz UPFQCMAJGMAXGN-HNNXBMFYSA-N 0 3 349.431 2.906 20 5 EFBDHN Cc1cccc(C(=O)N[C@H]2CCN(CC3CCCC3)C2)c1[N+](=O)[O-] ZINC000362062225 475969755 /nfs/dbraw/zinc/96/97/55/475969755.db2.gz SYDKWKJWUCXWCD-HNNXBMFYSA-N 0 3 331.416 2.898 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NCCN2[C@H](C)CCC[C@@H]2C)c1 ZINC000338535919 475991927 /nfs/dbraw/zinc/99/19/27/475991927.db2.gz LAPXWGRVVQORCS-OKILXGFUSA-N 0 3 349.431 2.986 20 5 EFBDHN CCn1ccnc1[C@@H]1OCC[C@H]1NCc1ccc(C)c([N+](=O)[O-])c1 ZINC000343392225 476015434 /nfs/dbraw/zinc/01/54/34/476015434.db2.gz TXVYXLJIPMXHJX-GDBMZVCRSA-N 0 3 330.388 2.739 20 5 EFBDHN CCOC1(C)CCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000298205358 476017009 /nfs/dbraw/zinc/01/70/09/476017009.db2.gz CUMHEPWWYQOGJO-UHFFFAOYSA-N 0 3 335.404 2.814 20 5 EFBDHN CCC(=O)c1ccc(NC[C@H](C)N2CCN(CC)CC2)c([N+](=O)[O-])c1 ZINC000358942437 476058297 /nfs/dbraw/zinc/05/82/97/476058297.db2.gz BDHCKTDHFZVZLQ-AWEZNQCLSA-N 0 3 348.447 2.625 20 5 EFBDHN O=[N+]([O-])c1cc(F)ccc1NC[C@@]1(O)CCN(Cc2ccccc2)C1 ZINC000355755262 476059169 /nfs/dbraw/zinc/05/91/69/476059169.db2.gz ODKAQRNTXIRYCB-SFHVURJKSA-N 0 3 345.374 2.783 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCCN(C)[C@H]1C ZINC000343438777 476065276 /nfs/dbraw/zinc/06/52/76/476065276.db2.gz LOPVKZNEJNOOJE-FZMZJTMJSA-N 0 3 337.445 2.919 20 5 EFBDHN C[C@H]1CCN(C)CCN1C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000343763613 476110995 /nfs/dbraw/zinc/11/09/95/476110995.db2.gz GWTDYEYYTISNNY-JTQLQIEISA-N 0 3 326.784 2.806 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@@H](CO)Cc2c[nH]c3ccccc23)c(F)c1 ZINC000350285657 476120751 /nfs/dbraw/zinc/12/07/51/476120751.db2.gz GRZCCBJMINCBKJ-CQSZACIVSA-N 0 3 343.358 2.908 20 5 EFBDHN CCc1nn(C)c(N[C@H](C)CN(C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000336695465 476125302 /nfs/dbraw/zinc/12/53/02/476125302.db2.gz IJBFLVFNLIUQHP-CYBMUJFWSA-N 0 3 331.420 2.823 20 5 EFBDHN CCNC(=O)[C@@H](C)NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000338714621 476127850 /nfs/dbraw/zinc/12/78/50/476127850.db2.gz UHDJUMUHMVRTHL-LLVKDONJSA-N 0 3 333.413 2.938 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N[C@H]2CCCN(C)[C@@H]2C)cc1[N+](=O)[O-] ZINC000343971009 476140768 /nfs/dbraw/zinc/14/07/68/476140768.db2.gz KISNGQRWVJRIBH-GUTXKFCHSA-N 0 3 334.420 2.746 20 5 EFBDHN CN(C)C[C@@H](NC(=O)c1cc([N+](=O)[O-])c[nH]1)c1ccc(Cl)cc1 ZINC000338751312 476155918 /nfs/dbraw/zinc/15/59/18/476155918.db2.gz AGMLIFOZWOTWNB-CQSZACIVSA-N 0 3 336.779 2.609 20 5 EFBDHN CN1CCN(CCOc2ccc([N+](=O)[O-])cc2)Cc2ccccc21 ZINC000340648760 476178944 /nfs/dbraw/zinc/17/89/44/476178944.db2.gz DJIHFXYWOBAJKP-UHFFFAOYSA-N 0 3 327.384 2.926 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)c1 ZINC000359114535 476200901 /nfs/dbraw/zinc/20/09/01/476200901.db2.gz IYAASNHRIRCKKL-MRXNPFEDSA-N 0 3 341.411 2.806 20 5 EFBDHN O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC[C@@H]1CN1CCCCC1 ZINC000344273526 476205722 /nfs/dbraw/zinc/20/57/22/476205722.db2.gz KAYUTXBZBLNOOV-OAHLLOKOSA-N 0 3 335.379 2.824 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CNC[C@H]2CC[C@H](CO)O2)s1 ZINC000353718748 476216014 /nfs/dbraw/zinc/21/60/14/476216014.db2.gz ZNTGIGYHHQFBBE-CHWSQXEVSA-N 0 3 348.424 2.953 20 5 EFBDHN CCCCNC(=O)CCN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000362391856 476217689 /nfs/dbraw/zinc/21/76/89/476217689.db2.gz UIUDSIBYNDVVLU-UHFFFAOYSA-N 0 3 349.431 2.744 20 5 EFBDHN COC(=O)COc1ccc(CNCc2ccccc2C)cc1[N+](=O)[O-] ZINC000353738840 476231387 /nfs/dbraw/zinc/23/13/87/476231387.db2.gz OGLKIHJBKMWYSW-UHFFFAOYSA-N 0 3 344.367 2.745 20 5 EFBDHN CC1(C)CCCN(CCNC(=O)Nc2cc(F)cc([N+](=O)[O-])c2)C1 ZINC000347295663 476238497 /nfs/dbraw/zinc/23/84/97/476238497.db2.gz YQUDKAUUMBIIFK-UHFFFAOYSA-N 0 3 338.383 2.977 20 5 EFBDHN CC(C)[C@H]1CCCCN1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000303733084 476247135 /nfs/dbraw/zinc/24/71/35/476247135.db2.gz ZXDOBFSXQGHOMC-MRXNPFEDSA-N 0 3 331.416 2.994 20 5 EFBDHN COC1CCN(C(C)(C)CNCc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000350617152 476267214 /nfs/dbraw/zinc/26/72/14/476267214.db2.gz ANDMULZPGPKZFS-UHFFFAOYSA-N 0 3 339.411 2.713 20 5 EFBDHN COc1ccc(-c2ccc(CNC[C@@H](O)C(C)C)o2)c([N+](=O)[O-])c1 ZINC000304210704 476269048 /nfs/dbraw/zinc/26/90/48/476269048.db2.gz DRJODPSHTBXCTJ-MRXNPFEDSA-N 0 3 334.372 2.970 20 5 EFBDHN CCOc1ccc([C@@H](C)N[C@H]2CCc3c[nH]nc3C2)cc1[N+](=O)[O-] ZINC000360059899 476287838 /nfs/dbraw/zinc/28/78/38/476287838.db2.gz RALJXCUOBPWOPO-RISCZKNCSA-N 0 3 330.388 2.925 20 5 EFBDHN CCOc1cc(N2CCN(C3CCOCC3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000362667903 476345961 /nfs/dbraw/zinc/34/59/61/476345961.db2.gz SHFTWMOJFPETSA-CQSZACIVSA-N 0 3 349.431 2.683 20 5 EFBDHN CN(C[C@@H]1CCN(C)[C@@H]1c1cccnc1)c1ccc([N+](=O)[O-])nc1 ZINC000362677255 476348065 /nfs/dbraw/zinc/34/80/65/476348065.db2.gz XLXJKBSNVUCTGF-WMLDXEAASA-N 0 3 327.388 2.514 20 5 EFBDHN O=[N+]([O-])c1ccc(NC[C@H]2CN3CCC[C@@H]3CO2)cc1C(F)(F)F ZINC000363622880 476464524 /nfs/dbraw/zinc/46/45/24/476464524.db2.gz CVXVXFLVYMYHPV-NEPJUHHUSA-N 0 3 345.321 2.889 20 5 EFBDHN O=[N+]([O-])c1ccc(NC[C@H]2CN3CCC[C@H]3CO2)cc1C(F)(F)F ZINC000363622882 476465057 /nfs/dbraw/zinc/46/50/57/476465057.db2.gz CVXVXFLVYMYHPV-RYUDHWBXSA-N 0 3 345.321 2.889 20 5 EFBDHN COc1cccc(OCCN2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1 ZINC000369681298 476476220 /nfs/dbraw/zinc/47/62/20/476476220.db2.gz KCKDCFCKTWPSBV-UHFFFAOYSA-N 0 3 346.387 2.516 20 5 EFBDHN Cc1cc(NCCCN2CCCCC2=O)c2cc([N+](=O)[O-])ccc2n1 ZINC000360934483 476487430 /nfs/dbraw/zinc/48/74/30/476487430.db2.gz KQJAPIASSNMWDS-UHFFFAOYSA-N 0 3 342.399 2.688 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@H](N2CCOCC2)[C@H]1C ZINC000352018178 476515596 /nfs/dbraw/zinc/51/55/96/476515596.db2.gz OHFVKDHSXBHEMY-DAYGRLMNSA-N 0 3 333.432 2.759 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCN(C3CCCC3)C2)c1 ZINC000374816440 476540794 /nfs/dbraw/zinc/54/07/94/476540794.db2.gz SABQTEFYQLVFLV-ZDUSSCGKSA-N 0 3 347.415 2.740 20 5 EFBDHN CS[C@H]1CN(c2cc([N+](=O)[O-])ccc2C(C)=O)C[C@@H]1N1CCCC1 ZINC000361016523 476545933 /nfs/dbraw/zinc/54/59/33/476545933.db2.gz ZIYAMDSXHNAYKH-IRXDYDNUSA-N 0 3 349.456 2.813 20 5 EFBDHN O=[N+]([O-])c1cccc(CNc2cccc(CN3CC[C@H](O)C3)c2)c1 ZINC000361054526 476568585 /nfs/dbraw/zinc/56/85/85/476568585.db2.gz UIIAOACGKHVBGE-SFHVURJKSA-N 0 3 327.384 2.774 20 5 EFBDHN O=[N+]([O-])c1ccc(CNc2cccc(CN3CC[C@@H](O)C3)c2)cc1 ZINC000361053934 476568722 /nfs/dbraw/zinc/56/87/22/476568722.db2.gz SIMYOAZZWXIWKH-GOSISDBHSA-N 0 3 327.384 2.774 20 5 EFBDHN CCn1c(C)nc([N+](=O)[O-])c1N(CCN(C)C)Cc1ccccc1F ZINC000361063825 476578035 /nfs/dbraw/zinc/57/80/35/476578035.db2.gz WCJJMIMLCWVRAL-UHFFFAOYSA-N 0 3 349.410 2.827 20 5 EFBDHN Cc1cc(N[C@H]2CCN(C)[C@H](C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000361066822 476578965 /nfs/dbraw/zinc/57/89/65/476578965.db2.gz PVAHRXKBRAIUJV-HIFRSBDPSA-N 0 3 341.415 2.677 20 5 EFBDHN COc1ccc(-c2ccc(CNC[C@@H](O)C3CC3)o2)c([N+](=O)[O-])c1 ZINC000357755986 476581423 /nfs/dbraw/zinc/58/14/23/476581423.db2.gz BDCSWLATDMEDQN-MRXNPFEDSA-N 0 3 332.356 2.724 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCN([C@H]2CCCN(C)C2)CC1 ZINC000374916803 476593120 /nfs/dbraw/zinc/59/31/20/476593120.db2.gz PSVYAQXTUKIVEP-WMZOPIPTSA-N 0 3 346.475 2.676 20 5 EFBDHN CC1(C)CCCN(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC1 ZINC000357776494 476596455 /nfs/dbraw/zinc/59/64/55/476596455.db2.gz WCDDLPBTCSGBLV-UHFFFAOYSA-N 0 3 331.416 2.996 20 5 EFBDHN CCCN(CC)C[C@@H](C)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000357789364 476605628 /nfs/dbraw/zinc/60/56/28/476605628.db2.gz XCUPYJFGHJXJSK-GFCCVEGCSA-N 0 3 343.449 2.531 20 5 EFBDHN CCCN(CC)C[C@H](C)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000357789367 476606213 /nfs/dbraw/zinc/60/62/13/476606213.db2.gz XCUPYJFGHJXJSK-LBPRGKRZSA-N 0 3 343.449 2.531 20 5 EFBDHN COc1cc(C[NH2+]C[C@]2(C)CCO[C@@H]2C2CC2)c([N+](=O)[O-])cc1[O-] ZINC000375121556 476682166 /nfs/dbraw/zinc/68/21/66/476682166.db2.gz RWLQCRPPBBTDEH-SJORKVTESA-N 0 3 336.388 2.604 20 5 EFBDHN C[C@H](CN1CCCCC1)NC(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000429834997 476700724 /nfs/dbraw/zinc/70/07/24/476700724.db2.gz YLYLXBHNYCBUNJ-CQSZACIVSA-N 0 3 333.432 2.863 20 5 EFBDHN CC(C)Oc1cc(C(=O)NCCN2CCCC2(C)C)ccc1[N+](=O)[O-] ZINC000413860027 476767783 /nfs/dbraw/zinc/76/77/83/476767783.db2.gz LMWXQIWKGYOTSV-UHFFFAOYSA-N 0 3 349.431 2.986 20 5 EFBDHN CN(C)C1(CNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)CCC1 ZINC000445872122 476785942 /nfs/dbraw/zinc/78/59/42/476785942.db2.gz RFWUKQKHAHKHND-UHFFFAOYSA-N 0 3 348.447 2.701 20 5 EFBDHN Cc1c(CC(=O)Nc2ccc3c(c2)CNCC3)cccc1[N+](=O)[O-] ZINC000422828023 476797777 /nfs/dbraw/zinc/79/77/77/476797777.db2.gz AMLKYYXNZOFPSH-UHFFFAOYSA-N 0 3 325.368 2.730 20 5 EFBDHN Cc1cc(NC(=O)c2cccc([N+](=O)[O-])c2)n(C2CCN(C)CC2)n1 ZINC000430434530 476831697 /nfs/dbraw/zinc/83/16/97/476831697.db2.gz DJHJDGVGYKPGKW-UHFFFAOYSA-N 0 3 343.387 2.619 20 5 EFBDHN CC(C)(C)[C@@H](CO)NCc1ccc(Br)cc1[N+](=O)[O-] ZINC000393975268 476836770 /nfs/dbraw/zinc/83/67/70/476836770.db2.gz UZKOICXTVCANIL-GFCCVEGCSA-N 0 3 331.210 2.854 20 5 EFBDHN CC(C)N1CC[C@@H](N(C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000452121328 476838840 /nfs/dbraw/zinc/83/88/40/476838840.db2.gz SOPZSINPMZCOPI-OAHLLOKOSA-N 0 3 345.403 2.559 20 5 EFBDHN CSc1ccc(C(=O)NC(C)(C)CN2CCCC2)cc1[N+](=O)[O-] ZINC000457045508 476843810 /nfs/dbraw/zinc/84/38/10/476843810.db2.gz YMSYUBBCRHWNOX-UHFFFAOYSA-N 0 3 337.445 2.921 20 5 EFBDHN C[C@H]1CN(C(=O)C(C)(C)c2ccccc2[N+](=O)[O-])CCN(C2CC2)C1 ZINC000452169202 476863960 /nfs/dbraw/zinc/86/39/60/476863960.db2.gz FIRCZXYYXGSKLI-CQSZACIVSA-N 0 3 345.443 2.815 20 5 EFBDHN C[C@@H]1CN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CCN(C2CC2)C1 ZINC000452173549 476869552 /nfs/dbraw/zinc/86/95/52/476869552.db2.gz NEMXEGIBDQCWKP-NSHDSACASA-N 0 3 337.807 2.805 20 5 EFBDHN CC(C)N1CC[C@H](N(C)C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000457104815 476877186 /nfs/dbraw/zinc/87/71/86/476877186.db2.gz BXYOZYCUGAPJTB-AWEZNQCLSA-N 0 3 339.823 2.732 20 5 EFBDHN CC(C)N1CC[C@H](N(C)C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC000457112368 476882833 /nfs/dbraw/zinc/88/28/33/476882833.db2.gz JESMOTAYHDOBIJ-ZDUSSCGKSA-N 0 3 330.388 2.631 20 5 EFBDHN CC(C)N1CC[C@H](N(C)C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000457114974 476884736 /nfs/dbraw/zinc/88/47/36/476884736.db2.gz KMMSCPIJFBRKGQ-AWEZNQCLSA-N 0 3 331.372 2.896 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H](N)CC1CCCCC1 ZINC000423058149 476910090 /nfs/dbraw/zinc/91/00/90/476910090.db2.gz BKGIFNPXIJDRKK-OAHLLOKOSA-N 0 3 335.404 2.517 20 5 EFBDHN COc1ccc(OCCN2CCNCc3ccccc32)c([N+](=O)[O-])c1 ZINC000430966301 476952508 /nfs/dbraw/zinc/95/25/08/476952508.db2.gz NEESJHDYULMHHV-UHFFFAOYSA-N 0 3 343.383 2.592 20 5 EFBDHN N[C@H](CC1CCCCC1)C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000423188202 476959095 /nfs/dbraw/zinc/95/90/95/476959095.db2.gz PUJINQVNHNFEII-QGZVFWFLSA-N 0 3 331.416 2.777 20 5 EFBDHN C[C@@H]1CN[C@@H](C)CN1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000423507397 477053777 /nfs/dbraw/zinc/05/37/77/477053777.db2.gz QAHZQERSNRRZMR-VHSXEESVSA-N 0 3 343.836 2.549 20 5 EFBDHN Cc1cc(OCC(=O)NC[C@H](C)N2CCC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000431576088 477054866 /nfs/dbraw/zinc/05/48/66/477054866.db2.gz SMGJAWFLGMDVPD-ZFWWWQNUSA-N 0 3 349.431 2.519 20 5 EFBDHN Cc1c(CNC(=O)NCCN2CCCC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000447812722 477063341 /nfs/dbraw/zinc/06/33/41/477063341.db2.gz SKMBAKLHKKEITQ-UHFFFAOYSA-N 0 3 348.447 2.824 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N[C@H]1CCN(C)[C@H](C)C1 ZINC000447810572 477063430 /nfs/dbraw/zinc/06/34/30/477063430.db2.gz JQYUQKQAFWEBDD-ZJUUUORDSA-N 0 3 341.795 2.929 20 5 EFBDHN CC(C)N1CCN([C@@H]2CCN([C@H](C)c3cccc([N+](=O)[O-])c3)C2)CC1 ZINC000375892991 477066546 /nfs/dbraw/zinc/06/65/46/477066546.db2.gz WSPWVNSMMUYCFA-VQIMIIECSA-N 0 3 346.475 2.756 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[C@]2(CCN(C)C2)C1 ZINC000366599922 477089628 /nfs/dbraw/zinc/08/96/28/477089628.db2.gz XABOTDIGIJJKGC-KRWDZBQOSA-N 0 3 332.404 2.771 20 5 EFBDHN O=C([C@@H]1CCCN1C1CC1)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452833888 477101275 /nfs/dbraw/zinc/10/12/75/477101275.db2.gz BJANNKGWLAVXRA-QAPCUYQASA-N 0 3 343.427 2.928 20 5 EFBDHN Cc1cc(OCC(=O)N[C@H](C)CN2CCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000431834365 477104049 /nfs/dbraw/zinc/10/40/49/477104049.db2.gz RFCJERZFUANXLS-UKRRQHHQSA-N 0 3 349.431 2.519 20 5 EFBDHN CN(C)c1ccccc1CN1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000376034635 477142681 /nfs/dbraw/zinc/14/26/81/477142681.db2.gz LROFVLFZLIZNRQ-UHFFFAOYSA-N 0 3 329.404 2.694 20 5 EFBDHN COC(=O)c1cc(C)nc(N[C@H]2CCN(C3CCCC3)C2)c1[N+](=O)[O-] ZINC000376219166 477235045 /nfs/dbraw/zinc/23/50/45/477235045.db2.gz MQHRVSOLARZSCY-LBPRGKRZSA-N 0 3 348.403 2.514 20 5 EFBDHN O=C(CCN[C@H](CCO)c1ccccc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411446943 477237642 /nfs/dbraw/zinc/23/76/42/477237642.db2.gz OWAUJAFDXDUREG-QGZVFWFLSA-N 0 3 343.383 2.637 20 5 EFBDHN CCc1ccccc1[C@H](N)CNC(=O)c1cc([N+](=O)[O-])ccc1C ZINC000423986125 477247489 /nfs/dbraw/zinc/24/74/89/477247489.db2.gz VSICQAXUFBFCKN-QGZVFWFLSA-N 0 3 327.384 2.895 20 5 EFBDHN CN(C)CCN(Cc1ccsc1)C(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000458194413 477315374 /nfs/dbraw/zinc/31/53/74/477315374.db2.gz ALPZQMFHAJXUJI-UHFFFAOYSA-N 0 3 347.440 2.789 20 5 EFBDHN Cn1nccc1[C@H]1CCCN(CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000371451954 477326589 /nfs/dbraw/zinc/32/65/89/477326589.db2.gz KBRSWFAVYIAUGT-HNNXBMFYSA-N 0 3 344.415 2.977 20 5 EFBDHN C[C@H](CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCC(C)CC1 ZINC000411697700 477332912 /nfs/dbraw/zinc/33/29/12/477332912.db2.gz SEHYXBJEUQZPMT-FHLIZLRMSA-N 0 3 345.443 2.935 20 5 EFBDHN Cc1cc(NC(=O)COc2ccc([N+](=O)[O-])cc2)ccc1CN(C)C ZINC000458322810 477351203 /nfs/dbraw/zinc/35/12/03/477351203.db2.gz RMTAXQOLOCVDNH-UHFFFAOYSA-N 0 3 343.383 2.982 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCN2CCC(c3ccncn3)CC2)c1 ZINC000411822708 477382451 /nfs/dbraw/zinc/38/24/51/477382451.db2.gz CBEGMYUCLHBYEI-UHFFFAOYSA-N 0 3 328.372 2.643 20 5 EFBDHN CN(C)CC(C)(C)NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000458421741 477407292 /nfs/dbraw/zinc/40/72/92/477407292.db2.gz LLYNDLGIAFWUCB-UHFFFAOYSA-N 0 3 336.436 2.557 20 5 EFBDHN CC(=O)c1ccc([N+](=O)[O-])cc1N1CC[C@@H](C2CCN(C)CC2)C1 ZINC000367285994 477432846 /nfs/dbraw/zinc/43/28/46/477432846.db2.gz HYLJTZMXBARWSZ-OAHLLOKOSA-N 0 3 331.416 2.966 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])NCc1ccccc1OCCO ZINC000449166824 477466935 /nfs/dbraw/zinc/46/69/35/477466935.db2.gz GJCJYAJPVWPXMK-AWEZNQCLSA-N 0 3 330.384 2.687 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])NCc1ccccc1OCCO ZINC000449166825 477467338 /nfs/dbraw/zinc/46/73/38/477467338.db2.gz GJCJYAJPVWPXMK-CQSZACIVSA-N 0 3 330.384 2.687 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])NCC(=O)N(C)C1CCCCC1 ZINC000449175848 477471587 /nfs/dbraw/zinc/47/15/87/477471587.db2.gz LFDRHRADKDFNAY-AWEZNQCLSA-N 0 3 333.432 2.907 20 5 EFBDHN COc1cccc([C@H](CNc2ncc([N+](=O)[O-])cc2F)N(C)C)c1 ZINC000413029199 477477206 /nfs/dbraw/zinc/47/72/06/477477206.db2.gz RLEKVVHQGBJDPZ-HNNXBMFYSA-N 0 3 334.351 2.852 20 5 EFBDHN CC[C@H](NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC000449235783 477499865 /nfs/dbraw/zinc/49/98/65/477499865.db2.gz HNZCNUIVEAXQRI-INIZCTEOSA-N 0 3 340.445 2.927 20 5 EFBDHN Cc1cccc(CCNCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000449238681 477500865 /nfs/dbraw/zinc/50/08/65/477500865.db2.gz SLQDLNXXUKMWGE-UHFFFAOYSA-N 0 3 348.424 2.509 20 5 EFBDHN CCc1nn(C)c(OC)c1CN[C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449246217 477505071 /nfs/dbraw/zinc/50/50/71/477505071.db2.gz CWQPEMLJLZSHDO-LBPRGKRZSA-N 0 3 332.404 2.620 20 5 EFBDHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)c1ncc([N+](=O)[O-])cc1F ZINC000413235261 477582147 /nfs/dbraw/zinc/58/21/47/477582147.db2.gz JMCCNULOJOQKGH-BBRMVZONSA-N 0 3 345.378 2.653 20 5 EFBDHN CC(C)Oc1cc(C(=O)N2CCC[C@H]3CN(C)C[C@H]32)ccc1[N+](=O)[O-] ZINC000425071709 477630200 /nfs/dbraw/zinc/63/02/00/477630200.db2.gz ZSGYHXWJZDMZKW-GOEBONIOSA-N 0 3 347.415 2.548 20 5 EFBDHN O=C(NC[C@H]1NCCc2ccccc21)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000377075971 477630222 /nfs/dbraw/zinc/63/02/22/477630222.db2.gz DSMJPTNJKBICAJ-OAHLLOKOSA-N 0 3 345.786 2.865 20 5 EFBDHN C[C@H]1CN(c2nc(-c3ccc([N+](=O)[O-])cc3)no2)CCN(C2CC2)C1 ZINC000450551313 477630366 /nfs/dbraw/zinc/63/03/66/477630366.db2.gz ZLOJZMYLCQPRRL-GFCCVEGCSA-N 0 3 343.387 2.565 20 5 EFBDHN COC[C@@H]1CCCCN(CCOc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000372095435 477636586 /nfs/dbraw/zinc/63/65/86/477636586.db2.gz OGZAKUAYSAONSD-CQSZACIVSA-N 0 3 338.404 2.731 20 5 EFBDHN CC(C)CN(CCN(C)C)C(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000458884553 477640930 /nfs/dbraw/zinc/64/09/30/477640930.db2.gz DHCIAIXLPOXQLL-AWEZNQCLSA-N 0 3 336.436 2.885 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)CCN(c2ccc([N+](=O)[O-])cn2)C1 ZINC000450811150 477725043 /nfs/dbraw/zinc/72/50/43/477725043.db2.gz NDQMEHWJASYCIY-OAHLLOKOSA-N 0 3 326.400 2.948 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1cccc(CN(C)C)c1 ZINC000426879605 477755656 /nfs/dbraw/zinc/75/56/56/477755656.db2.gz UGXJMQHFWFXEEE-UHFFFAOYSA-N 0 3 329.356 2.917 20 5 EFBDHN CC[C@H]1CCCCN1CCNC(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000426898993 477758704 /nfs/dbraw/zinc/75/87/04/477758704.db2.gz XYGWLFXUTUYKCG-ZDUSSCGKSA-N 0 3 335.404 2.598 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)CN1C[C@H](C)C[C@H](C)C1 ZINC000426915783 477759174 /nfs/dbraw/zinc/75/91/74/477759174.db2.gz HIDSECLTVURSMD-MJBXVCDLSA-N 0 3 349.431 2.700 20 5 EFBDHN C[C@H](CN(C)Cc1ccccc1)Nc1c(C(N)=O)cccc1[N+](=O)[O-] ZINC000420616711 477759567 /nfs/dbraw/zinc/75/95/67/477759567.db2.gz SUOZZRRNQXCNPC-CYBMUJFWSA-N 0 3 342.399 2.626 20 5 EFBDHN CC(=O)c1ccc([N+](=O)[O-])cc1NC1CCN(C[C@H]2CCOC2)CC1 ZINC000367936745 477761580 /nfs/dbraw/zinc/76/15/80/477761580.db2.gz YYRSFIOMMOBEBL-CQSZACIVSA-N 0 3 347.415 2.710 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)CCN1C ZINC000437984750 477783214 /nfs/dbraw/zinc/78/32/14/477783214.db2.gz KCPWOWHGLLFHAD-DZGCQCFKSA-N 0 3 346.431 2.752 20 5 EFBDHN C[C@H]1CN(C(=O)/C=C\c2ccc(F)cc2[N+](=O)[O-])CCN(C2CC2)C1 ZINC000493790333 477825134 /nfs/dbraw/zinc/82/51/34/477825134.db2.gz YEVLRYUBVPKANI-RBWDJNPFSA-N 0 3 347.390 2.690 20 5 EFBDHN CC[C@H]1CN(Cc2c(Cl)cccc2[N+](=O)[O-])CCN1C[C@H](C)O ZINC000493819332 477841366 /nfs/dbraw/zinc/84/13/66/477841366.db2.gz MQESFAODTAYTGG-STQMWFEESA-N 0 3 341.839 2.525 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1C[C@H](N2CCOCC2)C[C@H]1C ZINC000558411624 477864306 /nfs/dbraw/zinc/86/43/06/477864306.db2.gz JWQHBSUVKJUHAU-LNCHUYFUSA-N 0 3 345.443 2.793 20 5 EFBDHN COc1cc(C[NH2+][C@@H]2[C@@H]3Cc4ccccc4[C@@H]32)c([N+](=O)[O-])cc1[O-] ZINC000558417938 477866075 /nfs/dbraw/zinc/86/60/75/477866075.db2.gz LSAKVIYXIDCHQB-JEBQAFNWSA-N 0 3 326.352 2.737 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@H]2CCN(CCOCC3CCCC3)C2)nc1 ZINC000459377342 477874615 /nfs/dbraw/zinc/87/46/15/477874615.db2.gz MIEWUOOUOSEHSA-HNNXBMFYSA-N 0 3 334.420 2.683 20 5 EFBDHN C[C@H]1CC[C@@H](O)CN1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000421013825 477901073 /nfs/dbraw/zinc/90/10/73/477901073.db2.gz KGYMQALGBDDJIK-SWLSCSKDSA-N 0 3 331.372 2.638 20 5 EFBDHN CN(C)[C@@H](CNc1cccc(C(N)=O)c1[N+](=O)[O-])c1cccc(F)c1 ZINC000439130507 477934353 /nfs/dbraw/zinc/93/43/53/477934353.db2.gz KIESDWYTTLDEQA-HNNXBMFYSA-N 0 3 346.362 2.548 20 5 EFBDHN Cc1ccc([C@H](CNc2cccc(C(N)=O)c2[N+](=O)[O-])N(C)C)cc1 ZINC000439162535 477939735 /nfs/dbraw/zinc/93/97/35/477939735.db2.gz QCNBUSKTWVXTOL-INIZCTEOSA-N 0 3 342.399 2.717 20 5 EFBDHN C[C@H](N[C@@]1(C)CCO[C@@H]1C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000494276823 477957068 /nfs/dbraw/zinc/95/70/68/477957068.db2.gz LUPNKTPNBRQBIH-WMFXKJRFSA-N 0 3 341.795 2.732 20 5 EFBDHN C[C@@H]1CCN(CCNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000532625210 477959669 /nfs/dbraw/zinc/95/96/69/477959669.db2.gz VAGYJDCLESLGBL-SNVBAGLBSA-N 0 3 345.321 2.685 20 5 EFBDHN COC(=O)[C@]1(c2ccccc2)CCN(Cc2ccccc2[N+](=O)[O-])C1 ZINC000428793535 477984188 /nfs/dbraw/zinc/98/41/88/477984188.db2.gz ZDBFNJXSJFVWPO-LJQANCHMSA-N 0 3 340.379 2.912 20 5 EFBDHN CC[C@H]1CN(CCN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CCO1 ZINC000494459334 477992202 /nfs/dbraw/zinc/99/22/02/477992202.db2.gz XHNRJDPZJYMKRE-FUHWJXTLSA-N 0 3 333.432 2.673 20 5 EFBDHN C[C@@H](Cn1cccn1)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494498580 477999437 /nfs/dbraw/zinc/99/94/37/477999437.db2.gz WCCKSBDZOWLAMX-JTQLQIEISA-N 0 3 328.294 2.988 20 5 EFBDHN C[C@@]1(NC(=O)c2ccccc2[N+](=O)[O-])CCN(Cc2ccccc2)C1 ZINC000516870713 478002286 /nfs/dbraw/zinc/00/22/86/478002286.db2.gz LDYIJLVMIIZKES-LJQANCHMSA-N 0 3 339.395 2.989 20 5 EFBDHN O=[N+]([O-])c1ccc2oc(CN3CCC[C@@H]3[C@H]3CCC[C@H]3O)nc2c1 ZINC000451415774 478002650 /nfs/dbraw/zinc/00/26/50/478002650.db2.gz JUCMIFVLHFOJMY-BPLDGKMQSA-N 0 3 331.372 2.861 20 5 EFBDHN C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000451418719 478004114 /nfs/dbraw/zinc/00/41/14/478004114.db2.gz MWDUEKDNFHNUOO-BASLNEPJSA-N 0 3 347.415 2.547 20 5 EFBDHN C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000451418721 478004162 /nfs/dbraw/zinc/00/41/62/478004162.db2.gz MWDUEKDNFHNUOO-VJUNAUMWSA-N 0 3 347.415 2.547 20 5 EFBDHN C[C@H](N[C@@H]1[C@@H]2CCCO[C@@H]2C1(C)C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000439617446 478008279 /nfs/dbraw/zinc/00/82/79/478008279.db2.gz YORLJMPAICDLOE-RKLWJJNISA-N 0 3 347.415 2.715 20 5 EFBDHN CN(CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1cccc(O)c1 ZINC000532988521 478018297 /nfs/dbraw/zinc/01/82/97/478018297.db2.gz ZCNXISVNPJZLJX-UHFFFAOYSA-N 0 3 329.356 2.761 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@@H]1[C@@H]2CCCO[C@@H]2C1(C)C ZINC000451477143 478037553 /nfs/dbraw/zinc/03/75/53/478037553.db2.gz HGIFYXQJBLEBJI-XKQJLSEDSA-N 0 3 347.415 2.635 20 5 EFBDHN CC1(C)[C@H](NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@H]2CCCO[C@@H]21 ZINC000451480402 478040946 /nfs/dbraw/zinc/04/09/46/478040946.db2.gz QBRIVVLIVPWSGY-LYRGGWFBSA-N 0 3 330.388 2.764 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCN(C)[C@@H](C)C1 ZINC000439875318 478041090 /nfs/dbraw/zinc/04/10/90/478041090.db2.gz RZIXGNBBZOGOFL-RYUDHWBXSA-N 0 3 336.392 2.598 20 5 EFBDHN CC1(C)[C@H](NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@@H]2CCCO[C@H]21 ZINC000451480361 478041437 /nfs/dbraw/zinc/04/14/37/478041437.db2.gz QBRIVVLIVPWSGY-IUIKQTSFSA-N 0 3 330.388 2.764 20 5 EFBDHN NC(=O)CC1(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000421350398 478045993 /nfs/dbraw/zinc/04/59/93/478045993.db2.gz LKEVJXCSWZTSAO-UHFFFAOYSA-N 0 3 329.356 2.600 20 5 EFBDHN CO[C@H]1C[C@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1(C)C ZINC000451506339 478057707 /nfs/dbraw/zinc/05/77/07/478057707.db2.gz RYFMUUPXCWLTAD-STQMWFEESA-N 0 3 341.795 2.590 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC[C@H](N2CCOCC2)C1 ZINC000517245062 478071911 /nfs/dbraw/zinc/07/19/11/478071911.db2.gz QQZIZCHLVISDRQ-RDJZCZTQSA-N 0 3 333.432 2.761 20 5 EFBDHN CN(Cc1cc([N+](=O)[O-])ccc1OC(F)F)C[C@@H]1CCCN1C ZINC000421412269 478080095 /nfs/dbraw/zinc/08/00/95/478080095.db2.gz SDXXGUULHXFNCN-ZDUSSCGKSA-N 0 3 329.347 2.722 20 5 EFBDHN CO[C@@H]1C[C@@H](N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C12CCC2 ZINC000459777440 478086419 /nfs/dbraw/zinc/08/64/19/478086419.db2.gz VWTQVCNEXVPCTO-APHBMKBZSA-N 0 3 347.415 2.777 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCN2CC[C@@H](O)[C@H](C3CCCC3)C2)c1 ZINC000459792759 478095428 /nfs/dbraw/zinc/09/54/28/478095428.db2.gz JBOMZCOMMUOQHL-ZWKOTPCHSA-N 0 3 334.416 2.847 20 5 EFBDHN CO[C@@H]1C[C@@H](NCc2cc([N+](=O)[O-])cc3c2OCOC3)C12CCC2 ZINC000459793199 478095794 /nfs/dbraw/zinc/09/57/94/478095794.db2.gz TUVZOWWLCZFIAF-HUUCEWRRSA-N 0 3 334.372 2.509 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2cnc(CCN3C[C@@H]4C[C@H]3CS4)o2)c1 ZINC000459796767 478098867 /nfs/dbraw/zinc/09/88/67/478098867.db2.gz QPZAIPMLQRPOFZ-KBPBESRZSA-N 0 3 331.397 2.982 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCN(C)[C@H](C(C)C)C1 ZINC000488005244 478105262 /nfs/dbraw/zinc/10/52/62/478105262.db2.gz CKYDDCHDMRUWPF-KRWDZBQOSA-N 0 3 348.447 2.504 20 5 EFBDHN COCCN(CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@@H]1CCC[C@@H]1C ZINC000488039855 478109669 /nfs/dbraw/zinc/10/96/69/478109669.db2.gz CZSKESKSKIFBCU-SUMWQHHRSA-N 0 3 349.431 2.979 20 5 EFBDHN CCOC(=O)[C@@H]1CCCC[C@@H]1NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000451594737 478115421 /nfs/dbraw/zinc/11/54/21/478115421.db2.gz CADZPVXOJNWVDX-OLZOCXBDSA-N 0 3 346.387 2.683 20 5 EFBDHN CC(C)[C@@H](CO)[C@@H](NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(C)C ZINC000451603602 478119805 /nfs/dbraw/zinc/11/98/05/478119805.db2.gz XIDYYVAZMYNYCL-DYVFJYSZSA-N 0 3 334.420 2.850 20 5 EFBDHN CC(C)[C@H](CO)[C@@H](NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(C)C ZINC000451603604 478119821 /nfs/dbraw/zinc/11/98/21/478119821.db2.gz XIDYYVAZMYNYCL-GUYCJALGSA-N 0 3 334.420 2.850 20 5 EFBDHN CC(C)[C@@H](CO)[C@H](NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(C)C ZINC000451603601 478120189 /nfs/dbraw/zinc/12/01/89/478120189.db2.gz XIDYYVAZMYNYCL-CXAGYDPISA-N 0 3 334.420 2.850 20 5 EFBDHN CCOc1cc(CN2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)ccc1[N+](=O)[O-] ZINC000451698762 478163257 /nfs/dbraw/zinc/16/32/57/478163257.db2.gz JVPHSECOXSCSJK-OAGGEKHMSA-N 0 3 334.416 2.976 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCN[C@@]1(CO)CCCc2ccccc21 ZINC000440822384 478165431 /nfs/dbraw/zinc/16/54/31/478165431.db2.gz TWNSNHVJBUXHLK-LJQANCHMSA-N 0 3 342.395 2.787 20 5 EFBDHN Cc1cc(C(=O)N2CCCN(CC3CCC3)CC2)cc([N+](=O)[O-])c1 ZINC000518429583 478167068 /nfs/dbraw/zinc/16/70/68/478167068.db2.gz TZFZWTXFEVWVCH-UHFFFAOYSA-N 0 3 331.416 2.851 20 5 EFBDHN COC(=O)C[C@](C)(NCCc1ccc([N+](=O)[O-])cc1)c1ccccn1 ZINC000429672568 478170664 /nfs/dbraw/zinc/17/06/64/478170664.db2.gz OPERHQYEVJBCGS-SFHVURJKSA-N 0 3 343.383 2.600 20 5 EFBDHN NC(=O)c1ccc(CN2CCCc3ccccc3CC2)c([N+](=O)[O-])c1 ZINC000451712422 478173004 /nfs/dbraw/zinc/17/30/04/478173004.db2.gz QRKUNAYWBXHELL-UHFFFAOYSA-N 0 3 339.395 2.685 20 5 EFBDHN CC(=O)c1ccc([N+](=O)[O-])cc1N1CCN([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000488722700 478174688 /nfs/dbraw/zinc/17/46/88/478174688.db2.gz VOWFNEJGBVSKMJ-OGHNNQOOSA-N 0 3 331.416 2.964 20 5 EFBDHN C[C@@H]1C[C@@H]1N1CCN(c2c3c(ccc2[N+](=O)[O-])NCC3)C[C@@H](C)C1 ZINC000488747162 478179176 /nfs/dbraw/zinc/17/91/76/478179176.db2.gz IJVGZISGKPGFIN-AHIWAGSCSA-N 0 3 330.432 2.729 20 5 EFBDHN CCC1(CC)[C@H](NCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](C)[C@@H]1OC ZINC000561466924 478187700 /nfs/dbraw/zinc/18/77/00/478187700.db2.gz ARIBFBNELKLXTK-JLZZUVOBSA-N 0 3 349.431 2.963 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCN(c3ccnc4ccccc43)CC2)nc1 ZINC000561862570 478205617 /nfs/dbraw/zinc/20/56/17/478205617.db2.gz FSCUMMDPQWVYPN-UHFFFAOYSA-N 0 3 335.367 2.865 20 5 EFBDHN CN(CCn1cc([N+](=O)[O-])ccc1=O)[C@@H]1CCCc2ccccc21 ZINC000536376756 478249310 /nfs/dbraw/zinc/24/93/10/478249310.db2.gz CWNBEMQCYDNWLP-QGZVFWFLSA-N 0 3 327.384 2.766 20 5 EFBDHN O=[N+]([O-])c1cc(CN2CCC[C@@H]2[C@H]2CCCOC2)c2c(c1)COCO2 ZINC000579350060 478277262 /nfs/dbraw/zinc/27/72/62/478277262.db2.gz YQKFKZOIJWOCTI-SUMWQHHRSA-N 0 3 348.399 2.852 20 5 EFBDHN CC[C@@H](CN1CCCC1)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000590667788 478282602 /nfs/dbraw/zinc/28/26/02/478282602.db2.gz LKASSHZKFSHSFZ-HNNXBMFYSA-N 0 3 347.415 2.548 20 5 EFBDHN O=C1CCCN1CCCN1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000562716820 478328488 /nfs/dbraw/zinc/32/84/88/478328488.db2.gz ZESRRRSEAZTVJA-MRXNPFEDSA-N 0 3 331.416 2.787 20 5 EFBDHN CC1(C)C[C@@H](CNCc2cc3c(cc2[N+](=O)[O-])OCCO3)CCO1 ZINC000590781203 478336747 /nfs/dbraw/zinc/33/67/47/478336747.db2.gz FVJKHVDOFXJRBD-LBPRGKRZSA-N 0 3 336.388 2.661 20 5 EFBDHN CCC(C)(C)N1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000594389832 478356723 /nfs/dbraw/zinc/35/67/23/478356723.db2.gz ODHLCRSWIRERGL-UHFFFAOYSA-N 0 3 349.431 2.697 20 5 EFBDHN O=C(N[C@H]1CCCN2CCCC[C@H]12)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000594418185 478374900 /nfs/dbraw/zinc/37/49/00/478374900.db2.gz GYTGNPZFPRRPMX-UONOGXRCSA-N 0 3 337.807 2.995 20 5 EFBDHN C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1nnc([C@@H]2CCCO2)[n-]1 ZINC000594514458 478421134 /nfs/dbraw/zinc/42/11/34/478421134.db2.gz YFKWYUXQHXDJGZ-DOMZBBRYSA-N 0 3 345.403 2.675 20 5 EFBDHN COc1cc(CN[C@H](C)Cc2ccccn2)c([N+](=O)[O-])cc1OC ZINC000594517209 478422533 /nfs/dbraw/zinc/42/25/33/478422533.db2.gz ICHXFGCVRIWUGB-GFCCVEGCSA-N 0 3 331.372 2.728 20 5 EFBDHN CC[C@H]1CN(C)CCCN1C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000597603440 478428227 /nfs/dbraw/zinc/42/82/27/478428227.db2.gz BYXDEXGJEZXOFI-ZDUSSCGKSA-N 0 3 337.445 2.630 20 5 EFBDHN C[C@@H](C(=O)N1CC[C@@]2(C1)CCCN(C)C2)c1cccc([N+](=O)[O-])c1 ZINC000570750925 478436837 /nfs/dbraw/zinc/43/68/37/478436837.db2.gz XXFVGBOVVNOQKV-KDOFPFPSSA-N 0 3 331.416 2.643 20 5 EFBDHN CC[C@H](CN1CCCC1)NC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000591063094 478446189 /nfs/dbraw/zinc/44/61/89/478446189.db2.gz GGJOUJXIGANDBK-OAHLLOKOSA-N 0 3 349.431 2.986 20 5 EFBDHN CC[C@@H](CN1CCCC1)NC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000591063093 478446686 /nfs/dbraw/zinc/44/66/86/478446686.db2.gz GGJOUJXIGANDBK-HNNXBMFYSA-N 0 3 349.431 2.986 20 5 EFBDHN O=C1[C@H](N2CC[C@@H](C3CCC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000591062982 478447806 /nfs/dbraw/zinc/44/78/06/478447806.db2.gz DSZANTDWTBOAMK-RHSMWYFYSA-N 0 3 329.400 2.822 20 5 EFBDHN O=[N+]([O-])c1ccc2ncnc(N[C@H]3CCCN4CCCC[C@H]34)c2c1 ZINC000594596605 478455360 /nfs/dbraw/zinc/45/53/60/478455360.db2.gz AUHVPCMWJXPXMX-JKSUJKDBSA-N 0 3 327.388 2.967 20 5 EFBDHN O=C1CCc2cc([N+](=O)[O-])c(N[C@H]3CCCN4CCCC[C@@H]34)cc2N1 ZINC000594604578 478462157 /nfs/dbraw/zinc/46/21/57/478462157.db2.gz ZZLPHLIYOSVCQF-BBRMVZONSA-N 0 3 344.415 2.908 20 5 EFBDHN O=c1[nH]cnc2cc(N[C@@H]3CCCN4CCCC[C@@H]34)c([N+](=O)[O-])cc21 ZINC000594603272 478462249 /nfs/dbraw/zinc/46/22/49/478462249.db2.gz SUCRYNNMQAZHEJ-DOMZBBRYSA-N 0 3 343.387 2.672 20 5 EFBDHN COC1CCN(CCNc2ncc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000591149342 478476265 /nfs/dbraw/zinc/47/62/65/478476265.db2.gz MYEJGSRTXXNEEJ-UHFFFAOYSA-N 0 3 348.325 2.531 20 5 EFBDHN COC(=O)c1cc(-c2ccc([C@H]3CNCCO3)cc2)cc([N+](=O)[O-])c1 ZINC000600788179 478520300 /nfs/dbraw/zinc/52/03/00/478520300.db2.gz JXJPKGUXTZGNPD-QGZVFWFLSA-N 0 3 342.351 2.709 20 5 EFBDHN C[C@H]1CN(CCN[C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)CCO1 ZINC000591347975 478532220 /nfs/dbraw/zinc/53/22/20/478532220.db2.gz NVTPOCZPXXFENL-KBXCAEBGSA-N 0 3 333.432 2.673 20 5 EFBDHN Cn1cc([C@@H]2CN(CCOc3ccc([N+](=O)[O-])cc3)CC2(C)C)cn1 ZINC000563363846 478532619 /nfs/dbraw/zinc/53/26/19/478532619.db2.gz LUTMSZSALRVMEM-KRWDZBQOSA-N 0 3 344.415 2.833 20 5 EFBDHN CC(C)(C)N1CC[C@@H](NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000597922511 478575974 /nfs/dbraw/zinc/57/59/74/478575974.db2.gz FEWSKZFOWIWQLC-LLVKDONJSA-N 0 3 325.796 2.851 20 5 EFBDHN C[C@@H](NC(=O)C[C@H](N)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000582354740 478576644 /nfs/dbraw/zinc/57/66/44/478576644.db2.gz FAEXAINHTONHSH-CZUORRHYSA-N 0 3 327.384 2.732 20 5 EFBDHN CC(C)(C)N1CC[C@@H](NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000597925482 478579022 /nfs/dbraw/zinc/57/90/22/478579022.db2.gz VSCVHBANCDKMRX-CQSZACIVSA-N 0 3 333.432 2.861 20 5 EFBDHN CC(C)(C)N1CC[C@H](NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000597925480 478579540 /nfs/dbraw/zinc/57/95/40/478579540.db2.gz VSCVHBANCDKMRX-AWEZNQCLSA-N 0 3 333.432 2.861 20 5 EFBDHN CC(C)(C)N1CC[C@@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000597926019 478581116 /nfs/dbraw/zinc/58/11/16/478581116.db2.gz ZMNZRRRCNJJPHC-CQSZACIVSA-N 0 3 347.415 2.547 20 5 EFBDHN COc1ccc([C@@H](CO)CN[C@@H]2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000582370436 478582150 /nfs/dbraw/zinc/58/21/50/478582150.db2.gz PTICUFBMMRJHMA-RDTXWAMCSA-N 0 3 342.395 2.956 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](NC[C@@H]2C[C@H](F)CN2)c2ccccc2)c1 ZINC000591581213 478585897 /nfs/dbraw/zinc/58/58/97/478585897.db2.gz NYADWPFSWVAZNB-XYJFISCASA-N 0 3 329.375 2.974 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@@H]1CCC[C@@H]([S@](C)=O)C1 ZINC000594960644 478606437 /nfs/dbraw/zinc/60/64/37/478606437.db2.gz JPRVOYYUACJTFA-NHBFPYQTSA-N 0 3 340.445 2.773 20 5 EFBDHN C[C@@H](O)[C@@H]1CCCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000541890334 478607775 /nfs/dbraw/zinc/60/77/75/478607775.db2.gz RCZZXPIKCKCHRN-UKRRQHHQSA-N 0 3 344.415 2.588 20 5 EFBDHN C[C@@H](CN1CCC(C)CC1)NCc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000594979244 478615637 /nfs/dbraw/zinc/61/56/37/478615637.db2.gz GQGKTBUPCRYMIP-AWEZNQCLSA-N 0 3 349.431 2.576 20 5 EFBDHN CC1(C)CCC[C@H]1CNCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000591767789 478625390 /nfs/dbraw/zinc/62/53/90/478625390.db2.gz KWUXCZBJKQYGIV-ZDUSSCGKSA-N 0 3 340.445 2.784 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@H](O)Cc1ccccc1 ZINC000595011744 478627671 /nfs/dbraw/zinc/62/76/71/478627671.db2.gz MEFZJZINSOXVKM-CZUORRHYSA-N 0 3 330.384 2.858 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCCCN1CCCCC1=O ZINC000595010797 478628379 /nfs/dbraw/zinc/62/83/79/478628379.db2.gz ILKRRIOSTXZJDD-CYBMUJFWSA-N 0 3 335.404 2.657 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@H]1CCO[C@@]2(CCOC2)C1 ZINC000595028551 478634676 /nfs/dbraw/zinc/63/46/76/478634676.db2.gz UTEKANYDXYMMRR-DCGLDWPTSA-N 0 3 336.388 2.592 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCCCNC(=O)C1CCC1 ZINC000595027587 478635051 /nfs/dbraw/zinc/63/50/51/478635051.db2.gz QJSYSYNTMYDTLJ-GFCCVEGCSA-N 0 3 335.404 2.560 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@H](O)Cc1cccc(F)c1 ZINC000595041367 478638716 /nfs/dbraw/zinc/63/87/16/478638716.db2.gz KOBDQLQRECTMGT-BLLLJJGKSA-N 0 3 348.374 2.997 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCC1([S@](C)=O)CCC1 ZINC000595040326 478638938 /nfs/dbraw/zinc/63/89/38/478638938.db2.gz UAVOQQYZYJJIIZ-XFNZEKPQSA-N 0 3 326.418 2.555 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@H]1CCCN(C(C)=O)C1 ZINC000595046709 478640449 /nfs/dbraw/zinc/64/04/49/478640449.db2.gz CUWPEYXJCRAPHM-TZMCWYRMSA-N 0 3 335.404 2.513 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@H]1CC[C@H](C(N)=O)CC1 ZINC000595044926 478640597 /nfs/dbraw/zinc/64/05/97/478640597.db2.gz PELICKQBNXIACM-JHJVBQTASA-N 0 3 335.404 2.546 20 5 EFBDHN O=[N+]([O-])c1sccc1NC[C@@]1(O)CCN(Cc2ccccc2)C1 ZINC000601119405 478666748 /nfs/dbraw/zinc/66/67/48/478666748.db2.gz RMOZCOZVOLBJNY-INIZCTEOSA-N 0 3 333.413 2.705 20 5 EFBDHN COc1ccccc1C[C@](C)(CO)NCc1cccc([N+](=O)[O-])c1 ZINC000601154163 478692265 /nfs/dbraw/zinc/69/22/65/478692265.db2.gz ZBEQVKQKNYFJME-GOSISDBHSA-N 0 3 330.384 2.687 20 5 EFBDHN CN(CCc1ccccc1)[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])o2)C1 ZINC000598194002 478699752 /nfs/dbraw/zinc/69/97/52/478699752.db2.gz CXFQDQOMRUVSHV-HNNXBMFYSA-N 0 3 343.383 2.577 20 5 EFBDHN Cc1cc(C(=O)Nc2ccc([C@@H]3CNCCO3)cc2)cc([N+](=O)[O-])c1 ZINC000595256102 478704736 /nfs/dbraw/zinc/70/47/36/478704736.db2.gz AWTQWVNXHMXTND-KRWDZBQOSA-N 0 3 341.367 2.816 20 5 EFBDHN Cc1cc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2)cc([N+](=O)[O-])c1 ZINC000595256104 478705028 /nfs/dbraw/zinc/70/50/28/478705028.db2.gz AWTQWVNXHMXTND-QGZVFWFLSA-N 0 3 341.367 2.816 20 5 EFBDHN COc1c(C(=O)N[C@@H]2CCN(C3CCCCC3)C2)cccc1[N+](=O)[O-] ZINC000598218507 478709713 /nfs/dbraw/zinc/70/97/13/478709713.db2.gz GSGAJSFTMVBMPU-CYBMUJFWSA-N 0 3 347.415 2.740 20 5 EFBDHN CN(C[C@H]1CCCN(C)C1)C(=O)/C=C\c1ccc(F)cc1[N+](=O)[O-] ZINC000491870984 478718206 /nfs/dbraw/zinc/71/82/06/478718206.db2.gz WQRMXQNVQIRNRO-WOLRVDTOSA-N 0 3 335.379 2.547 20 5 EFBDHN C[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1CNc1cc[n-]c(=O)c1[N+](=O)[O-] ZINC000601211051 478724642 /nfs/dbraw/zinc/72/46/42/478724642.db2.gz VRHJJUQSCDPTTC-ZFWWWQNUSA-N 0 3 342.399 2.875 20 5 EFBDHN C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNc1cc[n-]c(=O)c1[N+](=O)[O-] ZINC000601211051 478724649 /nfs/dbraw/zinc/72/46/49/478724649.db2.gz VRHJJUQSCDPTTC-ZFWWWQNUSA-N 0 3 342.399 2.875 20 5 EFBDHN C[C@@H](CN1CCC(C)CC1)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000598265496 478733364 /nfs/dbraw/zinc/73/33/64/478733364.db2.gz TZEZEKOBEHSOBM-JCGIZDLHSA-N 0 3 345.443 2.935 20 5 EFBDHN Cc1noc(CN2CCCN(Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000595329766 478734785 /nfs/dbraw/zinc/73/47/85/478734785.db2.gz IKLHSPJXYFEGFN-AWEZNQCLSA-N 0 3 344.415 2.988 20 5 EFBDHN CCCN1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2SCC)C1 ZINC000598341410 478774771 /nfs/dbraw/zinc/77/47/71/478774771.db2.gz AZAGTRGGWKZRLT-GFCCVEGCSA-N 0 3 337.445 2.921 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)CN1C[C@H](C)C[C@H](C)C1 ZINC000500583343 478793251 /nfs/dbraw/zinc/79/32/51/478793251.db2.gz PICYEPLVUWKUCX-MJBXVCDLSA-N 0 3 349.431 2.700 20 5 EFBDHN Cc1noc(CN2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)c1[N+](=O)[O-] ZINC000595493553 478818231 /nfs/dbraw/zinc/81/82/31/478818231.db2.gz SHQGAQJULHJKNV-OAGGEKHMSA-N 0 3 343.383 2.896 20 5 EFBDHN O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2N[C@@H]2c3ccccc3C[C@@H]2O)n1 ZINC000564812396 478819024 /nfs/dbraw/zinc/81/90/24/478819024.db2.gz MMIMHHZOEAZJSV-XLMAVXFVSA-N 0 3 342.399 2.523 20 5 EFBDHN CC(C)(CO)[C@H](NCCOc1ccc([N+](=O)[O-])cc1)c1cccnc1 ZINC000595498604 478820711 /nfs/dbraw/zinc/82/07/11/478820711.db2.gz GIJVXNWWSBUSQG-QGZVFWFLSA-N 0 3 345.399 2.718 20 5 EFBDHN CC[C@H]1C[C@]1(NCCn1cc([N+](=O)[O-])ccc1=O)c1cccc(C)c1 ZINC000502590036 478825331 /nfs/dbraw/zinc/82/53/31/478825331.db2.gz BKNDJSXXBFTTKN-HNAYVOBHSA-N 0 3 341.411 2.980 20 5 EFBDHN CC(C)CC1(CNCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000564849611 478830286 /nfs/dbraw/zinc/83/02/86/478830286.db2.gz NJYCHLLBGNIJML-UHFFFAOYSA-N 0 3 340.445 2.784 20 5 EFBDHN Cc1noc(CN2CCN(Cc3ccccc3)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000595519209 478831197 /nfs/dbraw/zinc/83/11/97/478831197.db2.gz DQTVWQYQEWCYFN-AWEZNQCLSA-N 0 3 344.415 2.845 20 5 EFBDHN C[C@@H]1CN(CCN2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C[C@H](C)O1 ZINC000595527553 478835123 /nfs/dbraw/zinc/83/51/23/478835123.db2.gz VBIPZXHXEGCOCD-SOLBZPMBSA-N 0 3 347.459 2.883 20 5 EFBDHN CCCN(C(=O)Nc1ccc(OC)c([N+](=O)[O-])c1)[C@@H]1CCN(C)C1 ZINC000592244236 478838464 /nfs/dbraw/zinc/83/84/64/478838464.db2.gz FUIGWSNNDRJPFQ-CYBMUJFWSA-N 0 3 336.392 2.551 20 5 EFBDHN CC(C)[C@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCN1 ZINC000592241755 478839125 /nfs/dbraw/zinc/83/91/25/478839125.db2.gz HANSCXKGLWBSEG-GFCCVEGCSA-N 0 3 345.321 2.684 20 5 EFBDHN CCN1CCCN(Cc2cc(OC)c(F)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000595534579 478839443 /nfs/dbraw/zinc/83/94/43/478839443.db2.gz COVYXMGVEGDNAL-LBPRGKRZSA-N 0 3 325.384 2.659 20 5 EFBDHN C[C@H](CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)N1CCCC1 ZINC000545163827 478890691 /nfs/dbraw/zinc/89/06/91/478890691.db2.gz WHROGHJBCVSICK-GFCCVEGCSA-N 0 3 337.395 2.612 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN[C@@H](C(C)C)C1 ZINC000598569218 478901138 /nfs/dbraw/zinc/90/11/38/478901138.db2.gz BTFLRUJTTPZQNU-NVXWUHKLSA-N 0 3 333.432 2.620 20 5 EFBDHN CC(C)[C@H]1CN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CCN1 ZINC000598573787 478904016 /nfs/dbraw/zinc/90/40/16/478904016.db2.gz ORJJDYGLZOCBIH-GFCCVEGCSA-N 0 3 345.321 2.684 20 5 EFBDHN CC(C)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)CCN1 ZINC000598576731 478905797 /nfs/dbraw/zinc/90/57/97/478905797.db2.gz ZAQUQRVGXAGKFS-CYBMUJFWSA-N 0 3 345.321 2.684 20 5 EFBDHN COc1ccccc1CNC1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000583651959 478908453 /nfs/dbraw/zinc/90/84/53/478908453.db2.gz WRRKECNHMCFHRF-UHFFFAOYSA-N 0 3 342.399 2.757 20 5 EFBDHN CN1CCC2(CCCN2C(=O)/C=C/c2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000492323382 478930871 /nfs/dbraw/zinc/93/08/71/478930871.db2.gz YSCUNMAJYRDPAA-GQCTYLIASA-N 0 3 347.390 2.834 20 5 EFBDHN COC(=O)c1ccnc(N[C@H]2CCN(C3CCCCC3)C2)c1[N+](=O)[O-] ZINC000598636256 478937410 /nfs/dbraw/zinc/93/74/10/478937410.db2.gz DOLYUWDNAPOZCI-LBPRGKRZSA-N 0 3 348.403 2.595 20 5 EFBDHN CCOC(=O)c1cc(N[C@@H]2C[C@H](C)N(C3CC3)C2)ccc1[N+](=O)[O-] ZINC000583784958 478939784 /nfs/dbraw/zinc/93/97/84/478939784.db2.gz FHDXADKLTPIWFM-WCQYABFASA-N 0 3 333.388 2.809 20 5 EFBDHN CN(CCc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1CCN(C(C)(C)C)C1 ZINC000595701847 478944514 /nfs/dbraw/zinc/94/45/14/478944514.db2.gz GRSZKQHWTKPVJW-HNNXBMFYSA-N 0 3 348.447 2.652 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCOc2ccc3c(c2)OCCNC3)c1 ZINC000573110894 478994208 /nfs/dbraw/zinc/99/42/08/478994208.db2.gz JAFSHDNQXCJZOP-UHFFFAOYSA-N 0 3 330.340 2.535 20 5 EFBDHN COc1cccc(C(=O)N2CCCN(CC3CCC3)CC2)c1[N+](=O)[O-] ZINC000584099608 479014232 /nfs/dbraw/zinc/01/42/32/479014232.db2.gz OVEZIPRVZFVAKO-UHFFFAOYSA-N 0 3 347.415 2.551 20 5 EFBDHN CC[C@@H]1CCC[C@H]1CNCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000565654565 479054185 /nfs/dbraw/zinc/05/41/85/479054185.db2.gz MHXDOSYPTGAOEB-KGLIPLIRSA-N 0 3 340.445 2.784 20 5 EFBDHN CCCN(C(=O)Cc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCN(C)C1 ZINC000592828753 479063640 /nfs/dbraw/zinc/06/36/40/479063640.db2.gz JAABYUDLYUTFQX-CQSZACIVSA-N 0 3 339.823 2.733 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N(C)C[C@@H]1CC1(C)C ZINC000595908717 479064043 /nfs/dbraw/zinc/06/40/43/479064043.db2.gz KBBYQFZPMLTJKL-NEPJUHHUSA-N 0 3 335.404 2.908 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1cc2c(s1)CCNC2 ZINC000595914899 479069700 /nfs/dbraw/zinc/06/97/00/479069700.db2.gz GJRNNFQQTIOSAM-UHFFFAOYSA-N 0 3 331.397 2.574 20 5 EFBDHN CC(C)(NC(=O)c1cc2c(s1)CCNC2)c1ccc([N+](=O)[O-])cc1 ZINC000595968296 479085412 /nfs/dbraw/zinc/08/54/12/479085412.db2.gz XFFXPUTUQYZBPM-UHFFFAOYSA-N 0 3 345.424 2.967 20 5 EFBDHN O=c1[n-]ccc(NC[C@@H](c2ccccc2)[NH+]2CCCC2)c1[N+](=O)[O-] ZINC000596055251 479111623 /nfs/dbraw/zinc/11/16/23/479111623.db2.gz UCRSDQSZUXZFDV-HNNXBMFYSA-N 0 3 328.372 2.944 20 5 EFBDHN COc1ccc(-c2ccc(CNCCOCCF)o2)c([N+](=O)[O-])c1 ZINC000596057380 479112682 /nfs/dbraw/zinc/11/26/82/479112682.db2.gz NRIWLGZRQZBXOV-UHFFFAOYSA-N 0 3 338.335 2.939 20 5 EFBDHN O=c1[n-]ccc(NCc2ccccc2C[NH+]2CCCC2)c1[N+](=O)[O-] ZINC000596067104 479118971 /nfs/dbraw/zinc/11/89/71/479118971.db2.gz LVHVZPQMQGCGQR-UHFFFAOYSA-N 0 3 328.372 2.903 20 5 EFBDHN C[C@@H](C(=O)N(C)[C@@H](C)C1CCN(C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000515115630 479119725 /nfs/dbraw/zinc/11/97/25/479119725.db2.gz ARMHUXXESXBWIG-KGLIPLIRSA-N 0 3 333.432 2.887 20 5 EFBDHN O=[N+]([O-])c1ccc(CNCC[C@@H](O)COCc2ccccc2)c(F)c1 ZINC000599023475 479129657 /nfs/dbraw/zinc/12/96/57/479129657.db2.gz SRCVIGHYAFGGAN-QGZVFWFLSA-N 0 3 348.374 2.791 20 5 EFBDHN O=[N+]([O-])c1cc(CNCC[C@@H](O)COCc2ccccc2)cs1 ZINC000599021658 479129968 /nfs/dbraw/zinc/12/99/68/479129968.db2.gz DBJKUSWPUUEFAI-OAHLLOKOSA-N 0 3 336.413 2.714 20 5 EFBDHN C[C@@H](c1ccccc1)[N@@H+]1CC[C@H](Nc2cc[n-]c(=O)c2[N+](=O)[O-])C1 ZINC000596090004 479131724 /nfs/dbraw/zinc/13/17/24/479131724.db2.gz SUBITTJVPUUZQF-JSGCOSHPSA-N 0 3 328.372 2.943 20 5 EFBDHN C[C@@H](c1ccccc1)[N@H+]1CC[C@H](Nc2cc[n-]c(=O)c2[N+](=O)[O-])C1 ZINC000596090004 479131730 /nfs/dbraw/zinc/13/17/30/479131730.db2.gz SUBITTJVPUUZQF-JSGCOSHPSA-N 0 3 328.372 2.943 20 5 EFBDHN CCN(CC)[C@@H](CNc1ccc([N+](=O)[O-])c(C(N)=O)c1)c1ccco1 ZINC000596093131 479133457 /nfs/dbraw/zinc/13/34/57/479133457.db2.gz SBFQXCOXHCMXGO-HNNXBMFYSA-N 0 3 346.387 2.782 20 5 EFBDHN CCn1nncc1CN[C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000599061215 479144102 /nfs/dbraw/zinc/14/41/02/479144102.db2.gz LLLZXTOVQHEYHG-XJKSGUPXSA-N 0 3 329.404 2.707 20 5 EFBDHN CC[C@@H]1CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](CC)CO1 ZINC000593056932 479148977 /nfs/dbraw/zinc/14/89/77/479148977.db2.gz BMGWDODWSQFXEK-GDBMZVCRSA-N 0 3 335.404 2.813 20 5 EFBDHN C[C@H](N[C@@H]1CCO[C@H]1c1ccc(=O)[nH]c1)c1cccc([N+](=O)[O-])c1 ZINC000599075018 479150561 /nfs/dbraw/zinc/15/05/61/479150561.db2.gz ZWMZDIIHUZNNFK-CXMBCZLWSA-N 0 3 329.356 2.876 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCN3CC[C@H]2C3)nc1-c1ccc(F)cc1 ZINC000599084119 479155297 /nfs/dbraw/zinc/15/52/97/479155297.db2.gz RZBBHIOJOZDTKL-AWEZNQCLSA-N 0 3 328.347 2.690 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)NC1(C2CCC2)CC1 ZINC000593078880 479161146 /nfs/dbraw/zinc/16/11/46/479161146.db2.gz CLQFMDIHBQNBQX-LLVKDONJSA-N 0 3 333.388 2.853 20 5 EFBDHN C[C@@H]1CCN(c2cc[n-]c(=O)c2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000596144746 479162626 /nfs/dbraw/zinc/16/26/26/479162626.db2.gz MQYJGWSTVPRJRD-CQSZACIVSA-N 0 3 342.399 2.796 20 5 EFBDHN C[C@@H]1CCN(c2cc[n-]c(=O)c2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000596144746 479162627 /nfs/dbraw/zinc/16/26/27/479162627.db2.gz MQYJGWSTVPRJRD-CQSZACIVSA-N 0 3 342.399 2.796 20 5 EFBDHN CN1CCC[C@H](CNc2ccc(N)c([N+](=O)[O-])n2)[C@@H]1c1cccs1 ZINC000596146070 479162984 /nfs/dbraw/zinc/16/29/84/479162984.db2.gz KWYKLXKQXUUEFL-IAQYHMDHSA-N 0 3 347.444 2.550 20 5 EFBDHN CC[C@H](CN1CCCC1)NC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000610722169 479166277 /nfs/dbraw/zinc/16/62/77/479166277.db2.gz SFXRIZVNLHTSPV-OAHLLOKOSA-N 0 3 334.420 2.611 20 5 EFBDHN COc1ccc(OCCN2CC[C@H](c3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000573931336 479179285 /nfs/dbraw/zinc/17/92/85/479179285.db2.gz RTLROVWHFRJSNC-HNNXBMFYSA-N 0 3 343.383 2.867 20 5 EFBDHN O=[N+]([O-])c1cc(Br)cnc1N[C@@H]1CCN(CC2CC2)C1 ZINC000610769696 479182012 /nfs/dbraw/zinc/18/20/12/479182012.db2.gz GWXBFJULKXRIMM-LLVKDONJSA-N 0 3 341.209 2.649 20 5 EFBDHN CN(CCc1ccccc1[N+](=O)[O-])C(=O)[C@H]1CCN1C1CCCC1 ZINC000602151034 479204115 /nfs/dbraw/zinc/20/41/15/479204115.db2.gz MAFBHKGKJSEAPW-QGZVFWFLSA-N 0 3 331.416 2.613 20 5 EFBDHN C[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1Nc1cc[n-]c(=O)c1[N+](=O)[O-] ZINC000596217295 479205145 /nfs/dbraw/zinc/20/51/45/479205145.db2.gz BWHDDYYDBGLTOV-SWLSCSKDSA-N 0 3 328.372 2.628 20 5 EFBDHN C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1Nc1cc[n-]c(=O)c1[N+](=O)[O-] ZINC000596217295 479205150 /nfs/dbraw/zinc/20/51/50/479205150.db2.gz BWHDDYYDBGLTOV-SWLSCSKDSA-N 0 3 328.372 2.628 20 5 EFBDHN C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1Nc1cc[n-]c(=O)c1[N+](=O)[O-] ZINC000596217292 479206223 /nfs/dbraw/zinc/20/62/23/479206223.db2.gz BWHDDYYDBGLTOV-DOMZBBRYSA-N 0 3 328.372 2.628 20 5 EFBDHN C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Nc1cc[n-]c(=O)c1[N+](=O)[O-] ZINC000596217292 479206229 /nfs/dbraw/zinc/20/62/29/479206229.db2.gz BWHDDYYDBGLTOV-DOMZBBRYSA-N 0 3 328.372 2.628 20 5 EFBDHN CC[C@H](C)N[C@H](CNc1ccc([N+](=O)[O-])c(C(N)=O)c1)c1ccco1 ZINC000596231248 479212700 /nfs/dbraw/zinc/21/27/00/479212700.db2.gz OIQXFPIFADAYJQ-SMDDNHRTSA-N 0 3 346.387 2.828 20 5 EFBDHN CC[C@H](C)N[C@@H](CNc1ccc([N+](=O)[O-])c(C(N)=O)c1)c1ccco1 ZINC000596231246 479213013 /nfs/dbraw/zinc/21/30/13/479213013.db2.gz OIQXFPIFADAYJQ-FZMZJTMJSA-N 0 3 346.387 2.828 20 5 EFBDHN C[C@@H]1[C@@H](Nc2cc[n-]c(=O)c2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000596235843 479215855 /nfs/dbraw/zinc/21/58/55/479215855.db2.gz NFWLISVEQQPQRI-OCCSQVGLSA-N 0 3 328.372 2.770 20 5 EFBDHN C[C@@H]1[C@@H](Nc2cc[n-]c(=O)c2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000596235843 479215865 /nfs/dbraw/zinc/21/58/65/479215865.db2.gz NFWLISVEQQPQRI-OCCSQVGLSA-N 0 3 328.372 2.770 20 5 EFBDHN O=[N+]([O-])c1cnc(NC[C@H]2CCN(C3CC3)C2)c(C(F)(F)F)c1 ZINC000556842658 479223236 /nfs/dbraw/zinc/22/32/36/479223236.db2.gz IZRMYLZDYUTPFM-SECBINFHSA-N 0 3 330.310 2.905 20 5 EFBDHN Cc1ccc2c(c1)CC[C@@H]2NC[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000556860025 479228905 /nfs/dbraw/zinc/22/89/05/479228905.db2.gz TXZWKWJWHVWNFK-APWZRJJASA-N 0 3 342.395 2.920 20 5 EFBDHN C[C@H](NC(=O)N(C)CCN1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000593315194 479289574 /nfs/dbraw/zinc/28/95/74/479289574.db2.gz XTDWJWFHRWCWSU-AWEZNQCLSA-N 0 3 334.420 2.783 20 5 EFBDHN C[C@@H](NC(=O)N(C)CCN1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000593315196 479289599 /nfs/dbraw/zinc/28/95/99/479289599.db2.gz XTDWJWFHRWCWSU-CQSZACIVSA-N 0 3 334.420 2.783 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)ccc1Cn1cc(CCN2CCCCC2)nn1 ZINC000603217153 479308438 /nfs/dbraw/zinc/30/84/38/479308438.db2.gz WIHVTHZJDRBOKS-UHFFFAOYSA-N 0 3 349.822 2.916 20 5 EFBDHN CCN(C[C@H]1CCOC1)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000611205222 479310280 /nfs/dbraw/zinc/31/02/80/479310280.db2.gz OECLQSIQGJJXSO-UONOGXRCSA-N 0 3 335.404 2.589 20 5 EFBDHN C[C@@H]1CN(C[C@@H](O)COc2ccccc2[N+](=O)[O-])C[C@H](C)C1(F)F ZINC000599514182 479318355 /nfs/dbraw/zinc/31/83/55/479318355.db2.gz DZXICRSCZBEJQM-FRRDWIJNSA-N 0 3 344.358 2.558 20 5 EFBDHN CC(C)[C@@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CCN1 ZINC000596501369 479319165 /nfs/dbraw/zinc/31/91/65/479319165.db2.gz NRPOXLFBBFEDBM-ZDUSSCGKSA-N 0 3 326.784 2.710 20 5 EFBDHN CN(C)Cc1ccccc1CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000593390303 479322386 /nfs/dbraw/zinc/32/23/86/479322386.db2.gz BBJUHQGUAAXTSY-UHFFFAOYSA-N 0 3 345.374 2.654 20 5 EFBDHN CC(C)c1ccc(CN2CCN([C@@H]3CCC[C@@H]3O)CC2)cc1[N+](=O)[O-] ZINC000611268468 479330384 /nfs/dbraw/zinc/33/03/84/479330384.db2.gz SWMNTISLJRXIMX-MJGOQNOKSA-N 0 3 347.459 2.749 20 5 EFBDHN COc1cccc(C)c1CN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000602471387 479352498 /nfs/dbraw/zinc/35/24/98/479352498.db2.gz CMPJDHRRPOWAMC-CQSZACIVSA-N 0 3 342.399 2.993 20 5 EFBDHN C[C@@H](NC[C@H](O)CN(C)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000611383425 479363399 /nfs/dbraw/zinc/36/33/99/479363399.db2.gz KHIWOZKOOAOOIQ-BEFAXECRSA-N 0 3 343.427 2.738 20 5 EFBDHN C[C@@H](NC(=O)N1CCCC12CCN(C)CC2)c1ccccc1[N+](=O)[O-] ZINC000611397548 479368090 /nfs/dbraw/zinc/36/80/90/479368090.db2.gz QISZZNZWYHDEKI-CQSZACIVSA-N 0 3 346.431 2.926 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCC(NCc3ccccc3F)CC2)cn1 ZINC000602500298 479370012 /nfs/dbraw/zinc/37/00/12/479370012.db2.gz YMOKPLPSLAOXKI-UHFFFAOYSA-N 0 3 330.363 2.888 20 5 EFBDHN COC(=O)[C@H]1CN(CCc2ccc([N+](=O)[O-])cc2)Cc2ccccc21 ZINC000599668539 479380328 /nfs/dbraw/zinc/38/03/28/479380328.db2.gz LBOSAHPZTQSSCS-SFHVURJKSA-N 0 3 340.379 2.910 20 5 EFBDHN COc1cc(C[C@@H](C)NCc2ccc(OC)c([N+](=O)[O-])c2)ccn1 ZINC000602528996 479382881 /nfs/dbraw/zinc/38/28/81/479382881.db2.gz PTQIWHNINRGDFB-GFCCVEGCSA-N 0 3 331.372 2.728 20 5 EFBDHN CC(C)[C@@H](CCO)NCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602557371 479395927 /nfs/dbraw/zinc/39/59/27/479395927.db2.gz WLWHAUNYJXXSKV-SNVBAGLBSA-N 0 3 337.239 2.915 20 5 EFBDHN COC[C@@H](NC1CCN(c2ccc([N+](=O)[O-])nc2)CC1)c1ccco1 ZINC000602564344 479400005 /nfs/dbraw/zinc/40/00/05/479400005.db2.gz MACYAXWZBACSEH-OAHLLOKOSA-N 0 3 346.387 2.529 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNCCCO[C@@H]1CCOC1 ZINC000602568361 479400401 /nfs/dbraw/zinc/40/04/01/479400401.db2.gz LZRAUSPPJYODPB-CYBMUJFWSA-N 0 3 348.321 2.899 20 5 EFBDHN O=[N+]([O-])c1ccc2oc(CN[C@H]3CCOC4(CCOCC4)C3)nc2c1 ZINC000602568770 479400847 /nfs/dbraw/zinc/40/08/47/479400847.db2.gz MFENVOPEPIFDKK-LBPRGKRZSA-N 0 3 347.371 2.554 20 5 EFBDHN CNC(=O)[C@@H]1CCC[C@H]1NCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602576213 479406093 /nfs/dbraw/zinc/40/60/93/479406093.db2.gz JXNFNCIHKMQSCM-VXGBXAGGSA-N 0 3 345.321 2.618 20 5 EFBDHN COc1ccc(CN(CCn2c(C)ncc2[N+](=O)[O-])C2CC2)cc1 ZINC000611544210 479411215 /nfs/dbraw/zinc/41/12/15/479411215.db2.gz HFLNBOPTPFULRW-UHFFFAOYSA-N 0 3 330.388 2.773 20 5 EFBDHN CCS(=O)(=O)c1ccc(CNCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000602584479 479411368 /nfs/dbraw/zinc/41/13/68/479411368.db2.gz CNUWGVRUDADTNZ-UHFFFAOYSA-N 0 3 348.424 2.721 20 5 EFBDHN CCN1C[C@@H](CNCc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1=O ZINC000593684802 479422488 /nfs/dbraw/zinc/42/24/88/479422488.db2.gz BBOHPPWXEVXODK-CYBMUJFWSA-N 0 3 343.383 2.813 20 5 EFBDHN CCN1C[C@@H](CNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1=O ZINC000593687287 479423992 /nfs/dbraw/zinc/42/39/92/479423992.db2.gz LDJCITPLEORRMV-CYBMUJFWSA-N 0 3 343.383 2.813 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CNCC[C@]2(O)CCCOC2)o1 ZINC000593691272 479424300 /nfs/dbraw/zinc/42/43/00/479424300.db2.gz SUIOMDDDZMHFRA-GOSISDBHSA-N 0 3 346.383 2.876 20 5 EFBDHN O=[N+]([O-])c1sc(CNC2CCC(O)CC2)cc1Br ZINC000602620514 479429127 /nfs/dbraw/zinc/42/91/27/479429127.db2.gz LBRGLQCAJUTMJG-UHFFFAOYSA-N 0 3 335.223 2.812 20 5 EFBDHN O=[N+]([O-])c1sccc1NCc1ccccc1CN1CC[C@@H](O)C1 ZINC000611617968 479430899 /nfs/dbraw/zinc/43/08/99/479430899.db2.gz KMAAXCKTMPGMST-CQSZACIVSA-N 0 3 333.413 2.835 20 5 EFBDHN COc1cccc(C)c1CN1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000602641393 479443376 /nfs/dbraw/zinc/44/33/76/479443376.db2.gz QUFSRCAEGQQZEM-UHFFFAOYSA-N 0 3 330.388 2.945 20 5 EFBDHN COCCN(CCN(C)C)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602656814 479453182 /nfs/dbraw/zinc/45/31/82/479453182.db2.gz OCQKQQFCGFGRBC-UHFFFAOYSA-N 0 3 349.353 2.624 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1CNC[C@@H]1COc3ccccc31)OCCO2 ZINC000588934463 479460715 /nfs/dbraw/zinc/46/07/15/479460715.db2.gz ZQCKKRVQHPKAOO-CYBMUJFWSA-N 0 3 342.351 2.632 20 5 EFBDHN CN(C)[C@@H](CNc1c(Cl)cncc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000589107373 479478983 /nfs/dbraw/zinc/47/89/83/479478983.db2.gz SEXCKOBGZIQTGT-ZDUSSCGKSA-N 0 3 338.770 2.919 20 5 EFBDHN CC[C@H](NCCc1ccc([N+](=O)[O-])cc1)C(=O)NCc1cccs1 ZINC000602695162 479481853 /nfs/dbraw/zinc/48/18/53/479481853.db2.gz FBNNLKZQEMFMQB-INIZCTEOSA-N 0 3 347.440 2.883 20 5 EFBDHN CON1CCC(NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602698232 479484010 /nfs/dbraw/zinc/48/40/10/479484010.db2.gz MMGFLJMEQPGJLH-UHFFFAOYSA-N 0 3 333.310 2.729 20 5 EFBDHN O=[N+]([O-])c1ccc2oc(CN[C@H]3CCCN4CCCC[C@@H]34)nc2c1 ZINC000602713007 479496685 /nfs/dbraw/zinc/49/66/85/479496685.db2.gz XRWOQPAWGVVVEY-ZFWWWQNUSA-N 0 3 330.388 2.843 20 5 EFBDHN CN(CCN1CCCCC1)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000593883500 479497263 /nfs/dbraw/zinc/49/72/63/479497263.db2.gz NPIYTPRAFOJQGH-UHFFFAOYSA-N 0 3 339.823 2.735 20 5 EFBDHN O=C([C@H]1CCN(C/C=C\c2ccccc2[N+](=O)[O-])C1)N1CCCC1 ZINC000589205475 479499060 /nfs/dbraw/zinc/49/90/60/479499060.db2.gz SCNIJEPIRZNGCQ-WRLNGNIRSA-N 0 3 329.400 2.552 20 5 EFBDHN COC(=O)COc1ccc(CN2CCC[C@H](C3CC3)C2)cc1[N+](=O)[O-] ZINC000589209370 479499825 /nfs/dbraw/zinc/49/98/25/479499825.db2.gz IZAHOYFAGGILBK-HNNXBMFYSA-N 0 3 348.399 2.769 20 5 EFBDHN O=[N+]([O-])c1sc(CNC[C@H](CO)CC2CC2)cc1Br ZINC000602718208 479501537 /nfs/dbraw/zinc/50/15/37/479501537.db2.gz QWLCIKPAXWIZLI-SECBINFHSA-N 0 3 349.250 2.917 20 5 EFBDHN CCOc1ccc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC000575944158 479508290 /nfs/dbraw/zinc/50/82/90/479508290.db2.gz ZJLPTLUEYCUZAY-MRXNPFEDSA-N 0 3 346.383 2.523 20 5 EFBDHN CN(C)CCN(c1ncnc2sc([N+](=O)[O-])cc21)C1CCCC1 ZINC000575978089 479513743 /nfs/dbraw/zinc/51/37/43/479513743.db2.gz WITPQXBKPYLFEZ-UHFFFAOYSA-N 0 3 335.433 2.910 20 5 EFBDHN NC(=O)Cc1ccc(CN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000589344784 479516328 /nfs/dbraw/zinc/51/63/28/479516328.db2.gz GONCRYYSVCYWFY-GOSISDBHSA-N 0 3 339.395 2.790 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN[C@@H](CN2CCCCC2)c2ccccc2)n1 ZINC000611935377 479525172 /nfs/dbraw/zinc/52/51/72/479525172.db2.gz VNDYZQHVNJUUCD-KRWDZBQOSA-N 0 3 343.431 2.608 20 5 EFBDHN O=C(CC1CCCC1)NCCN[C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000576052817 479528469 /nfs/dbraw/zinc/52/84/69/479528469.db2.gz VWIMLQQOCNQBFW-INIZCTEOSA-N 0 3 331.416 2.868 20 5 EFBDHN Cc1ccncc1[C@@H](C)NCCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000611940352 479528999 /nfs/dbraw/zinc/52/89/99/479528999.db2.gz YQVSBDLZURKRLI-CYBMUJFWSA-N 0 3 328.372 2.978 20 5 EFBDHN Cc1ccc(C)n1C1CCN(CCn2c(C)ncc2[N+](=O)[O-])CC1 ZINC000602772558 479543114 /nfs/dbraw/zinc/54/31/14/479543114.db2.gz SXKDBCFKGJTJBG-UHFFFAOYSA-N 0 3 331.420 2.855 20 5 EFBDHN CC[C@H](CN1CCCC1)NC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000614934750 479552516 /nfs/dbraw/zinc/55/25/16/479552516.db2.gz URQUDZYXQVGSBT-GFCCVEGCSA-N 0 3 336.392 2.599 20 5 EFBDHN O=C(CCN1CCC[C@H](OC2CCC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000594026543 479555214 /nfs/dbraw/zinc/55/52/14/479555214.db2.gz LUBFEFXIDUXGCH-HNNXBMFYSA-N 0 3 347.415 2.957 20 5 EFBDHN O=C(CCN1CCC[C@@H](OC2CCC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000594027603 479556545 /nfs/dbraw/zinc/55/65/45/479556545.db2.gz XAMFFBMADLCINF-QGZVFWFLSA-N 0 3 347.415 2.957 20 5 EFBDHN Cc1cc(N2CCCN(C[C@@H]3CCCO3)CC2)c(F)cc1[N+](=O)[O-] ZINC000589685031 479558501 /nfs/dbraw/zinc/55/85/01/479558501.db2.gz XKOLLYVTGYMKGQ-AWEZNQCLSA-N 0 3 337.395 2.733 20 5 EFBDHN Cc1ncc(CNC(=O)CCN[C@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000602800184 479562810 /nfs/dbraw/zinc/56/28/10/479562810.db2.gz KGPLHUVRMDPEFR-LLVKDONJSA-N 0 3 348.428 2.717 20 5 EFBDHN COc1cc(C)c([C@H](C)NCCn2c(C)ncc2[N+](=O)[O-])cc1OC ZINC000602802604 479564689 /nfs/dbraw/zinc/56/46/89/479564689.db2.gz RCWMHJTUWZUNAS-LBPRGKRZSA-N 0 3 348.403 2.776 20 5 EFBDHN CN(Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@]1(CO)CCOC1 ZINC000600178647 479565915 /nfs/dbraw/zinc/56/59/15/479565915.db2.gz NYXHRKUWPGCBIQ-KRWDZBQOSA-N 0 3 348.424 2.907 20 5 EFBDHN CC(C)OC(=O)C[C@@H](NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(C)C ZINC000594047507 479566589 /nfs/dbraw/zinc/56/65/89/479566589.db2.gz XQHVMBXXDNWUTA-CQSZACIVSA-N 0 3 348.403 2.927 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN[C@H](C)c1ccc(-n2cccn2)cc1 ZINC000602808100 479567225 /nfs/dbraw/zinc/56/72/25/479567225.db2.gz XDOGELIVGGRNQH-CYBMUJFWSA-N 0 3 340.387 2.636 20 5 EFBDHN Cc1cnc(C2CCN(CCn3c(C)ncc3[N+](=O)[O-])CC2)s1 ZINC000602822861 479575904 /nfs/dbraw/zinc/57/59/04/479575904.db2.gz STTBYQSMNNCSPT-UHFFFAOYSA-N 0 3 335.433 2.744 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN[C@H](c1cccs1)C(C)(C)CO ZINC000602828364 479579309 /nfs/dbraw/zinc/57/93/09/479579309.db2.gz GNTWVUJSYFTDMX-CQSZACIVSA-N 0 3 338.433 2.511 20 5 EFBDHN CC(C)(NC(=O)N[C@H]1CCN(CC2CC2)C1)c1ccccc1[N+](=O)[O-] ZINC000589886812 479581209 /nfs/dbraw/zinc/58/12/09/479581209.db2.gz CXGUIPKIZHGEJN-AWEZNQCLSA-N 0 3 346.431 2.613 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CN1CC(Cc2ccccc2)C1 ZINC000612110413 479587133 /nfs/dbraw/zinc/58/71/33/479587133.db2.gz NPOCYURSGMWAOA-QGZVFWFLSA-N 0 3 342.395 2.509 20 5 EFBDHN O=[N+]([O-])c1ccc(CN2CCCN(c3ccncc3)CC2)c(F)c1 ZINC000602845850 479590493 /nfs/dbraw/zinc/59/04/93/479590493.db2.gz LTXCTSIOAZZWAO-UHFFFAOYSA-N 0 3 330.363 2.841 20 5 EFBDHN COc1ccc(-c2ccc(CN3C[C@H]4[C@H](CO)[C@H]4C3)o2)c([N+](=O)[O-])c1 ZINC000590053405 479596500 /nfs/dbraw/zinc/59/65/00/479596500.db2.gz WGLGHPIGMGLZQF-ZSHCYNCHSA-N 0 3 344.367 2.534 20 5 EFBDHN CC1=Nc2ccccc2C12CCN(CCn1cc([N+](=O)[O-])cn1)CC2 ZINC000602858756 479598875 /nfs/dbraw/zinc/59/88/75/479598875.db2.gz BHZKPGRCPHFDIX-UHFFFAOYSA-N 0 3 339.399 2.931 20 5 EFBDHN CC[C@H]1CN(C)CCN1c1cc(C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000590146733 479610223 /nfs/dbraw/zinc/61/02/23/479610223.db2.gz PBLXYIBWVYQMGD-HNNXBMFYSA-N 0 3 341.415 2.891 20 5 EFBDHN CCOC1(CNCc2cc3c(cc2[N+](=O)[O-])OCCO3)CCCC1 ZINC000590195095 479615969 /nfs/dbraw/zinc/61/59/69/479615969.db2.gz WPGRHMHNGNYYLN-UHFFFAOYSA-N 0 3 336.388 2.805 20 5 EFBDHN C[C@H](C(=O)N[C@@H]1CCCN2CCCC[C@H]12)c1ccc([N+](=O)[O-])cc1F ZINC000594196054 479626404 /nfs/dbraw/zinc/62/64/04/479626404.db2.gz KMYKXGFMCBRJPV-JCURWCKSSA-N 0 3 349.406 2.971 20 5 EFBDHN COc1cc(C(=O)N[C@H]2CCCN3CCCC[C@H]23)cc([N+](=O)[O-])c1C ZINC000594197502 479628534 /nfs/dbraw/zinc/62/85/34/479628534.db2.gz OUGYQDIVJYQSLA-LSDHHAIUSA-N 0 3 347.415 2.659 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CCCN2CCCC[C@H]12 ZINC000594199398 479629811 /nfs/dbraw/zinc/62/98/11/479629811.db2.gz YIOPHDNJWYONBB-UONOGXRCSA-N 0 3 347.415 2.740 20 5 EFBDHN O=C(N[C@H]1CCCN2CCCC[C@H]12)c1ccc([N+](=O)[O-])cc1Cl ZINC000594202777 479631250 /nfs/dbraw/zinc/63/12/50/479631250.db2.gz RQLOXRDWDJBXAQ-LSDHHAIUSA-N 0 3 337.807 2.995 20 5 EFBDHN O=C(N[C@@H]1CCCN2CCCC[C@H]12)c1ccc([N+](=O)[O-])cc1Cl ZINC000594202776 479631390 /nfs/dbraw/zinc/63/13/90/479631390.db2.gz RQLOXRDWDJBXAQ-HUUCEWRRSA-N 0 3 337.807 2.995 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC[C@H](CN2CCCC2=O)C1 ZINC000597228825 479631542 /nfs/dbraw/zinc/63/15/42/479631542.db2.gz OZDWPRTYMDKJPQ-OBHPCNEJSA-N 0 3 343.427 2.942 20 5 EFBDHN O=C1CCCN1C[C@H]1CCN(C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000597227207 479631591 /nfs/dbraw/zinc/63/15/91/479631591.db2.gz ATPKNUXVRASHRT-VFQAQYNWSA-N 0 3 329.400 2.552 20 5 EFBDHN O=C1CCCN1C[C@H]1CCN(C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000597227203 479631842 /nfs/dbraw/zinc/63/18/42/479631842.db2.gz ATPKNUXVRASHRT-BYPUDFOVSA-N 0 3 329.400 2.552 20 5 EFBDHN O=C1CCCN1C[C@@H]1CCN(C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000597227205 479632050 /nfs/dbraw/zinc/63/20/50/479632050.db2.gz ATPKNUXVRASHRT-OMVNSRBRSA-N 0 3 329.400 2.552 20 5 EFBDHN CC[C@@H]1CN(C)CCCN1C(=O)c1ccc(SC)c([N+](=O)[O-])c1 ZINC000590344425 479633359 /nfs/dbraw/zinc/63/33/59/479633359.db2.gz MBLKAEGGCJUTSR-CYBMUJFWSA-N 0 3 337.445 2.873 20 5 EFBDHN CC(C)c1ccc(C(=O)N[C@H]2CCN(CC3CC3)C2)cc1[N+](=O)[O-] ZINC000615240678 479636527 /nfs/dbraw/zinc/63/65/27/479636527.db2.gz OOPYVRGLFMDPNG-HNNXBMFYSA-N 0 3 331.416 2.932 20 5 EFBDHN CCN(C[C@H]1CCCN1CC)C(=O)c1cc([N+](=O)[O-])ccc1OC ZINC000579043965 479653747 /nfs/dbraw/zinc/65/37/47/479653747.db2.gz SHJWNXUCKOWRGH-CQSZACIVSA-N 0 3 335.404 2.550 20 5 EFBDHN CN1CCN(CC2(C)CCN(c3ccc([N+](=O)[O-])s3)CC2)CC1 ZINC000612455830 479675711 /nfs/dbraw/zinc/67/57/11/479675711.db2.gz RFNDZTCLHYCFAU-UHFFFAOYSA-N 0 3 338.477 2.510 20 5 EFBDHN CN1CCN(CC2(C)CCN(c3ccsc3[N+](=O)[O-])CC2)CC1 ZINC000612455792 479675892 /nfs/dbraw/zinc/67/58/92/479675892.db2.gz OCALNLSRLOOLGX-UHFFFAOYSA-N 0 3 338.477 2.510 20 5 EFBDHN CC[C@@H](CN1CCCC1)NC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000612544097 479689568 /nfs/dbraw/zinc/68/95/68/479689568.db2.gz LQYOCIIIRHKRNT-STQMWFEESA-N 0 3 337.395 2.828 20 5 EFBDHN CC[C@H](CN1CCCC1)NC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000612544094 479689630 /nfs/dbraw/zinc/68/96/30/479689630.db2.gz LQYOCIIIRHKRNT-CHWSQXEVSA-N 0 3 337.395 2.828 20 5 EFBDHN CN1CCC[C@H](CNc2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)C1 ZINC000619527181 479818949 /nfs/dbraw/zinc/81/89/49/479818949.db2.gz TVUVXTBTYGPMFC-CYBMUJFWSA-N 0 3 344.390 2.972 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCC12CCCN1CCC2 ZINC000619574183 479832285 /nfs/dbraw/zinc/83/22/85/479832285.db2.gz YLMGEXROURLZLC-ZDUSSCGKSA-N 0 3 349.456 2.820 20 5 EFBDHN CC[C@@H]1CCCCN1CCNC(=O)c1ccc(NC)c([N+](=O)[O-])c1 ZINC000609594388 480184092 /nfs/dbraw/zinc/18/40/92/480184092.db2.gz OCJQLTYZKVRIIV-CQSZACIVSA-N 0 3 334.420 2.631 20 5 EFBDHN CC(C)[C@H](NC/C=C\c1ccccc1[N+](=O)[O-])C(=O)N1CCCC1 ZINC000609616272 480186667 /nfs/dbraw/zinc/18/66/67/480186667.db2.gz ZQFZBMZNRBIUFG-KMDWOBIYSA-N 0 3 331.416 2.845 20 5 EFBDHN CCn1cnnc1CCNCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000610480137 480316205 /nfs/dbraw/zinc/31/62/05/480316205.db2.gz BNJJVTNCFJMVSO-UHFFFAOYSA-N 0 3 341.371 2.799 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)N[C@H]2CCN(CC3CC3)C2)cc1[N+](=O)[O-] ZINC000610595836 480346913 /nfs/dbraw/zinc/34/69/13/480346913.db2.gz MSPQCYJOFUIQGF-CJNGLKHVSA-N 0 3 346.431 2.748 20 5 EFBDHN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N)[C@@H](c1ccccc1)N(C)C ZINC000189825702 533748722 /nfs/dbraw/zinc/74/87/22/533748722.db2.gz MBOAAYTWDSWUPT-SJCJKPOMSA-N 0 3 342.399 2.598 20 5 EFBDHN Cc1c(CC(=O)NCC(C)(C)N2CCCCC2)cccc1[N+](=O)[O-] ZINC000159536893 533831283 /nfs/dbraw/zinc/83/12/83/533831283.db2.gz OQNCUAWTKTTYKM-UHFFFAOYSA-N 0 3 333.432 2.826 20 5 EFBDHN C[C@H](NCCn1ccc([N+](=O)[O-])n1)c1cccc(OC(F)F)c1 ZINC000179574436 533876996 /nfs/dbraw/zinc/87/69/96/533876996.db2.gz HWSMLMSACVCTJU-JTQLQIEISA-N 0 3 326.303 2.744 20 5 EFBDHN C[C@H]1CN(Cc2cc([N+](=O)[O-])ccc2Cl)CCN1CC(C)(C)O ZINC000189893999 533951171 /nfs/dbraw/zinc/95/11/71/533951171.db2.gz YTKIIEMCASXRFG-LBPRGKRZSA-N 0 3 341.839 2.525 20 5 EFBDHN C[C@@H]1CCN(CCOc2ccc([N+](=O)[O-])cc2)C[C@@H]1n1ccnc1 ZINC000129640589 534034773 /nfs/dbraw/zinc/03/47/73/534034773.db2.gz NPUJQBVMCJZASI-PBHICJAKSA-N 0 3 330.388 2.753 20 5 EFBDHN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000191371444 534055844 /nfs/dbraw/zinc/05/58/44/534055844.db2.gz AJSFRTHGSQEEIQ-AWEZNQCLSA-N 0 3 330.388 2.690 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCCN(C3CCCC3)CC2)c1 ZINC000173861931 534316611 /nfs/dbraw/zinc/31/66/11/534316611.db2.gz CHMBOJGVVZNXNQ-UHFFFAOYSA-N 0 3 331.416 2.994 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(NCc2ccc(OCCN(C)C)cc2)n1 ZINC000178175815 534327192 /nfs/dbraw/zinc/32/71/92/534327192.db2.gz ZJTBDLHWWVPEFE-UHFFFAOYSA-N 0 3 330.388 2.851 20 5 EFBDHN CC(C)C1CCC(N2CCN(CCn3cc([N+](=O)[O-])cn3)CC2)CC1 ZINC000084680612 519563076 /nfs/dbraw/zinc/56/30/76/519563076.db2.gz CMQFWUQVBXSPMW-UHFFFAOYSA-N 0 3 349.479 2.624 20 5 EFBDHN CCN1CCC(N(C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC000157411168 521564803 /nfs/dbraw/zinc/56/48/03/521564803.db2.gz BFPBZDXPQAFGCE-UHFFFAOYSA-N 0 3 345.403 2.561 20 5 EFBDHN CN(C)Cc1cccc(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)c1 ZINC000089420890 521921452 /nfs/dbraw/zinc/92/14/52/521921452.db2.gz LBROSZZZMXZMND-UHFFFAOYSA-N 0 3 339.355 2.785 20 5 EFBDHN CN(CCOc1ccc([N+](=O)[O-])cc1)[C@H]1CCCc2c1cnn2C ZINC000135645109 522910882 /nfs/dbraw/zinc/91/08/82/522910882.db2.gz MQDFAHVGRKCTCS-INIZCTEOSA-N 0 3 330.388 2.717 20 5 EFBDHN Cc1ccc(CN2CCC[C@@H]2CN2C[C@@H](C)O[C@H](C)C2)cc1[N+](=O)[O-] ZINC000245553194 524450217 /nfs/dbraw/zinc/45/02/17/524450217.db2.gz FCZKDNSMOWYYEC-JFIYKMOQSA-N 0 3 347.459 2.977 20 5 EFBDHN C[C@H]1CN(CCn2cc([N+](=O)[O-])ccc2=O)CC[C@H]1c1ccccc1 ZINC000245586119 524603281 /nfs/dbraw/zinc/60/32/81/524603281.db2.gz MJSQNKNSHXRRLP-MAUKXSAKSA-N 0 3 341.411 2.882 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CCN(CC2CCCC2)C1 ZINC000194771538 524904029 /nfs/dbraw/zinc/90/40/29/524904029.db2.gz RJSSIVMAHOGJOK-HNNXBMFYSA-N 0 3 331.416 2.898 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1NCCc2ccccc21 ZINC000261604764 524904095 /nfs/dbraw/zinc/90/40/95/524904095.db2.gz CKZXBVQVLCYNSZ-OAHLLOKOSA-N 0 3 325.368 2.520 20 5 EFBDHN Cc1ccc([C@@H](C)NC[C@H](C(C)C)N2CCOCC2)cc1[N+](=O)[O-] ZINC000120077949 525731436 /nfs/dbraw/zinc/73/14/36/525731436.db2.gz LNGGTLOGANQLHV-CRAIPNDOSA-N 0 3 335.448 2.911 20 5 EFBDHN Cc1ccc(C(=O)NCCN[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000120919243 526168168 /nfs/dbraw/zinc/16/81/68/526168168.db2.gz JUUCRUPOEAEEPK-AWEZNQCLSA-N 0 3 327.384 2.984 20 5 EFBDHN Cc1cnn(-c2cc[nH+]cc2[N-]C(=O)c2csc([N+](=O)[O-])c2)c1 ZINC000179271399 526250393 /nfs/dbraw/zinc/25/03/93/526250393.db2.gz OBSQOJGNWPGODM-UHFFFAOYSA-N 0 3 329.341 2.798 20 5 EFBDHN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCC[C@@H](N2CCCC2)C1 ZINC000136979419 526574919 /nfs/dbraw/zinc/57/49/19/526574919.db2.gz LMYSUPPYTZHYPM-GFCCVEGCSA-N 0 3 337.807 2.949 20 5 EFBDHN O=C(NC[C@H]1CCN(Cc2ccccc2)C1)c1csc([N+](=O)[O-])c1 ZINC000193787170 526613899 /nfs/dbraw/zinc/61/38/99/526613899.db2.gz CLXZAAZUHYRSST-CQSZACIVSA-N 0 3 345.424 2.908 20 5 EFBDHN CC(C)(NCCn1cc([N+](=O)[O-])ccc1=O)c1ccc(F)c(F)c1 ZINC000180858934 527291777 /nfs/dbraw/zinc/29/17/77/527291777.db2.gz VFNGVUJQVUEDOJ-UHFFFAOYSA-N 0 3 337.326 2.560 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@H]2CCN(CCc3ccccc3F)C2)nc1 ZINC000121398468 527367723 /nfs/dbraw/zinc/36/77/23/527367723.db2.gz UGPPAEMDHBPUPQ-AWEZNQCLSA-N 0 3 330.363 2.858 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@@H]2CCN(CCc3ccccc3F)C2)nc1 ZINC000121398664 527367993 /nfs/dbraw/zinc/36/79/93/527367993.db2.gz UGPPAEMDHBPUPQ-CQSZACIVSA-N 0 3 330.363 2.858 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCc2nnc[n-]2)s1 ZINC000119163564 527396052 /nfs/dbraw/zinc/39/60/52/527396052.db2.gz ABLQDOFOQUDEMH-UHFFFAOYSA-N 0 3 329.385 2.774 20 5 EFBDHN CCCCN(CCO)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159421826 528428573 /nfs/dbraw/zinc/42/85/73/528428573.db2.gz NGPZQTWBNPPQFL-UHFFFAOYSA-N 0 3 331.210 2.952 20 5 EFBDHN CCOc1ccc([C@@H](C)NCCC(=O)N[C@H](C)CC)cc1[N+](=O)[O-] ZINC000153244619 528594667 /nfs/dbraw/zinc/59/46/67/528594667.db2.gz KRYOYYOYWNSIOK-CHWSQXEVSA-N 0 3 337.420 2.949 20 5 EFBDHN CCN(Cc1ccc2c(c1)OCO2)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136821696 528799647 /nfs/dbraw/zinc/79/96/47/528799647.db2.gz PCDKYKUFTCCADW-INIZCTEOSA-N 0 3 344.367 2.879 20 5 EFBDHN CC(C)N(CCNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])C(C)C ZINC000179562021 528906634 /nfs/dbraw/zinc/90/66/34/528906634.db2.gz QEGZJBGJGQDOKF-UHFFFAOYSA-N 0 3 349.478 2.591 20 5 EFBDHN CCN1CCCN(C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000159950581 529030763 /nfs/dbraw/zinc/03/07/63/529030763.db2.gz JKNCXLGIJBSQTJ-CQSZACIVSA-N 0 3 334.420 2.701 20 5 EFBDHN CO[C@@H]([C@H](C)N[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C)C1CC1 ZINC000414163018 536552866 /nfs/dbraw/zinc/55/28/66/536552866.db2.gz FLCZCBWDPNOMLL-OZVIIMIRSA-N 0 3 335.404 2.633 20 5 EFBDHN CC(C)Oc1cc(C(=O)N(C)CCN2CCCC2)ccc1[N+](=O)[O-] ZINC000411998987 534940720 /nfs/dbraw/zinc/94/07/20/534940720.db2.gz ALUQLRNQOFTVCT-UHFFFAOYSA-N 0 3 335.404 2.550 20 5 EFBDHN CC(C)Oc1cc(C(=O)N(C)CC2CCN(C)CC2)ccc1[N+](=O)[O-] ZINC000412003411 534941064 /nfs/dbraw/zinc/94/10/64/534941064.db2.gz AGNQYDFASQJFDV-UHFFFAOYSA-N 0 3 349.431 2.796 20 5 EFBDHN CC(C)Oc1cc(C(=O)N(C)[C@@H]2CCN(C)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000412120650 534943316 /nfs/dbraw/zinc/94/33/16/534943316.db2.gz DUGVLCUYDZYSNC-DZGCQCFKSA-N 0 3 349.431 2.794 20 5 EFBDHN CC(C)CN(C(=O)Cc1cccc([N+](=O)[O-])c1)C1CCN(C)CC1 ZINC000266266769 535008541 /nfs/dbraw/zinc/00/85/41/535008541.db2.gz XCZRGFGUBDKXOF-UHFFFAOYSA-N 0 3 333.432 2.716 20 5 EFBDHN CCCCN(C)CCNC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000412105800 535223894 /nfs/dbraw/zinc/22/38/94/535223894.db2.gz FPHANVXKWBSSIL-UHFFFAOYSA-N 0 3 337.420 2.844 20 5 EFBDHN CCOc1ccc([C@@H](C)NCCn2ccc([N+](=O)[O-])n2)cc1OC ZINC000341435467 535411689 /nfs/dbraw/zinc/41/16/89/535411689.db2.gz SCGAXHWOKAFITE-GFCCVEGCSA-N 0 3 334.376 2.549 20 5 EFBDHN CCOc1cccc(NC2CCN([C@@H]3CCOC3)CC2)c1[N+](=O)[O-] ZINC000364855848 535469904 /nfs/dbraw/zinc/46/99/04/535469904.db2.gz NFVTXIMTXWIKJV-CQSZACIVSA-N 0 3 335.404 2.659 20 5 EFBDHN CCO[C@@H]1C[C@H](O)C12CCN([C@@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000266505853 535521890 /nfs/dbraw/zinc/52/18/90/535521890.db2.gz BWSBXMGKQMMSJL-RRQGHBQHSA-N 0 3 334.416 2.908 20 5 EFBDHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)c1c([N+](=O)[O-])ncn1C ZINC000266441027 535772172 /nfs/dbraw/zinc/77/21/72/535772172.db2.gz GSQYSZVNBBBSSD-MRXNPFEDSA-N 0 3 343.431 2.677 20 5 EFBDHN CN(C)CCN(C/C=C/c1ccccc1[N+](=O)[O-])C[C@@H]1CCCO1 ZINC000349065147 535854908 /nfs/dbraw/zinc/85/49/08/535854908.db2.gz XVJHGGVMTFNXOE-JZLODUJNSA-N 0 3 333.432 2.651 20 5 EFBDHN CN(C)C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)c1ccc(F)cc1 ZINC000360211136 535953574 /nfs/dbraw/zinc/95/35/74/535953574.db2.gz BTBRPZJGRXNNSK-INIZCTEOSA-N 0 3 349.337 2.906 20 5 EFBDHN CN(C)Cc1ccccc1CNC(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000344190735 536048275 /nfs/dbraw/zinc/04/82/75/536048275.db2.gz SGJROKRDGJIDOV-UHFFFAOYSA-N 0 3 331.347 2.726 20 5 EFBDHN CN(C)C(=O)c1ccccc1CNCCc1ccccc1[N+](=O)[O-] ZINC000417950475 536106370 /nfs/dbraw/zinc/10/63/70/536106370.db2.gz XOMGIWNAWOLPQG-UHFFFAOYSA-N 0 3 327.384 2.629 20 5 EFBDHN CC[C@H]1CN2CCC[C@H]2CN1C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000246945509 536166254 /nfs/dbraw/zinc/16/62/54/536166254.db2.gz LEMLGTMEMBIFQU-ZFWWWQNUSA-N 0 3 349.456 2.772 20 5 EFBDHN CN(CCCN(C)c1ccc([N+](=O)[O-])c(N)c1F)Cc1ccco1 ZINC000343756254 536342425 /nfs/dbraw/zinc/34/24/25/536342425.db2.gz BAXOCRHPFIPNLH-UHFFFAOYSA-N 0 3 336.367 2.867 20 5 EFBDHN CN1CCC2(CCCN2C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CC1 ZINC000412222156 536347810 /nfs/dbraw/zinc/34/78/10/536347810.db2.gz FXLUZTSLMUVZFU-DLBZAZTESA-N 0 3 343.427 2.785 20 5 EFBDHN CNc1c(C(=O)Nc2cccc(CN(C)C)c2)cccc1[N+](=O)[O-] ZINC000361120548 536419349 /nfs/dbraw/zinc/41/93/49/536419349.db2.gz BPOKYTFFJACBGH-UHFFFAOYSA-N 0 3 328.372 2.950 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CNC1(CO)C2CC3CC(C2)CC1C3 ZINC000412015270 536956198 /nfs/dbraw/zinc/95/61/98/536956198.db2.gz SETCMCSGPUJEIR-UHFFFAOYSA-N 0 3 346.427 2.880 20 5 EFBDHN O=[N+]([O-])c1ccc(CNCCc2nnc3ccccn32)cc1Cl ZINC000761520858 576174027 /nfs/dbraw/zinc/17/40/27/576174027.db2.gz QKUCQHOZIRIJIK-UHFFFAOYSA-N 0 3 331.763 2.623 20 5 EFBDHN CCO[C@H]1CCCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000753917395 575359210 /nfs/dbraw/zinc/35/92/10/575359210.db2.gz MVZYSTOXNJCWOO-ZDUSSCGKSA-N 0 3 339.367 2.563 20 5 EFBDHN O=[N+]([O-])c1ccc([C@@H](O)CNCCOc2ccccc2Cl)cc1 ZINC000754250187 575410697 /nfs/dbraw/zinc/41/06/97/575410697.db2.gz FEKZPZCJNNFFIO-HNNXBMFYSA-N 0 3 336.775 2.950 20 5 EFBDHN O=[N+]([O-])c1ccc([C@H](O)CNCc2ccc(-n3ccnc3)cc2)cc1 ZINC000754250550 575410724 /nfs/dbraw/zinc/41/07/24/575410724.db2.gz JJFIGRAPDONKSU-GOSISDBHSA-N 0 3 338.367 2.604 20 5 EFBDHN O=[N+]([O-])c1ccc2c(cnn2CN2CC[C@@H](C3CCOCC3)C2)c1 ZINC000754781870 575488619 /nfs/dbraw/zinc/48/86/19/575488619.db2.gz GGYKAZDAKGWEHN-CQSZACIVSA-N 0 3 330.388 2.651 20 5 EFBDHN CCCn1ccnc1CCCN(C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000759763569 575931109 /nfs/dbraw/zinc/93/11/09/575931109.db2.gz GSIPSLCWNODTLF-QGZVFWFLSA-N 0 3 346.431 2.799 20 5 EFBDHN CS[C@H]1CN(c2ccc([N+](=O)[O-])cc2OC(F)F)C[C@H]1N(C)C ZINC000760576873 576049064 /nfs/dbraw/zinc/04/90/64/576049064.db2.gz MXSVBVULXIPAGJ-YPMHNXCESA-N 0 3 347.387 2.678 20 5 EFBDHN Cc1nn(CN(C[C@H]2CCOC2)C2CC2)c2ccc([N+](=O)[O-])cc12 ZINC000764887963 576517858 /nfs/dbraw/zinc/51/78/58/576517858.db2.gz YTTIGCVYSLCVFC-CYBMUJFWSA-N 0 3 330.388 2.711 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1CCCCN1C1CC1 ZINC000765663269 577063910 /nfs/dbraw/zinc/06/39/10/577063910.db2.gz NMDJTTDMJJQORC-AWEZNQCLSA-N 0 3 348.403 2.742 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCN1CCC[C@H]1C ZINC000765747568 577072142 /nfs/dbraw/zinc/07/21/42/577072142.db2.gz ZCMJZKSLUCTNHV-GDBMZVCRSA-N 0 3 333.432 2.764 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCN1CCC[C@@H]1C ZINC000765747581 577072185 /nfs/dbraw/zinc/07/21/85/577072185.db2.gz ZCMJZKSLUCTNHV-GOEBONIOSA-N 0 3 333.432 2.764 20 5 EFBDHN C[C@H](NC[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc([S@](C)=O)cc1 ZINC000765848561 577082659 /nfs/dbraw/zinc/08/26/59/577082659.db2.gz HPJXZEDQXKGLCG-BLPFDFMYSA-N 0 3 348.424 2.716 20 5 EFBDHN O=[N+]([O-])c1ccc([C@H](O)CN2CCC(O)(c3ccccc3)CC2)cc1 ZINC000767855764 577238649 /nfs/dbraw/zinc/23/86/49/577238649.db2.gz LTXYGROJWJZPHL-GOSISDBHSA-N 0 3 342.395 2.612 20 5 EFBDHN Cc1c(CNCCn2cc([N+](=O)[O-])cn2)sc2nc(C)nc(C)c12 ZINC000769421766 577361514 /nfs/dbraw/zinc/36/15/14/577361514.db2.gz AODRNKZNYIQADT-UHFFFAOYSA-N 0 3 346.416 2.511 20 5 EFBDHN Cc1cc([N+](=O)[O-])cc(Cl)c1NC[C@H]1CN2CCC[C@@H]2CO1 ZINC000770099898 577402110 /nfs/dbraw/zinc/40/21/10/577402110.db2.gz LLVSWYFAYAQYGL-YPMHNXCESA-N 0 3 325.796 2.832 20 5 EFBDHN O=C(OCCN1CCCCC1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000770407615 577416171 /nfs/dbraw/zinc/41/61/71/577416171.db2.gz MUGWGLPOOFYRRR-UHFFFAOYSA-N 0 3 329.356 2.786 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)cnc1NC1CCN(C[C@H]2CCCO2)CC1 ZINC000771916405 581258782 /nfs/dbraw/zinc/25/87/82/581258782.db2.gz OOAXRHNSUIYUEE-CYBMUJFWSA-N 0 3 340.811 2.699 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](NCCc1nnc3ccccn31)CCC2 ZINC000774110999 581483786 /nfs/dbraw/zinc/48/37/86/581483786.db2.gz RAFAITKKFHZNJD-MRXNPFEDSA-N 0 3 337.383 2.847 20 5 EFBDHN O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2NCc2ccccc2[N+](=O)[O-])n1 ZINC000774224033 581487539 /nfs/dbraw/zinc/48/75/39/581487539.db2.gz GRRLFHZLBKYXAR-UKRRQHHQSA-N 0 3 345.359 2.973 20 5 EFBDHN O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2NCc2ccc([N+](=O)[O-])cc2)n1 ZINC000774232463 581487762 /nfs/dbraw/zinc/48/77/62/581487762.db2.gz YTKXSFHCKHWKLA-GJZGRUSLSA-N 0 3 345.359 2.973 20 5 EFBDHN C[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccc(-c2nnn[n-]2)cc1 ZINC000820427226 599382219 /nfs/dbraw/zinc/38/22/19/599382219.db2.gz QLUPQAAUFNQXLN-GFCCVEGCSA-N 0 3 338.371 2.668 20 5 EFBDHN C[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccc(-c2nn[n-]n2)cc1 ZINC000820427226 599382222 /nfs/dbraw/zinc/38/22/22/599382222.db2.gz QLUPQAAUFNQXLN-GFCCVEGCSA-N 0 3 338.371 2.668 20 5 EFBDHN CC(C)[NH+](CCCNc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])C(C)C ZINC000820116367 606036917 /nfs/dbraw/zinc/03/69/17/606036917.db2.gz JAWKHXRVAUYDRM-UHFFFAOYSA-N 0 3 347.423 2.696 20 5 EFBDHN CC(C)[NH+](CCCNc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])C(C)C ZINC000820116367 606036923 /nfs/dbraw/zinc/03/69/23/606036923.db2.gz JAWKHXRVAUYDRM-UHFFFAOYSA-N 0 3 347.423 2.696 20 5 EFBDHN CC([C@@H](OC(=O)c1ccnn1C(F)F)c1ccccc1F)[N+](=O)[O-] ZINC000851108956 1250806018 /nfs/dbraw/zinc/80/60/18/1250806018.db2.gz SUQUVKLINKGWAZ-PRHODGIISA-N 0 3 343.261 2.981 20 5 EFBDHN CC(C)(COC(=O)C1(C)CCN(Cc2ccccc2)CC1)[N+](=O)[O-] ZINC000851129614 1250817102 /nfs/dbraw/zinc/81/71/02/1250817102.db2.gz MREGPZMFGIUKEU-UHFFFAOYSA-N 0 3 334.416 2.887 20 5 EFBDHN CCN(C)C(C)(C)C(=O)NC/C=C\CNc1ccc([N+](=O)[O-])c(C)c1 ZINC001107390949 1255705678 /nfs/dbraw/zinc/70/56/78/1255705678.db2.gz BQCIFRDROIIHSQ-FPLPWBNLSA-N 0 3 348.447 2.718 20 5 EFBDHN CCN(C)C(C)(C)C(=O)NC/C=C/CNc1ccc([N+](=O)[O-])c(C)c1 ZINC001107390948 1255705860 /nfs/dbraw/zinc/70/58/60/1255705860.db2.gz BQCIFRDROIIHSQ-BQYQJAHWSA-N 0 3 348.447 2.718 20 5 EFBDHN Cc1cc(C(F)(F)F)nn1CCNCc1ccc([N+](=O)[O-])cc1 ZINC000922432371 1266028370 /nfs/dbraw/zinc/02/83/70/1266028370.db2.gz PXWVMECPIYTLHW-UHFFFAOYSA-N 0 3 328.294 2.908 20 5 EFBDHN Cc1coc(C(=O)N2CCC(NCc3csc([N+](=O)[O-])c3)CC2)c1 ZINC000996895600 1256390385 /nfs/dbraw/zinc/39/03/85/1256390385.db2.gz NTABMMAHQPMSLE-UHFFFAOYSA-N 0 3 349.412 2.952 20 5 EFBDHN CC(C)=CC(=O)N1CCC(CNCc2csc([N+](=O)[O-])c2)CC1 ZINC000997495207 1257789811 /nfs/dbraw/zinc/78/98/11/1257789811.db2.gz JZTKJLPCGUFTIM-UHFFFAOYSA-N 0 3 337.445 2.951 20 5 EFBDHN COc1ccc(CN2CCC[C@@H](c3nccn3C)C2)cc1[N+](=O)[O-] ZINC000444804674 1259009169 /nfs/dbraw/zinc/00/91/69/1259009169.db2.gz QBBHVPOPCFXKCG-CQSZACIVSA-N 0 3 330.388 2.717 20 5 EFBDHN COc1ccc(CNC[C@@](C)(O)c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000922563669 1266258229 /nfs/dbraw/zinc/25/82/29/1266258229.db2.gz KOHADVULQWKFCR-QGZVFWFLSA-N 0 3 334.347 2.740 20 5 EFBDHN COc1ccc(-c2ccc(CN[C@@H]3COC[C@H]3C)o2)c([N+](=O)[O-])c1 ZINC000922642913 1266505252 /nfs/dbraw/zinc/50/52/52/1266505252.db2.gz IVTWYUUPLFIYNF-IAQYHMDHSA-N 0 3 332.356 2.988 20 5 EFBDHN Cc1cc(C)c(C(=O)NCCNCc2cccc([N+](=O)[O-])c2)s1 ZINC001128289510 1264150619 /nfs/dbraw/zinc/15/06/19/1264150619.db2.gz JNMNKURTFWIDNT-UHFFFAOYSA-N 0 3 333.413 2.793 20 5 EFBDHN C[C@@H](NC(=O)NC[C@H]1CCCCN1C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000922205466 1264918273 /nfs/dbraw/zinc/91/82/73/1264918273.db2.gz LCCCFUWVWVROQK-CXAGYDPISA-N 0 3 346.431 2.972 20 5 EFBDHN O=[N+]([O-])c1ccc2oc(=S)n(CN3CCN(C4CCC4)CC3)c2c1 ZINC000733297621 1265164621 /nfs/dbraw/zinc/16/46/21/1265164621.db2.gz MBNWBAUMRIAYRK-UHFFFAOYSA-N 0 3 348.428 3.000 20 5 EFBDHN O=C(NC[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1)C1CCCC1 ZINC001086291778 1270846018 /nfs/dbraw/zinc/84/60/18/1270846018.db2.gz WXEPPGFNHSPSNM-SAZUREKKSA-N 0 3 331.416 2.769 20 5 EFBDHN Cc1occc1C(=O)NC[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001086303459 1270908822 /nfs/dbraw/zinc/90/88/22/1270908822.db2.gz HIDIJXUZGQPXGG-CTYIDZIISA-N 0 3 343.383 2.794 20 5 EFBDHN Cc1ccoc1C(=O)NC[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001086308227 1270930384 /nfs/dbraw/zinc/93/03/84/1270930384.db2.gz MSYHYTBAGZGYMO-CTYIDZIISA-N 0 3 343.383 2.794 20 5 EFBDHN CCOC(=O)CCN(CC1CC1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000745437284 1271476259 /nfs/dbraw/zinc/47/62/59/1271476259.db2.gz FAGSGLZXAOIZCD-UHFFFAOYSA-N 0 3 346.387 2.567 20 5 EFBDHN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N1CCN(C2CCC2)C[C@@H](C)C1 ZINC000843892852 1278641488 /nfs/dbraw/zinc/64/14/88/1278641488.db2.gz HPVKAGBJQKPPKI-GFCCVEGCSA-N 0 3 349.406 2.989 20 5 EFBDHN Cc1cocc1C(=O)NC[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001086448795 1271526040 /nfs/dbraw/zinc/52/60/40/1271526040.db2.gz XZJTWOJAWNBARO-CTYIDZIISA-N 0 3 343.383 2.794 20 5 EFBDHN C[C@H](NCCNC(=O)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000746049362 1271743560 /nfs/dbraw/zinc/74/35/60/1271743560.db2.gz PXEQWERCUNYGLR-LBPRGKRZSA-N 0 3 331.347 2.815 20 5 EFBDHN CC(C)(F)C(=O)N[C@H]1CC[C@H](NCc2csc([N+](=O)[O-])c2)CC1 ZINC001034575194 1272317457 /nfs/dbraw/zinc/31/74/57/1272317457.db2.gz AFLWWLIAVFOMLT-HAQNSBGRSA-N 0 3 343.424 2.921 20 5 EFBDHN O=[N+]([O-])C[C@H]1CC[C@@H](N2CCN(c3ccc(F)c(F)c3)CC2)C1 ZINC001169007427 1272580682 /nfs/dbraw/zinc/58/06/82/1272580682.db2.gz NQPWCQVTRIREFS-QWHCGFSZSA-N 0 3 325.359 2.532 20 5 EFBDHN CCOc1ccccc1N1CCN([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169006197 1272581009 /nfs/dbraw/zinc/58/10/09/1272581009.db2.gz FZAPSPMEDJQFAM-HZPDHXFCSA-N 0 3 333.432 2.653 20 5 EFBDHN O=[N+]([O-])C[C@H]1CC[C@H](N2CCN(c3nsc4ccccc43)CC2)C1 ZINC001169010652 1272583895 /nfs/dbraw/zinc/58/38/95/1272583895.db2.gz FGMOSTOCFCORQV-KBPBESRZSA-N 0 3 346.456 2.864 20 5 EFBDHN O=[N+]([O-])C[C@H]1CC[C@H](N2CCN(c3ccc4ccccc4n3)CC2)C1 ZINC001169040012 1272609893 /nfs/dbraw/zinc/60/98/93/1272609893.db2.gz WXWHXFIPWLOFJV-RDJZCZTQSA-N 0 3 340.427 2.802 20 5 EFBDHN O=[N+]([O-])C[C@@H]1CC[C@H](N2C[C@@H]3C[C@H](C2)c2cc4nccnc4cc23)C1 ZINC001169040197 1272610246 /nfs/dbraw/zinc/61/02/46/1272610246.db2.gz YPNHLKUTBNONDZ-KBXIAJHMSA-N 0 3 338.411 2.962 20 5 EFBDHN O=[N+]([O-])C[C@@H]1CC[C@@H](N2CCN(c3ccc4ccccc4n3)CC2)C1 ZINC001169040011 1272611380 /nfs/dbraw/zinc/61/13/80/1272611380.db2.gz WXWHXFIPWLOFJV-NVXWUHKLSA-N 0 3 340.427 2.802 20 5 EFBDHN C[C@@H](N)c1ccn(-c2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)n1 ZINC001169230513 1272748063 /nfs/dbraw/zinc/74/80/63/1272748063.db2.gz STNOJAVJRGCPPR-GFCCVEGCSA-N 0 3 339.355 2.774 20 5 EFBDHN NCc1cnnn1-c1cnc2c3ccccc3c3ccccc3c2n1 ZINC001169308149 1272826676 /nfs/dbraw/zinc/82/66/76/1272826676.db2.gz IQJCLNYBXSFPKN-UHFFFAOYSA-N 0 3 326.363 2.976 20 5 EFBDHN Cc1cscc1C(=O)NCCCNCc1csc([N+](=O)[O-])c1 ZINC001156296223 1272839791 /nfs/dbraw/zinc/83/97/91/1272839791.db2.gz JAPBADJLEOTBAG-UHFFFAOYSA-N 0 3 339.442 2.936 20 5 EFBDHN CN(Cc1ccc(Br)c([N+](=O)[O-])c1)C[C@H]1C[C@@H](O)C1 ZINC000703868672 1273014081 /nfs/dbraw/zinc/01/40/81/1273014081.db2.gz FXFYZEPRMKWAQI-PHIMTYICSA-N 0 3 329.194 2.560 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1N[C@H]1CCc3ccccc3[C@H]1O)CNC2 ZINC001169619178 1273059350 /nfs/dbraw/zinc/05/93/50/1273059350.db2.gz HWQFSNRIRFWSAG-MAUKXSAKSA-N 0 3 325.368 2.658 20 5 EFBDHN O=C(NCCNCc1ccc([N+](=O)[O-])cc1)c1cc2c(o1)CCCC2 ZINC001129186137 1274164732 /nfs/dbraw/zinc/16/47/32/1274164732.db2.gz BQEPDLKDLZOYDH-UHFFFAOYSA-N 0 3 343.383 2.586 20 5 EFBDHN O=C(NCCNCc1cccc([N+](=O)[O-])c1)c1cc2c(o1)CCCC2 ZINC001129186853 1274166628 /nfs/dbraw/zinc/16/66/28/1274166628.db2.gz OSGFEQXWFBASQD-UHFFFAOYSA-N 0 3 343.383 2.586 20 5 EFBDHN CC1CCN(CC(=O)N(C)CCCNc2ccc([N+](=O)[O-])cc2)CC1 ZINC001109498543 1274353800 /nfs/dbraw/zinc/35/38/00/1274353800.db2.gz ASZFBXIDVBGIMO-UHFFFAOYSA-N 0 3 348.447 2.587 20 5 EFBDHN Cc1ccc(NCCCN(C)C(=O)C2(N(C)C)CCC2)c([N+](=O)[O-])c1 ZINC001109547823 1274408410 /nfs/dbraw/zinc/40/84/10/1274408410.db2.gz XEICAGAXUCHSSP-UHFFFAOYSA-N 0 3 348.447 2.648 20 5 EFBDHN O=C(NCC1(NCc2csc([N+](=O)[O-])c2)CCCCC1)C(F)F ZINC001115375910 1275372494 /nfs/dbraw/zinc/37/24/94/1275372494.db2.gz ATGHSLOERORQEC-UHFFFAOYSA-N 0 3 347.387 2.830 20 5 EFBDHN COc1ccc(C[C@@H](C)NCc2cn3ccccc3n2)c([N+](=O)[O-])c1 ZINC001170297428 1278981459 /nfs/dbraw/zinc/98/14/59/1278981459.db2.gz ODUCEBLWUDLVDS-CYBMUJFWSA-N 0 3 340.383 2.972 20 5 EFBDHN COc1ccc(C[C@@H](C)N2CCC[C@@]3(CCC(=O)O3)C2)c([N+](=O)[O-])c1 ZINC001170355234 1279034698 /nfs/dbraw/zinc/03/46/98/1279034698.db2.gz YAPCUNZFQYOTAL-FZKQIMNGSA-N 0 3 348.399 2.706 20 5 EFBDHN CCN(CC)c1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cn1 ZINC000818962781 1276550827 /nfs/dbraw/zinc/55/08/27/1276550827.db2.gz YTZRIDPNWGAEOA-KRWDZBQOSA-N 0 3 344.415 2.659 20 5 EFBDHN CCN(CC)c1ccc(CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000818962689 1276551191 /nfs/dbraw/zinc/55/11/91/1276551191.db2.gz VKGCBJHMIHJFGF-KRWDZBQOSA-N 0 3 344.415 2.659 20 5 EFBDHN COc1ccc2c(c1)OCC[C@@H]2NC[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000819104690 1276608824 /nfs/dbraw/zinc/60/88/24/1276608824.db2.gz RYGZGJCLSFDIPN-DLBZAZTESA-N 0 3 344.367 2.750 20 5 EFBDHN CC[C@H](C)N[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000819386746 1276767740 /nfs/dbraw/zinc/76/77/40/1276767740.db2.gz CJIHEPWWZZHQCK-RRQGHBQHSA-N 0 3 347.415 2.940 20 5 EFBDHN COc1ccnc(CN[C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])c1 ZINC001170306726 1279029048 /nfs/dbraw/zinc/02/90/48/1279029048.db2.gz AWWVSFNJFGIFFF-LBPRGKRZSA-N 0 3 331.372 2.728 20 5 EFBDHN CCN(C(=O)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1)C1CCN(C)CC1 ZINC000821400742 1277536755 /nfs/dbraw/zinc/53/67/55/1277536755.db2.gz IENBEUIJEORPRX-IAGOWNOFSA-N 0 3 331.416 2.641 20 5 EFBDHN COc1ccc(C[C@H](C)n2c(C)nc3c2CNCC3)c([N+](=O)[O-])c1 ZINC001170351029 1279057353 /nfs/dbraw/zinc/05/73/53/1279057353.db2.gz DHPZSUDOHGMMMM-NSHDSACASA-N 0 3 330.388 2.558 20 5 EFBDHN CC(C)(C)N1CC[C@@H]1COC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000845737457 1279809906 /nfs/dbraw/zinc/80/99/06/1279809906.db2.gz HSKCCBCNNHSXHW-CYBMUJFWSA-N 0 3 335.404 2.813 20 5 EFBDHN CC([C@@H](OC(=O)/C=C\c1cnn(C)c1)c1ccccc1F)[N+](=O)[O-] ZINC000845872299 1279900932 /nfs/dbraw/zinc/90/09/32/1279900932.db2.gz GCWCHFIAMFJMSC-ZXTJNULESA-N 0 3 333.319 2.522 20 5 EFBDHN Cc1cc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])cc(=O)[nH]1 ZINC000845874005 1279902059 /nfs/dbraw/zinc/90/20/59/1279902059.db2.gz FTPIVLZANCWOBP-ZUZCIYMTSA-N 0 3 334.303 2.798 20 5 EFBDHN CC([C@H](OC(=O)c1cnn(C)c1Cl)c1ccccc1F)[N+](=O)[O-] ZINC000845877613 1279902891 /nfs/dbraw/zinc/90/28/91/1279902891.db2.gz FPDJOYJSQFBSKC-PELKAZGASA-N 0 3 341.726 2.776 20 5 EFBDHN CCOc1cnc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])cn1 ZINC000845876768 1279903395 /nfs/dbraw/zinc/90/33/95/1279903395.db2.gz OOMHCIQKRNGCLD-BONVTDFDSA-N 0 3 349.318 2.578 20 5 EFBDHN CC([C@@H](OC(=O)[C@@H]1CCO[C@H](C)C1)c1ccccc1F)[N+](=O)[O-] ZINC000845876731 1279903481 /nfs/dbraw/zinc/90/34/81/1279903481.db2.gz ODCDZTNAIKOYBL-NWJSVONSSA-N 0 3 325.336 2.890 20 5 EFBDHN CC([C@H](OC(=O)COCc1cccnc1)c1ccccc1F)[N+](=O)[O-] ZINC000845878437 1279903571 /nfs/dbraw/zinc/90/35/71/1279903571.db2.gz GVEDBDVXOZXJTH-PXAZEXFGSA-N 0 3 348.330 2.687 20 5 EFBDHN CC([C@H](OC(=O)[C@H](C)OCC1CC1)c1ccccc1F)[N+](=O)[O-] ZINC000845878745 1279903586 /nfs/dbraw/zinc/90/35/86/1279903586.db2.gz VUWHSOXXHXKDDH-PGUXBMHVSA-N 0 3 325.336 2.890 20 5 EFBDHN CC([C@H](OC(=O)COCc1cccnc1)c1ccccc1F)[N+](=O)[O-] ZINC000845878440 1279903670 /nfs/dbraw/zinc/90/36/70/1279903670.db2.gz GVEDBDVXOZXJTH-SJCJKPOMSA-N 0 3 348.330 2.687 20 5 EFBDHN CC([C@@H](OC(=O)C[C@@H]1CCCOC1)c1ccccc1F)[N+](=O)[O-] ZINC000845883827 1279906151 /nfs/dbraw/zinc/90/61/51/1279906151.db2.gz WHMDVUMJVMQFMJ-BFQNTYOBSA-N 0 3 325.336 2.892 20 5 EFBDHN COCC(C)(C)N1CCN(Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000822497978 1289015734 /nfs/dbraw/zinc/01/57/34/1289015734.db2.gz QSIMBDJQVYIDOG-UHFFFAOYSA-N 0 3 341.839 2.791 20 5 EFBDHN CC(C)c1ccc(C(=O)NCCNCc2ccc([N+](=O)[O-])cc2)cn1 ZINC001129400895 1280188324 /nfs/dbraw/zinc/18/83/24/1280188324.db2.gz MKSZABSHWCCHQK-UHFFFAOYSA-N 0 3 342.399 2.633 20 5 EFBDHN CN(CCN1CCCCC1)C(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000846611165 1280319540 /nfs/dbraw/zinc/31/95/40/1280319540.db2.gz BAZXZPLHBKAYHX-UHFFFAOYSA-N 0 3 325.796 2.806 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(N[C@H]2C[C@@H](CNC(=O)CN(C)C(C)C)C2)c1 ZINC001091350296 1280384311 /nfs/dbraw/zinc/38/43/11/1280384311.db2.gz LEKKCSQOADJGSF-GASCZTMLSA-N 0 3 348.447 2.550 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCC(C)(C)OCCO ZINC000872073179 1287420354 /nfs/dbraw/zinc/42/03/54/1287420354.db2.gz OBKCXFDSIGVGBO-NSHDSACASA-N 0 3 328.434 2.755 20 5 EFBDHN CCCN(C)CC(=O)NC[C@H]1C[C@H](Nc2cc(C)ccc2[N+](=O)[O-])C1 ZINC001091471015 1280760204 /nfs/dbraw/zinc/76/02/04/1280760204.db2.gz QSBKIJBPURSBKA-SHTZXODSSA-N 0 3 348.447 2.552 20 5 EFBDHN CC(C)(CC(F)(F)F)C(=O)NCCNCc1cccc([N+](=O)[O-])c1 ZINC001146818893 1281041060 /nfs/dbraw/zinc/04/10/60/1281041060.db2.gz GHURBGBTMPHWJD-UHFFFAOYSA-N 0 3 347.337 2.779 20 5 EFBDHN CCCc1occc1C(=O)NCCNCc1ccc([N+](=O)[O-])cc1 ZINC001147748150 1281263616 /nfs/dbraw/zinc/26/36/16/1281263616.db2.gz IVFNVMIWHMBVKT-UHFFFAOYSA-N 0 3 331.372 2.660 20 5 EFBDHN CCc1ccc(C(=O)NCCNCc2cccc([N+](=O)[O-])c2)s1 ZINC001130966175 1281341993 /nfs/dbraw/zinc/34/19/93/1281341993.db2.gz YHTMTIMPQVADKX-UHFFFAOYSA-N 0 3 333.413 2.738 20 5 EFBDHN Cc1cc(F)c(C(=O)NCCNCc2cccc([N+](=O)[O-])c2)c(F)c1 ZINC001131120564 1281487049 /nfs/dbraw/zinc/48/70/49/1281487049.db2.gz QDYDXSNUYHJQHY-UHFFFAOYSA-N 0 3 349.337 2.701 20 5 EFBDHN Cc1cc(C)cc(C(=O)NCCNCc2ccc([N+](=O)[O-])cc2)c1 ZINC001148992711 1281836435 /nfs/dbraw/zinc/83/64/35/1281836435.db2.gz DMRHBOBKNKHLHQ-UHFFFAOYSA-N 0 3 327.384 2.731 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1CNCC[C@H](O)c1ccccc1)OCCO2 ZINC000809748270 1282447225 /nfs/dbraw/zinc/44/72/25/1282447225.db2.gz MVLUMCLIPYZOSR-INIZCTEOSA-N 0 3 344.367 2.579 20 5 EFBDHN C[C@H](NC[C@@H](O)c1c(F)cccc1F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815594636 1287622471 /nfs/dbraw/zinc/62/24/71/1287622471.db2.gz UYJSTYUMRWMZRK-BJOHPYRUSA-N 0 3 337.326 2.839 20 5 EFBDHN C[C@H](NCc1ccc(C[S@@](C)=O)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815625933 1287646102 /nfs/dbraw/zinc/64/61/02/1287646102.db2.gz QIDGXRIEKQGPJS-FNODVLLQSA-N 0 3 347.440 2.906 20 5 EFBDHN O=C(NCCNCc1ccc([N+](=O)[O-])cc1)C1(C(F)F)CCCC1 ZINC001132812461 1284316516 /nfs/dbraw/zinc/31/65/16/1284316516.db2.gz HNEAJDRVWKPWKW-UHFFFAOYSA-N 0 3 341.358 2.626 20 5 EFBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCCCn1cncn1 ZINC000811478314 1284362427 /nfs/dbraw/zinc/36/24/27/1284362427.db2.gz GHJCUVMMUOJWIW-UHFFFAOYSA-N 0 3 330.175 2.673 20 5 EFBDHN CNc1cc([N+](=O)[O-])cnc1-n1c(-c2ccccc2)cnc1[C@H](C)N ZINC001170679253 1285213480 /nfs/dbraw/zinc/21/34/80/1285213480.db2.gz DTXPFSFFWXEJTJ-NSHDSACASA-N 0 3 338.371 2.904 20 5 EFBDHN Cc1ccc(-n2ccnc2SCC(=O)OCC(C)[N+](=O)[O-])cc1C ZINC000813100134 1285651552 /nfs/dbraw/zinc/65/15/52/1285651552.db2.gz NLKDGTDEDIHCON-ZDUSSCGKSA-N 0 3 349.412 2.790 20 5 EFBDHN Cc1noc(C)c1COc1ccccc1C(=O)OCC(C)[N+](=O)[O-] ZINC000813104703 1285653396 /nfs/dbraw/zinc/65/33/96/1285653396.db2.gz FZGBDBQQNKRBRE-JTQLQIEISA-N 0 3 334.328 2.692 20 5 EFBDHN Cc1ccc(OCc2cccc(C(=O)OCC(C)[N+](=O)[O-])c2)cn1 ZINC000813101525 1285654428 /nfs/dbraw/zinc/65/44/28/1285654428.db2.gz CTJDQWLVOKRZMY-CYBMUJFWSA-N 0 3 330.340 2.791 20 5 EFBDHN CC(COC(=O)c1ccccc1-c1nc(C(C)(C)C)no1)[N+](=O)[O-] ZINC000813101490 1285655014 /nfs/dbraw/zinc/65/50/14/1285655014.db2.gz BLSSUPJURFUBMB-JTQLQIEISA-N 0 3 333.344 2.856 20 5 EFBDHN CC(COC(=O)c1ccc(C(=O)N(C)c2ccccc2)cc1)[N+](=O)[O-] ZINC000813107930 1285679060 /nfs/dbraw/zinc/67/90/60/1285679060.db2.gz ZFKZFATUXCLJAG-CYBMUJFWSA-N 0 3 342.351 2.785 20 5 EFBDHN Cc1nc(C(=O)OCC(C)[N+](=O)[O-])nn1-c1ccccc1C(C)C ZINC000813108986 1285680283 /nfs/dbraw/zinc/68/02/83/1285680283.db2.gz CXYREZFPUSXPDZ-NSHDSACASA-N 0 3 332.360 2.521 20 5 EFBDHN CCc1c(C(=O)OCC(C)[N+](=O)[O-])cnn1-c1ccc(Cl)cc1 ZINC000813108726 1285680947 /nfs/dbraw/zinc/68/09/47/1285680947.db2.gz AASLIIIMJMXZMI-SNVBAGLBSA-N 0 3 337.763 2.910 20 5 EFBDHN CC(COC(=O)c1ccnc(Oc2ccc(F)cc2F)c1)[N+](=O)[O-] ZINC000813108806 1285681531 /nfs/dbraw/zinc/68/15/31/1285681531.db2.gz LXAZSIVXVHXBMO-VIFPVBQESA-N 0 3 338.266 2.974 20 5 EFBDHN CC(COC(=O)c1cccc(C(=O)N(C)c2ccccc2)c1)[N+](=O)[O-] ZINC000813111074 1285682298 /nfs/dbraw/zinc/68/22/98/1285682298.db2.gz BYVXWVMPYFYHKP-ZDUSSCGKSA-N 0 3 342.351 2.785 20 5 EFBDHN CC(COC(=O)c1cn(C)nc1-c1ccc(Cl)s1)[N+](=O)[O-] ZINC000813109284 1285682583 /nfs/dbraw/zinc/68/25/83/1285682583.db2.gz RAMGEURTSNYPRW-SSDOTTSWSA-N 0 3 329.765 2.624 20 5 EFBDHN CC(COC(=O)c1cccc(NC(=O)c2cccs2)c1)[N+](=O)[O-] ZINC000813109193 1285683102 /nfs/dbraw/zinc/68/31/02/1285683102.db2.gz PIZMKLIHRFHPMC-JTQLQIEISA-N 0 3 334.353 2.822 20 5 EFBDHN O=C(CCc1ccccc1)NCCCNCc1csc([N+](=O)[O-])c1 ZINC001171864590 1285864321 /nfs/dbraw/zinc/86/43/21/1285864321.db2.gz AWCNCMBDNZNUOG-UHFFFAOYSA-N 0 3 347.440 2.885 20 5 EFBDHN O=C(NCCNCc1ccc([N+](=O)[O-])cc1)c1cc2occc2s1 ZINC001133766367 1285920281 /nfs/dbraw/zinc/92/02/81/1285920281.db2.gz BZKBDMXJTDDFJP-UHFFFAOYSA-N 0 3 345.380 2.922 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)NCc2cncc(F)c2)c1F ZINC001173175186 1286451278 /nfs/dbraw/zinc/45/12/78/1286451278.db2.gz AUCRDTMCXCVDST-JTQLQIEISA-N 0 3 337.326 2.997 20 5 EFBDHN CCOC(CN[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-])OCC ZINC001173176645 1286452749 /nfs/dbraw/zinc/45/27/49/1286452749.db2.gz LEKCZOZBOOYVAI-NSHDSACASA-N 0 3 344.383 2.662 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CCCC[C@@](C)(O)C2)c1F ZINC001173179789 1286454596 /nfs/dbraw/zinc/45/45/96/1286454596.db2.gz GTKNPWXTRJIMNC-YVEFUNNKSA-N 0 3 340.395 2.910 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CC[C@@H]3COC[C@@H]3C2)c1F ZINC001173180356 1286454711 /nfs/dbraw/zinc/45/47/11/1286454711.db2.gz KASYYCPQYZLNCL-XQQFMLRXSA-N 0 3 338.379 2.642 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N2C[C@H](C)N(C)C[C@H]2C)c1F ZINC001173184179 1286456391 /nfs/dbraw/zinc/45/63/91/1286456391.db2.gz DCSWGJSXCGSNTI-RWMBFGLXSA-N 0 3 339.411 2.698 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)NCc2ccnc(C)n2)c1F ZINC001173190146 1286458159 /nfs/dbraw/zinc/45/81/59/1286458159.db2.gz ULHBXDRSMFUJDH-JTQLQIEISA-N 0 3 334.351 2.562 20 5 EFBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N[C@@H](C)c1nnc2ccccn21 ZINC001173210320 1286485080 /nfs/dbraw/zinc/48/50/80/1286485080.db2.gz ITGYMFZNVBEODT-STQMWFEESA-N 0 3 325.372 2.919 20 5 EFBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](Oc2ncccn2)C1 ZINC001173238991 1286497125 /nfs/dbraw/zinc/49/71/25/1286497125.db2.gz ZTMCOVWLCLXMJS-WMLDXEAASA-N 0 3 342.399 2.859 20 5 EFBDHN CCN(CC)CC(=O)N1CCC(Nc2cc(C)ccc2[N+](=O)[O-])CC1 ZINC001095228689 1286712082 /nfs/dbraw/zinc/71/20/82/1286712082.db2.gz QXRGDNWICOGHOJ-UHFFFAOYSA-N 0 3 348.447 2.648 20 5 EFBDHN CCCN(C)CC(=O)N1CCC(Nc2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC001095233604 1286720927 /nfs/dbraw/zinc/72/09/27/1286720927.db2.gz FWKRGJUVUFGTDN-UHFFFAOYSA-N 0 3 348.447 2.648 20 5 EFBDHN CC(C)(CCC(=O)N1CCN(CC2CCCCC2)CC1)[N+](=O)[O-] ZINC000822823962 1289124695 /nfs/dbraw/zinc/12/46/95/1289124695.db2.gz OKOWIWFCRKXWDK-UHFFFAOYSA-N 0 3 325.453 2.546 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1CNC[C@@H](O)COc1cccc(F)c1 ZINC000873020727 1289525036 /nfs/dbraw/zinc/52/50/36/1289525036.db2.gz BQOLKCXFQXUIMZ-OAHLLOKOSA-N 0 3 348.374 2.880 20 5 EFBDHN O=C(NCCCNCc1csc([N+](=O)[O-])c1)c1occc1Cl ZINC001166024932 1312719494 /nfs/dbraw/zinc/71/94/94/1312719494.db2.gz IBOJIZDVZMCHAY-UHFFFAOYSA-N 0 3 343.792 2.812 20 5 EFBDHN CCN(C)C(C)(C)C(=O)NCC1(Nc2cc(C)ccc2[N+](=O)[O-])CC1 ZINC001110266177 1290134334 /nfs/dbraw/zinc/13/43/34/1290134334.db2.gz ODHMSQFQUTUTFB-UHFFFAOYSA-N 0 3 348.447 2.694 20 5 EFBDHN O=C(c1cc([N+](=O)[O-])ccc1F)N1CCC[C@@H]1CN1CCCCC1 ZINC000825731648 1290266916 /nfs/dbraw/zinc/26/69/16/1290266916.db2.gz JUXVHENEJJGARK-CQSZACIVSA-N 0 3 335.379 2.824 20 5 EFBDHN CC1(CCNCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])OCCO1 ZINC000877346806 1291201880 /nfs/dbraw/zinc/20/18/80/1291201880.db2.gz NLJNRYDHZLPIHP-UHFFFAOYSA-N 0 3 334.294 2.856 20 5 EFBDHN Nc1ccnc(NC[C@@H](c2ccccc2)N2CCCC2)c1[N+](=O)[O-] ZINC001166888520 1312861065 /nfs/dbraw/zinc/86/10/65/1312861065.db2.gz JRCHTQFUUXIAAE-HNNXBMFYSA-N 0 3 327.388 2.821 20 5 EFBDHN Cn1cc(NC[C@H](c2ccccc2)N2CCCC2)cc([N+](=O)[O-])c1=O ZINC001166902492 1312863792 /nfs/dbraw/zinc/86/37/92/1312863792.db2.gz YHQKUXGWCZUPIW-QGZVFWFLSA-N 0 3 342.399 2.543 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@H]([C@H]2CCCO2)C2(CO)CCC2)cc1F ZINC000878870354 1291836340 /nfs/dbraw/zinc/83/63/40/1291836340.db2.gz ZHFAGRILLLOMKS-HZPDHXFCSA-N 0 3 338.379 2.534 20 5 EFBDHN Cc1ccc(NC[C@H]2C[C@H](NC(=O)CN(C)C(C)C)C2)c([N+](=O)[O-])c1 ZINC001114775720 1291929782 /nfs/dbraw/zinc/92/97/82/1291929782.db2.gz FPYVJOMZIRPTKL-SHTZXODSSA-N 0 3 348.447 2.550 20 5 EFBDHN COc1ccc([C@H]2CN(Cc3ccc([N+](=O)[O-])cc3F)CCN2)cc1 ZINC000879520308 1292169127 /nfs/dbraw/zinc/16/91/27/1292169127.db2.gz DNLGRWXUGXZXHI-GOSISDBHSA-N 0 3 345.374 2.889 20 5 EFBDHN COc1cccc([C@@H]2CN(Cc3ccc([N+](=O)[O-])c(F)c3)CCN2)c1 ZINC000879525427 1292171808 /nfs/dbraw/zinc/17/18/08/1292171808.db2.gz YHDMWYFOJZZYAF-KRWDZBQOSA-N 0 3 345.374 2.889 20 5 EFBDHN CCNC(=O)OC[C@H]1CCCCN1CCc1ccc([N+](=O)[O-])cc1 ZINC000796164684 1292198736 /nfs/dbraw/zinc/19/87/36/1292198736.db2.gz MVBWAIAKGKPAHK-MRXNPFEDSA-N 0 3 335.404 2.738 20 5 EFBDHN Cc1ccc(C(=O)NCCCN(C)Cc2ccc([N+](=O)[O-])cc2)o1 ZINC001233597998 1312964230 /nfs/dbraw/zinc/96/42/30/1312964230.db2.gz DMHUWJVQBDXYCL-UHFFFAOYSA-N 0 3 331.372 2.748 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@]1(O)CCc2ccccc21 ZINC000132118667 1293627625 /nfs/dbraw/zinc/62/76/25/1293627625.db2.gz TURXMUNOYZBNAA-LJQANCHMSA-N 0 3 342.395 2.917 20 5 EFBDHN CC(C)SCC(=O)NCCCN(C)Cc1cccc([N+](=O)[O-])c1 ZINC001234137851 1313066275 /nfs/dbraw/zinc/06/62/75/1313066275.db2.gz WNDPNCPGDIHQTQ-UHFFFAOYSA-N 0 3 339.461 2.675 20 5 EFBDHN O=[N+]([O-])c1ncccc1CN1CCN(c2ccnc3ccccc32)CC1 ZINC000886200199 1294760045 /nfs/dbraw/zinc/76/00/45/1294760045.db2.gz BDWOOTRAJLZKIP-UHFFFAOYSA-N 0 3 349.394 2.860 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H](CO)C[C@@H]2CCCO2)o1 ZINC000886229337 1294775572 /nfs/dbraw/zinc/77/55/72/1294775572.db2.gz OFIWIKVRDPXOLK-KGLIPLIRSA-N 0 3 346.383 2.874 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H](CO)C[C@H]2CCCO2)o1 ZINC000886229338 1294775773 /nfs/dbraw/zinc/77/57/73/1294775773.db2.gz OFIWIKVRDPXOLK-UONOGXRCSA-N 0 3 346.383 2.874 20 5 EFBDHN CN1CCC[C@@H](Oc2cc(O)cc3oc4ccc(O)cc4c(=O)c23)C1 ZINC001234743981 1313187583 /nfs/dbraw/zinc/18/75/83/1313187583.db2.gz IGDAUEDRYFJICI-CYBMUJFWSA-N 0 3 341.363 2.830 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(O[C@H]2CN(Cc3ccccc3)C[C@@H]2C)n1 ZINC001234881939 1313203154 /nfs/dbraw/zinc/20/31/54/1313203154.db2.gz SVYTXVLQMOPODH-BBRMVZONSA-N 0 3 343.383 2.898 20 5 EFBDHN O=C(CCC(F)F)N1CCC(NCc2csc([N+](=O)[O-])c2)CC1 ZINC001201641056 1296991889 /nfs/dbraw/zinc/99/18/89/1296991889.db2.gz UYHJSBWZMSIDMJ-UHFFFAOYSA-N 0 3 347.387 2.782 20 5 EFBDHN Cc1ccccc1OCCN(C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776274387 1297338692 /nfs/dbraw/zinc/33/86/92/1297338692.db2.gz HHSBMYVKMZISMY-QGZVFWFLSA-N 0 3 330.384 2.947 20 5 EFBDHN CN(CCOc1ccc(F)cc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776275954 1297339741 /nfs/dbraw/zinc/33/97/41/1297339741.db2.gz MATDCPGDPHIEMU-QGZVFWFLSA-N 0 3 334.347 2.778 20 5 EFBDHN Cc1c(CN2C[C@@H](Cc3ccccc3)[C@H](O)C2)cccc1[N+](=O)[O-] ZINC000934440190 1297557545 /nfs/dbraw/zinc/55/75/45/1297557545.db2.gz ZGGVIWRYEWHDTJ-IEBWSBKVSA-N 0 3 326.396 2.939 20 5 EFBDHN COC[C@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)c1cccc(OC)c1 ZINC000852444092 1299705921 /nfs/dbraw/zinc/70/59/21/1299705921.db2.gz SFTVHPKPWCSCDU-ZWKOTPCHSA-N 0 3 346.383 2.614 20 5 EFBDHN Nc1ccc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000854496330 1300592369 /nfs/dbraw/zinc/59/23/69/1300592369.db2.gz JTYYQEIMEYQDGD-NXEZZACHSA-N 0 3 347.293 2.863 20 5 EFBDHN O=C(NC1CC2(CC(NCc3csc([N+](=O)[O-])c3)C2)C1)C1CC1 ZINC000963457431 1300894505 /nfs/dbraw/zinc/89/45/05/1300894505.db2.gz SZIFQLASUVEVDG-UHFFFAOYSA-N 0 3 335.429 2.583 20 5 EFBDHN CC(C)C(=O)NC1CC2(CC(NCc3csc([N+](=O)[O-])c3)C2)C1 ZINC000963576817 1301082704 /nfs/dbraw/zinc/08/27/04/1301082704.db2.gz MZTTXFOUPMDHBS-UHFFFAOYSA-N 0 3 337.445 2.829 20 5 EFBDHN CN(CCNC(=O)Cc1cccc(F)c1[N+](=O)[O-])Cc1ccccc1 ZINC000864983508 1303110721 /nfs/dbraw/zinc/11/07/21/1303110721.db2.gz OVFJNARNOCBNRD-UHFFFAOYSA-N 0 3 345.374 2.525 20 5 EFBDHN CCN(C)C(C)(C)C(=O)N[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(C)c2)C1 ZINC001097230903 1313921672 /nfs/dbraw/zinc/92/16/72/1313921672.db2.gz DPTCWUBFNBSGPN-GASCZTMLSA-N 0 3 348.447 2.693 20 5 EFBDHN C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])NCC(=O)NCc1ccccc1 ZINC000866245884 1303578196 /nfs/dbraw/zinc/57/81/96/1303578196.db2.gz HINRXSPSAQTSOM-CYBMUJFWSA-N 0 3 345.374 2.571 20 5 EFBDHN C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])N[C@@H]1CCN(C(C)(C)C)C1=O ZINC000866380874 1303618138 /nfs/dbraw/zinc/61/81/38/1303618138.db2.gz LUAFLQLKUUMANT-BXUZGUMPSA-N 0 3 337.395 2.654 20 5 EFBDHN CC([C@@H](OC(=O)c1cnn(C(F)F)c1)c1ccccc1F)[N+](=O)[O-] ZINC000870454929 1305329959 /nfs/dbraw/zinc/32/99/59/1305329959.db2.gz ROQUKHCAWNFNHX-QPUJVOFHSA-N 0 3 343.261 2.981 20 5 EFBDHN CC([C@H](OC(=O)c1ncc2n1CCCC2)c1ccccc1F)[N+](=O)[O-] ZINC000870455143 1305330701 /nfs/dbraw/zinc/33/07/01/1305330701.db2.gz WDOHQCWZZCGTOT-ABAIWWIYSA-N 0 3 347.346 2.922 20 5 EFBDHN CC([C@H](OC(=O)c1ncc2n1CCCC2)c1ccccc1F)[N+](=O)[O-] ZINC000870455145 1305331147 /nfs/dbraw/zinc/33/11/47/1305331147.db2.gz WDOHQCWZZCGTOT-NHYWBVRUSA-N 0 3 347.346 2.922 20 5 EFBDHN CC([C@H](OC(=O)c1cnn(CC2CC2)c1)c1ccccc1F)[N+](=O)[O-] ZINC000870455387 1305331248 /nfs/dbraw/zinc/33/12/48/1305331248.db2.gz YLVBPTUIOJKYGE-BZNIZROVSA-N 0 3 347.346 2.996 20 5 EFBDHN Cc1cccc(CN2CC[C@H](NC(=O)CCC(C)(C)[N+](=O)[O-])C2)c1 ZINC000870909074 1305673293 /nfs/dbraw/zinc/67/32/93/1305673293.db2.gz JPWWCOVSWXNHGN-INIZCTEOSA-N 0 3 333.432 2.521 20 5 EFBDHN Cc1ccc(CN2CC[C@H](NC(=O)CCC(C)(C)[N+](=O)[O-])C2)cc1 ZINC000871187619 1305876074 /nfs/dbraw/zinc/87/60/74/1305876074.db2.gz HJGJLUBZNGLHGN-INIZCTEOSA-N 0 3 333.432 2.521 20 5 EFBDHN CN1CCN(Cc2ccc(Nc3ccc(N)c([N+](=O)[O-])c3)cc2)CC1 ZINC001209936590 1314261434 /nfs/dbraw/zinc/26/14/34/1314261434.db2.gz UCUVFQKUZKTFDE-UHFFFAOYSA-N 0 3 341.415 2.668 20 5 EFBDHN C[C@H]1CN(C2CC2)C[C@H]1NC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC000901026725 1309225020 /nfs/dbraw/zinc/22/50/20/1309225020.db2.gz OULWIOJUCNTWIC-QPUJVOFHSA-N 0 3 341.770 2.600 20 5 EFBDHN O=C(OCc1nc2cc([N+](=O)[O-])ccc2o1)C1CCN(C2CC2)CC1 ZINC000801874629 1311042230 /nfs/dbraw/zinc/04/22/30/1311042230.db2.gz COFJMLKYEJPNPC-UHFFFAOYSA-N 0 3 345.355 2.654 20 5 EFBDHN COC(=O)[C@H]1CNCCN1Cc1c2ccccc2cc2ccccc21 ZINC001222413871 1311127609 /nfs/dbraw/zinc/12/76/09/1311127609.db2.gz FEOXCBGUOUIRNY-HXUWFJFHSA-N 0 3 334.419 2.940 20 5 EFBDHN CC(=O)O[C@H]1C[C@@H]2C[C@H](OCc3c(C)cccc3[N+](=O)[O-])C[C@H]1N2C ZINC001223539294 1311273117 /nfs/dbraw/zinc/27/31/17/1311273117.db2.gz PDCWKICFIZIILH-ZZCKCESHSA-N 0 3 348.399 2.587 20 5 EFBDHN O=C(NCC1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1)C1(CF)CC1 ZINC001224504280 1311399984 /nfs/dbraw/zinc/39/99/84/1311399984.db2.gz AAHUNBZGELTVGW-UHFFFAOYSA-N 0 3 349.406 2.673 20 5 EFBDHN O=C(NCCCNCc1csc([N+](=O)[O-])c1)c1cc2occc2[nH]1 ZINC001159121928 1311454688 /nfs/dbraw/zinc/45/46/88/1311454688.db2.gz ULRRRFJAIDTGKS-UHFFFAOYSA-N 0 3 348.384 2.640 20 5 EFBDHN C[C@@H](Nc1nc2ccccc2c(Cl)c1[N+](=O)[O-])[C@H]1CNCCO1 ZINC001159501073 1311528394 /nfs/dbraw/zinc/52/83/94/1311528394.db2.gz YESHNSCFFFWBAS-BXKDBHETSA-N 0 3 336.779 2.585 20 5 EFBDHN CC(C)N1CC[C@H](Oc2ncc(Br)cc2[N+](=O)[O-])C1 ZINC001225748757 1311572328 /nfs/dbraw/zinc/57/23/28/1311572328.db2.gz VWFPGRCKBCXOHU-JTQLQIEISA-N 0 3 330.182 2.614 20 5 EFBDHN NCc1ccc(Nc2cc([N+](=O)[O-])cc3c(Cl)ncnc23)cn1 ZINC001160405347 1311703831 /nfs/dbraw/zinc/70/38/31/1311703831.db2.gz HRAVLECOIXONHT-UHFFFAOYSA-N 0 3 330.735 2.789 20 5 EFBDHN C[C@@H]1CCN(Cc2ccccc2)C[C@@H]1Oc1ncc([N+](=O)[O-])cn1 ZINC001226729193 1311714906 /nfs/dbraw/zinc/71/49/06/1311714906.db2.gz BPBXFQUTZKGHTR-CJNGLKHVSA-N 0 3 328.372 2.674 20 5 EFBDHN CN(C)Cc1ccc(-c2noc(-c3ccnc([N+](=O)[O-])c3)n2)cc1 ZINC001213025904 1311766118 /nfs/dbraw/zinc/76/61/18/1311766118.db2.gz YJKKUISKGXMCFV-UHFFFAOYSA-N 0 3 325.328 2.768 20 5 EFBDHN CN1CCN(CCCNc2ncnc3cc4ccccc4cc32)CC1 ZINC001161706448 1311956231 /nfs/dbraw/zinc/95/62/31/1311956231.db2.gz XVTUKPUUWWLPOZ-UHFFFAOYSA-N 0 3 335.455 2.832 20 5 EFBDHN CN1CCN(CCCNc2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC001161708585 1311956463 /nfs/dbraw/zinc/95/64/63/1311956463.db2.gz NZBWAKNBEAUWHZ-UHFFFAOYSA-N 0 3 346.353 2.663 20 5 EFBDHN CN1CCN(CCCNc2cc3cccnc3c3ncccc23)CC1 ZINC001161709939 1311957449 /nfs/dbraw/zinc/95/74/49/1311957449.db2.gz LBXGIGTXYQEHID-UHFFFAOYSA-N 0 3 335.455 2.832 20 5 EFBDHN Cc1cc2nc(O[C@@H]3[C@@H]4CCC[C@H]3C[N@@H+](C)C4)[n-]c2cc1[N+](=O)[O-] ZINC001228676359 1311980267 /nfs/dbraw/zinc/98/02/67/1311980267.db2.gz DFLDSYRNURGBTO-DRXBFXEBSA-N 0 3 330.388 2.889 20 5 EFBDHN Cc1cc2nc(O[C@@H]3[C@@H]4CCC[C@H]3C[N@H+](C)C4)[n-]c2cc1[N+](=O)[O-] ZINC001228676359 1311980268 /nfs/dbraw/zinc/98/02/68/1311980268.db2.gz DFLDSYRNURGBTO-DRXBFXEBSA-N 0 3 330.388 2.889 20 5 EFBDHN Cc1cc2[n-]c(O[C@@H]3[C@@H]4CCC[C@H]3C[N@@H+](C)C4)nc2cc1[N+](=O)[O-] ZINC001228676359 1311980272 /nfs/dbraw/zinc/98/02/72/1311980272.db2.gz DFLDSYRNURGBTO-DRXBFXEBSA-N 0 3 330.388 2.889 20 5 EFBDHN Cc1cc2[n-]c(O[C@@H]3[C@@H]4CCC[C@H]3C[N@H+](C)C4)nc2cc1[N+](=O)[O-] ZINC001228676359 1311980275 /nfs/dbraw/zinc/98/02/75/1311980275.db2.gz DFLDSYRNURGBTO-DRXBFXEBSA-N 0 3 330.388 2.889 20 5 EFBDHN Cc1[nH]c(=O)cc(O[C@@H]2CCN([C@@H](C)c3ccccn3)C2)c1[N+](=O)[O-] ZINC001228687729 1311981752 /nfs/dbraw/zinc/98/17/52/1311981752.db2.gz AFMFBYQJAYVMMA-QWHCGFSZSA-N 0 3 344.371 2.613 20 5 EFBDHN O=C(C1CCCC1)N1C[C@H]2CN(Cc3cccc([N+](=O)[O-])c3)C[C@H]2C1 ZINC001048641385 1311996618 /nfs/dbraw/zinc/99/66/18/1311996618.db2.gz ZUESGPNDMGGNQX-CALCHBBNSA-N 0 3 343.427 2.675 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1NCCc1ccc3c(c1)OCO3)CNC2 ZINC001162087737 1312045085 /nfs/dbraw/zinc/04/50/85/1312045085.db2.gz DDZKSTUGKYNVKK-UHFFFAOYSA-N 0 3 327.340 2.581 20 5 EFBDHN NCc1cn(-c2cc([N+](=O)[O-])cc3cc(Br)cnc32)cn1 ZINC001162304428 1312084678 /nfs/dbraw/zinc/08/46/78/1312084678.db2.gz RGANVCZXEYBQKW-UHFFFAOYSA-N 0 3 348.160 2.550 20 5 EFBDHN C[C@H](c1ccccn1)[N@@H+]1CC[C@@H](Oc2cc([N+](=O)[O-])ccc2[O-])C1 ZINC001229396395 1312088807 /nfs/dbraw/zinc/08/88/07/1312088807.db2.gz SSULXIXVOGVQHR-TZMCWYRMSA-N 0 3 329.356 2.910 20 5 EFBDHN C[C@H](c1ccccn1)[N@H+]1CC[C@@H](Oc2cc([N+](=O)[O-])ccc2[O-])C1 ZINC001229396395 1312088809 /nfs/dbraw/zinc/08/88/09/1312088809.db2.gz SSULXIXVOGVQHR-TZMCWYRMSA-N 0 3 329.356 2.910 20 5 EFBDHN O=C(C=C1CCC1)N1C[C@H]2CN(Cc3cccc([N+](=O)[O-])c3)C[C@H]2C1 ZINC001048758753 1312110166 /nfs/dbraw/zinc/11/01/66/1312110166.db2.gz IUWBARMYQLRKHC-CALCHBBNSA-N 0 3 341.411 2.595 20 5 EFBDHN CC(=O)Nc1ccc(N[C@@H]2CNCc3ccsc32)cc1[N+](=O)[O-] ZINC001163230263 1312270921 /nfs/dbraw/zinc/27/09/21/1312270921.db2.gz UOKQMSVHXFBOQK-CYBMUJFWSA-N 0 3 332.385 2.871 20 5 EFBDHN CC1(CC(=O)N2C[C@H]3CN(Cc4cccc([N+](=O)[O-])c4)C[C@H]3C2)CC1 ZINC001048941314 1312283155 /nfs/dbraw/zinc/28/31/55/1312283155.db2.gz HUOLFCFLIRNMHC-IYBDPMFKSA-N 0 3 343.427 2.675 20 5 EFBDHN O=C(NCCC1(CNCc2csc([N+](=O)[O-])c2)CC1)c1ccoc1 ZINC001163411371 1312307789 /nfs/dbraw/zinc/30/77/89/1312307789.db2.gz HBBVQVXCAPJFKQ-UHFFFAOYSA-N 0 3 349.412 2.939 20 5 EFBDHN CC(C)[C@@H](N[C@@H](C)Cc1ccc(F)cc1[N+](=O)[O-])c1nncn1C ZINC000903065653 1312320687 /nfs/dbraw/zinc/32/06/87/1312320687.db2.gz RSFUKYVLFMTHKH-XHDPSFHLSA-N 0 3 335.383 2.780 20 5 EFBDHN CCC(C)(C)C(=O)N1C[C@H]2CN(Cc3ccc([N+](=O)[O-])cc3)C[C@H]2C1 ZINC001049017908 1312366635 /nfs/dbraw/zinc/36/66/35/1312366635.db2.gz YKFPSAJXXPAKSW-IYBDPMFKSA-N 0 3 345.443 2.921 20 5 EFBDHN CCC1(C(=O)N2C[C@H]3CN(Cc4ccccc4[N+](=O)[O-])C[C@H]3C2)CC1 ZINC001049035118 1312385731 /nfs/dbraw/zinc/38/57/31/1312385731.db2.gz XGOWCYCUQFTFGH-IYBDPMFKSA-N 0 3 343.427 2.675 20 5 EFBDHN O=C(NCCC1(CNCc2csc([N+](=O)[O-])c2)CC1)C1CC=CC1 ZINC001163917863 1312407395 /nfs/dbraw/zinc/40/73/95/1312407395.db2.gz JATODPGBLXTGIT-UHFFFAOYSA-N 0 3 349.456 2.999 20 5 EFBDHN O=C(/C=C/C1CC1)NCCC1(CNCc2ccccc2[N+](=O)[O-])CC1 ZINC001163941096 1312411569 /nfs/dbraw/zinc/41/15/69/1312411569.db2.gz XSJDFTIRABOTHL-BQYQJAHWSA-N 0 3 343.427 2.937 20 5 EFBDHN Cc1cc(CN)nn1-c1ccc([N+](=O)[O-])c(OCc2ccccc2)n1 ZINC001163982122 1312419697 /nfs/dbraw/zinc/41/96/97/1312419697.db2.gz YJMNXNKGTAZCNE-UHFFFAOYSA-N 0 3 339.355 2.522 20 5 EFBDHN CC(C)=C(C)CC(=O)NCCCNCc1csc([N+](=O)[O-])c1 ZINC001164034152 1312433340 /nfs/dbraw/zinc/43/33/40/1312433340.db2.gz BSDKYQKCFXLETP-UHFFFAOYSA-N 0 3 325.434 2.999 20 5 EFBDHN CN(CCCNC(=O)c1ccccc1F)Cc1ccc([N+](=O)[O-])cc1 ZINC001231308994 1312475436 /nfs/dbraw/zinc/47/54/36/1312475436.db2.gz CNADZMJXNKJQNS-UHFFFAOYSA-N 0 3 345.374 2.986 20 5 EFBDHN O=C(NCCC1(CNCc2ccccc2[N+](=O)[O-])CC1)c1cc[nH]c1 ZINC001164612213 1312551249 /nfs/dbraw/zinc/55/12/49/1312551249.db2.gz NLTQWTNBQORQFD-UHFFFAOYSA-N 0 3 342.399 2.613 20 5 EFBDHN Cc1ccc(-c2ccc(N3CC(C)(N(C)C)C3)nn2)cc1[N+](=O)[O-] ZINC001165120860 1312572128 /nfs/dbraw/zinc/57/21/28/1312572128.db2.gz PKXZWPMXTPDXTM-UHFFFAOYSA-N 0 3 327.388 2.501 20 5 EFBDHN CN(CCN1CCCC1)C(F)(F)c1ccc([N+](=O)[O-])c(Cl)n1 ZINC001165140695 1312576991 /nfs/dbraw/zinc/57/69/91/1312576991.db2.gz YIOIOMUEQWKVIA-UHFFFAOYSA-N 0 3 334.754 2.720 20 5 EFBDHN O=[N+]([O-])c1c(Cl)c2ccccc2nc1-n1ncc2c1CCNC2 ZINC001165218960 1312589023 /nfs/dbraw/zinc/58/90/23/1312589023.db2.gz NDLONPSHHRJFRG-UHFFFAOYSA-N 0 3 329.747 2.628 20 5 EFBDHN O=[N+]([O-])c1c(Cl)ccnc1N1C[C@H]2c3ccccc3CN[C@@H]2C1 ZINC001165349935 1312613314 /nfs/dbraw/zinc/61/33/14/1312613314.db2.gz KRRGEKBIEZJNKP-GXTWGEPZSA-N 0 3 330.775 2.719 20 5 EFBDHN CC(=O)NC1CCN(Cc2ccc3ccc4cccnc4c3n2)CC1 ZINC001232219272 1312651762 /nfs/dbraw/zinc/65/17/62/1312651762.db2.gz OOQNYTJCOCGNOW-UHFFFAOYSA-N 0 3 334.423 2.884 20 5 EFBDHN CN(Cc1nc(-c2cc3ccccc3c3ccccc23)no1)C(=O)CN ZINC001211362182 1314484464 /nfs/dbraw/zinc/48/44/64/1314484464.db2.gz TXGUCXCAQRCUHB-UHFFFAOYSA-N 0 3 346.390 2.960 20 5 EFBDHN O=C(N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1)c1cccs1 ZINC001019955853 1314549299 /nfs/dbraw/zinc/54/92/99/1314549299.db2.gz HOUQGQMHNCHMOK-JOCQHMNTSA-N 0 3 331.397 2.707 20 5 EFBDHN O=C(Cc1ccsc1)N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001019962206 1314550428 /nfs/dbraw/zinc/55/04/28/1314550428.db2.gz OHOBHRZGSRCROW-SHTZXODSSA-N 0 3 345.424 2.636 20 5 EFBDHN Cc1cc(C(=O)N[C@H]2C[C@H](NCc3ccccc3[N+](=O)[O-])C2)co1 ZINC001020105923 1314612180 /nfs/dbraw/zinc/61/21/80/1314612180.db2.gz TXTHSLISFBRKHP-SHTZXODSSA-N 0 3 329.356 2.547 20 5 EFBDHN CC1(C)N[C@@H](CO[C@@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)CO1 ZINC001217917369 1315120791 /nfs/dbraw/zinc/12/07/91/1315120791.db2.gz WKPJFUFOJVYMJI-JQWIXIFHSA-N 0 3 334.294 2.939 20 5 EFBDHN O=[N+]([O-])c1cc2[n-]c(O[C@@H]3CCC[NH2+]C[C@@H]3F)nc2cc1Cl ZINC001217945970 1315123594 /nfs/dbraw/zinc/12/35/94/1315123594.db2.gz FUXUTQBWGFZTGH-QPUJVOFHSA-N 0 3 328.731 2.593 20 5 EFBDHN O=[N+]([O-])c1cc2nc(O[C@@H]3CCC[NH2+]C[C@@H]3F)[n-]c2cc1Cl ZINC001217945970 1315123595 /nfs/dbraw/zinc/12/35/95/1315123595.db2.gz FUXUTQBWGFZTGH-QPUJVOFHSA-N 0 3 328.731 2.593 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)cc(Br)c1O[C@@H]1CNC[C@@H]1F ZINC001218001227 1315131674 /nfs/dbraw/zinc/13/16/74/1315131674.db2.gz RPYVENUWAWDTAA-IONNQARKSA-N 0 3 339.548 2.699 20 5 EFBDHN Cc1cc(O[C@H]2CCNC[C@H]2F)c([N+](=O)[O-])cc1Br ZINC001218065409 1315141810 /nfs/dbraw/zinc/14/18/10/1315141810.db2.gz FNDZZFRYKULDGT-KOLCDFICSA-N 0 3 333.157 2.745 20 5 EFBDHN CC(C)(C)c1cc([N+](=O)[O-])c(O[C@H]2CCNC[C@H]2F)c([N+](=O)[O-])c1 ZINC001218071892 1315143290 /nfs/dbraw/zinc/14/32/90/1315143290.db2.gz QLGGANCTQLHORE-MFKMUULPSA-N 0 3 341.339 2.879 20 5 EFBDHN O=[N+]([O-])c1ccc(O[C@H]2CNCCC2(F)F)cc1C(F)(F)F ZINC001218450255 1315197798 /nfs/dbraw/zinc/19/77/98/1315197798.db2.gz XYYIQPIHTJHJDC-JTQLQIEISA-N 0 3 326.221 2.990 20 5 EFBDHN CCOC(=O)c1ccc(O[C@@H]2CNCc3ccccc32)c([N+](=O)[O-])c1 ZINC001218485289 1315204065 /nfs/dbraw/zinc/20/40/65/1315204065.db2.gz GUPGXBCEKHZHCW-QGZVFWFLSA-N 0 3 342.351 2.995 20 5 EFBDHN NCc1ccc(NC2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cn1 ZINC001254467452 1315707001 /nfs/dbraw/zinc/70/70/01/1315707001.db2.gz AGPBKFHLADGCEX-UHFFFAOYSA-N 0 3 327.388 2.529 20 5 EFBDHN C[C@H](NC1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1cnccn1 ZINC001254468905 1315707083 /nfs/dbraw/zinc/70/70/83/1315707083.db2.gz QMUXJVAXKQOVLC-ZDUSSCGKSA-N 0 3 327.388 2.704 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCC(NCc3cnc(Cl)cn3)CC2)cc1 ZINC001254472899 1315707595 /nfs/dbraw/zinc/70/75/95/1315707595.db2.gz UGGHNELKNJQNNT-UHFFFAOYSA-N 0 3 347.806 2.797 20 5 EFBDHN CC(C)[C@H]1COCCN1C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001254479626 1315707950 /nfs/dbraw/zinc/70/79/50/1315707950.db2.gz FQFRTVHXCBIWQK-GOSISDBHSA-N 0 3 333.432 2.920 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCC(N3CC(N4CCCCC4)C3)CC2)cc1 ZINC001254480223 1315708410 /nfs/dbraw/zinc/70/84/10/1315708410.db2.gz YPJMNFPUIYDUDH-UHFFFAOYSA-N 0 3 344.459 2.734 20 5 EFBDHN Cc1cc(CN(C)C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)n(C)n1 ZINC001254478538 1315708421 /nfs/dbraw/zinc/70/84/21/1315708421.db2.gz GILHZVLAJPHULX-UHFFFAOYSA-N 0 3 343.431 2.738 20 5 EFBDHN O=C(NCC1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1)c1ccco1 ZINC001001106642 1315710916 /nfs/dbraw/zinc/71/09/16/1315710916.db2.gz WJHQQDOTLSXUFM-UHFFFAOYSA-N 0 3 343.383 2.830 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N[C@H]1Cc2ccccc2NC1=O ZINC001254535815 1315721443 /nfs/dbraw/zinc/72/14/43/1315721443.db2.gz LPNPPPKBDWDDCO-LRDDRELGSA-N 0 3 325.368 2.679 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])NCC(=O)NCc1ccc(F)cc1 ZINC001254547154 1315722208 /nfs/dbraw/zinc/72/22/08/1315722208.db2.gz VTTBIRZVTCCKDU-ZDUSSCGKSA-N 0 3 345.374 2.571 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])NCc1cc(OCC2CC2)ncn1 ZINC001254550066 1315722782 /nfs/dbraw/zinc/72/27/82/1315722782.db2.gz ZUSVMQYKNMFKRA-CYBMUJFWSA-N 0 3 342.399 2.894 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N1CCC(NC(=O)C2CC2)CC1 ZINC001254561115 1315724189 /nfs/dbraw/zinc/72/41/89/1315724189.db2.gz FICNKBGQHOYSLB-CYBMUJFWSA-N 0 3 331.416 2.516 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N1CCC(C(=O)N2CCCC2)CC1 ZINC001254563479 1315724214 /nfs/dbraw/zinc/72/42/14/1315724214.db2.gz WXULBXNBQMIJPP-OAHLLOKOSA-N 0 3 345.443 2.860 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N1CCC[C@H](Oc2ncccn2)C1 ZINC001254570573 1315725185 /nfs/dbraw/zinc/72/51/85/1315725185.db2.gz NYOAJHQVAWHVLQ-ZBFHGGJFSA-N 0 3 342.399 2.859 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N1CCC(N2CCCOC2=O)CC1 ZINC001254571446 1315725636 /nfs/dbraw/zinc/72/56/36/1315725636.db2.gz VQRVIBZDNAGGTH-CQSZACIVSA-N 0 3 347.415 2.833 20 5 EFBDHN O=C(CN[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1)Cc1ccc(F)cc1 ZINC001254581070 1315727049 /nfs/dbraw/zinc/72/70/49/1315727049.db2.gz JSMHUQIQRXMERW-MRXNPFEDSA-N 0 3 328.343 2.603 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@H](NCc1cc(OC3CCC3)ncn1)C2 ZINC001254588320 1315727878 /nfs/dbraw/zinc/72/78/78/1315727878.db2.gz XWZHSHMQGWGTGN-CQSZACIVSA-N 0 3 340.383 2.573 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@@H](NCc1cn(CC3CCC3)cn1)C2 ZINC001254586494 1315727998 /nfs/dbraw/zinc/72/79/98/1315727998.db2.gz KKSGZIPZUCTFNP-INIZCTEOSA-N 0 3 326.400 2.848 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@H](N1CCC3(CC(F)(F)CO3)CC1)C2 ZINC001254595397 1315728957 /nfs/dbraw/zinc/72/89/57/1315728957.db2.gz WQFMPPCSXNGIDM-OAHLLOKOSA-N 0 3 338.354 2.952 20 5 EFBDHN CCc1noc(C2CCN([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)CC2)n1 ZINC001254602543 1315729721 /nfs/dbraw/zinc/72/97/21/1315729721.db2.gz GDZSUNKCRSRHLV-MRXNPFEDSA-N 0 3 342.399 2.887 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@H](N1CC[C@@H](Oc3cccnc3)C1)C2 ZINC001254599940 1315729809 /nfs/dbraw/zinc/72/98/09/1315729809.db2.gz MZPRCEVRLDNYML-SJLPKXTDSA-N 0 3 325.368 2.610 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@@H](N1CC3(CN(Cc4ccccc4)C3)C1)C2 ZINC001254603015 1315729867 /nfs/dbraw/zinc/72/98/67/1315729867.db2.gz KJYVTTSOWVHWAF-FQEVSTJZSA-N 0 3 349.434 2.880 20 5 EFBDHN CC(C)CC(=O)NC1CCN([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254601253 1315729932 /nfs/dbraw/zinc/72/99/32/1315729932.db2.gz WSJYNKMXFPAPSH-SFHVURJKSA-N 0 3 345.443 2.689 20 5 EFBDHN CCc1noc(C2CCN([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)CC2)n1 ZINC001254602541 1315729951 /nfs/dbraw/zinc/72/99/51/1315729951.db2.gz GDZSUNKCRSRHLV-INIZCTEOSA-N 0 3 342.399 2.887 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@@H](N1CC[C@H](Oc3ccccn3)C1)C2 ZINC001254607245 1315730185 /nfs/dbraw/zinc/73/01/85/1315730185.db2.gz JWGVDWVGMRADHS-IRXDYDNUSA-N 0 3 325.368 2.610 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@@H](N1CC[C@H](N3CCCC3)[C@@H](F)C1)C2 ZINC001254610215 1315730895 /nfs/dbraw/zinc/73/08/95/1315730895.db2.gz JGYVKKKZEOPIIC-BZSNNMDCSA-N 0 3 333.407 2.570 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@H](N1CC[C@@H](N3CCCC3)[C@@H](F)C1)C2 ZINC001254610216 1315730998 /nfs/dbraw/zinc/73/09/98/1315730998.db2.gz JGYVKKKZEOPIIC-FGTMMUONSA-N 0 3 333.407 2.570 20 5 EFBDHN CCCC(=O)N1CC2(C1)CCN(Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001050408935 1315768296 /nfs/dbraw/zinc/76/82/96/1315768296.db2.gz DEXLPQKTGAZHMN-UHFFFAOYSA-N 0 3 331.416 2.819 20 5 EFBDHN C[C@H]1[C@H](C)N(Cc2ccc([N+](=O)[O-])cc2Br)CCN1C ZINC001255184398 1315788386 /nfs/dbraw/zinc/78/83/86/1315788386.db2.gz NCMUSDXUFSEQCC-QWRGUYRKSA-N 0 3 342.237 2.882 20 5 EFBDHN COC(=O)[C@H]1CCC[C@H]1NCc1cc([N+](=O)[O-])ccc1OC(F)F ZINC001255734444 1315862814 /nfs/dbraw/zinc/86/28/14/1315862814.db2.gz VZGCVJJWBMJTCC-NWDGAFQWSA-N 0 3 344.314 2.628 20 5 EFBDHN COc1cc(N2CCC(N3CCOCC3(C)C)CC2)ccc1[N+](=O)[O-] ZINC001256099564 1315904096 /nfs/dbraw/zinc/90/40/96/1315904096.db2.gz RPGXJQOXSOCOAV-UHFFFAOYSA-N 0 3 349.431 2.683 20 5 EFBDHN O=C(C1CC1)N1CCC2(C1)CCN(Cc1cccc([N+](=O)[O-])c1)CC2 ZINC001040568324 1316324932 /nfs/dbraw/zinc/32/49/32/1316324932.db2.gz OUXBKTZMRSACQS-UHFFFAOYSA-N 0 3 343.427 2.819 20 5 EFBDHN C[C@@H](NCCN1C(=O)COc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC001320025899 1329058019 /nfs/dbraw/zinc/05/80/19/1329058019.db2.gz JGMZLRWJKJVGAP-CYBMUJFWSA-N 0 3 341.367 2.671 20 5 EFBDHN CN(C)[C@H]1CCCC[C@@H]1Nc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC001323107006 1329512517 /nfs/dbraw/zinc/51/25/17/1329512517.db2.gz GWDBZYGHCJNARM-KBPBESRZSA-N 0 3 331.376 2.528 20 5 EFBDHN Cc1cncc([N+](=O)[O-])c1N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC001324270458 1329612417 /nfs/dbraw/zinc/61/24/17/1329612417.db2.gz ANQGLFZDVYJIST-GDBMZVCRSA-N 0 3 326.400 2.968 20 5 EFBDHN Cc1cccc(CN2CC[C@H](Nc3ncc([N+](=O)[O-])c(C)n3)C2)c1 ZINC001329364110 1330698440 /nfs/dbraw/zinc/69/84/40/1330698440.db2.gz PSAVZAWWJCKSCR-HNNXBMFYSA-N 0 3 327.388 2.688 20 5 EFBDHN CC1CCN(CCNC(=O)[C@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)CC1 ZINC001332747128 1331015584 /nfs/dbraw/zinc/01/55/84/1331015584.db2.gz XMPGQRUCKAUVAI-IRXDYDNUSA-N 0 3 331.416 2.546 20 5 EFBDHN CC(C)NC(=O)c1ccc(NC[C@@H]2CCCCN2C)c([N+](=O)[O-])c1 ZINC001338020116 1331636607 /nfs/dbraw/zinc/63/66/07/1331636607.db2.gz BGGBNFFWWOODGS-AWEZNQCLSA-N 0 3 334.420 2.629 20 5 EFBDHN CN1CCCC[C@@H]1CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC001340857909 1332213281 /nfs/dbraw/zinc/21/32/81/1332213281.db2.gz OGCDGZYLRMYEIE-CYBMUJFWSA-N 0 3 337.395 2.612 20 5 EFBDHN CC(C)N1CCC[C@@H]1C(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC001344024859 1332397891 /nfs/dbraw/zinc/39/78/91/1332397891.db2.gz ZANSQLJRTOUHMA-APHBMKBZSA-N 0 3 338.379 2.948 20 5 EFBDHN CO[C@@H]1CCC[C@@H]1C(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC001345207365 1332522006 /nfs/dbraw/zinc/52/20/06/1332522006.db2.gz KLRYWEIGVAVEPW-BQPHKTIFSA-N 0 3 325.336 2.890 20 5 EFBDHN N[C@@H](C(=O)NCc1cc([N+](=O)[O-])ccc1Cl)C1CCCCC1 ZINC001346046508 1332594320 /nfs/dbraw/zinc/59/43/20/1332594320.db2.gz KOAOMFJUWHDOTP-CQSZACIVSA-N 0 3 325.796 2.772 20 5 EFBDHN O=C(N[C@@H]1CCCN2CCCC[C@@H]12)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000847253611 1333448464 /nfs/dbraw/zinc/44/84/64/1333448464.db2.gz JLBHWGGGLKMGAL-KGLIPLIRSA-N 0 3 337.807 2.995 20 5 EFBDHN O=C(N[C@H]1CCCN2CCCC[C@@H]12)c1cc(F)c([N+](=O)[O-])cc1F ZINC000847255362 1333450635 /nfs/dbraw/zinc/45/06/35/1333450635.db2.gz KOZFYRKVVKXGNC-KBPBESRZSA-N 0 3 339.342 2.620 20 5 EFBDHN CCN1CCN([C@H](C)CNc2ncc([N+](=O)[O-])c3ccccc32)CC1 ZINC001353229993 1334033629 /nfs/dbraw/zinc/03/36/29/1334033629.db2.gz ZUVCUQACDMHUOL-CQSZACIVSA-N 0 3 343.431 2.581 20 5 EFBDHN CN(C)C[C@@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC001353274477 1334059539 /nfs/dbraw/zinc/05/95/39/1334059539.db2.gz UCHQKZALFUBIOR-MSOLQXFVSA-N 0 3 347.390 2.660 20 5 EFBDHN Cc1cc(N2CC[C@]3(CCOC3=O)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC001354352316 1334246866 /nfs/dbraw/zinc/24/68/66/1334246866.db2.gz ANJJCEJZDVVILX-KRWDZBQOSA-N 0 3 327.340 2.595 20 5 EFBDHN C[C@H](NC(=O)[C@@H]1CNCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC001354829487 1334544510 /nfs/dbraw/zinc/54/45/10/1334544510.db2.gz JXEWTBWBUJLJLU-YVEFUNNKSA-N 0 3 325.368 2.659 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1cnn(CN2CCC3(C2)CCOCC3)c1 ZINC000848480410 1334737583 /nfs/dbraw/zinc/73/75/83/1334737583.db2.gz MBRQRYBNVPBUON-UHFFFAOYSA-N 0 3 342.399 2.918 20 5 EFBDHN C[C@H](O)C[C@H]1CCCN1Cn1cc(-c2ccccc2[N+](=O)[O-])cn1 ZINC000848483111 1334739551 /nfs/dbraw/zinc/73/95/51/1334739551.db2.gz YRQCAVSNCZNPSY-DZGCQCFKSA-N 0 3 330.388 2.651 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2N[C@H]1COc2ccccc2[C@@H]1O ZINC000848550110 1334789594 /nfs/dbraw/zinc/78/95/94/1334789594.db2.gz CMECUEAMYDMTGQ-MPGHIAIKSA-N 0 3 326.352 2.666 20 5 EFBDHN CN1CCCC[C@H]1CNC(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC001357313479 1335299311 /nfs/dbraw/zinc/29/93/11/1335299311.db2.gz FGVFFWOARRKWBG-ZDUSSCGKSA-N 0 3 340.811 2.532 20 5 EFBDHN C[C@@H](NC(=O)c1cc2c(s1)CCNC2)c1ccc([N+](=O)[O-])cc1 ZINC001358143465 1335363096 /nfs/dbraw/zinc/36/30/96/1335363096.db2.gz TYLMYUPQKMWWPO-SNVBAGLBSA-N 0 3 331.397 2.793 20 5 EFBDHN CCCC[C@H](N)C(=O)Nc1ccc([N+](=O)[O-])c(Br)c1 ZINC000211396927 1417294466 /nfs/dbraw/zinc/29/44/66/1417294466.db2.gz GWQGTQLVGMYNQA-JTQLQIEISA-N 0 3 330.182 2.813 20 5 EFBDHN CCc1ccoc1C(=O)N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001020550735 713154407 /nfs/dbraw/zinc/15/44/07/713154407.db2.gz HEHBJTBGYFWBBP-SHTZXODSSA-N 0 3 343.383 2.801 20 5 EFBDHN CC(COC(=O)Cc1c[nH]c2cccc(Br)c12)[N+](=O)[O-] ZINC000813106488 713530315 /nfs/dbraw/zinc/53/03/15/713530315.db2.gz DFDGZQZMOGWFEL-QMMMGPOBSA-N 0 3 341.161 2.681 20 5 EFBDHN CC(COC(=O)Cc1c[nH]c2cc(Br)ccc12)[N+](=O)[O-] ZINC000813115401 713643371 /nfs/dbraw/zinc/64/33/71/713643371.db2.gz QWQDEPZCCNNTPF-MRVPVSSYSA-N 0 3 341.161 2.681 20 5 EFBDHN O=C(Cc1cccs1)N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001021782090 714471982 /nfs/dbraw/zinc/47/19/82/714471982.db2.gz JDGWIFDPEBSGIM-OKILXGFUSA-N 0 3 345.424 2.636 20 5 EFBDHN CCc1occc1C(=O)N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001022029424 714665789 /nfs/dbraw/zinc/66/57/89/714665789.db2.gz WXNPGKOAXIAOSF-OKILXGFUSA-N 0 3 343.383 2.801 20 5 EFBDHN CC[C@@H](CNc1c2ccccc2n(C)c(=O)c1[N+](=O)[O-])N1CCCC1 ZINC000891810828 715032934 /nfs/dbraw/zinc/03/29/34/715032934.db2.gz XNZITJIXQNRJCP-ZDUSSCGKSA-N 0 3 344.415 2.733 20 5 EFBDHN CC(C)(C(=O)N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1)C1CC1 ZINC001022572007 715221285 /nfs/dbraw/zinc/22/12/85/715221285.db2.gz OGBFZAJSOYKKNY-GASCZTMLSA-N 0 3 331.416 2.768 20 5 EFBDHN C[C@H](Cc1cccnc1)NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000934232731 715271318 /nfs/dbraw/zinc/27/13/18/715271318.db2.gz FZFIFJVEWOMIJK-LLVKDONJSA-N 0 3 348.790 2.803 20 5 EFBDHN CCc1ccoc1C(=O)N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001022656576 715276265 /nfs/dbraw/zinc/27/62/65/715276265.db2.gz HEHBJTBGYFWBBP-GASCZTMLSA-N 0 3 343.383 2.801 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)ccc1CNCCCOC[C@@H]1CCCO1 ZINC000892460456 717623818 /nfs/dbraw/zinc/62/38/18/717623818.db2.gz CSGXKTZYRHZSJG-AWEZNQCLSA-N 0 3 328.796 2.924 20 5 EFBDHN COc1ccc(CN[C@H]2COc3c(cccc3OC)C2)cc1[N+](=O)[O-] ZINC000106469367 718059302 /nfs/dbraw/zinc/05/93/02/718059302.db2.gz YFQOCDYZLFJXOH-CQSZACIVSA-N 0 3 344.367 2.705 20 5 EFBDHN C[C@@H](CN1CCOCC1)NCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000892581961 718306829 /nfs/dbraw/zinc/30/68/29/718306829.db2.gz YYDNYUUNJJOSES-JTQLQIEISA-N 0 3 348.230 2.712 20 5 EFBDHN COc1c(O)ccc(CNCCc2c(F)cccc2F)c1[N+](=O)[O-] ZINC000892616030 718346149 /nfs/dbraw/zinc/34/61/49/718346149.db2.gz WVHLHRXYQTZJGV-UHFFFAOYSA-N 0 3 338.310 2.920 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1C(=O)N1CCCN(C(C)C)CC1 ZINC000931794617 718554131 /nfs/dbraw/zinc/55/41/31/718554131.db2.gz NOYPRZJFOAGLNX-UHFFFAOYSA-N 0 3 337.445 2.873 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])CC1CCN(C(=O)C2CC2)CC1 ZINC001029924403 724575723 /nfs/dbraw/zinc/57/57/23/724575723.db2.gz NAMHYDSTVUSCNM-UHFFFAOYSA-N 0 3 331.416 2.675 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)ccc1CNCCCOC[C@@H]1CCOC1 ZINC000893037020 719516096 /nfs/dbraw/zinc/51/60/96/719516096.db2.gz HUZSTAQWIOBHNT-LBPRGKRZSA-N 0 3 328.796 2.781 20 5 EFBDHN CCOCCC1(C[NH2+]Cc2ccc([O-])c(OC)c2[N+](=O)[O-])CCC1 ZINC000893167603 719909170 /nfs/dbraw/zinc/90/91/70/719909170.db2.gz LGCPCHRKPYTADV-UHFFFAOYSA-N 0 3 338.404 2.996 20 5 EFBDHN COc1c([O-])ccc(C[NH2+][C@@H]2[C@H]3CCO[C@@H]3C23CCCC3)c1[N+](=O)[O-] ZINC000893210654 720060021 /nfs/dbraw/zinc/06/00/21/720060021.db2.gz RHAOFQKTEUGSDK-JLZZUVOBSA-N 0 3 348.399 2.746 20 5 EFBDHN COc1cc([N+](=O)[O-])cnc1N(C)CCCN(C)Cc1ccco1 ZINC000893848905 720124128 /nfs/dbraw/zinc/12/41/28/720124128.db2.gz SHIQZDKXOFYELW-UHFFFAOYSA-N 0 3 334.376 2.550 20 5 EFBDHN COCCN(Cc1ccc(O)c(OC)c1[N+](=O)[O-])[C@H]1CC[C@@H](C)C1 ZINC000894002259 720216306 /nfs/dbraw/zinc/21/63/06/720216306.db2.gz VCJSWDMEWJQVBL-OCCSQVGLSA-N 0 3 338.404 2.946 20 5 EFBDHN COCC[N@H+](Cc1ccc([O-])c(OC)c1[N+](=O)[O-])[C@H]1CC[C@@H](C)C1 ZINC000894002259 720216308 /nfs/dbraw/zinc/21/63/08/720216308.db2.gz VCJSWDMEWJQVBL-OCCSQVGLSA-N 0 3 338.404 2.946 20 5 EFBDHN COCC[N@@H+](Cc1ccc([O-])c(OC)c1[N+](=O)[O-])[C@H]1CC[C@@H](C)C1 ZINC000894002259 720216311 /nfs/dbraw/zinc/21/63/11/720216311.db2.gz VCJSWDMEWJQVBL-OCCSQVGLSA-N 0 3 338.404 2.946 20 5 EFBDHN O=[N+]([O-])c1ccn(C2CCN(Cc3cccc4c3OCC4)CC2)n1 ZINC000894077576 720270843 /nfs/dbraw/zinc/27/08/43/720270843.db2.gz BZSDMLZEWRDSDN-UHFFFAOYSA-N 0 3 328.372 2.563 20 5 EFBDHN COc1c([O-])ccc(C[NH2+][C@@H]2CCO[C@H](C(C)(C)C)C2)c1[N+](=O)[O-] ZINC000893256281 720282248 /nfs/dbraw/zinc/28/22/48/720282248.db2.gz OWBHEBKKUFMRMP-OCCSQVGLSA-N 0 3 338.404 2.992 20 5 EFBDHN C[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N(C)C)N1CCC(C)CC1 ZINC000067272269 721138350 /nfs/dbraw/zinc/13/83/50/721138350.db2.gz XOCAMWMNUVQWCL-CQSZACIVSA-N 0 3 348.447 2.511 20 5 EFBDHN COCC1(C[NH2+]Cc2ccc([O-])c(OC)c2[N+](=O)[O-])CCCCC1 ZINC000894554581 722781354 /nfs/dbraw/zinc/78/13/54/722781354.db2.gz IUUGHELUYPLAIL-UHFFFAOYSA-N 0 3 338.404 2.996 20 5 EFBDHN CCN(C(=O)CNCCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000896295218 723237594 /nfs/dbraw/zinc/23/75/94/723237594.db2.gz YYSJEPJUAQJQJU-UHFFFAOYSA-N 0 3 327.384 2.780 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]CCc2nc3c(s2)CCC3)c1[N+](=O)[O-] ZINC000896840204 723535833 /nfs/dbraw/zinc/53/58/33/723535833.db2.gz CKMZHECBCALAAE-UHFFFAOYSA-N 0 3 349.412 2.587 20 5 EFBDHN COc1c(O)ccc(CNCCc2nc3c(s2)CCC3)c1[N+](=O)[O-] ZINC000896840204 723535836 /nfs/dbraw/zinc/53/58/36/723535836.db2.gz CKMZHECBCALAAE-UHFFFAOYSA-N 0 3 349.412 2.587 20 5 EFBDHN Cc1c[nH]cc1C(=O)N[C@H]1C[C@H](CNCc2csc([N+](=O)[O-])c2)C1 ZINC000985116256 723853702 /nfs/dbraw/zinc/85/37/02/723853702.db2.gz NMPCOVFDYDEAMM-AULYBMBSSA-N 0 3 348.428 2.591 20 5 EFBDHN Cc1cc(F)cc(C(=O)NC[C@H]2NCCc3ccccc32)c1[N+](=O)[O-] ZINC000262413946 723869491 /nfs/dbraw/zinc/86/94/91/723869491.db2.gz QXQWUISHNVYDGT-MRXNPFEDSA-N 0 3 343.358 2.659 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]CCc2ncc(C)cc2C)c1[N+](=O)[O-] ZINC000895209202 723877017 /nfs/dbraw/zinc/87/70/17/723877017.db2.gz RKFHPESVJRLRHT-UHFFFAOYSA-N 0 3 331.372 2.653 20 5 EFBDHN COc1c(O)ccc(CNCCc2ncc(C)cc2C)c1[N+](=O)[O-] ZINC000895209202 723877024 /nfs/dbraw/zinc/87/70/24/723877024.db2.gz RKFHPESVJRLRHT-UHFFFAOYSA-N 0 3 331.372 2.653 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C1CCN(C(=O)C(C)(F)F)CC1 ZINC000985206755 723987712 /nfs/dbraw/zinc/98/77/12/723987712.db2.gz OEVJPOUHRCLSGU-UHFFFAOYSA-N 0 3 341.358 2.673 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C1CCN(C(=O)c2ccc[nH]2)CC1 ZINC000985263247 724033453 /nfs/dbraw/zinc/03/34/53/724033453.db2.gz LILLUUGDGZOXIY-UHFFFAOYSA-N 0 3 342.399 2.660 20 5 EFBDHN COc1c(O)ccc(CN[C@H]2COc3cc(F)ccc3C2)c1[N+](=O)[O-] ZINC000895383836 724095874 /nfs/dbraw/zinc/09/58/74/724095874.db2.gz MLDIDOUPOKLWEG-CYBMUJFWSA-N 0 3 348.330 2.541 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN[C@@H](CO)C[C@H]1CCCO1 ZINC000895748319 724293353 /nfs/dbraw/zinc/29/33/53/724293353.db2.gz LQCRBDFDQLLIFQ-CHWSQXEVSA-N 0 3 348.321 2.633 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]CC(C)(C)C2CCOCC2)c1[N+](=O)[O-] ZINC000897445160 726212288 /nfs/dbraw/zinc/21/22/88/726212288.db2.gz BXCSCCGTVTYYDX-UHFFFAOYSA-N 0 3 338.404 2.851 20 5 EFBDHN CN1CCN(C(=O)Cc2cccc(F)c2[N+](=O)[O-])CC12CCCCC2 ZINC000908571896 727218262 /nfs/dbraw/zinc/21/82/62/727218262.db2.gz NSGGCCRSQNEIIM-UHFFFAOYSA-N 0 3 349.406 2.753 20 5 EFBDHN CCN1CCCN(C(=O)c2ccc(SC)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000910294878 727431081 /nfs/dbraw/zinc/43/10/81/727431081.db2.gz KNQFBLLWZNSULH-GFCCVEGCSA-N 0 3 337.445 2.873 20 5 EFBDHN CN(C[C@@H]1CCCN1C)C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC000911200763 727509885 /nfs/dbraw/zinc/50/98/85/727509885.db2.gz METPGWQFWYORLW-JTQLQIEISA-N 0 3 329.759 2.554 20 5 EFBDHN C[C@H]1CCCN(CCNC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000916053887 727652485 /nfs/dbraw/zinc/65/24/85/727652485.db2.gz KFNLAUATAQXVOE-NSHDSACASA-N 0 3 325.796 2.710 20 5 EFBDHN COc1ccc(CNC[C@H](O)c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000917416682 727805114 /nfs/dbraw/zinc/80/51/14/727805114.db2.gz KZCVLPQRTYNQBO-HNNXBMFYSA-N 0 3 338.310 2.705 20 5 EFBDHN C[C@H](CNC(=O)OC(C)(C)C)N(C)CCc1ccc([N+](=O)[O-])cc1 ZINC000171956419 728560363 /nfs/dbraw/zinc/56/03/63/728560363.db2.gz XHPIZJIQQWIKIW-CYBMUJFWSA-N 0 3 337.420 2.982 20 5 EFBDHN COc1ccc(C[C@@](C)(CO)NCc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000873191045 1126118831 /nfs/dbraw/zinc/11/88/31/1126118831.db2.gz ONUNMNPQGRSQQS-SFHVURJKSA-N 0 3 348.374 2.826 20 5 EFBDHN CC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)[C@H](CC)CN1 ZINC001573721126 1087882494 /nfs/dbraw/zinc/88/24/94/1087882494.db2.gz XJFHUIWGDRZLFM-GHMZBOCLSA-N 0 3 325.796 2.851 20 5 EFBDHN CCOc1ccc(C(=O)Nc2ccc3c(c2)CNC3)cc1[N+](=O)[O-] ZINC001578174683 1090290776 /nfs/dbraw/zinc/29/07/76/1090290776.db2.gz ZVBIYECNORGRGJ-UHFFFAOYSA-N 0 3 327.340 2.849 20 5 EFBDHN CNCC(=O)N(CC(C)C)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC001578617851 1090411399 /nfs/dbraw/zinc/41/13/99/1090411399.db2.gz NNVYLXAPARLDKJ-UHFFFAOYSA-N 0 3 348.428 2.927 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN[C@@H]1CNCCC1(F)F ZINC001580874863 1091030894 /nfs/dbraw/zinc/03/08/94/1091030894.db2.gz MMCVVVWEABDUHR-LLVKDONJSA-N 0 3 339.264 2.700 20 5 EFBDHN CC(C)(C)[C@H]1CC[N@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001589103784 1093031952 /nfs/dbraw/zinc/03/19/52/1093031952.db2.gz WSOZSRFQFIXSPI-ZDUSSCGKSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)(C)[C@H]1CC[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001589103784 1093031957 /nfs/dbraw/zinc/03/19/57/1093031957.db2.gz WSOZSRFQFIXSPI-ZDUSSCGKSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)(C)[C@H]1CC[N@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001589103784 1093031962 /nfs/dbraw/zinc/03/19/62/1093031962.db2.gz WSOZSRFQFIXSPI-ZDUSSCGKSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)(C)[C@H]1CC[N@@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001589103784 1093031968 /nfs/dbraw/zinc/03/19/68/1093031968.db2.gz WSOZSRFQFIXSPI-ZDUSSCGKSA-N 0 3 330.392 2.643 20 5 EFBDHN C[C@@H]1CC[N@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC12CCC2 ZINC001590272553 1093354559 /nfs/dbraw/zinc/35/45/59/1093354559.db2.gz QMRBBYCDBVTBLG-GFCCVEGCSA-N 0 3 342.403 2.787 20 5 EFBDHN C[C@@H]1CC[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC12CCC2 ZINC001590272553 1093354567 /nfs/dbraw/zinc/35/45/67/1093354567.db2.gz QMRBBYCDBVTBLG-GFCCVEGCSA-N 0 3 342.403 2.787 20 5 EFBDHN CCC1(C)CC[NH+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC1 ZINC001590490470 1093452203 /nfs/dbraw/zinc/45/22/03/1093452203.db2.gz ZHJNVKROFQQYSV-UHFFFAOYSA-N 0 3 330.392 2.787 20 5 EFBDHN CC[C@H]1CCCC[C@@H]1[NH2+]Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001590510185 1093465022 /nfs/dbraw/zinc/46/50/22/1093465022.db2.gz FNNRTRHLHASGDR-FZMZJTMJSA-N 0 3 330.392 2.833 20 5 EFBDHN CC[C@H]1CCCC[C@@H]1[NH2+]Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001590510185 1093465025 /nfs/dbraw/zinc/46/50/25/1093465025.db2.gz FNNRTRHLHASGDR-FZMZJTMJSA-N 0 3 330.392 2.833 20 5 EFBDHN CCC[C@@H]1CCC[N@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001590571200 1093496088 /nfs/dbraw/zinc/49/60/88/1093496088.db2.gz XWBFZJIGPXEZQF-GFCCVEGCSA-N 0 3 330.392 2.787 20 5 EFBDHN CCC[C@@H]1CCC[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001590571200 1093496093 /nfs/dbraw/zinc/49/60/93/1093496093.db2.gz XWBFZJIGPXEZQF-GFCCVEGCSA-N 0 3 330.392 2.787 20 5 EFBDHN CCC[C@H]1CCC[N@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001590571201 1093496115 /nfs/dbraw/zinc/49/61/15/1093496115.db2.gz XWBFZJIGPXEZQF-LBPRGKRZSA-N 0 3 330.392 2.787 20 5 EFBDHN CCC[C@H]1CCC[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001590571201 1093496119 /nfs/dbraw/zinc/49/61/19/1093496119.db2.gz XWBFZJIGPXEZQF-LBPRGKRZSA-N 0 3 330.392 2.787 20 5 EFBDHN CC[NH+](CC)CC[C@@H](C)Nc1cc(C)c([N+](=O)[O-])cc1-c1nnn[n-]1 ZINC001590686780 1093548510 /nfs/dbraw/zinc/54/85/10/1093548510.db2.gz JUFVWOCNJDWHRH-GFCCVEGCSA-N 0 3 347.423 2.616 20 5 EFBDHN CC[NH+](CC)CC[C@@H](C)Nc1cc(C)c([N+](=O)[O-])cc1-c1nn[n-]n1 ZINC001590686780 1093548515 /nfs/dbraw/zinc/54/85/15/1093548515.db2.gz JUFVWOCNJDWHRH-GFCCVEGCSA-N 0 3 347.423 2.616 20 5 EFBDHN CC[NH+](CC)CCC[C@@H](C)Nc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001590687848 1093550997 /nfs/dbraw/zinc/55/09/97/1093550997.db2.gz RJDZHBPOUOCBKG-GFCCVEGCSA-N 0 3 347.423 2.697 20 5 EFBDHN CC[NH+](CC)CCC[C@@H](C)Nc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001590687848 1093551005 /nfs/dbraw/zinc/55/10/05/1093551005.db2.gz RJDZHBPOUOCBKG-GFCCVEGCSA-N 0 3 347.423 2.697 20 5 EFBDHN CC[C@@H]1CC[C@@H](C)[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590857716 1093603507 /nfs/dbraw/zinc/60/35/07/1093603507.db2.gz GDDGLVVBDUHHPV-VXGBXAGGSA-N 0 3 330.392 2.785 20 5 EFBDHN CC[C@@H]1CC[C@@H](C)[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590857716 1093603511 /nfs/dbraw/zinc/60/35/11/1093603511.db2.gz GDDGLVVBDUHHPV-VXGBXAGGSA-N 0 3 330.392 2.785 20 5 EFBDHN CC[C@@H]1CC[C@@H](C)[N@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590857716 1093603514 /nfs/dbraw/zinc/60/35/14/1093603514.db2.gz GDDGLVVBDUHHPV-VXGBXAGGSA-N 0 3 330.392 2.785 20 5 EFBDHN CC[C@@H]1CC[C@@H](C)[N@@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590857716 1093603518 /nfs/dbraw/zinc/60/35/18/1093603518.db2.gz GDDGLVVBDUHHPV-VXGBXAGGSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@]12CCCC[C@H]1C[N@@H+]2Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001591777532 1093856641 /nfs/dbraw/zinc/85/66/41/1093856641.db2.gz QBRHAMYUCHRKBB-ZBEGNZNMSA-N 0 3 328.376 2.539 20 5 EFBDHN C[C@]12CCCC[C@H]1C[N@H+]2Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001591777532 1093856646 /nfs/dbraw/zinc/85/66/46/1093856646.db2.gz QBRHAMYUCHRKBB-ZBEGNZNMSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[N@@H+]1CCC[C@H]2CCC[C@H]21 ZINC001593467402 1094311984 /nfs/dbraw/zinc/31/19/84/1094311984.db2.gz PVNUIHAVZMCBKJ-BXUZGUMPSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[N@H+]1CCC[C@H]2CCC[C@H]21 ZINC001593467402 1094311990 /nfs/dbraw/zinc/31/19/90/1094311990.db2.gz PVNUIHAVZMCBKJ-BXUZGUMPSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1C[N@@H+]1CCC[C@H]2CCC[C@H]21 ZINC001593467402 1094311998 /nfs/dbraw/zinc/31/19/98/1094311998.db2.gz PVNUIHAVZMCBKJ-BXUZGUMPSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1C[N@H+]1CCC[C@H]2CCC[C@H]21 ZINC001593467402 1094312007 /nfs/dbraw/zinc/31/20/07/1094312007.db2.gz PVNUIHAVZMCBKJ-BXUZGUMPSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[N@@H+]1CCC[C@H]1C1CCC1 ZINC001593481744 1094326978 /nfs/dbraw/zinc/32/69/78/1094326978.db2.gz JYUIOKCNTIYVTD-AWEZNQCLSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[N@H+]1CCC[C@H]1C1CCC1 ZINC001593481744 1094326985 /nfs/dbraw/zinc/32/69/85/1094326985.db2.gz JYUIOKCNTIYVTD-AWEZNQCLSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[N@@H+]1CCC[C@H]1C1CCC1 ZINC001593481744 1094326996 /nfs/dbraw/zinc/32/69/96/1094326996.db2.gz JYUIOKCNTIYVTD-AWEZNQCLSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[N@H+]1CCC[C@H]1C1CCC1 ZINC001593481744 1094327005 /nfs/dbraw/zinc/32/70/05/1094327005.db2.gz JYUIOKCNTIYVTD-AWEZNQCLSA-N 0 3 328.376 2.539 20 5 EFBDHN C[C@@H](C1CC1)[N@H+](Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])C1CC1 ZINC001603435832 1096527655 /nfs/dbraw/zinc/52/76/55/1096527655.db2.gz CKRPZHGEFRXASX-JTQLQIEISA-N 0 3 328.376 2.538 20 5 EFBDHN C[C@@H](C1CC1)[N@@H+](Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])C1CC1 ZINC001603435832 1096527663 /nfs/dbraw/zinc/52/76/63/1096527663.db2.gz CKRPZHGEFRXASX-JTQLQIEISA-N 0 3 328.376 2.538 20 5 EFBDHN C[C@@H](C1CC1)[N@H+](Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])C1CC1 ZINC001603435832 1096527667 /nfs/dbraw/zinc/52/76/67/1096527667.db2.gz CKRPZHGEFRXASX-JTQLQIEISA-N 0 3 328.376 2.538 20 5 EFBDHN C[C@@H](C1CC1)[N@@H+](Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])C1CC1 ZINC001603435832 1096527670 /nfs/dbraw/zinc/52/76/70/1096527670.db2.gz CKRPZHGEFRXASX-JTQLQIEISA-N 0 3 328.376 2.538 20 5 EFBDHN CC1(C)CCCC[C@@H]1[NH2+]Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001603777495 1096623957 /nfs/dbraw/zinc/62/39/57/1096623957.db2.gz CFXCQQYUDICORV-AWEZNQCLSA-N 0 3 330.392 2.833 20 5 EFBDHN CC1(C)CCCC[C@@H]1[NH2+]Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001603777495 1096623960 /nfs/dbraw/zinc/62/39/60/1096623960.db2.gz CFXCQQYUDICORV-AWEZNQCLSA-N 0 3 330.392 2.833 20 5 EFBDHN C[C@H]1CC[C@]2(CC[N@H+](Cc3c(-c4nnn[n-]4)cccc3[N+](=O)[O-])C2)C1 ZINC001603880080 1096654160 /nfs/dbraw/zinc/65/41/60/1096654160.db2.gz DQHFHPDLBUPIBT-SJCJKPOMSA-N 0 3 342.403 2.787 20 5 EFBDHN C[C@H]1CC[C@]2(CC[N@@H+](Cc3c(-c4nnn[n-]4)cccc3[N+](=O)[O-])C2)C1 ZINC001603880080 1096654162 /nfs/dbraw/zinc/65/41/62/1096654162.db2.gz DQHFHPDLBUPIBT-SJCJKPOMSA-N 0 3 342.403 2.787 20 5 EFBDHN C[C@H]1CC[C@]2(CC[N@H+](Cc3c(-c4nn[n-]n4)cccc3[N+](=O)[O-])C2)C1 ZINC001603880080 1096654165 /nfs/dbraw/zinc/65/41/65/1096654165.db2.gz DQHFHPDLBUPIBT-SJCJKPOMSA-N 0 3 342.403 2.787 20 5 EFBDHN C[C@H]1CC[C@]2(CC[N@@H+](Cc3c(-c4nn[n-]n4)cccc3[N+](=O)[O-])C2)C1 ZINC001603880080 1096654169 /nfs/dbraw/zinc/65/41/69/1096654169.db2.gz DQHFHPDLBUPIBT-SJCJKPOMSA-N 0 3 342.403 2.787 20 5 EFBDHN CC[C@H]([NH2+]Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])[C@H]1CC1(C)C ZINC001604063236 1096716591 /nfs/dbraw/zinc/71/65/91/1096716591.db2.gz XCFXAYLMSDCZRY-OLZOCXBDSA-N 0 3 330.392 2.689 20 5 EFBDHN CC[C@H]([NH2+]Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])[C@H]1CC1(C)C ZINC001604063236 1096716597 /nfs/dbraw/zinc/71/65/97/1096716597.db2.gz XCFXAYLMSDCZRY-OLZOCXBDSA-N 0 3 330.392 2.689 20 5 EFBDHN CC[C@@H]1CCCCC[N@@H+]1Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001604103223 1096738873 /nfs/dbraw/zinc/73/88/73/1096738873.db2.gz RZHRPCLAUPKQBS-CQSZACIVSA-N 0 3 330.392 2.930 20 5 EFBDHN CC[C@@H]1CCCCC[N@H+]1Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001604103223 1096738877 /nfs/dbraw/zinc/73/88/77/1096738877.db2.gz RZHRPCLAUPKQBS-CQSZACIVSA-N 0 3 330.392 2.930 20 5 EFBDHN CC[C@@H]1CCCCC[N@@H+]1Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001604103223 1096738880 /nfs/dbraw/zinc/73/88/80/1096738880.db2.gz RZHRPCLAUPKQBS-CQSZACIVSA-N 0 3 330.392 2.930 20 5 EFBDHN CC[C@@H]1CCCCC[N@H+]1Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001604103223 1096738885 /nfs/dbraw/zinc/73/88/85/1096738885.db2.gz RZHRPCLAUPKQBS-CQSZACIVSA-N 0 3 330.392 2.930 20 5 EFBDHN CCC[C@H]([NH2+]Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])C1CCC1 ZINC001604144848 1096751323 /nfs/dbraw/zinc/75/13/23/1096751323.db2.gz MWLIHDXPXKPIJS-AWEZNQCLSA-N 0 3 330.392 2.833 20 5 EFBDHN CCC[C@H]([NH2+]Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])C1CCC1 ZINC001604144848 1096751329 /nfs/dbraw/zinc/75/13/29/1096751329.db2.gz MWLIHDXPXKPIJS-AWEZNQCLSA-N 0 3 330.392 2.833 20 5 EFBDHN CC(C)[C@H]1CCCC[N@@H+]1Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001609090705 1098139721 /nfs/dbraw/zinc/13/97/21/1098139721.db2.gz CIISHWRDCKZVOV-CQSZACIVSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)[C@H]1CCCC[N@H+]1Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001609090705 1098139723 /nfs/dbraw/zinc/13/97/23/1098139723.db2.gz CIISHWRDCKZVOV-CQSZACIVSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)[C@H]1CCCC[N@@H+]1Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001609090705 1098139727 /nfs/dbraw/zinc/13/97/27/1098139727.db2.gz CIISHWRDCKZVOV-CQSZACIVSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)[C@H]1CCCC[N@H+]1Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001609090705 1098139733 /nfs/dbraw/zinc/13/97/33/1098139733.db2.gz CIISHWRDCKZVOV-CQSZACIVSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)C[C@H]1CCC[N@@H+]1Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001609093980 1098140997 /nfs/dbraw/zinc/14/09/97/1098140997.db2.gz ZGRZKYQPISXCSA-GFCCVEGCSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)C[C@H]1CCC[N@H+]1Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001609093980 1098141000 /nfs/dbraw/zinc/14/10/00/1098141000.db2.gz ZGRZKYQPISXCSA-GFCCVEGCSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)C[C@H]1CCC[N@@H+]1Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001609093980 1098141004 /nfs/dbraw/zinc/14/10/04/1098141004.db2.gz ZGRZKYQPISXCSA-GFCCVEGCSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)C[C@H]1CCC[N@H+]1Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001609093980 1098141007 /nfs/dbraw/zinc/14/10/07/1098141007.db2.gz ZGRZKYQPISXCSA-GFCCVEGCSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1C[C@@H](C)[C@@H](C)[N@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001609153920 1098171409 /nfs/dbraw/zinc/17/14/09/1098171409.db2.gz FWBJFHFMMJIQOO-IJLUTSLNSA-N 0 3 330.392 2.641 20 5 EFBDHN C[C@@H]1C[C@@H](C)[C@@H](C)[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001609153920 1098171412 /nfs/dbraw/zinc/17/14/12/1098171412.db2.gz FWBJFHFMMJIQOO-IJLUTSLNSA-N 0 3 330.392 2.641 20 5 EFBDHN C[C@@H]1C[C@@H](C)[C@@H](C)[N@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001609153920 1098171414 /nfs/dbraw/zinc/17/14/14/1098171414.db2.gz FWBJFHFMMJIQOO-IJLUTSLNSA-N 0 3 330.392 2.641 20 5 EFBDHN C[C@@H]1C[C@@H](C)[C@@H](C)[N@@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001609153920 1098171416 /nfs/dbraw/zinc/17/14/16/1098171416.db2.gz FWBJFHFMMJIQOO-IJLUTSLNSA-N 0 3 330.392 2.641 20 5 EFBDHN CN1C[C@H]2C[C@@H](C1)N(C(=O)c1cc3cccnc3c3ncccc13)C2 ZINC001269518358 1098210907 /nfs/dbraw/zinc/21/09/07/1098210907.db2.gz VXPJXPPQXVKIJV-HIFRSBDPSA-N 0 3 332.407 2.559 20 5 EFBDHN CN1CC[C@H](Nc2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)C1 ZINC001167273220 1102216566 /nfs/dbraw/zinc/21/65/66/1102216566.db2.gz XSLLDTGVPCJXTR-AWEZNQCLSA-N 0 3 328.372 2.685 20 5 EFBDHN CC1(C)[C@@H](O)C[C@@H]1NCc1ccc(Br)c([N+](=O)[O-])c1 ZINC000128098184 1108635200 /nfs/dbraw/zinc/63/52/00/1108635200.db2.gz GTPRJMAKAADKTP-RYUDHWBXSA-N 0 3 329.194 2.606 20 5 EFBDHN CCN(CCNc1ccc([N+](=O)[O-])c(C)c1)C(=O)CN(C)C(C)C ZINC001106779063 1111826214 /nfs/dbraw/zinc/82/62/14/1111826214.db2.gz UBBQIIMSGBSZAU-UHFFFAOYSA-N 0 3 336.436 2.504 20 5 EFBDHN CN1CCN(C[C@H](O)c2cccc([N+](=O)[O-])c2)C2(CCCCC2)C1 ZINC000154415408 529773055 /nfs/dbraw/zinc/77/30/55/529773055.db2.gz MNEMMWJNXVWQHO-KRWDZBQOSA-N 0 3 333.432 2.579 20 5 EFBDHN CN1CCC(NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000181809503 530050218 /nfs/dbraw/zinc/05/02/18/530050218.db2.gz DIQIYDBOJJQVNG-UHFFFAOYSA-N 0 3 343.836 2.551 20 5 EFBDHN COc1cc(C(=O)NCC(C)(C)N2CCC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000101653502 219151331 /nfs/dbraw/zinc/15/13/31/219151331.db2.gz HKLGLFHSILZLSM-ZDUSSCGKSA-N 0 3 349.431 2.844 20 5 EFBDHN CN1CCC[C@@H](CNc2ncc(Br)cc2[N+](=O)[O-])C1 ZINC000044537807 213631750 /nfs/dbraw/zinc/63/17/50/213631750.db2.gz RSPSDKRGARGFLM-VIFPVBQESA-N 0 3 329.198 2.506 20 5 EFBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NC1CCN(C)CC1 ZINC000103596185 219316188 /nfs/dbraw/zinc/31/61/88/219316188.db2.gz NOPCAOBKBAYOHA-UHFFFAOYSA-N 0 3 334.420 2.609 20 5 EFBDHN CN1CCC2(CCCN2C(=O)c2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000370202165 282734821 /nfs/dbraw/zinc/73/48/21/282734821.db2.gz AHGZRJAFICMFDF-UHFFFAOYSA-N 0 3 337.807 2.949 20 5 EFBDHN COc1ccc(OCCN(C)CCc2ccncc2)c([N+](=O)[O-])c1 ZINC000181463315 234194375 /nfs/dbraw/zinc/19/43/75/234194375.db2.gz DBEGVPDVDWGQKP-UHFFFAOYSA-N 0 3 331.372 2.552 20 5 EFBDHN Cc1c(NC(=O)CCN[C@@H](C)c2ccccn2)cccc1[N+](=O)[O-] ZINC000181773222 234318010 /nfs/dbraw/zinc/31/80/10/234318010.db2.gz VNZRCTDCUXYCQR-ZDUSSCGKSA-N 0 3 328.372 2.978 20 5 EFBDHN Cc1ccc([C@@H](C)NCCCS(=O)(=O)C(C)C)cc1[N+](=O)[O-] ZINC000181828312 234341497 /nfs/dbraw/zinc/34/14/97/234341497.db2.gz MVFHOWPXNSRTJU-CYBMUJFWSA-N 0 3 328.434 2.767 20 5 EFBDHN C[C@@H]1C[C@H](N(C)C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)CCN1C ZINC000127870805 222891410 /nfs/dbraw/zinc/89/14/10/222891410.db2.gz HUALABBIGQRZSR-VXGBXAGGSA-N 0 3 330.388 2.631 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN[C@H](C)c1cccnc1 ZINC000182889610 234802985 /nfs/dbraw/zinc/80/29/85/234802985.db2.gz NLLUVZNUIPRRAG-CYBMUJFWSA-N 0 3 328.372 2.978 20 5 EFBDHN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)CCN(C)C1CC1 ZINC000186780881 236017609 /nfs/dbraw/zinc/01/76/09/236017609.db2.gz XKGIZUFAIAXBCU-GFCCVEGCSA-N 0 3 345.403 2.732 20 5 EFBDHN C[C@@H](NCCc1ccc([N+](=O)[O-])cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000129713968 223084079 /nfs/dbraw/zinc/08/40/79/223084079.db2.gz HPAPHCGLWBYPAF-CYBMUJFWSA-N 0 3 348.424 2.892 20 5 EFBDHN C[C@H](N[C@H]1CC(C)(C)OC1(C)C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000132624257 223348457 /nfs/dbraw/zinc/34/84/57/223348457.db2.gz UMUKNXALUVFCQT-FZMZJTMJSA-N 0 3 335.404 2.858 20 5 EFBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNC[C@]1(O)CCSC1 ZINC000290948127 294228026 /nfs/dbraw/zinc/22/80/26/294228026.db2.gz UUUJIILXKKTMPR-GFCCVEGCSA-N 0 3 337.228 2.859 20 5 EFBDHN CCC[C@H](N[C@@H]1CCc2nc(C)nn2C1)c1cccc([N+](=O)[O-])c1 ZINC000160453246 283937426 /nfs/dbraw/zinc/93/74/26/283937426.db2.gz JUVAEAVXMQDAMZ-ZBFHGGJFSA-N 0 3 329.404 2.941 20 5 EFBDHN C[C@@H](CNc1ncc([N+](=O)[O-])cc1Br)N(C)C1CC1 ZINC000226357436 242101230 /nfs/dbraw/zinc/10/12/30/242101230.db2.gz LDEQWMZPTHKCCG-QMMMGPOBSA-N 0 3 329.198 2.647 20 5 EFBDHN O=C(NC[C@@H]1CCCCN1C1CC1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412290965 243248006 /nfs/dbraw/zinc/24/80/06/243248006.db2.gz JWVJLDPKGIOKBQ-OKZBNKHCSA-N 0 3 343.427 2.831 20 5 EFBDHN COc1cc(CNCC(C)(C)OCC2CC2)c([N+](=O)[O-])cc1OC ZINC000414518607 244208019 /nfs/dbraw/zinc/20/80/19/244208019.db2.gz VRLQEHIDCFQQCU-UHFFFAOYSA-N 0 3 338.404 2.907 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2ccc(CN[C@@H](CO)[C@@H]3CCCOC3)o2)c1 ZINC000414562890 244235743 /nfs/dbraw/zinc/23/57/43/244235743.db2.gz UCGJPIMTHCXAKF-PBHICJAKSA-N 0 3 346.383 2.732 20 5 EFBDHN CC(C)c1ccc([C@@H](N)CNC(=O)c2cccc([N+](=O)[O-])c2N)cc1 ZINC000262539060 245022749 /nfs/dbraw/zinc/02/27/49/245022749.db2.gz DOZINFACBARQEK-HNNXBMFYSA-N 0 3 342.399 2.730 20 5 EFBDHN C[C@@H](C(=O)N1CCc2c1cccc2[N+](=O)[O-])[C@H](N)c1ccccc1 ZINC000262653455 245097961 /nfs/dbraw/zinc/09/79/61/245097961.db2.gz WHXCVYSXLQXWTQ-PXAZEXFGSA-N 0 3 325.368 2.820 20 5 EFBDHN C[C@@H](C(=O)N1CCc2c1cccc2[N+](=O)[O-])[C@@H](N)c1ccccc1 ZINC000262653462 245098280 /nfs/dbraw/zinc/09/82/80/245098280.db2.gz WHXCVYSXLQXWTQ-SJKOYZFVSA-N 0 3 325.368 2.820 20 5 EFBDHN O=C(N[C@H]1CNCCC1(F)F)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000449661244 284245421 /nfs/dbraw/zinc/24/54/21/284245421.db2.gz ZOXYOUIMQVMGDE-LBPRGKRZSA-N 0 3 341.339 2.537 20 5 EFBDHN COC(=O)c1cccc(OCCN(C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000419106632 245340758 /nfs/dbraw/zinc/34/07/58/245340758.db2.gz DASAFXDAXWQFGC-UHFFFAOYSA-N 0 3 344.367 2.892 20 5 EFBDHN O=C(CCN1CCC(OC2CCC2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000419301202 245372165 /nfs/dbraw/zinc/37/21/65/245372165.db2.gz KKZZZLJHTUPDDG-UHFFFAOYSA-N 0 3 347.415 2.957 20 5 EFBDHN CN(C[C@H]1CCCN1C)C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000421709388 246076147 /nfs/dbraw/zinc/07/61/47/246076147.db2.gz DYSNTSDSPFDCDQ-GFCCVEGCSA-N 0 3 345.321 2.780 20 5 EFBDHN CN(C[C@H]1CCCN1C)C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000421712037 246078235 /nfs/dbraw/zinc/07/82/35/246078235.db2.gz PPQGIKUGQPETOE-LLVKDONJSA-N 0 3 345.321 2.780 20 5 EFBDHN COC1CCN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000264189865 246159292 /nfs/dbraw/zinc/15/92/92/246159292.db2.gz MJPYLSOPRPPBNX-UHFFFAOYSA-N 0 3 331.372 2.903 20 5 EFBDHN CN(Cc1ccc(Br)cc1[N+](=O)[O-])C[C@@H]1CCCN1C ZINC000425471755 247098246 /nfs/dbraw/zinc/09/82/46/247098246.db2.gz ICRVKWMICNOKIU-ZDUSSCGKSA-N 0 3 342.237 2.883 20 5 EFBDHN Cn1cnc2cc(CN3CCC(n4ccc([N+](=O)[O-])n4)CC3)ccc21 ZINC000425975109 247221395 /nfs/dbraw/zinc/22/13/95/247221395.db2.gz AZLMPZPUNLKYGD-UHFFFAOYSA-N 0 3 340.387 2.515 20 5 EFBDHN CN(C[C@@H]1CCCN(C)C1)C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000265995757 248009274 /nfs/dbraw/zinc/00/92/74/248009274.db2.gz MYCOCJMFNBZDFE-CQSZACIVSA-N 0 3 333.432 2.673 20 5 EFBDHN O=C1CCC[C@H](CNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)N1 ZINC000433194184 248026235 /nfs/dbraw/zinc/02/62/35/248026235.db2.gz MECKDXBWGWUJBM-CYBMUJFWSA-N 0 3 329.356 2.613 20 5 EFBDHN O=C1CCC[C@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)N1 ZINC000433202938 248027765 /nfs/dbraw/zinc/02/77/65/248027765.db2.gz VGCACGMRBMJMQC-CYBMUJFWSA-N 0 3 329.356 2.613 20 5 EFBDHN Cc1c(NC(=O)[C@H](C)N[C@@H]2[C@@H]3CCO[C@H]3C2(C)C)cccc1[N+](=O)[O-] ZINC000266012235 248028103 /nfs/dbraw/zinc/02/81/03/248028103.db2.gz QCHXVEKBGPNILM-YXAMBPQSSA-N 0 3 347.415 2.633 20 5 EFBDHN COCCN(Cc1ccc(OC)c([N+](=O)[O-])c1)[C@@H]1CCCSC1 ZINC000433203225 248028556 /nfs/dbraw/zinc/02/85/56/248028556.db2.gz WQLZGSCNORDSHF-CQSZACIVSA-N 0 3 340.445 2.947 20 5 EFBDHN Cc1cnc(N(C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)c([N+](=O)[O-])c1 ZINC000433777178 248088931 /nfs/dbraw/zinc/08/89/31/248088931.db2.gz ITOPVAGODHQZEX-RDJZCZTQSA-N 0 3 341.415 2.822 20 5 EFBDHN C[C@H]1C[C@H](N(C)C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CCN1C ZINC000266098129 248095233 /nfs/dbraw/zinc/09/52/33/248095233.db2.gz RAEXTHWQRRYQKW-WCQYABFASA-N 0 3 330.388 2.631 20 5 EFBDHN C[C@H]1C[C@@H](N(C)C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CCN1C ZINC000266047794 248061914 /nfs/dbraw/zinc/06/19/14/248061914.db2.gz FKXOBBPIROENKJ-RYUDHWBXSA-N 0 3 330.388 2.631 20 5 EFBDHN C[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CCN1Cc1ccccc1 ZINC000266343398 248256548 /nfs/dbraw/zinc/25/65/48/248256548.db2.gz MVQZNTOCUWSORA-CQSZACIVSA-N 0 3 342.399 2.660 20 5 EFBDHN C[C@@H](NC[C@H](O)COc1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000266825326 248465543 /nfs/dbraw/zinc/46/55/43/248465543.db2.gz CTQYZJRZPIULMD-WBMJQRKESA-N 0 3 334.347 2.824 20 5 EFBDHN C[C@H](N[C@@H]1[C@@H]2CCCO[C@@H]2C1(C)C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000439650014 249846363 /nfs/dbraw/zinc/84/63/63/249846363.db2.gz REXSYVFHTJSHKM-KSYCFECVSA-N 0 3 347.415 2.715 20 5 EFBDHN COc1ccc(OCCN(C)CCOc2ccccc2)c([N+](=O)[O-])c1 ZINC000441177887 250003725 /nfs/dbraw/zinc/00/37/25/250003725.db2.gz RVUPGQYWKGGPPC-UHFFFAOYSA-N 0 3 346.383 2.993 20 5 EFBDHN CN(Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C[C@H]1CCCCO1 ZINC000092427329 218140014 /nfs/dbraw/zinc/14/00/14/218140014.db2.gz IWVCEQANUFMKDV-QGZVFWFLSA-N 0 3 344.415 2.996 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@H]1C[C@@H](C)N(C2CC2)C1 ZINC000092429313 218141335 /nfs/dbraw/zinc/14/13/35/218141335.db2.gz MHQGYWPXCLXAHE-OCCSQVGLSA-N 0 3 331.416 2.875 20 5 EFBDHN Cc1c(C(=O)NC[C@@H](c2ccccc2)N(C)C)cccc1[N+](=O)[O-] ZINC000010017720 211140887 /nfs/dbraw/zinc/14/08/87/211140887.db2.gz NOOKFAFDHNMCFP-KRWDZBQOSA-N 0 3 327.384 2.936 20 5 EFBDHN Cc1nn(C)c(N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000267232580 250857062 /nfs/dbraw/zinc/85/70/62/250857062.db2.gz QHBOIZIKDHBAMY-CJNGLKHVSA-N 0 3 343.431 2.959 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])NCC(=O)N(C)Cc1ccccc1 ZINC000449093115 250912547 /nfs/dbraw/zinc/91/25/47/250912547.db2.gz VLLURQQJSPSJSD-HNNXBMFYSA-N 0 3 341.411 2.774 20 5 EFBDHN Cc1cc(CN[C@@H](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2)ccn1 ZINC000449404293 251014174 /nfs/dbraw/zinc/01/41/74/251014174.db2.gz UHBKUZOQFDYKHY-ZDUSSCGKSA-N 0 3 328.372 2.805 20 5 EFBDHN Cc1cc(CN[C@H](C)CC(=O)Nc2cccc([N+](=O)[O-])c2)ccn1 ZINC000449405287 251015413 /nfs/dbraw/zinc/01/54/13/251015413.db2.gz XZWXOOOAJDLNOV-CYBMUJFWSA-N 0 3 328.372 2.805 20 5 EFBDHN COc1cc(C[NH2+][C@H](C(C)C)[C@H](CO)C(C)C)c([N+](=O)[O-])cc1[O-] ZINC000449508385 251047887 /nfs/dbraw/zinc/04/78/87/251047887.db2.gz HDYLYADBYDVHBV-CXAGYDPISA-N 0 3 340.420 2.688 20 5 EFBDHN CCOC(=O)[C@@H]1CCCC[C@@H]1NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000449515446 251049333 /nfs/dbraw/zinc/04/93/33/251049333.db2.gz ZFVWASTWZUTBEN-KGLIPLIRSA-N 0 3 336.388 2.815 20 5 EFBDHN CO[C@H]1CCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000449503767 251045348 /nfs/dbraw/zinc/04/53/48/251045348.db2.gz PWYSGEURZSYZCN-GUYCJALGSA-N 0 3 344.415 2.852 20 5 EFBDHN C[C@@H](NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)C(C)(C)CN(C)C ZINC000449941214 251207258 /nfs/dbraw/zinc/20/72/58/251207258.db2.gz VBRSGUQESQMXEK-CYBMUJFWSA-N 0 3 349.431 2.650 20 5 EFBDHN COCCN1CCC(Nc2nccc3c2cccc3[N+](=O)[O-])CC1 ZINC000450280569 251327639 /nfs/dbraw/zinc/32/76/39/251327639.db2.gz YUIYMFQQZSXLGP-UHFFFAOYSA-N 0 3 330.388 2.666 20 5 EFBDHN O=[N+]([O-])c1ccc2oc(CN3CCC[C@@H]3[C@@H]3CCC[C@@H]3O)nc2c1 ZINC000451415775 251554409 /nfs/dbraw/zinc/55/44/09/251554409.db2.gz JUCMIFVLHFOJMY-CFVMTHIKSA-N 0 3 331.372 2.861 20 5 EFBDHN CN(C)CCN(Cc1cccc(O)c1)C(=O)c1ccc([N+](=O)[O-])s1 ZINC000153324992 224088747 /nfs/dbraw/zinc/08/87/47/224088747.db2.gz QTJGDBOGJKVBPN-UHFFFAOYSA-N 0 3 349.412 2.566 20 5 EFBDHN Cc1ccc([C@@H](C)NC[C@H](O)COc2ccccc2)cc1[N+](=O)[O-] ZINC000268737707 252188086 /nfs/dbraw/zinc/18/80/86/252188086.db2.gz CASIDSQHRNNRJW-ZBFHGGJFSA-N 0 3 330.384 2.994 20 5 EFBDHN Cc1ccc([C@@H](C)NC[C@@H](O)COc2ccccc2)cc1[N+](=O)[O-] ZINC000268737699 252188591 /nfs/dbraw/zinc/18/85/91/252188591.db2.gz CASIDSQHRNNRJW-GDBMZVCRSA-N 0 3 330.384 2.994 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)C1 ZINC000454310035 252209540 /nfs/dbraw/zinc/20/95/40/252209540.db2.gz FRGZDUILJTVVOB-CQSZACIVSA-N 0 3 342.399 2.517 20 5 EFBDHN COc1ccc([C@H](NCCn2cc([N+](=O)[O-])ccc2=O)C2CC2)cc1 ZINC000179686871 533195216 /nfs/dbraw/zinc/19/52/16/533195216.db2.gz MDSLIJUIZINCQC-GOSISDBHSA-N 0 3 343.383 2.506 20 5 EFBDHN C[C@@H]1CCCN(CCNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000117756512 221086549 /nfs/dbraw/zinc/08/65/49/221086549.db2.gz RPFAMNVZGXWMMN-GFCCVEGCSA-N 0 3 339.823 2.639 20 5 EFBDHN CCc1ccc(C(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)cc1[N+](=O)[O-] ZINC000118988033 221218661 /nfs/dbraw/zinc/21/86/61/221218661.db2.gz DAOMDSNHTOCMJG-HZPDHXFCSA-N 0 3 331.416 2.714 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)CCN[C@H](C)c1ccccn1 ZINC000181813590 533224652 /nfs/dbraw/zinc/22/46/52/533224652.db2.gz CMORDZLOAHUVHC-GFCCVEGCSA-N 0 3 344.371 2.678 20 5 EFBDHN Cc1c(CC(=O)N2CCC[C@@H]2CN2CCCCC2)cccc1[N+](=O)[O-] ZINC000119689720 221377321 /nfs/dbraw/zinc/37/73/21/221377321.db2.gz JXPWKWFWODJORA-QGZVFWFLSA-N 0 3 345.443 2.923 20 5 EFBDHN Cc1ccccc1[C@@H](C)NC[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000039982521 258059419 /nfs/dbraw/zinc/05/94/19/258059419.db2.gz IBZPZBIFGRKQPI-GDBMZVCRSA-N 0 3 330.384 2.994 20 5 EFBDHN Cc1ccccc1[C@@H](C)NC[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000039982517 258059464 /nfs/dbraw/zinc/05/94/64/258059464.db2.gz IBZPZBIFGRKQPI-ZBFHGGJFSA-N 0 3 330.384 2.994 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC[C@H](n2ccnn2)C1 ZINC000425346702 533382856 /nfs/dbraw/zinc/38/28/56/533382856.db2.gz GIAMJWBTTCWNMF-QXSWTLKVSA-N 0 3 327.388 2.927 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CNCCNC(=O)c1ccco1 ZINC000344818947 533408332 /nfs/dbraw/zinc/40/83/32/533408332.db2.gz GBARCCABFSLAQE-JLHYYAGUSA-N 0 3 329.356 2.611 20 5 EFBDHN COc1ccc(CN2CCC[C@H](C3(C)OCCO3)C2)cc1[N+](=O)[O-] ZINC000183822377 533557824 /nfs/dbraw/zinc/55/78/24/533557824.db2.gz ZYAMSTPBFDWEIV-AWEZNQCLSA-N 0 3 336.388 2.578 20 5 EFBDHN COc1ccc(CNCC[C@@](C)(O)c2ccccc2)cc1[N+](=O)[O-] ZINC000189819775 533663351 /nfs/dbraw/zinc/66/33/51/533663351.db2.gz IIHKEJJXCINEAA-GOSISDBHSA-N 0 3 330.384 2.991 20 5 EFBDHN COc1c(C(=O)Nc2cccc(CN(C)C)c2)cccc1[N+](=O)[O-] ZINC000354391125 146702028 /nfs/dbraw/zinc/70/20/28/146702028.db2.gz QKMKTENPKZPCMH-UHFFFAOYSA-N 0 3 329.356 2.917 20 5 EFBDHN C[C@H]1CC[C@H](C)N1CC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000345024944 142113015 /nfs/dbraw/zinc/11/30/15/142113015.db2.gz PLABBRUKKPQYEN-QWRGUYRKSA-N 0 3 325.796 2.737 20 5 EFBDHN C[C@@H]1CC[C@H](C)N1CC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000345024942 142113273 /nfs/dbraw/zinc/11/32/73/142113273.db2.gz PLABBRUKKPQYEN-PHIMTYICSA-N 0 3 325.796 2.737 20 5 EFBDHN C[C@@H](NC(=O)C(C)(C)c1ccccc1[N+](=O)[O-])C1=CCN(C)CC1 ZINC000346109627 142147941 /nfs/dbraw/zinc/14/79/41/142147941.db2.gz OZZUTSSOBLTADS-CYBMUJFWSA-N 0 3 331.416 2.639 20 5 EFBDHN Cc1cccc(C(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000346160224 142157730 /nfs/dbraw/zinc/15/77/30/142157730.db2.gz FEOFWTABEPXWCJ-DUVNUKRYSA-N 0 3 331.416 2.706 20 5 EFBDHN CC(C)[C@@H](CN(C)Cc1ccccc1)Nc1ncc([N+](=O)[O-])cn1 ZINC000346202848 142166370 /nfs/dbraw/zinc/16/63/70/142166370.db2.gz AMXFGJDIGMKZCA-MRXNPFEDSA-N 0 3 329.404 2.953 20 5 EFBDHN Cc1c(CC(=O)N2CCN([C@@H]3C[C@H]3C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000346221975 142170683 /nfs/dbraw/zinc/17/06/83/142170683.db2.gz LAHPAPOOLPLSSH-PMUMKWKESA-N 0 3 345.443 2.634 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@]2(CCN(C)C2)C1 ZINC000346331703 142190669 /nfs/dbraw/zinc/19/06/69/142190669.db2.gz WSGQEHWFAIFOPK-APWZRJJASA-N 0 3 345.443 2.718 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@]2(CCN(C)C2)C1 ZINC000346331705 142190868 /nfs/dbraw/zinc/19/08/68/142190868.db2.gz WSGQEHWFAIFOPK-QFBILLFUSA-N 0 3 345.443 2.718 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)c2ccc3c(c2)CNC3)cc1[N+](=O)[O-] ZINC000347545449 142233764 /nfs/dbraw/zinc/23/37/64/142233764.db2.gz CMHLHFDKHVCXOK-GFCCVEGCSA-N 0 3 325.368 2.997 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(N2CCC(C)(CN3CCN(C)CC3)CC2)c1 ZINC000347858680 142283396 /nfs/dbraw/zinc/28/33/96/142283396.db2.gz GVDHGGOVUMUCKF-UHFFFAOYSA-N 0 3 346.475 2.757 20 5 EFBDHN CC(C)N1CCC[C@H](NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000347950312 142298372 /nfs/dbraw/zinc/29/83/72/142298372.db2.gz MMHXGUOBRIDLLX-INIZCTEOSA-N 0 3 348.447 2.776 20 5 EFBDHN O=[N+]([O-])c1ccc(S(=O)(=O)CCN[C@H]2CCC[C@H]2C2CC2)cc1 ZINC000349661904 142345488 /nfs/dbraw/zinc/34/54/88/142345488.db2.gz GZPVWYARGBJPLN-HOTGVXAUSA-N 0 3 338.429 2.537 20 5 EFBDHN CN1CCN(CCCNc2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000341394074 145044490 /nfs/dbraw/zinc/04/44/90/145044490.db2.gz XKQVIQFQEKPZMX-UHFFFAOYSA-N 0 3 347.246 2.951 20 5 EFBDHN COC(=O)[C@]12CN(Cc3ccc(OC)c([N+](=O)[O-])c3)C[C@@H]1CCCC2 ZINC000342128077 145067231 /nfs/dbraw/zinc/06/72/31/145067231.db2.gz RLLDRNGXKOABBL-KBXCAEBGSA-N 0 3 348.399 2.769 20 5 EFBDHN COC(=O)[C@]12CN(Cc3ccc([N+](=O)[O-])c(OC)c3)C[C@@H]1CCCC2 ZINC000342149770 145071597 /nfs/dbraw/zinc/07/15/97/145071597.db2.gz GRXMWCLMYMVUGB-KBXCAEBGSA-N 0 3 348.399 2.769 20 5 EFBDHN C[C@H]1CCC[C@H](CNCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000342353817 145107386 /nfs/dbraw/zinc/10/73/86/145107386.db2.gz HFTCITMYDOUNEY-KBPBESRZSA-N 0 3 340.445 2.784 20 5 EFBDHN C[C@@H]1CCC[C@@H](CNCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000342353824 145107804 /nfs/dbraw/zinc/10/78/04/145107804.db2.gz HFTCITMYDOUNEY-ZIAGYGMSSA-N 0 3 340.445 2.784 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)CSc1ccccc1[N+](=O)[O-] ZINC000342418981 145121803 /nfs/dbraw/zinc/12/18/03/145121803.db2.gz RPILXIDAUCTKAL-KGLIPLIRSA-N 0 3 349.456 2.772 20 5 EFBDHN COc1ccc([C@@H](CN(C)C)NC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000342610265 145158925 /nfs/dbraw/zinc/15/89/25/145158925.db2.gz AIQFVNNBRLEGHY-QGZVFWFLSA-N 0 3 343.383 2.636 20 5 EFBDHN Cc1ccc(NCc2ccnc(OCCN(C)C)c2)c([N+](=O)[O-])c1 ZINC000342767677 145188135 /nfs/dbraw/zinc/18/81/35/145188135.db2.gz FGBKYWNIIUSKTO-UHFFFAOYSA-N 0 3 330.388 2.851 20 5 EFBDHN CCCN(CCN1CCCCC1)C(=O)c1cccc([N+](=O)[O-])c1OC ZINC000342777143 145189534 /nfs/dbraw/zinc/18/95/34/145189534.db2.gz BXUTWQPDWNCAOF-UHFFFAOYSA-N 0 3 349.431 2.942 20 5 EFBDHN O=C(NC[C@@H]1CCN(C2CC2)C1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000342887948 145215296 /nfs/dbraw/zinc/21/52/96/145215296.db2.gz BREHEMYGDWIGCT-NSHDSACASA-N 0 3 329.356 2.555 20 5 EFBDHN C[C@H](CN1CCC[C@@H](C)C1)NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000342889749 145215929 /nfs/dbraw/zinc/21/59/29/145215929.db2.gz ZMEMNAVJDVGIEJ-CHWSQXEVSA-N 0 3 344.415 2.926 20 5 EFBDHN CCCN1CCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000343550601 145235499 /nfs/dbraw/zinc/23/54/99/145235499.db2.gz CCMKMYWNCAYPTM-ZDUSSCGKSA-N 0 3 342.399 2.747 20 5 EFBDHN CCCN1CCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000343550599 145235582 /nfs/dbraw/zinc/23/55/82/145235582.db2.gz CCMKMYWNCAYPTM-CYBMUJFWSA-N 0 3 342.399 2.747 20 5 EFBDHN Cc1cc(N[C@@H]2CCCN(C)[C@@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000343598879 145248523 /nfs/dbraw/zinc/24/85/23/145248523.db2.gz IHSTUYFIEBLRFR-CZUORRHYSA-N 0 3 341.415 2.677 20 5 EFBDHN C[C@H]1[C@@H](NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)CCCN1C ZINC000343764759 145289850 /nfs/dbraw/zinc/28/98/50/145289850.db2.gz WOAWANRJRBVGFW-YOEHRIQHSA-N 0 3 348.447 2.699 20 5 EFBDHN O=C(C1CC1)N1CCC(NCc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000344133091 145375986 /nfs/dbraw/zinc/37/59/86/145375986.db2.gz PCMAHHSTEGDFRA-UHFFFAOYSA-N 0 3 337.807 2.739 20 5 EFBDHN C[C@@H]1CCCN(C(C)(C)CNC(=O)c2cc(F)cc([N+](=O)[O-])c2)C1 ZINC000344216004 145394464 /nfs/dbraw/zinc/39/44/64/145394464.db2.gz LHZMQRWVALGDEB-GFCCVEGCSA-N 0 3 337.395 2.974 20 5 EFBDHN C[C@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCCOC1 ZINC000348140344 145879825 /nfs/dbraw/zinc/87/98/25/145879825.db2.gz BBHVWTOZGYHIIU-QWRGUYRKSA-N 0 3 341.795 2.591 20 5 EFBDHN CCOc1ncccc1CN[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000351505114 146133098 /nfs/dbraw/zinc/13/30/98/146133098.db2.gz ZPPSOLISPKKWTF-HUUCEWRRSA-N 0 3 345.403 2.859 20 5 EFBDHN CN1CC[C@H]2[C@@H](CCCN2C(=O)Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC000351621080 146160404 /nfs/dbraw/zinc/16/04/04/146160404.db2.gz PSOKAHACLQENSD-NHYWBVRUSA-N 0 3 336.367 2.682 20 5 EFBDHN CC(C)CN(CCN(C)C)C(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000351656642 146170039 /nfs/dbraw/zinc/17/00/39/146170039.db2.gz UOLDPBMMXUMUEO-UHFFFAOYSA-N 0 3 326.372 2.785 20 5 EFBDHN O=[N+]([O-])c1cc(F)c(CN2CCN(C3CCCC3)CC2)c(F)c1 ZINC000351859411 146220492 /nfs/dbraw/zinc/22/04/92/146220492.db2.gz OMUVOZNRHIOCJS-UHFFFAOYSA-N 0 3 325.359 2.933 20 5 EFBDHN COC(=O)COc1ccc(CN2CCC[C@H]3CCC[C@H]32)cc1[N+](=O)[O-] ZINC000355599737 147008063 /nfs/dbraw/zinc/00/80/63/147008063.db2.gz NZZZSZLBTYDHOM-HUUCEWRRSA-N 0 3 348.399 2.911 20 5 EFBDHN COC(=O)COc1ccc(CN2C[C@H](C)C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000355597899 147008083 /nfs/dbraw/zinc/00/80/83/147008083.db2.gz FTHJXZZEYPZFPB-CHWSQXEVSA-N 0 3 336.388 2.625 20 5 EFBDHN COC(=O)COc1ccc(CN2CCC[C@@H](C)[C@H]2C)cc1[N+](=O)[O-] ZINC000355765149 147056550 /nfs/dbraw/zinc/05/65/50/147056550.db2.gz YBPPSHRZJQPICH-CHWSQXEVSA-N 0 3 336.388 2.767 20 5 EFBDHN CSc1cccc(C(=O)N2CC[C@@]3(C2)CCCN(C)C3)c1[N+](=O)[O-] ZINC000356250394 147189009 /nfs/dbraw/zinc/18/90/09/147189009.db2.gz FOENSQATUKHHRN-KRWDZBQOSA-N 0 3 349.456 2.875 20 5 EFBDHN CCNc1ccc(C(=O)N2C[C@@H](N3CCCC3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000356285923 147200498 /nfs/dbraw/zinc/20/04/98/147200498.db2.gz VOBXRFQUMBEPOR-HIFRSBDPSA-N 0 3 346.431 2.725 20 5 EFBDHN C[C@@H](C(=O)N1CC[C@]2(C1)CCCN(C)C2)c1ccc([N+](=O)[O-])cc1F ZINC000356295676 147204286 /nfs/dbraw/zinc/20/42/86/147204286.db2.gz UXAXNLNJYYYFHY-FZKQIMNGSA-N 0 3 349.406 2.782 20 5 EFBDHN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)CCN(C)C ZINC000356617042 147291688 /nfs/dbraw/zinc/29/16/88/147291688.db2.gz IKYOOTMHXFQJFY-UHFFFAOYSA-N 0 3 325.434 2.731 20 5 EFBDHN Cc1cc(NC[C@]2(O)CCN(Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000356749199 147326565 /nfs/dbraw/zinc/32/65/65/147326565.db2.gz WVQLTJHSMACJHK-LJQANCHMSA-N 0 3 341.411 2.952 20 5 EFBDHN Cc1cc(N2CCN(C)[C@@H](C)[C@@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000356790996 147336810 /nfs/dbraw/zinc/33/68/10/147336810.db2.gz IVAKKADADCVELJ-KBPBESRZSA-N 0 3 341.415 2.889 20 5 EFBDHN O=C1CC[C@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CN1 ZINC000356882786 147361651 /nfs/dbraw/zinc/36/16/51/147361651.db2.gz UQEYDRUALCUFAQ-JTQLQIEISA-N 0 3 349.774 2.876 20 5 EFBDHN Cc1ccccc1[C@@H]([C@H](C)NC(=O)c1ccc([N+](=O)[O-])n1C)N(C)C ZINC000357860825 147644149 /nfs/dbraw/zinc/64/41/49/147644149.db2.gz XATHFQGEWVKNPP-SUMWQHHRSA-N 0 3 344.415 2.663 20 5 EFBDHN CCn1nc(C)c([N+](=O)[O-])c1NC[C@@H](Cc1ccccc1)N(C)C ZINC000359368208 148068387 /nfs/dbraw/zinc/06/83/87/148068387.db2.gz ZEXOIUDVRADHQR-OAHLLOKOSA-N 0 3 331.420 2.704 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@@H](CCO)C2CCOCC2)c(Cl)c1 ZINC000359577817 148128386 /nfs/dbraw/zinc/12/83/86/148128386.db2.gz HIQMHHCLHXDRFF-HNNXBMFYSA-N 0 3 328.796 2.515 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@H](CO)C3CCOCC3)o2)cc1 ZINC000359946907 148231355 /nfs/dbraw/zinc/23/13/55/148231355.db2.gz NBWGXGJRELVXLE-QGZVFWFLSA-N 0 3 346.383 2.732 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2ccc(CN[C@@H](CO)C3CCOCC3)o2)c1 ZINC000359949449 148232279 /nfs/dbraw/zinc/23/22/79/148232279.db2.gz LZKXHWDNJRNDAU-KRWDZBQOSA-N 0 3 346.383 2.732 20 5 EFBDHN Cc1c(CNC(=O)c2ccc(CN(C)C)cc2)cccc1[N+](=O)[O-] ZINC000360516068 148381030 /nfs/dbraw/zinc/38/10/30/148381030.db2.gz RFBGPIWSJIZLBR-UHFFFAOYSA-N 0 3 327.384 2.895 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C/CN1CCOC2(CCOCC2)CC1 ZINC000364226205 149097187 /nfs/dbraw/zinc/09/71/87/149097187.db2.gz KTUBAWKISFVWLL-HWKANZROSA-N 0 3 332.400 2.880 20 5 EFBDHN Cc1noc(C2(C)CCN(CCc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000364695287 149219235 /nfs/dbraw/zinc/21/92/35/149219235.db2.gz INLGKYAUOBNANX-UHFFFAOYSA-N 0 3 330.388 2.882 20 5 EFBDHN COc1cc(C(=O)N2CCC[C@H](N3CCCC3)C2)cc([N+](=O)[O-])c1C ZINC000365155796 149332140 /nfs/dbraw/zinc/33/21/40/149332140.db2.gz LPHQLSFRWAQDSV-HNNXBMFYSA-N 0 3 347.415 2.612 20 5 EFBDHN NC(=O)C[C@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000368135133 150047930 /nfs/dbraw/zinc/04/79/30/150047930.db2.gz OPSBFKRAGPBAGL-GFCCVEGCSA-N 0 3 329.356 2.552 20 5 EFBDHN COc1cccc([C@@H]2C[C@H](C)CN2CCn2ccc([N+](=O)[O-])n2)c1 ZINC000371716033 150877404 /nfs/dbraw/zinc/87/74/04/150877404.db2.gz MRPOCXPGKYTKEQ-BBRMVZONSA-N 0 3 330.388 2.883 20 5 EFBDHN Cc1ccc(CN2CCC[C@H]2C[C@@H](O)c2cnn(C)c2)cc1[N+](=O)[O-] ZINC000374256248 151310419 /nfs/dbraw/zinc/31/04/19/151310419.db2.gz NCLBMNPVWCGGTP-FUHWJXTLSA-N 0 3 344.415 2.725 20 5 EFBDHN Cc1c([C@@H](C)N[C@H]2CCN(c3cnn(C)c3)C2)cccc1[N+](=O)[O-] ZINC000374574555 151373152 /nfs/dbraw/zinc/37/31/52/151373152.db2.gz IIZNSTZCLONDCJ-KGLIPLIRSA-N 0 3 329.404 2.566 20 5 EFBDHN Cc1c([C@H](C)N[C@H]2CCN(c3cnn(C)c3)C2)cccc1[N+](=O)[O-] ZINC000374574554 151373307 /nfs/dbraw/zinc/37/33/07/151373307.db2.gz IIZNSTZCLONDCJ-KBPBESRZSA-N 0 3 329.404 2.566 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCN1CCC[C@H]1/C=C/c1ccccc1 ZINC000378602581 152124844 /nfs/dbraw/zinc/12/48/44/152124844.db2.gz XRMIMTZPEWEQJI-IJDCCNJMSA-N 0 3 339.395 2.934 20 5 EFBDHN Cc1c(CNC(=O)N2CCC[C@@H]3CN(C)CC[C@@H]32)cccc1[N+](=O)[O-] ZINC000408331331 152177658 /nfs/dbraw/zinc/17/76/58/152177658.db2.gz QQKAQEGZPVYLQG-WBVHZDCISA-N 0 3 346.431 2.529 20 5 EFBDHN COc1cccc(C(=O)N[C@@H](CC(C)C)CN2CCCC2)c1[N+](=O)[O-] ZINC000452341800 286444435 /nfs/dbraw/zinc/44/44/35/286444435.db2.gz FLEBLJMQLGGEHB-AWEZNQCLSA-N 0 3 349.431 2.844 20 5 EFBDHN C[C@@]1(c2ccccc2)CCCN(CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000159826841 225284695 /nfs/dbraw/zinc/28/46/95/225284695.db2.gz UQAIFMQWMABVPE-LJQANCHMSA-N 0 3 341.411 2.810 20 5 EFBDHN CN(C)[C@@H]1CCCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 ZINC000171634875 227188416 /nfs/dbraw/zinc/18/84/16/227188416.db2.gz GNZSZMVOWKKACB-CYBMUJFWSA-N 0 3 333.413 2.976 20 5 EFBDHN COc1cccc(NCCCCN2C[C@H](C)O[C@@H](C)C2)c1[N+](=O)[O-] ZINC000185543597 265045311 /nfs/dbraw/zinc/04/53/11/265045311.db2.gz KMWQBRKKIRXYLE-KBPBESRZSA-N 0 3 337.420 2.905 20 5 EFBDHN COC(=O)N1CCC([C@@H](C)NCc2csc([N+](=O)[O-])c2)CC1 ZINC000186354808 265064140 /nfs/dbraw/zinc/06/41/40/265064140.db2.gz WHRNSCYBNOUHCP-SNVBAGLBSA-N 0 3 327.406 2.613 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@@H](CO)Cc1ccc(C)cc1 ZINC000188974112 265167245 /nfs/dbraw/zinc/16/72/45/265167245.db2.gz HTEJWVYDMIUXGX-QGZVFWFLSA-N 0 3 344.411 2.995 20 5 EFBDHN CSc1ccc(C(=O)NCCN2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000192671182 265303250 /nfs/dbraw/zinc/30/32/50/265303250.db2.gz VBDFCRCEDSFFCZ-UHFFFAOYSA-N 0 3 337.445 2.778 20 5 EFBDHN CCc1nn(C)c(NC2CCN(Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000271154230 265900547 /nfs/dbraw/zinc/90/05/47/265900547.db2.gz MNPCFDCVPHRDLL-UHFFFAOYSA-N 0 3 343.431 2.967 20 5 EFBDHN COc1ccc(OCCN[C@@H](CCO)c2ccccc2)c([N+](=O)[O-])c1 ZINC000271695374 266044182 /nfs/dbraw/zinc/04/41/82/266044182.db2.gz RRPVEKNPCBQCOX-INIZCTEOSA-N 0 3 346.383 2.696 20 5 EFBDHN CC[C@@H](NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)c1cccc(Cl)c1 ZINC000271761459 266055015 /nfs/dbraw/zinc/05/50/15/266055015.db2.gz MLQYWGKYUIZIEE-HUUCEWRRSA-N 0 3 338.795 2.547 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)NCC2=CCN(C)CC2)cc1[N+](=O)[O-] ZINC000271821461 266069331 /nfs/dbraw/zinc/06/93/31/266069331.db2.gz CWIMHSUAWMMLTM-CYBMUJFWSA-N 0 3 332.404 2.525 20 5 EFBDHN CO[C@@H]1[C@@H](C)[C@H](NCc2cc([N+](=O)[O-])cc3c2OCOC3)C1(C)C ZINC000271979641 266113733 /nfs/dbraw/zinc/11/37/33/266113733.db2.gz JCUVSGVBBZPDPF-CIISACIHSA-N 0 3 336.388 2.610 20 5 EFBDHN COc1ccc(OCCN2CCC[C@@]2(C)CCCO)c([N+](=O)[O-])c1 ZINC000272026397 266127283 /nfs/dbraw/zinc/12/72/83/266127283.db2.gz NXXVLENJOXQORZ-KRWDZBQOSA-N 0 3 338.404 2.609 20 5 EFBDHN CC(C)(C)OC(=O)c1cccc(CNCCn2cc([N+](=O)[O-])cn2)c1 ZINC000272140046 266166610 /nfs/dbraw/zinc/16/66/10/266166610.db2.gz BLHQDPXVNZWXIQ-UHFFFAOYSA-N 0 3 346.387 2.536 20 5 EFBDHN CN1CC[C@H]2CCN(c3ccc(Br)cc3[N+](=O)[O-])[C@@H]2C1 ZINC000272223821 266195950 /nfs/dbraw/zinc/19/59/50/266195950.db2.gz SLXUDYJHAYITEU-IINYFYTJSA-N 0 3 340.221 2.888 20 5 EFBDHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)[C@H]2C1 ZINC000272305354 266223434 /nfs/dbraw/zinc/22/34/34/266223434.db2.gz QNPJSOCNJABARY-YGRLFVJLSA-N 0 3 338.795 2.806 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])NCC(=O)NCC1CC1 ZINC000272644846 266337516 /nfs/dbraw/zinc/33/75/16/266337516.db2.gz OTTHLZRNAZGSBE-CYBMUJFWSA-N 0 3 337.445 2.581 20 5 EFBDHN C[C@]1(NCc2cc([N+](=O)[O-])cc3c2OCOC3)CCO[C@@H]1C1CC1 ZINC000273052914 266443967 /nfs/dbraw/zinc/44/39/67/266443967.db2.gz KTVGKAWZWZGSHQ-SJORKVTESA-N 0 3 334.372 2.509 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CCCN(C)C1 ZINC000108329815 273009177 /nfs/dbraw/zinc/00/91/77/273009177.db2.gz XXFDMQBVUKWRDC-CHWSQXEVSA-N 0 3 337.445 2.533 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@@H](C)C(=O)N(C)C ZINC000276911463 267075037 /nfs/dbraw/zinc/07/50/37/267075037.db2.gz PBLNMMYPCXIFKN-NWDGAFQWSA-N 0 3 325.434 2.532 20 5 EFBDHN C[C@H]1CN(C2CC2)C[C@@H]1Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000277510735 267189932 /nfs/dbraw/zinc/18/99/32/267189932.db2.gz ACMAUKBKEAVJCW-KWQFWETISA-N 0 3 330.310 2.903 20 5 EFBDHN C[C@H]1c2ccccc2CCN1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000181858851 273045468 /nfs/dbraw/zinc/04/54/68/273045468.db2.gz XQHDITZMMRJCME-HOCLYGCPSA-N 0 3 342.395 2.954 20 5 EFBDHN CCO[C@@H]1C[C@@H](NCc2ccc(C(N)=O)cc2[N+](=O)[O-])C1(CC)CC ZINC000187042306 273051715 /nfs/dbraw/zinc/05/17/15/273051715.db2.gz XGSANIMJTKYWJF-HZPDHXFCSA-N 0 3 349.431 2.767 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CCC[C@@H]2C[C@H](O)c2ccco2)c1 ZINC000269642212 273086946 /nfs/dbraw/zinc/08/69/46/273086946.db2.gz JSRNQHOTULLMKC-HYVNUMGLSA-N 0 3 346.383 2.809 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000274269658 273128797 /nfs/dbraw/zinc/12/87/97/273128797.db2.gz MFWNGUULHUMXSO-ZDUSSCGKSA-N 0 3 332.404 2.984 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CNCCc1cn2c(n1)SCC2 ZINC000274288953 273130750 /nfs/dbraw/zinc/13/07/50/273130750.db2.gz XUOFJTWOOHYRDM-UHFFFAOYSA-N 0 3 348.428 2.628 20 5 EFBDHN C[C@@H]1CC[C@@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000274303727 273131107 /nfs/dbraw/zinc/13/11/07/273131107.db2.gz OTPKGHPEFNRMKB-HZSPNIEDSA-N 0 3 340.445 2.783 20 5 EFBDHN C[C@@H](CN1CCCC1=O)N[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000278989600 273163883 /nfs/dbraw/zinc/16/38/83/273163883.db2.gz DSRBRFWIRSNIEX-BLLLJJGKSA-N 0 3 331.416 2.918 20 5 EFBDHN Cc1nc2n(n1)C[C@@H](N[C@H]1CC(C)(C)c3ccc([N+](=O)[O-])cc31)CC2 ZINC000279044386 273169885 /nfs/dbraw/zinc/16/98/85/273169885.db2.gz JPDFBJCVTBLJPF-LRDDRELGSA-N 0 3 341.415 2.822 20 5 EFBDHN CN1CCC(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1 ZINC000279170174 273184295 /nfs/dbraw/zinc/18/42/95/273184295.db2.gz CKLLNFJZDZQIGH-UHFFFAOYSA-N 0 3 345.321 2.572 20 5 EFBDHN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)[C@H]1CCCN1C1CC1 ZINC000279295577 273199132 /nfs/dbraw/zinc/19/91/32/273199132.db2.gz ZFUXQXXQDHOSCV-QGZVFWFLSA-N 0 3 331.416 2.661 20 5 EFBDHN CC(=O)N1CCC[C@@H](CNCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000279781631 273252821 /nfs/dbraw/zinc/25/28/21/273252821.db2.gz LIMAVSAJMVEFKR-LBPRGKRZSA-N 0 3 325.796 2.596 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CNC[C@@H](CO)[C@H]2CCOC2)o1 ZINC000280150539 273296327 /nfs/dbraw/zinc/29/63/27/273296327.db2.gz AHEQVTRBULHHNX-KBPBESRZSA-N 0 3 346.383 2.589 20 5 EFBDHN CCOc1cc(N2CCN(CC[C@@H]3CCCO3)CC2)ccc1[N+](=O)[O-] ZINC000280295397 273312562 /nfs/dbraw/zinc/31/25/62/273312562.db2.gz UZJSZRDWMRZDOO-INIZCTEOSA-N 0 3 349.431 2.685 20 5 EFBDHN Cc1ccc([C@@H]2CCN(CCn3cc([N+](=O)[O-])ccc3=O)C2)c(C)c1 ZINC000280298595 273312824 /nfs/dbraw/zinc/31/28/24/273312824.db2.gz FNMXMNKQGZNQFY-MRXNPFEDSA-N 0 3 341.411 2.863 20 5 EFBDHN Cc1c(CN(C)[C@@H](CC(N)=O)c2ccccc2)cccc1[N+](=O)[O-] ZINC000280532893 273337939 /nfs/dbraw/zinc/33/79/39/273337939.db2.gz PASZVYQEQATCSL-KRWDZBQOSA-N 0 3 327.384 2.952 20 5 EFBDHN O=[N+]([O-])c1cnc(NCC23CCCN2CCC3)c(Br)c1 ZINC000280819705 273370324 /nfs/dbraw/zinc/37/03/24/273370324.db2.gz DRAMGOOVXYISRC-UHFFFAOYSA-N 0 3 341.209 2.793 20 5 EFBDHN CN(C)CC1(NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CCC1 ZINC000281294495 273420613 /nfs/dbraw/zinc/42/06/13/273420613.db2.gz JKRBCAUYFKXXLH-UHFFFAOYSA-N 0 3 326.784 2.854 20 5 EFBDHN CCO[C@@H]1CCCC[C@H]1N[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000452034948 273703234 /nfs/dbraw/zinc/70/32/34/273703234.db2.gz MPEBXGFFJXXIRK-DAXOMENPSA-N 0 3 335.404 2.859 20 5 EFBDHN CN(C)Cc1ccc(C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000283599433 273735313 /nfs/dbraw/zinc/73/53/13/273735313.db2.gz MJZLZUFQFJVNPI-UHFFFAOYSA-N 0 3 341.411 2.971 20 5 EFBDHN CN(C)CC(C)(C)NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000411096169 273794044 /nfs/dbraw/zinc/79/40/44/273794044.db2.gz IMNVSYLACHZDEP-UHFFFAOYSA-N 0 3 333.310 2.684 20 5 EFBDHN Cc1cccc(C[C@H](CO)N[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000285324106 273979698 /nfs/dbraw/zinc/97/96/98/273979698.db2.gz TZSGTMOSNJHMSH-XJKSGUPXSA-N 0 3 329.400 2.740 20 5 EFBDHN C[C@@H]1C[C@H](N2CCCC2)CN1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000285355128 273984631 /nfs/dbraw/zinc/98/46/31/273984631.db2.gz ABOPNSMAMFVKOB-OCCSQVGLSA-N 0 3 330.388 2.795 20 5 EFBDHN C[C@H](N[C@@H](CO)Cc1ccc(F)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000285358840 273985224 /nfs/dbraw/zinc/98/52/24/273985224.db2.gz VONVSMSEMMGKIW-XHDPSFHLSA-N 0 3 333.363 2.570 20 5 EFBDHN CN(CCCN(C)C[C@H](O)c1cccc([N+](=O)[O-])c1)Cc1ccco1 ZINC000285685529 274052649 /nfs/dbraw/zinc/05/26/49/274052649.db2.gz OEXDVMCGQFZSJP-SFHVURJKSA-N 0 3 347.415 2.675 20 5 EFBDHN COc1cc(C(=O)N2C[C@@H](N3CCCC3)C[C@H]2C)cc([N+](=O)[O-])c1C ZINC000285792298 274076091 /nfs/dbraw/zinc/07/60/91/274076091.db2.gz MISZPRPAYYJAGS-DOMZBBRYSA-N 0 3 347.415 2.611 20 5 EFBDHN COc1nccc(CN[C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])n1 ZINC000449373561 274170095 /nfs/dbraw/zinc/17/00/95/274170095.db2.gz RYORVFKZNFDYOU-XJKSGUPXSA-N 0 3 342.399 2.894 20 5 EFBDHN CCCN(CCN1CCCCC1)C(=O)c1cccc([N+](=O)[O-])c1N ZINC000286295819 274171856 /nfs/dbraw/zinc/17/18/56/274171856.db2.gz SDPSZCDRNKHXOV-UHFFFAOYSA-N 0 3 334.420 2.515 20 5 EFBDHN C[C@H](CN1CCCCC1)NC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000286519453 274217497 /nfs/dbraw/zinc/21/74/97/274217497.db2.gz BGNUWPWTERPCKX-OAHLLOKOSA-N 0 3 348.447 2.653 20 5 EFBDHN C[C@@H](CN1CCCCC1)NC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000286519449 274217616 /nfs/dbraw/zinc/21/76/16/274217616.db2.gz BGNUWPWTERPCKX-HNNXBMFYSA-N 0 3 348.447 2.653 20 5 EFBDHN C[C@@H]1CCC[C@H](C)CN1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000357735608 274295122 /nfs/dbraw/zinc/29/51/22/274295122.db2.gz YLXOMFAKZVJPOU-UONOGXRCSA-N 0 3 331.416 2.994 20 5 EFBDHN CS[C@H]1CN(c2ccc([N+](=O)[O-])cc2C(C)=O)C[C@H]1N1CCCC1 ZINC000286904906 274297378 /nfs/dbraw/zinc/29/73/78/274297378.db2.gz PGSZNLGYXMXQEO-SJORKVTESA-N 0 3 349.456 2.813 20 5 EFBDHN C[C@@H]1[C@@H](N2CCCC2)CCN1C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000287000921 274319351 /nfs/dbraw/zinc/31/93/51/274319351.db2.gz HJGFTYULMNGEPV-RISCZKNCSA-N 0 3 337.807 2.947 20 5 EFBDHN C[C@@H](NC(=O)Nc1ccncc1[N+](=O)[O-])[C@H](c1ccccc1)N(C)C ZINC000287019568 274323556 /nfs/dbraw/zinc/32/35/56/274323556.db2.gz IERZLYSKMPBSBO-MLGOLLRUSA-N 0 3 343.387 2.803 20 5 EFBDHN C[C@@H]1CN(C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)CCN(C2CC2)C1 ZINC000452171387 274330284 /nfs/dbraw/zinc/33/02/84/274330284.db2.gz KMYVDURTNCRBCN-LBPRGKRZSA-N 0 3 342.399 2.632 20 5 EFBDHN C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000288485877 274602729 /nfs/dbraw/zinc/60/27/29/274602729.db2.gz RFVLSGUNIYLELI-OCCSQVGLSA-N 0 3 342.399 2.775 20 5 EFBDHN CCO[C@@H]1C[C@@H](NCc2ccc(C(N)=O)cc2[N+](=O)[O-])C12CCCC2 ZINC000289290102 274735935 /nfs/dbraw/zinc/73/59/35/274735935.db2.gz HAXQTZQSECBZLH-HZPDHXFCSA-N 0 3 347.415 2.521 20 5 EFBDHN Cc1ccccc1[C@@H]([C@@H](C)NC(=O)c1ccc([N+](=O)[O-])n1C)N(C)C ZINC000357860811 274809579 /nfs/dbraw/zinc/80/95/79/274809579.db2.gz XATHFQGEWVKNPP-CXAGYDPISA-N 0 3 344.415 2.663 20 5 EFBDHN Cc1ncc(C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])c(=O)[n-]1 ZINC000346812365 274856790 /nfs/dbraw/zinc/85/67/90/274856790.db2.gz WMBSXFBFBVFNNB-XJKSGUPXSA-N 0 3 342.399 2.900 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nc(CNCCN3CCCC3)cs2)c1 ZINC000172112225 275039242 /nfs/dbraw/zinc/03/92/42/275039242.db2.gz FILMHZRCWOKWEJ-UHFFFAOYSA-N 0 3 332.429 2.904 20 5 EFBDHN CN1CCC[C@@]2(CCN(c3nc(-c4ccc([N+](=O)[O-])cc4)no3)C2)C1 ZINC000338740028 277072882 /nfs/dbraw/zinc/07/28/82/277072882.db2.gz ACAONQFCFRDEBI-QGZVFWFLSA-N 0 3 343.387 2.567 20 5 EFBDHN CN1CC[C@H]2[C@@H](CCCN2C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C1 ZINC000342954407 277181517 /nfs/dbraw/zinc/18/15/17/277181517.db2.gz BSKQZGCOKSBVTR-WFASDCNBSA-N 0 3 342.399 2.632 20 5 EFBDHN COC(=O)[C@@H]1CCN(c2cc(C)nc3ccc([N+](=O)[O-])cc32)[C@@H]1C ZINC000344981180 277355011 /nfs/dbraw/zinc/35/50/11/277355011.db2.gz HMMOTPZQXHEYLI-DGCLKSJQSA-N 0 3 329.356 2.839 20 5 EFBDHN COC[C@@H](N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000136652258 277570471 /nfs/dbraw/zinc/57/04/71/277570471.db2.gz OYVFUTHLFSJZRU-LKFCYVNXSA-N 0 3 341.795 2.590 20 5 EFBDHN CS[C@H]1CN(c2ccc3cc([N+](=O)[O-])ccc3n2)C[C@@H]1N(C)C ZINC000340733967 278168040 /nfs/dbraw/zinc/16/80/40/278168040.db2.gz BUGCZPRRWBVHBC-GJZGRUSLSA-N 0 3 332.429 2.625 20 5 EFBDHN C[C@@H](C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)N1[C@H](C)CC[C@@H]1C ZINC000153440190 278197250 /nfs/dbraw/zinc/19/72/50/278197250.db2.gz JNQUAFJHYAPHJC-MJBXVCDLSA-N 0 3 331.416 2.741 20 5 EFBDHN C[C@@H](CN(C)Cc1ccccc1)NC(=O)c1ccccc1[N+](=O)[O-] ZINC000182093613 278241740 /nfs/dbraw/zinc/24/17/40/278241740.db2.gz AHCRDQXRNUDXPA-AWEZNQCLSA-N 0 3 327.384 2.845 20 5 EFBDHN Cc1cc(N2CCO[C@H](CN(C)C)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000360047759 278713408 /nfs/dbraw/zinc/71/34/08/278713408.db2.gz NMDWHWYLZSSRIE-LLVKDONJSA-N 0 3 347.337 2.689 20 5 EFBDHN CCN(C)CCNC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000112926526 279032933 /nfs/dbraw/zinc/03/29/33/279032933.db2.gz XWKJRCXLRWCKTN-UHFFFAOYSA-N 0 3 348.447 2.513 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)n1 ZINC000268817243 281009986 /nfs/dbraw/zinc/00/99/86/281009986.db2.gz NZABXNQBYNBTNT-GASCZTMLSA-N 0 3 348.447 2.624 20 5 EFBDHN Cc1ccccc1[C@@H]([C@@H](C)NC(=O)c1cc([N+](=O)[O-])c[nH]1)N(C)C ZINC000354379660 281360712 /nfs/dbraw/zinc/36/07/12/281360712.db2.gz BVXLRQXJTYRZHN-MLGOLLRUSA-N 0 3 330.388 2.653 20 5 EFBDHN CC(C)(CNC(=O)NCc1cccc([N+](=O)[O-])c1)N1CCCCC1 ZINC000067725105 292698643 /nfs/dbraw/zinc/69/86/43/292698643.db2.gz MEGSLVDBKUYZIE-UHFFFAOYSA-N 0 3 334.420 2.659 20 5 EFBDHN COc1cc(CN[C@@H]2C[C@](C)(OC)C2(C)C)c([N+](=O)[O-])cc1OC ZINC000072926672 292721447 /nfs/dbraw/zinc/72/14/47/292721447.db2.gz XJPFOQMZXRQHFZ-WBVHZDCISA-N 0 3 338.404 2.905 20 5 EFBDHN COc1cc(CN[C@@H]2C[C@@](C)(OC)C2(C)C)c([N+](=O)[O-])cc1OC ZINC000072926670 292721479 /nfs/dbraw/zinc/72/14/79/292721479.db2.gz XJPFOQMZXRQHFZ-NVXWUHKLSA-N 0 3 338.404 2.905 20 5 EFBDHN CN(C)CCN(CCCc1ccccc1)c1ccc([N+](=O)[O-])cn1 ZINC000081012055 292810124 /nfs/dbraw/zinc/81/01/24/292810124.db2.gz OIYQRSUZJPTHRG-UHFFFAOYSA-N 0 3 328.416 2.991 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)N(CCN(C)C)C1CCCC1 ZINC000081551891 292817270 /nfs/dbraw/zinc/81/72/70/292817270.db2.gz LLUVAHFSSVBKRP-UHFFFAOYSA-N 0 3 335.404 2.550 20 5 EFBDHN CN(C)C[C@@H]1CCCCN1C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000129381020 293132303 /nfs/dbraw/zinc/13/23/03/293132303.db2.gz NDYJHEOUMAVMMF-HNNXBMFYSA-N 0 3 344.415 2.561 20 5 EFBDHN COc1cc(CN2CCC[C@]2(C)CCCO)c([N+](=O)[O-])cc1OC ZINC000290301542 294050934 /nfs/dbraw/zinc/05/09/34/294050934.db2.gz BJYKVXRETSKWHK-QGZVFWFLSA-N 0 3 338.404 2.739 20 5 EFBDHN C[C@H]1C[C@H](N2CCCC2)CN1C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000290339237 294061069 /nfs/dbraw/zinc/06/10/69/294061069.db2.gz FLAWIWXNFLSUGC-AAEUAGOBSA-N 0 3 337.807 2.947 20 5 EFBDHN C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000290339245 294061145 /nfs/dbraw/zinc/06/11/45/294061145.db2.gz FLAWIWXNFLSUGC-DGCLKSJQSA-N 0 3 337.807 2.947 20 5 EFBDHN C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000290339267 294061170 /nfs/dbraw/zinc/06/11/70/294061170.db2.gz FLAWIWXNFLSUGC-YPMHNXCESA-N 0 3 337.807 2.947 20 5 EFBDHN CN(C)C[C@@H](NC(=O)Cc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000290352242 294064379 /nfs/dbraw/zinc/06/43/79/294064379.db2.gz GBAKYCYNVIWKGG-QGZVFWFLSA-N 0 3 345.374 2.696 20 5 EFBDHN COc1cc(CN(C)CCCn2ccnc2C)c([N+](=O)[O-])cc1OC ZINC000290370469 294069459 /nfs/dbraw/zinc/06/94/59/294069459.db2.gz HKYSXUHUVDMFCD-UHFFFAOYSA-N 0 3 348.403 2.639 20 5 EFBDHN CN(C[C@@H](O)CSc1nc2ccc([N+](=O)[O-])cc2s1)C1CC1 ZINC000290742650 294172603 /nfs/dbraw/zinc/17/26/03/294172603.db2.gz HMVSZTTYSZSXMC-LLVKDONJSA-N 0 3 339.442 2.752 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN1CC2(CCC2)[C@H]1C1CC1 ZINC000290851336 294203056 /nfs/dbraw/zinc/20/30/56/294203056.db2.gz XJMBZEUBIYFJAT-WMLDXEAASA-N 0 3 332.400 2.599 20 5 EFBDHN C[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2N2CCOC2=O)CN1C1CC1 ZINC000290871181 294207936 /nfs/dbraw/zinc/20/79/36/294207936.db2.gz ZQTRZHYGDSYEQJ-VXGBXAGGSA-N 0 3 346.387 2.589 20 5 EFBDHN CC(C)(NC[C@@H](O)COc1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000292065810 294568160 /nfs/dbraw/zinc/56/81/60/294568160.db2.gz CZGDJSMDNAPAIX-CYBMUJFWSA-N 0 3 348.374 2.999 20 5 EFBDHN CN(C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CCN(C)CC1 ZINC000292732787 294770584 /nfs/dbraw/zinc/77/05/84/294770584.db2.gz QBPFSSOBLBMCPN-UHFFFAOYSA-N 0 3 345.321 2.780 20 5 EFBDHN CC[C@@H](NC[C@@H](O)COCC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000292813023 294793449 /nfs/dbraw/zinc/79/34/49/294793449.db2.gz CLOOUYQHZLMMGA-CHWSQXEVSA-N 0 3 336.310 2.575 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])CN1C1CC1 ZINC000293587944 295005727 /nfs/dbraw/zinc/00/57/27/295005727.db2.gz XEUQXUKILJJSKT-STQMWFEESA-N 0 3 346.431 2.754 20 5 EFBDHN C[C@@H]1CN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CCN(C2CCC2)C1 ZINC000293695933 295029637 /nfs/dbraw/zinc/02/96/37/295029637.db2.gz MUGJVSLOCWYOPV-FEAKQIBJSA-N 0 3 343.427 2.941 20 5 EFBDHN CN1CCC[C@]2(CCN(C(=O)c3c[nH]c4cc([N+](=O)[O-])ccc34)C2)C1 ZINC000293900116 295074951 /nfs/dbraw/zinc/07/49/51/295074951.db2.gz HBONWSSJJMXEIC-SFHVURJKSA-N 0 3 342.399 2.634 20 5 EFBDHN C[C@H](CNC(=O)OC(C)(C)C)N[C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000293975509 295091193 /nfs/dbraw/zinc/09/11/93/295091193.db2.gz AZYBUJSVVPJPHD-GHMZBOCLSA-N 0 3 338.408 2.741 20 5 EFBDHN CC(C)(CCC(=O)N[C@@H](CN1CCCC1)c1ccccc1)[N+](=O)[O-] ZINC000294491947 295175443 /nfs/dbraw/zinc/17/54/43/295175443.db2.gz PPKSOPCILFUROI-INIZCTEOSA-N 0 3 333.432 2.775 20 5 EFBDHN CCN1CCC[C@H]1CNC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000294502609 295177134 /nfs/dbraw/zinc/17/71/34/295177134.db2.gz SAYQMAKARCGHHT-NSHDSACASA-N 0 3 345.321 2.828 20 5 EFBDHN NC(=O)[C@@H]1CCCC[C@@H]1NCc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000294563298 295186412 /nfs/dbraw/zinc/18/64/12/295186412.db2.gz LQOSBMHRKWGICR-YPMHNXCESA-N 0 3 345.321 2.747 20 5 EFBDHN CC[S@](=O)[C@@H]1CCC[C@@H](N[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)C1 ZINC000294638206 295198512 /nfs/dbraw/zinc/19/85/12/295198512.db2.gz GEUSDRFPHVRNQR-XAFGUMMBSA-N 0 3 339.461 2.907 20 5 EFBDHN COc1cc(CNCCc2scnc2C)c([N+](=O)[O-])cc1OC ZINC000294692597 295209113 /nfs/dbraw/zinc/20/91/13/295209113.db2.gz ARQCYWZSIBJXKF-UHFFFAOYSA-N 0 3 337.401 2.709 20 5 EFBDHN CCn1cc([C@H](C)N[C@@H](C)CC(=O)Nc2cccc([N+](=O)[O-])c2)cn1 ZINC000294870367 295239142 /nfs/dbraw/zinc/23/91/42/295239142.db2.gz PEYWDIZMMQMMQV-STQMWFEESA-N 0 3 345.403 2.879 20 5 EFBDHN Cc1cc(N2CC[C@@H](OC(=O)N(C)C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000294882083 295240797 /nfs/dbraw/zinc/24/07/97/295240797.db2.gz FHJUUVNRSFRKKN-CYBMUJFWSA-N 0 3 344.371 2.728 20 5 EFBDHN Cc1nc(N[C@H](CN2CCCC2)c2ccccc2)ncc1[N+](=O)[O-] ZINC000295004975 295256805 /nfs/dbraw/zinc/25/68/05/295256805.db2.gz AJKSMPSJQASAQP-OAHLLOKOSA-N 0 3 327.388 2.942 20 5 EFBDHN COc1cc(C[NH2+]CCCc2ncccc2C)c([N+](=O)[O-])cc1[O-] ZINC000295110927 295269477 /nfs/dbraw/zinc/26/94/77/295269477.db2.gz WDGYEIDJFOBNSV-UHFFFAOYSA-N 0 3 331.372 2.735 20 5 EFBDHN O=C(c1ccc(Cl)c([N+](=O)[O-])c1)N1CC[C@@H](N2CCCCC2)C1 ZINC000295257692 295288751 /nfs/dbraw/zinc/28/87/51/295288751.db2.gz NJAQLLXTWGXEET-CYBMUJFWSA-N 0 3 337.807 2.949 20 5 EFBDHN CCc1ccc(C(=O)N2CCN(C3CC3)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000295290867 295294400 /nfs/dbraw/zinc/29/44/00/295294400.db2.gz IPWKPZZDKTVBPD-ZDUSSCGKSA-N 0 3 331.416 2.714 20 5 EFBDHN Cc1cc(Cl)c(C(=O)N2CC[C@]3(CCN(C)C3)C2)cc1[N+](=O)[O-] ZINC000295300477 295296154 /nfs/dbraw/zinc/29/61/54/295296154.db2.gz KDUVFJTYGMGDGN-INIZCTEOSA-N 0 3 337.807 2.724 20 5 EFBDHN CC(C)(CCC(=O)NC[C@@H]1CCCN1Cc1ccccc1)[N+](=O)[O-] ZINC000295330941 295301841 /nfs/dbraw/zinc/30/18/41/295301841.db2.gz UBSWHHZANCANGR-INIZCTEOSA-N 0 3 333.432 2.603 20 5 EFBDHN COCCN1CCC(Nc2nccc3cc([N+](=O)[O-])ccc32)CC1 ZINC000295415493 295316271 /nfs/dbraw/zinc/31/62/71/295316271.db2.gz DLGUVJNWSYRSED-UHFFFAOYSA-N 0 3 330.388 2.666 20 5 EFBDHN CC(C)C[C@@H](CN1CCCC1)NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000295535752 295337019 /nfs/dbraw/zinc/33/70/19/295337019.db2.gz RRURNOPBAIKRFP-INIZCTEOSA-N 0 3 333.432 2.764 20 5 EFBDHN CC(C)(C[C@@H]1CCCN(CCOc2ccccc2[N+](=O)[O-])C1)C(N)=O ZINC000295588461 295345350 /nfs/dbraw/zinc/34/53/50/295345350.db2.gz MJHPULPSQQRBHU-AWEZNQCLSA-N 0 3 349.431 2.587 20 5 EFBDHN C[C@H](c1ccc([N+](=O)[O-])cc1)N1C[C@H]2C[C@H](Cn3c(=O)cccc32)C1 ZINC000295737695 295368564 /nfs/dbraw/zinc/36/85/64/295368564.db2.gz WKVPIVHFBVGDSC-IJEWVQPXSA-N 0 3 339.395 2.937 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@@H]2[C@H]3CCO[C@H]3C23CCCC3)c([N+](=O)[O-])c1 ZINC000296146232 295431345 /nfs/dbraw/zinc/43/13/45/295431345.db2.gz XOWHAAAFCQAQQN-FVQBIDKESA-N 0 3 347.371 2.940 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](Cc2ccccc2)N(C)C)c1 ZINC000359114532 301850115 /nfs/dbraw/zinc/85/01/15/301850115.db2.gz IYAASNHRIRCKKL-INIZCTEOSA-N 0 3 341.411 2.806 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCN([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000346257709 302038012 /nfs/dbraw/zinc/03/80/12/302038012.db2.gz HBZMVHMCJIPUJO-DUVNUKRYSA-N 0 3 331.416 2.706 20 5 EFBDHN CN(C)CCOc1ccccc1-c1noc(CCC(C)(C)[N+](=O)[O-])n1 ZINC000297625870 310915622 /nfs/dbraw/zinc/91/56/22/310915622.db2.gz JBYYEDXHHMZAGP-UHFFFAOYSA-N 0 3 348.403 2.665 20 5 EFBDHN CCN1CCC[C@H]1CNC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000298643758 311010610 /nfs/dbraw/zinc/01/06/10/311010610.db2.gz MGTYIZIEZMHUEH-JSGCOSHPSA-N 0 3 337.445 2.676 20 5 EFBDHN C[C@H](NC(=O)NCCN1CCC(C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000299007327 311041393 /nfs/dbraw/zinc/04/13/93/311041393.db2.gz KUFRGEBVEJVFHV-AWEZNQCLSA-N 0 3 334.420 2.687 20 5 EFBDHN C[C@@H]1CN(C[C@H]2CCCN2Cc2ccccc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000299189278 311060392 /nfs/dbraw/zinc/06/03/92/311060392.db2.gz FJUMTTWTHWXPTR-BFYDXBDKSA-N 0 3 333.432 2.668 20 5 EFBDHN CC(C)N(Cc1ccco1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000299375124 311078259 /nfs/dbraw/zinc/07/82/59/311078259.db2.gz LUPPOMAZIJOVRV-OAHLLOKOSA-N 0 3 334.372 2.838 20 5 EFBDHN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCC[C@H]1CN1CCCC1 ZINC000299577654 311098595 /nfs/dbraw/zinc/09/85/95/311098595.db2.gz UUTVXVXUNOZZEG-ZDUSSCGKSA-N 0 3 337.807 2.949 20 5 EFBDHN O=c1[nH]cnc2cc(NCCN3CCCCCC3)c([N+](=O)[O-])cc21 ZINC000301107044 311119268 /nfs/dbraw/zinc/11/92/68/311119268.db2.gz UKIYKERQMYUEOZ-UHFFFAOYSA-N 0 3 331.376 2.532 20 5 EFBDHN CC(C)(C)CCN1CCN(c2nc3sccn3c2[N+](=O)[O-])CC1 ZINC000301114233 311120053 /nfs/dbraw/zinc/12/00/53/311120053.db2.gz YBHRWWXOGXBJNW-UHFFFAOYSA-N 0 3 337.449 2.862 20 5 EFBDHN CC[C@H]1CCCCN1CCNc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000301238252 311126336 /nfs/dbraw/zinc/12/63/36/311126336.db2.gz DZVCUCAQUDBAEV-LBPRGKRZSA-N 0 3 345.403 2.920 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1NC[C@H](O)CN1CCc2ccccc2C1 ZINC000301523740 311142393 /nfs/dbraw/zinc/14/23/93/311142393.db2.gz MJLGKQXPSDUFCP-KRWDZBQOSA-N 0 3 341.411 2.734 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1NC[C@@H]1C[C@@H](O)CN1Cc1ccccc1 ZINC000301892062 311165168 /nfs/dbraw/zinc/16/51/68/311165168.db2.gz VMKFXABGYINILE-DLBZAZTESA-N 0 3 341.411 2.951 20 5 EFBDHN CC(C)(O)CN1CCc2c(cccc2Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000302168515 311182011 /nfs/dbraw/zinc/18/20/11/311182011.db2.gz PKZAWKILDJZOIP-UHFFFAOYSA-N 0 3 342.399 2.862 20 5 EFBDHN CCc1nn(C)c(N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000302187034 311183047 /nfs/dbraw/zinc/18/30/47/311183047.db2.gz VTOJENHMZXZMCB-CZUORRHYSA-N 0 3 343.431 2.823 20 5 EFBDHN C[C@@H](CCN1CCN(C)CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000302297020 311188051 /nfs/dbraw/zinc/18/80/51/311188051.db2.gz XXTVCZQQNBGNLY-LBPRGKRZSA-N 0 3 326.828 2.686 20 5 EFBDHN C[C@H](CCN1CCN(C)CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000302297018 311188236 /nfs/dbraw/zinc/18/82/36/311188236.db2.gz XXTVCZQQNBGNLY-GFCCVEGCSA-N 0 3 326.828 2.686 20 5 EFBDHN CCN1CCN([C@H](C)CNc2c(C)cc([N+](=O)[O-])cc2Cl)CC1 ZINC000302632472 311194925 /nfs/dbraw/zinc/19/49/25/311194925.db2.gz CGSGMXGTCODLQC-CYBMUJFWSA-N 0 3 340.855 2.995 20 5 EFBDHN CCNc1ccc(C(=O)NC(C)(C)CN2CCCC2)cc1[N+](=O)[O-] ZINC000308676563 311228294 /nfs/dbraw/zinc/22/82/94/311228294.db2.gz GRUAJCWIPPURAJ-UHFFFAOYSA-N 0 3 334.420 2.631 20 5 EFBDHN CC(C)(CN1CCCC1)NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000308675162 311228330 /nfs/dbraw/zinc/22/83/30/311228330.db2.gz MTPCHTQOAMMSNJ-UHFFFAOYSA-N 0 3 325.796 2.852 20 5 EFBDHN O=[N+]([O-])c1cccc(CNC[C@@H](O)COc2ccc(Cl)cc2)c1 ZINC000320218281 311237539 /nfs/dbraw/zinc/23/75/39/311237539.db2.gz YVGMPLOLJRITSN-OAHLLOKOSA-N 0 3 336.775 2.778 20 5 EFBDHN CC(C)c1ccc(CN2CCN(C[C@H](C)O)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000330516295 311320242 /nfs/dbraw/zinc/32/02/42/311320242.db2.gz IFRSDUOOQGZECC-GJZGRUSLSA-N 0 3 335.448 2.605 20 5 EFBDHN CCN1C[C@@H](C)N(CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C[C@@H]1C ZINC000330578819 311322832 /nfs/dbraw/zinc/32/28/32/311322832.db2.gz PIRULCIGHMDPFV-LSDHHAIUSA-N 0 3 348.447 2.646 20 5 EFBDHN CCOc1ccc(C(=O)N(C)[C@H](C)C2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000330724435 311330927 /nfs/dbraw/zinc/33/09/27/311330927.db2.gz DFTHGBZQHYWATO-CYBMUJFWSA-N 0 3 349.431 2.796 20 5 EFBDHN CCN1CCC(N(C)C(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000330862945 311339626 /nfs/dbraw/zinc/33/96/26/311339626.db2.gz QQFNAEDKLCCCNT-GFCCVEGCSA-N 0 3 337.395 2.780 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCN(C)[C@H](C)C1 ZINC000330897759 311342227 /nfs/dbraw/zinc/34/22/27/311342227.db2.gz HVBTUVJEXSYZDS-AGIUHOORSA-N 0 3 337.445 2.674 20 5 EFBDHN COc1cc(CN2CCN(C)C[C@H]2C(C)C)c([N+](=O)[O-])cc1F ZINC000331236912 311362503 /nfs/dbraw/zinc/36/25/03/311362503.db2.gz HCULWEUDIGKOTE-HNNXBMFYSA-N 0 3 325.384 2.515 20 5 EFBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@@H](c2ccnc(N)n2)C1 ZINC000331623385 311398596 /nfs/dbraw/zinc/39/85/96/311398596.db2.gz YCQJIIGNWQXEIU-GXTWGEPZSA-N 0 3 327.388 2.738 20 5 EFBDHN CC[C@H]1C[C@@H](CN2CCN(c3ccccc3[N+](=O)[O-])CC2)CCO1 ZINC000332399336 311499066 /nfs/dbraw/zinc/49/90/66/311499066.db2.gz RNAXZFMCLOMHOW-HOTGVXAUSA-N 0 3 333.432 2.922 20 5 EFBDHN CC(C)c1nc2n(n1)C[C@@H](N[C@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000332644781 311530341 /nfs/dbraw/zinc/53/03/41/311530341.db2.gz MBJDVLLJUUKQBB-OLZOCXBDSA-N 0 3 329.404 2.975 20 5 EFBDHN Cc1c(Br)c(NCC2(N(C)C)CC2)ncc1[N+](=O)[O-] ZINC000397962009 311961924 /nfs/dbraw/zinc/96/19/24/311961924.db2.gz DVXGYWOAGUBAJJ-UHFFFAOYSA-N 0 3 329.198 2.567 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc2c(c1)CNCC2 ZINC000415885277 312179339 /nfs/dbraw/zinc/17/93/39/312179339.db2.gz RWFRGZZHOPUNHA-UHFFFAOYSA-N 0 3 340.383 2.904 20 5 EFBDHN CNC(=O)[C@@H]1CCC[C@H]1N[C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417309772 312206754 /nfs/dbraw/zinc/20/67/54/312206754.db2.gz KAPOYHLJOYUMAV-OIISXLGYSA-N 0 3 331.416 2.867 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](NC[C@H]1CN(C3CC3)CCO1)CCCC2 ZINC000417311207 312207274 /nfs/dbraw/zinc/20/72/74/312207274.db2.gz OAELQKGCHJFLKY-HKUYNNGSSA-N 0 3 345.443 2.815 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](NC[C@@H](O)C1CCOCC1)CCCC2 ZINC000417314194 312207713 /nfs/dbraw/zinc/20/77/13/312207713.db2.gz YHVYWWQIPRSNTB-ZWKOTPCHSA-N 0 3 334.416 2.739 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](N[C@@H]1CCN(CC(F)F)C1)CCC2 ZINC000417394622 312217550 /nfs/dbraw/zinc/21/75/50/312217550.db2.gz VNYWWLKTYLQYJD-DOMZBBRYSA-N 0 3 325.359 2.901 20 5 EFBDHN CCOc1ccc([C@@H](C)N[C@H]2CCN(CC(F)F)C2)cc1[N+](=O)[O-] ZINC000417397257 312218336 /nfs/dbraw/zinc/21/83/36/312218336.db2.gz XXJCPNNEKQNSDN-YPMHNXCESA-N 0 3 343.374 2.984 20 5 EFBDHN CC1(C)CCCN[C@@H]1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000423848932 312470667 /nfs/dbraw/zinc/47/06/67/312470667.db2.gz PTORWGSENFUOSZ-CYBMUJFWSA-N 0 3 325.796 2.643 20 5 EFBDHN CCOc1ccc([C@H](C)NCCc2cnc(C)cn2)cc1[N+](=O)[O-] ZINC000453396374 312897664 /nfs/dbraw/zinc/89/76/64/312897664.db2.gz IMDZEAYOYBIDPA-ZDUSSCGKSA-N 0 3 330.388 2.985 20 5 EFBDHN C[C@H](CC1CCOCC1)CN1CCN(c2ncccc2[N+](=O)[O-])CC1 ZINC000453578095 312911618 /nfs/dbraw/zinc/91/16/18/312911618.db2.gz PXTLRYYCKMTCQC-OAHLLOKOSA-N 0 3 348.447 2.565 20 5 EFBDHN Cc1cnc(CCNCc2cc([N+](=O)[O-])ccc2OC(F)F)cn1 ZINC000453601045 312915959 /nfs/dbraw/zinc/91/59/59/312915959.db2.gz SYSFLYHNJBVWDK-UHFFFAOYSA-N 0 3 338.314 2.627 20 5 EFBDHN CNc1nc(C(=O)Nc2ccc(C)cc2CN(C)C)ccc1[N+](=O)[O-] ZINC000455661504 312963539 /nfs/dbraw/zinc/96/35/39/312963539.db2.gz DNWICTCTTNUUMT-UHFFFAOYSA-N 0 3 343.387 2.654 20 5 EFBDHN CC[C@@H]1C[C@H](C)CN1Cc1ccc(OCC(=O)OC)c([N+](=O)[O-])c1 ZINC000475703711 313225227 /nfs/dbraw/zinc/22/52/27/313225227.db2.gz YAOGKIZRDZEOEM-GXTWGEPZSA-N 0 3 336.388 2.767 20 5 EFBDHN CCN1CCC[C@@H]1CN(C)c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000486967785 313353883 /nfs/dbraw/zinc/35/38/83/313353883.db2.gz NNAJKEXWXSRIGL-CQSZACIVSA-N 0 3 331.376 2.565 20 5 EFBDHN CCOc1cc(N2CCC(OCCN(C)C)CC2)ccc1[N+](=O)[O-] ZINC000486975514 313354097 /nfs/dbraw/zinc/35/40/97/313354097.db2.gz ZPFXKBJHQOFTRS-UHFFFAOYSA-N 0 3 337.420 2.541 20 5 EFBDHN CCOC(=O)N1CC[C@H](NC/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000492511591 314019704 /nfs/dbraw/zinc/01/97/04/314019704.db2.gz QQGZVUBKOOXHFI-CTXBLAANSA-N 0 3 333.388 2.819 20 5 EFBDHN C[C@H]1C[C@H]1N1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000492898932 314169390 /nfs/dbraw/zinc/16/93/90/314169390.db2.gz UXYUWWSOLULGQT-JMSSTFSISA-N 0 3 343.427 2.797 20 5 EFBDHN C[C@@H]1C[C@H]1N1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000492898931 314169602 /nfs/dbraw/zinc/16/96/02/314169602.db2.gz UXYUWWSOLULGQT-GIIMBGIHSA-N 0 3 343.427 2.797 20 5 EFBDHN CN1CCC[C@]2(CCN(C(=O)/C=C\c3ccccc3[N+](=O)[O-])C2)C1 ZINC000493026533 314215892 /nfs/dbraw/zinc/21/58/92/314215892.db2.gz QTQCZRMTUQDEAS-ZEVQVBBLSA-N 0 3 329.400 2.552 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)N(C)CCN2CCCC2)cc1[N+](=O)[O-] ZINC000493248766 314290939 /nfs/dbraw/zinc/29/09/39/314290939.db2.gz ASNDNHBKFYEVQU-CQSZACIVSA-N 0 3 334.420 2.701 20 5 EFBDHN COC(=O)N1CCC[C@@H]([C@H](C)NCc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000495480929 314729148 /nfs/dbraw/zinc/72/91/48/314729148.db2.gz ODOIYLNIHCAUIS-NWDGAFQWSA-N 0 3 339.367 2.690 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@H](CN2CCOC2=O)C1 ZINC000496362965 315040480 /nfs/dbraw/zinc/04/04/80/315040480.db2.gz NXLALTBIAFSEEJ-KBPBESRZSA-N 0 3 333.388 2.738 20 5 EFBDHN CC(COC(=O)c1ccc(N(C)C(=O)OC(C)(C)C)s1)[N+](=O)[O-] ZINC000496454265 315071841 /nfs/dbraw/zinc/07/18/41/315071841.db2.gz MCXTVKSAYGURDI-SECBINFHSA-N 0 3 344.389 2.941 20 5 EFBDHN CCN(CC)[C@H](CNC(=O)c1cc([N+](=O)[O-])cn1C)c1ccccc1 ZINC000515176979 315597660 /nfs/dbraw/zinc/59/76/60/315597660.db2.gz BAJQHXUNIJHLTC-QGZVFWFLSA-N 0 3 344.415 2.746 20 5 EFBDHN C[C@H](NC(C)(C)CNC(=O)c1cc([N+](=O)[O-])cn1C)c1ccccc1 ZINC000521339181 316015795 /nfs/dbraw/zinc/01/57/95/316015795.db2.gz PNOYFOJGYBQGBP-ZDUSSCGKSA-N 0 3 344.415 2.793 20 5 EFBDHN C[C@@H]1CCN(CCNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000524719391 316168252 /nfs/dbraw/zinc/16/82/52/316168252.db2.gz KJTREENSOFQXPB-SNVBAGLBSA-N 0 3 345.321 2.685 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCN1CC[C@@H](C)C1 ZINC000525292097 316206268 /nfs/dbraw/zinc/20/62/68/316206268.db2.gz IBEGCEQFURBUAM-CHWSQXEVSA-N 0 3 337.445 2.533 20 5 EFBDHN C[C@@H]1CCN(CCNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 ZINC000525291599 316206309 /nfs/dbraw/zinc/20/63/09/316206309.db2.gz MLFLDXBIWMKMQH-LLVKDONJSA-N 0 3 333.413 2.881 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCN1CC[C@@H](C)C1 ZINC000525292098 316206346 /nfs/dbraw/zinc/20/63/46/316206346.db2.gz IBEGCEQFURBUAM-OLZOCXBDSA-N 0 3 337.445 2.533 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCN1CC[C@H](C)C1 ZINC000525292100 316206386 /nfs/dbraw/zinc/20/63/86/316206386.db2.gz IBEGCEQFURBUAM-STQMWFEESA-N 0 3 337.445 2.533 20 5 EFBDHN CN(CCN1CCCC1)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000525354923 316211778 /nfs/dbraw/zinc/21/17/78/316211778.db2.gz HHANUCKUWRLVML-UHFFFAOYSA-N 0 3 348.447 2.655 20 5 EFBDHN CNc1ccc(C(=O)Nc2ccccc2CCN(C)C)cc1[N+](=O)[O-] ZINC000525878081 316251331 /nfs/dbraw/zinc/25/13/31/316251331.db2.gz JPWSKAOOCYJQOD-UHFFFAOYSA-N 0 3 342.399 2.993 20 5 EFBDHN CC(C)(C)N1CCCN(C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 ZINC000530793277 317179906 /nfs/dbraw/zinc/17/99/06/317179906.db2.gz SNXKZCYPHJKFRF-UHFFFAOYSA-N 0 3 333.432 2.860 20 5 EFBDHN COC(=O)CCC1CCN(CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000531479050 317273092 /nfs/dbraw/zinc/27/30/92/317273092.db2.gz HXOPHJPJNQJGNS-UHFFFAOYSA-N 0 3 336.388 2.639 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H](O)COc1ccccc1 ZINC000532198687 317369151 /nfs/dbraw/zinc/36/91/51/317369151.db2.gz MQKBLYAPAAZHRO-ZBFHGGJFSA-N 0 3 330.384 2.994 20 5 EFBDHN Cc1c([C@H](C)NC[C@@H](O)COc2ccccc2)cccc1[N+](=O)[O-] ZINC000532453086 317403116 /nfs/dbraw/zinc/40/31/16/317403116.db2.gz URAMVSZFTFFMCN-LSDHHAIUSA-N 0 3 330.384 2.994 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@@H](CO)Cc1ccco1 ZINC000532675234 317429266 /nfs/dbraw/zinc/42/92/66/317429266.db2.gz BKEZIBZRQATHDU-ZDUSSCGKSA-N 0 3 334.372 2.527 20 5 EFBDHN C[C@@H](CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)N1CCCC1 ZINC000545163828 317907021 /nfs/dbraw/zinc/90/70/21/317907021.db2.gz WHROGHJBCVSICK-LBPRGKRZSA-N 0 3 337.395 2.612 20 5 EFBDHN C[C@@H](CS(=O)(=O)c1ccccc1)NCCc1ccccc1[N+](=O)[O-] ZINC000548067206 318069592 /nfs/dbraw/zinc/06/95/92/318069592.db2.gz AHZDYLYYYLYGOY-AWEZNQCLSA-N 0 3 348.424 2.589 20 5 EFBDHN C[C@@H](C(=O)NC[C@@H]1N(C)CCCC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000548403921 318104165 /nfs/dbraw/zinc/10/41/65/318104165.db2.gz WVOQZKARFOQJDK-CJNGLKHVSA-N 0 3 333.432 2.935 20 5 EFBDHN CCOc1cccc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000555574078 318362352 /nfs/dbraw/zinc/36/23/52/318362352.db2.gz GUDBGDRVEBKYQL-MRXNPFEDSA-N 0 3 346.383 2.523 20 5 EFBDHN CC(C)(NC(=O)C[C@@H](N)Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000563700019 318810431 /nfs/dbraw/zinc/81/04/31/318810431.db2.gz HNCDKTMAFBVQDJ-INIZCTEOSA-N 0 3 341.411 2.906 20 5 EFBDHN O=C(CCNc1ccccc1[N+](=O)[O-])Nc1cccc2c1CCNC2 ZINC000563701466 318810533 /nfs/dbraw/zinc/81/05/33/318810533.db2.gz PCLKYGDFWFXETE-UHFFFAOYSA-N 0 3 340.383 2.681 20 5 EFBDHN CC(C)(NC(=O)[C@@H]1CNCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000563887704 318826146 /nfs/dbraw/zinc/82/61/46/318826146.db2.gz LYFDEWRZSLXOGD-QGZVFWFLSA-N 0 3 339.395 2.833 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@@H]2C[C@H]2c2ccccc2F)c1 ZINC000564652252 318878203 /nfs/dbraw/zinc/87/82/03/318878203.db2.gz WFPQEHQZVWOHNC-RPVQJOFSSA-N 0 3 346.358 2.619 20 5 EFBDHN COc1ccc(CC(=O)Nc2ccccc2CN(C)C)cc1[N+](=O)[O-] ZINC000565882697 319011561 /nfs/dbraw/zinc/01/15/61/319011561.db2.gz DPAIJXXPRFEDNY-UHFFFAOYSA-N 0 3 343.383 2.846 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2N[C@H]1CCN(c2ncccc2F)C1 ZINC000572422614 319668573 /nfs/dbraw/zinc/66/85/73/319668573.db2.gz DIGJCANCWDADDD-BLLLJJGKSA-N 0 3 342.374 2.985 20 5 EFBDHN Cc1c(CN(CCN(C)C)Cc2ccccn2)cccc1[N+](=O)[O-] ZINC000574924853 319908743 /nfs/dbraw/zinc/90/87/43/319908743.db2.gz ISUMPTFLKJRQEQ-UHFFFAOYSA-N 0 3 328.416 2.862 20 5 EFBDHN Cn1nccc1N1CCC[C@H](N[C@@H]2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000578247257 320189061 /nfs/dbraw/zinc/18/90/61/320189061.db2.gz PNAPVVIIEQSYJA-XJKSGUPXSA-N 0 3 341.415 2.574 20 5 EFBDHN C[C@@H](C(=O)N1CCCC12CCN(C)CC2)c1cccc([N+](=O)[O-])c1 ZINC000578271135 320190001 /nfs/dbraw/zinc/19/00/01/320190001.db2.gz GHHSBFHRQZMYFS-CQSZACIVSA-N 0 3 331.416 2.785 20 5 EFBDHN CCN(CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)C1CCCCC1 ZINC000027285784 323212451 /nfs/dbraw/zinc/21/24/51/323212451.db2.gz YDGNWLGIGPSTOM-UHFFFAOYSA-N 0 3 349.387 2.917 20 5 EFBDHN CC[C@@H](NC[C@@H](O)COc1ccccc1[N+](=O)[O-])c1c(C)noc1C ZINC000182519281 323286968 /nfs/dbraw/zinc/28/69/68/323286968.db2.gz ZLNYUYOJLIITOT-ZIAGYGMSSA-N 0 3 349.387 2.680 20 5 EFBDHN C[C@H](NCC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)C1CCCCC1 ZINC000182683113 323295813 /nfs/dbraw/zinc/29/58/13/323295813.db2.gz MBISNTDKHFYTKW-NSHDSACASA-N 0 3 349.387 2.820 20 5 EFBDHN CCNC(=O)C(C)(C)CN[C@H](C)c1ccc(OCC)c([N+](=O)[O-])c1 ZINC000183211525 323322521 /nfs/dbraw/zinc/32/25/21/323322521.db2.gz PJTOECPMHUSLMZ-GFCCVEGCSA-N 0 3 337.420 2.806 20 5 EFBDHN C[C@H](C(=O)N(C)[C@H]1CCN(C)C[C@H]1C)c1ccc([N+](=O)[O-])cc1F ZINC000184192155 323359149 /nfs/dbraw/zinc/35/91/49/323359149.db2.gz DGUUDFIJOFYVJY-WQGACYEGSA-N 0 3 337.395 2.636 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CCCN(C)C1 ZINC000184769218 323373754 /nfs/dbraw/zinc/37/37/54/323373754.db2.gz BHZLTJVNSCYQMA-CVEARBPZSA-N 0 3 333.432 2.622 20 5 EFBDHN C[C@@H](C(=O)N[C@@H](C)CN1CCCCC1)c1ccc([N+](=O)[O-])cc1F ZINC000184923727 323378162 /nfs/dbraw/zinc/37/81/62/323378162.db2.gz ZLSGLFHMKIBZJB-QWHCGFSZSA-N 0 3 337.395 2.828 20 5 EFBDHN CN(C)C(=O)C1(CN[C@@H]2CCc3c2cccc3[N+](=O)[O-])CCCC1 ZINC000580328299 324143186 /nfs/dbraw/zinc/14/31/86/324143186.db2.gz QUDUBVXKADZNMJ-OAHLLOKOSA-N 0 3 331.416 2.820 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2ccc(Cl)s2)c1 ZINC000580667396 324209327 /nfs/dbraw/zinc/20/93/27/324209327.db2.gz QKOLLCIRYYMGDB-LLVKDONJSA-N 0 3 342.804 2.839 20 5 EFBDHN C[C@@H](C(=O)N(CCN(C)C)Cc1ccco1)c1cccc([N+](=O)[O-])c1 ZINC000581463129 324382167 /nfs/dbraw/zinc/38/21/67/324382167.db2.gz SGKGJMHKPKFQPV-CQSZACIVSA-N 0 3 345.399 2.882 20 5 EFBDHN CC[C@H](CC(F)(F)F)NC[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000583259181 324773952 /nfs/dbraw/zinc/77/39/52/324773952.db2.gz XEYZRDQIZKAPBF-PWSUYJOCSA-N 0 3 336.310 2.655 20 5 EFBDHN C[C@H](C(=O)N1CCC[C@@H]1CN1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000583787025 324869569 /nfs/dbraw/zinc/86/95/69/324869569.db2.gz SVKOSNPRKZCXBE-WMLDXEAASA-N 0 3 331.416 2.785 20 5 EFBDHN O=C(NCc1cccc([N+](=O)[O-])c1)N1CCN(C2CCCCC2)CC1 ZINC000137876916 473213316 /nfs/dbraw/zinc/21/33/16/473213316.db2.gz ZJYSDBXSYDEMPN-UHFFFAOYSA-N 0 3 346.431 2.755 20 5 EFBDHN CNC(=O)[C@H](C)CN(C)Cc1cc(=O)oc2ccc3ccccc3c12 ZINC000081529555 473216312 /nfs/dbraw/zinc/21/63/12/473216312.db2.gz JDDDNENHMHVRPR-CYBMUJFWSA-N 0 3 338.407 2.760 20 5 EFBDHN Cc1c(CN(C)CC(C)(C)CN2CCOCC2)cccc1[N+](=O)[O-] ZINC000124185455 473218128 /nfs/dbraw/zinc/21/81/28/473218128.db2.gz MLFUJCOQTVCDFV-UHFFFAOYSA-N 0 3 335.448 2.693 20 5 EFBDHN CN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000161308853 473226005 /nfs/dbraw/zinc/22/60/05/473226005.db2.gz ZDFBOMJVVWJGMR-OCCSQVGLSA-N 0 3 337.807 2.805 20 5 EFBDHN CN1CCN(CCOc2ccccc2[N+](=O)[O-])C2(CCCCC2)C1 ZINC000081597332 473228656 /nfs/dbraw/zinc/22/86/56/473228656.db2.gz MZTGASOYQLDASZ-UHFFFAOYSA-N 0 3 333.432 2.924 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN(C)CCc1ccccn1 ZINC000124330174 473234173 /nfs/dbraw/zinc/23/41/73/473234173.db2.gz DZISFIGDKIJBMQ-UHFFFAOYSA-N 0 3 342.399 2.801 20 5 EFBDHN CC(C)N1C[C@@H](C)[C@@H](NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000161398855 473232947 /nfs/dbraw/zinc/23/29/47/473232947.db2.gz AVCSVBALQNRZQN-BZNIZROVSA-N 0 3 330.388 2.535 20 5 EFBDHN CCS[C@H]1CCCCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000112088741 473242217 /nfs/dbraw/zinc/24/22/17/473242217.db2.gz QNQHNIQQYZYRLP-AWEZNQCLSA-N 0 3 337.445 2.801 20 5 EFBDHN Cc1cc(NC[C@]2(CCO)CCOC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000096008521 473254259 /nfs/dbraw/zinc/25/42/59/473254259.db2.gz LFDDWKCVMDRFGM-KRWDZBQOSA-N 0 3 331.372 2.652 20 5 EFBDHN CCCCN(C)CCNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000112309831 473255657 /nfs/dbraw/zinc/25/56/57/473255657.db2.gz LURSOBKUKBFUGS-UHFFFAOYSA-N 0 3 348.447 2.657 20 5 EFBDHN C[C@@H]1CCC[N@H+](CC[N-]c2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000486952186 468015179 /nfs/dbraw/zinc/01/51/79/468015179.db2.gz AEGCLMAAJRVVOV-GFCCVEGCSA-N 0 3 331.376 2.789 20 5 EFBDHN C[C@@H]1CCC[N@@H+](CC[N-]c2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000486952186 468015182 /nfs/dbraw/zinc/01/51/82/468015182.db2.gz AEGCLMAAJRVVOV-GFCCVEGCSA-N 0 3 331.376 2.789 20 5 EFBDHN CCN(CCn1cc([N+](=O)[O-])ccc1=O)Cc1c[nH]c2ccccc12 ZINC000190466078 473284420 /nfs/dbraw/zinc/28/44/20/473284420.db2.gz BTDXGARGLGTOGP-UHFFFAOYSA-N 0 3 340.383 2.760 20 5 EFBDHN Cc1ccc([C@@H](CNC(=O)Nc2ccncc2[N+](=O)[O-])N(C)C)cc1 ZINC000124696900 473288999 /nfs/dbraw/zinc/28/89/99/473288999.db2.gz KNRKQIGCIRMSNZ-OAHLLOKOSA-N 0 3 343.387 2.723 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCN(CCO)CCc1ccccc1 ZINC000112698340 473296772 /nfs/dbraw/zinc/29/67/72/473296772.db2.gz XRABTWLABNIYGZ-UHFFFAOYSA-N 0 3 330.384 2.511 20 5 EFBDHN C[C@H](CN1CCC[C@H](C)C1)NC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000171167794 473308202 /nfs/dbraw/zinc/30/82/02/473308202.db2.gz KCMDUTJXTQGNBZ-LSDHHAIUSA-N 0 3 348.447 2.557 20 5 EFBDHN Cc1cc(C(=O)NCCN(C)Cc2ccccc2)cc([N+](=O)[O-])c1 ZINC000148328259 473316593 /nfs/dbraw/zinc/31/65/93/473316593.db2.gz OCDGCJMUCHOYKN-UHFFFAOYSA-N 0 3 327.384 2.765 20 5 EFBDHN CN(CCNC(=O)Cc1ccc([N+](=O)[O-])cc1F)Cc1ccccc1 ZINC000150777229 473353596 /nfs/dbraw/zinc/35/35/96/473353596.db2.gz GWWYUQGCNCCFRH-UHFFFAOYSA-N 0 3 345.374 2.525 20 5 EFBDHN CCN(C)C(=O)CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000185182436 473354091 /nfs/dbraw/zinc/35/40/91/473354091.db2.gz WGQMGOOASSFOJK-UHFFFAOYSA-N 0 3 333.413 2.891 20 5 EFBDHN O=C1CC[C@@H]2CN(Cc3ccc([N+](=O)[O-])cc3)CC[C@H]2N1C1CC1 ZINC000125257225 473383749 /nfs/dbraw/zinc/38/37/49/473383749.db2.gz PORRKLROZJUCOY-RHSMWYFYSA-N 0 3 329.400 2.570 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@@H]1CCCC12CCOCC2 ZINC000619723157 479866669 /nfs/dbraw/zinc/86/66/69/479866669.db2.gz OJNFYEQCZAPLHV-MRXNPFEDSA-N 0 3 347.415 2.781 20 5 EFBDHN CC(C)c1ccc([C@H](N)CNC(=O)c2c(N)cccc2[N+](=O)[O-])cc1 ZINC000422798784 476781300 /nfs/dbraw/zinc/78/13/00/476781300.db2.gz SUWOGODLCHNESW-OAHLLOKOSA-N 0 3 342.399 2.730 20 5 EFBDHN O=C(CN[C@@H]1CCC12CCCC2)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000451465120 478031447 /nfs/dbraw/zinc/03/14/47/478031447.db2.gz ZSTZWQRJAAXQAL-MRXNPFEDSA-N 0 3 329.400 2.796 20 5 EFBDHN O=C(NCc1ccccc1)[C@H]1CCN(Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000592155896 478802409 /nfs/dbraw/zinc/80/24/09/478802409.db2.gz TXFKVENEENQCDR-KRWDZBQOSA-N 0 3 339.395 2.733 20 5 EFBDHN CC(C)[C@H](CNCc1nc2cc([N+](=O)[O-])ccc2o1)c1ccnn1C ZINC000602630928 479436060 /nfs/dbraw/zinc/43/60/60/479436060.db2.gz PMKFWMXHWHHQNE-ZDUSSCGKSA-N 0 3 343.387 2.999 20 5 EFBDHN Cc1cc(N2C[C@H](C)S(=O)[C@@H](C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000616394514 479897915 /nfs/dbraw/zinc/89/79/15/479897915.db2.gz AADZKPSGDCIGJB-RYUDHWBXSA-N 0 3 333.413 2.797 20 5 EFBDHN Cc1ccc(C(=O)N2CCCN(CC3CCC3)CC2)cc1[N+](=O)[O-] ZINC000619868396 479898320 /nfs/dbraw/zinc/89/83/20/479898320.db2.gz OJQLQWUUVCBBGW-UHFFFAOYSA-N 0 3 331.416 2.851 20 5 EFBDHN Cc1ccc([C@@H](CNC(=O)c2ccc([N+](=O)[O-])s2)N(C)C)cc1 ZINC000067269054 472012710 /nfs/dbraw/zinc/01/27/10/472012710.db2.gz DQAREKLUQOSQRO-CYBMUJFWSA-N 0 3 333.413 2.997 20 5 EFBDHN CN(CCNC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000053751167 472033979 /nfs/dbraw/zinc/03/39/79/472033979.db2.gz LWJHEDVNMMTUFM-UHFFFAOYSA-N 0 3 328.372 2.848 20 5 EFBDHN O=[N+]([O-])c1cc(Br)cnc1NC[C@@H]1CCN(C2CC2)C1 ZINC000040713404 472040235 /nfs/dbraw/zinc/04/02/35/472040235.db2.gz FYOBZAWLFMRSPG-VIFPVBQESA-N 0 3 341.209 2.649 20 5 EFBDHN CN(C)[C@@H](CNc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cccc(F)c1 ZINC000024107857 472047857 /nfs/dbraw/zinc/04/78/57/472047857.db2.gz YUWOQONSOZHESG-INIZCTEOSA-N 0 3 346.362 2.548 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(CN(C)C)cc1 ZINC000067571047 472051100 /nfs/dbraw/zinc/05/11/00/472051100.db2.gz FGNPCJOGLGCYLH-UHFFFAOYSA-N 0 3 327.384 2.895 20 5 EFBDHN COc1ccc(CC(=O)Nc2cccc(CN(C)C)c2)cc1[N+](=O)[O-] ZINC000067811184 472092270 /nfs/dbraw/zinc/09/22/70/472092270.db2.gz OXZQMGYEDFKFDZ-UHFFFAOYSA-N 0 3 343.383 2.846 20 5 EFBDHN C[C@@H](CNC(=O)NCCc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](C)C1 ZINC000054647074 472104460 /nfs/dbraw/zinc/10/44/60/472104460.db2.gz XGGVQKWGJFDJTA-CABCVRRESA-N 0 3 348.447 2.557 20 5 EFBDHN C[C@@H]1CCC[C@H](N(C)CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000026473483 472138465 /nfs/dbraw/zinc/13/84/65/472138465.db2.gz HGAOXZYRGDGITK-NEPJUHHUSA-N 0 3 349.387 2.773 20 5 EFBDHN COc1ccc(C(=O)N2CCC[C@@H]2CN2CCCCC2)cc1[N+](=O)[O-] ZINC000068134755 472140381 /nfs/dbraw/zinc/14/03/81/472140381.db2.gz YIVNCHSTHMFSFK-OAHLLOKOSA-N 0 3 347.415 2.694 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC1CCN(C2CC2)CC1 ZINC000026711791 472145148 /nfs/dbraw/zinc/14/51/48/472145148.db2.gz WMARJBBVXZRIAH-LBPRGKRZSA-N 0 3 349.456 2.818 20 5 EFBDHN Cn1cnc([N+](=O)[O-])c1NCC(C)(C)N1CCc2ccccc2C1 ZINC000026725686 472146128 /nfs/dbraw/zinc/14/61/28/472146128.db2.gz IVQJQPLNRGSMSN-UHFFFAOYSA-N 0 3 329.404 2.577 20 5 EFBDHN CN(C)CCN(Cc1cccs1)C(=O)c1cccc([N+](=O)[O-])c1 ZINC000084250474 472160220 /nfs/dbraw/zinc/16/02/20/472160220.db2.gz MNTSVENBQNXXCD-UHFFFAOYSA-N 0 3 333.413 2.860 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@@H](N(C)C)C1 ZINC000068341923 472172235 /nfs/dbraw/zinc/17/22/35/472172235.db2.gz RQRKAUGGWYPPPG-GXTWGEPZSA-N 0 3 337.445 2.628 20 5 EFBDHN Cc1ccc([C@H]2CCCCN2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000075767214 472194440 /nfs/dbraw/zinc/19/44/40/472194440.db2.gz YILLCPAKJSJRLD-ZWKOTPCHSA-N 0 3 344.415 2.688 20 5 EFBDHN C[C@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)c1csc([N+](=O)[O-])c1 ZINC000055749941 472234818 /nfs/dbraw/zinc/23/48/18/472234818.db2.gz YQTWPASNQVPKAI-IJLUTSLNSA-N 0 3 325.434 2.753 20 5 EFBDHN CCN1CCC(n2nccc2NC(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000068742967 472234855 /nfs/dbraw/zinc/23/48/55/472234855.db2.gz NOIWPWFGEKEMST-UHFFFAOYSA-N 0 3 349.416 2.762 20 5 EFBDHN C[C@H](NC(=O)N(C)[C@H]1CCN(C)C[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000085393186 472241737 /nfs/dbraw/zinc/24/17/37/472241737.db2.gz FHDXWLSXEDIWIJ-WWGRRREGSA-N 0 3 334.420 2.637 20 5 EFBDHN C[C@H](NC(=O)N(C)[C@H]1CCN(C)C[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000085393190 472242259 /nfs/dbraw/zinc/24/22/59/472242259.db2.gz FHDXWLSXEDIWIJ-XEZPLFJOSA-N 0 3 334.420 2.637 20 5 EFBDHN Cc1ccc([C@H]2CCCCCN2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)o1 ZINC000076089516 472267356 /nfs/dbraw/zinc/26/73/56/472267356.db2.gz BFHCEGFFCRHDEJ-JKSUJKDBSA-N 0 3 348.403 2.671 20 5 EFBDHN CCCNC(=O)C1(NCCOc2ccccc2[N+](=O)[O-])CCCCC1 ZINC000085864303 472270408 /nfs/dbraw/zinc/27/04/08/472270408.db2.gz LGIWQFBBGXHBIE-UHFFFAOYSA-N 0 3 349.431 2.792 20 5 EFBDHN CC(C)(C)CCN1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000056042898 472275186 /nfs/dbraw/zinc/27/51/86/472275186.db2.gz NJYMGERKUOEITA-UHFFFAOYSA-N 0 3 333.432 2.718 20 5 EFBDHN CN(C)Cc1ccccc1CNC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000087005165 472296838 /nfs/dbraw/zinc/29/68/38/472296838.db2.gz LKKGFJYULORAIP-UHFFFAOYSA-N 0 3 341.411 2.905 20 5 EFBDHN O=C(CCc1cccc([N+](=O)[O-])c1)N1CC[C@H](N2CCCCC2)C1 ZINC000087323941 472326209 /nfs/dbraw/zinc/32/62/09/472326209.db2.gz PTFPOKDREQRIJF-KRWDZBQOSA-N 0 3 331.416 2.614 20 5 EFBDHN C[C@@H](C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)N1CCCCCC1 ZINC000088252081 472352151 /nfs/dbraw/zinc/35/21/51/472352151.db2.gz XHKUTIMXTIEERY-AWEZNQCLSA-N 0 3 331.416 2.744 20 5 EFBDHN CN(C)Cc1ccc(CNC(=O)NCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000057005711 472372489 /nfs/dbraw/zinc/37/24/89/472372489.db2.gz NDPNXHIAEOXAJD-UHFFFAOYSA-N 0 3 342.399 2.656 20 5 EFBDHN C[C@@H](CNC(=O)NCc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](C)C1 ZINC000057004842 472372603 /nfs/dbraw/zinc/37/26/03/472372603.db2.gz PGYBJYMDINXRQB-KGLIPLIRSA-N 0 3 334.420 2.514 20 5 EFBDHN CCN(CC)[C@H](CNc1ncc([N+](=O)[O-])c(N)n1)c1ccsc1 ZINC000076715798 472389626 /nfs/dbraw/zinc/38/96/26/472389626.db2.gz NHZHXZRIFQEPTK-LLVKDONJSA-N 0 3 336.421 2.524 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCCCN1CC(C)C ZINC000154186828 472400057 /nfs/dbraw/zinc/40/00/57/472400057.db2.gz NTHINUZLJYDZLM-HNNXBMFYSA-N 0 3 349.431 2.844 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCCCN2CC(C)C)c1 ZINC000154223910 472404268 /nfs/dbraw/zinc/40/42/68/472404268.db2.gz FXNNGTYBWDGICH-AWEZNQCLSA-N 0 3 349.431 2.844 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CCCCN2CC(C)C)c1 ZINC000154223801 472404704 /nfs/dbraw/zinc/40/47/04/472404704.db2.gz FXNNGTYBWDGICH-CQSZACIVSA-N 0 3 349.431 2.844 20 5 EFBDHN O=C(NCC1(N2CCSCC2)CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000031960827 472404841 /nfs/dbraw/zinc/40/48/41/472404841.db2.gz ZXXBTWIKSAWUCT-UHFFFAOYSA-N 0 3 349.456 2.686 20 5 EFBDHN O=[N+]([O-])c1ccc(CNC2CCN(Cc3ccccn3)CC2)cc1 ZINC000069710731 472406943 /nfs/dbraw/zinc/40/69/43/472406943.db2.gz OPAGDFKZMXJAAN-UHFFFAOYSA-N 0 3 326.400 2.744 20 5 EFBDHN COc1cc(CN[C@@H](CO)[C@@H](C)c2ccccc2)c([N+](=O)[O-])cc1F ZINC000613389999 479985998 /nfs/dbraw/zinc/98/59/98/479985998.db2.gz PNAFICCZFIYTSS-LRDDRELGSA-N 0 3 348.374 2.997 20 5 EFBDHN Cc1cc(NCC(C)(C)S(C)(=O)=O)c2cc([N+](=O)[O-])ccc2n1 ZINC000097083905 472437509 /nfs/dbraw/zinc/43/75/09/472437509.db2.gz JWJWMGCCTWXCCG-UHFFFAOYSA-N 0 3 337.401 2.687 20 5 EFBDHN CCN(Cc1ccccc1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000032758301 472464781 /nfs/dbraw/zinc/46/47/81/472464781.db2.gz SKNNAUZSTLXCNR-QGZVFWFLSA-N 0 3 330.384 2.857 20 5 EFBDHN Cc1cc(NC[C@@H]2C[C@@H](O)CN2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000089643942 472476248 /nfs/dbraw/zinc/47/62/48/472476248.db2.gz WBTOLJKUSYJWFF-ZWKOTPCHSA-N 0 3 341.411 2.951 20 5 EFBDHN O=[N+]([O-])c1ccc(NC[C@H]2C[C@H](O)CN2Cc2ccccc2)cc1 ZINC000089644737 472477444 /nfs/dbraw/zinc/47/74/44/472477444.db2.gz AWSGUAVARLCTFW-MSOLQXFVSA-N 0 3 327.384 2.642 20 5 EFBDHN O=[N+]([O-])c1ccc(NC[C@H]2C[C@@H](O)CN2Cc2ccccc2)cc1 ZINC000089644736 472478919 /nfs/dbraw/zinc/47/89/19/472478919.db2.gz AWSGUAVARLCTFW-QZTJIDSGSA-N 0 3 327.384 2.642 20 5 EFBDHN Cc1nccn1CCCCN1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000118985796 472517306 /nfs/dbraw/zinc/51/73/06/472517306.db2.gz QKQKDCQVLFCJJY-UHFFFAOYSA-N 0 3 343.431 2.702 20 5 EFBDHN C[C@@H](CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-])N1CCCC[C@H]1C ZINC000046338423 472543256 /nfs/dbraw/zinc/54/32/56/472543256.db2.gz LXHUOMQVEMSJDS-CABCVRRESA-N 0 3 348.447 2.999 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000089977206 472567826 /nfs/dbraw/zinc/56/78/26/472567826.db2.gz XDFZWOBQQFNCDO-KGLIPLIRSA-N 0 3 332.404 2.994 20 5 EFBDHN C[C@@H]1C[C@@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CN1C1CC1 ZINC000119856443 472592643 /nfs/dbraw/zinc/59/26/43/472592643.db2.gz FUTXCVBDHOCOSE-NXEZZACHSA-N 0 3 338.795 2.995 20 5 EFBDHN O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CCC[C@H](N2CCCC2)C1 ZINC000058918904 472612558 /nfs/dbraw/zinc/61/25/58/472612558.db2.gz FTDBRLLTHZHADW-AWEZNQCLSA-N 0 3 342.399 2.777 20 5 EFBDHN CCN1CCN([C@@H](C)CNc2ccc([N+](=O)[O-])c3cnccc23)CC1 ZINC000071954166 472625336 /nfs/dbraw/zinc/62/53/36/472625336.db2.gz UPWNDURBLCIWDP-AWEZNQCLSA-N 0 3 343.431 2.581 20 5 EFBDHN C[C@H]1C[C@H](c2ccccc2F)N(CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000090550920 472633708 /nfs/dbraw/zinc/63/37/08/472633708.db2.gz PZEPUYSTNRGARA-SUMWQHHRSA-N 0 3 345.374 2.979 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCN(CC2CC2)C1 ZINC000120118531 472633836 /nfs/dbraw/zinc/63/38/36/472633836.db2.gz SIIKFFPCSUNLFL-CQSZACIVSA-N 0 3 332.404 2.817 20 5 EFBDHN C[C@@H]1C[C@H](c2ccccc2F)N(CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000090550919 472633859 /nfs/dbraw/zinc/63/38/59/472633859.db2.gz PZEPUYSTNRGARA-CXAGYDPISA-N 0 3 345.374 2.979 20 5 EFBDHN C[C@H]1[C@@H](c2ccccc2)CCN1CCn1cc([N+](=O)[O-])ccc1=O ZINC000090552053 472634381 /nfs/dbraw/zinc/63/43/81/472634381.db2.gz SSFOZIJYRADJAM-YOEHRIQHSA-N 0 3 327.384 2.635 20 5 EFBDHN Cc1c(NC(=O)[C@H](C)N(C)CC2CCOCC2)cccc1[N+](=O)[O-] ZINC000155910446 472637977 /nfs/dbraw/zinc/63/79/77/472637977.db2.gz QKMZZWNPZWSTKI-ZDUSSCGKSA-N 0 3 335.404 2.589 20 5 EFBDHN CCOC(=O)c1ccnc(N[C@H]2CCN(C3CCCC3)C2)c1[N+](=O)[O-] ZINC000077965166 472645204 /nfs/dbraw/zinc/64/52/04/472645204.db2.gz PGOGUFOQEKZOCD-LBPRGKRZSA-N 0 3 348.403 2.595 20 5 EFBDHN Cc1c(NC(=O)CCN2CC[C@H](OCC(C)C)C2)cccc1[N+](=O)[O-] ZINC000120196568 472647029 /nfs/dbraw/zinc/64/70/29/472647029.db2.gz ZHVCWWGQQYLIQB-HNNXBMFYSA-N 0 3 349.431 2.979 20 5 EFBDHN CCOc1ccc([C@H](C)NCC2(OC)CCOCC2)cc1[N+](=O)[O-] ZINC000090651415 472647828 /nfs/dbraw/zinc/64/78/28/472647828.db2.gz ACTXIBHIPUXOEU-ZDUSSCGKSA-N 0 3 338.404 2.840 20 5 EFBDHN C[C@@H]1CN(CC2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)C[C@H](C)O1 ZINC000060368496 472648780 /nfs/dbraw/zinc/64/87/80/472648780.db2.gz VRJSEEURAVPPPU-IYBDPMFKSA-N 0 3 347.459 2.916 20 5 EFBDHN C[C@@H](SCCN(C)C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000120227379 472652124 /nfs/dbraw/zinc/65/21/24/472652124.db2.gz LWBIIIIVVLCWFK-SECBINFHSA-N 0 3 331.825 2.870 20 5 EFBDHN CCO[C@H]1CCCN(CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000156024637 472657209 /nfs/dbraw/zinc/65/72/09/472657209.db2.gz BYRQEGVNRRFNNX-AWEZNQCLSA-N 0 3 335.404 2.733 20 5 EFBDHN C[C@H]1CCCN(CCNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000047148525 472661296 /nfs/dbraw/zinc/66/12/96/472661296.db2.gz IGHJJQJXDUKFJH-ZDUSSCGKSA-N 0 3 346.431 2.631 20 5 EFBDHN CN(C)CCN(CCc1ccccc1)C(=O)c1ccc([N+](=O)[O-])s1 ZINC000060536447 472664988 /nfs/dbraw/zinc/66/49/88/472664988.db2.gz FOQPTDRUNSADSN-UHFFFAOYSA-N 0 3 347.440 2.903 20 5 EFBDHN CCCN(CCN(C)C)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000104530319 472675730 /nfs/dbraw/zinc/67/57/30/472675730.db2.gz GYSGYZNIGPZBNF-UHFFFAOYSA-N 0 3 334.420 2.583 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)CCN(C)CCC(F)(F)F ZINC000104678570 472682806 /nfs/dbraw/zinc/68/28/06/472682806.db2.gz YJWHMMHXPRYBHB-UHFFFAOYSA-N 0 3 349.309 2.816 20 5 EFBDHN Cn1cnc([N+](=O)[O-])c1NC[C@H]1CCCN(C)[C@@H]1c1cccs1 ZINC000078338065 472698354 /nfs/dbraw/zinc/69/83/54/472698354.db2.gz HTKSTDQPXAFBTP-YPMHNXCESA-N 0 3 335.433 2.885 20 5 EFBDHN Cc1n[nH]c(C)c1[C@H]1CCCN1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000091081278 472698609 /nfs/dbraw/zinc/69/86/09/472698609.db2.gz WFBOAUCKXGNQFW-CVEARBPZSA-N 0 3 330.388 2.805 20 5 EFBDHN CSc1ccc(C(=O)N(C)[C@H]2CCN(C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000120614350 472717971 /nfs/dbraw/zinc/71/79/71/472717971.db2.gz BVLSUTJQPYCFHE-AAEUAGOBSA-N 0 3 337.445 2.729 20 5 EFBDHN CN1CCO[C@@H](CNCc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000105471251 472754543 /nfs/dbraw/zinc/75/45/43/472754543.db2.gz BFYZAIDQJPQBFZ-ZDUSSCGKSA-N 0 3 347.440 2.744 20 5 EFBDHN CNC(=O)c1ccc(NC[C@@H](c2ccccc2)N(C)C)c([N+](=O)[O-])c1 ZINC000064904600 472885486 /nfs/dbraw/zinc/88/54/86/472885486.db2.gz KLVGHFMAVXNELT-KRWDZBQOSA-N 0 3 342.399 2.669 20 5 EFBDHN C[C@@H](CNC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)N(C)C1CC1 ZINC000121672043 472888915 /nfs/dbraw/zinc/88/89/15/472888915.db2.gz DTERJOACXUKGQF-ZDUSSCGKSA-N 0 3 346.431 2.752 20 5 EFBDHN COc1ccc(-c2ccc(CN3CCC[C@H]3CO)o2)c([N+](=O)[O-])c1 ZINC000092455827 472915287 /nfs/dbraw/zinc/91/52/87/472915287.db2.gz PZIKOHPQUNVIQU-LBPRGKRZSA-N 0 3 332.356 2.820 20 5 EFBDHN Cc1cc(C(=O)NC[C@H](c2ccccc2)N(C)C)cc([N+](=O)[O-])c1 ZINC000121849975 472929326 /nfs/dbraw/zinc/92/93/26/472929326.db2.gz MYDNZAPBFCTVMS-QGZVFWFLSA-N 0 3 327.384 2.936 20 5 EFBDHN CN(C)CCN(Cc1ccccn1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000107324297 472942466 /nfs/dbraw/zinc/94/24/66/472942466.db2.gz MXFHIHUHAZYVFY-UHFFFAOYSA-N 0 3 343.387 2.586 20 5 EFBDHN CC(C)CN(C(=O)CNc1ccccc1[N+](=O)[O-])C1CCN(C)CC1 ZINC000074139684 472950815 /nfs/dbraw/zinc/95/08/15/472950815.db2.gz YYCPSOXXPPDPFC-UHFFFAOYSA-N 0 3 348.447 2.586 20 5 EFBDHN CC(C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)C(F)(F)F ZINC000074238420 472970017 /nfs/dbraw/zinc/97/00/17/472970017.db2.gz COAMWZCUGCLYOL-SSDOTTSWSA-N 0 3 334.250 2.893 20 5 EFBDHN C[C@H]1CCCN(CCNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000080073346 472971777 /nfs/dbraw/zinc/97/17/77/472971777.db2.gz QGGWFYMOGNMITC-AWEZNQCLSA-N 0 3 348.447 2.861 20 5 EFBDHN CN(C)C[C@@H]1CCCCN1C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000134836041 472973452 /nfs/dbraw/zinc/97/34/52/472973452.db2.gz MPYLYAALZVJAPZ-ZDUSSCGKSA-N 0 3 325.796 2.805 20 5 EFBDHN O=C(Cc1ccccc1[N+](=O)[O-])N1CCN(CC2CCCCC2)CC1 ZINC000050009127 472974097 /nfs/dbraw/zinc/97/40/97/472974097.db2.gz NXBPWXVYBRRPMS-UHFFFAOYSA-N 0 3 345.443 2.862 20 5 EFBDHN CC(C)C[C@H](CN[C@@H](C)c1ccc([N+](=O)[O-])cc1)N1CCOCC1 ZINC000122140424 472981049 /nfs/dbraw/zinc/98/10/49/472981049.db2.gz JGYJHRGJRLUMNV-MAUKXSAKSA-N 0 3 335.448 2.992 20 5 EFBDHN COc1ccc(-c2ccc(CN3CC[C@@H](CO)C3)o2)c([N+](=O)[O-])c1 ZINC000092763999 472981099 /nfs/dbraw/zinc/98/10/99/472981099.db2.gz KAXODXMZKRPCKR-GFCCVEGCSA-N 0 3 332.356 2.678 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCN1CC[C@@H]2[C@H](CCCN2C2CC2)C1 ZINC000134913347 472987823 /nfs/dbraw/zinc/98/78/23/472987823.db2.gz HODWYJOKSHEMQQ-NVXWUHKLSA-N 0 3 345.443 2.922 20 5 EFBDHN CC(C)C[C@H](CNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)N(C)C ZINC000134927225 472991686 /nfs/dbraw/zinc/99/16/86/472991686.db2.gz VDIXPXUSYIUSKH-CQSZACIVSA-N 0 3 327.812 2.954 20 5 EFBDHN C[C@@H]1C[C@H](Nc2c([N+](=O)[O-])ncn2C)CCN1Cc1ccccc1 ZINC000080230969 472999161 /nfs/dbraw/zinc/99/91/61/472999161.db2.gz BYTALFDAEMGYCB-UKRRQHHQSA-N 0 3 329.404 2.793 20 5 EFBDHN CC(C)(C)CCN1CCN(C(=O)CNc2ccccc2[N+](=O)[O-])CC1 ZINC000065875702 473021510 /nfs/dbraw/zinc/02/15/10/473021510.db2.gz IKFBXVWQQLHQFX-UHFFFAOYSA-N 0 3 348.447 2.587 20 5 EFBDHN CCCCNC(=O)[C@@H]1CCCN(CCOc2ccccc2[N+](=O)[O-])C1 ZINC000051057534 473022062 /nfs/dbraw/zinc/02/20/62/473022062.db2.gz WDHGRBCSXRKZGH-OAHLLOKOSA-N 0 3 349.431 2.602 20 5 EFBDHN O=C1C[C@H]([C@@H]2CCCCN2Cc2ccc([N+](=O)[O-])cc2Cl)CN1 ZINC000108495850 473032415 /nfs/dbraw/zinc/03/24/15/473032415.db2.gz IOAVQWGANKJWFZ-WFASDCNBSA-N 0 3 337.807 2.739 20 5 EFBDHN CC(C)N(Cc1ccccn1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000051430206 473047850 /nfs/dbraw/zinc/04/78/50/473047850.db2.gz IFFGFNYGNSHVPV-QGZVFWFLSA-N 0 3 345.399 2.640 20 5 EFBDHN COc1ccc(OCCN(C)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000051563071 473058366 /nfs/dbraw/zinc/05/83/66/473058366.db2.gz VWEGSPSIKVXGAB-UHFFFAOYSA-N 0 3 346.383 2.993 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCCN2CCS[C@@H]3COCC[C@@H]32)cc1 ZINC000135562108 473093465 /nfs/dbraw/zinc/09/34/65/473093465.db2.gz XRUKFWUCKWIURN-JKSUJKDBSA-N 0 3 338.429 2.570 20 5 EFBDHN NC(=O)c1ccc(CN(CCc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000052532147 473121164 /nfs/dbraw/zinc/12/11/64/473121164.db2.gz ACVWUWCHXKBZKM-UHFFFAOYSA-N 0 3 339.395 2.901 20 5 EFBDHN COC[C@H](N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000136652188 473169460 /nfs/dbraw/zinc/16/94/60/473169460.db2.gz OYVFUTHLFSJZRU-XPTSAGLGSA-N 0 3 341.795 2.590 20 5 EFBDHN CCc1nn(C)c(NC[C@H](c2ccc(C)cc2)N(C)C)c1[N+](=O)[O-] ZINC000094150980 473180746 /nfs/dbraw/zinc/18/07/46/473180746.db2.gz WMNYIXNZBYVJQN-OAHLLOKOSA-N 0 3 331.420 2.914 20 5 EFBDHN CC(=O)Nc1cccc([C@@H](C)NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000136914471 473184661 /nfs/dbraw/zinc/18/46/61/473184661.db2.gz ZPZRIJVNXPCZCW-KZULUSFZSA-N 0 3 343.383 2.937 20 5 EFBDHN CN(C)Cc1cccc(C(=O)N2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000081421991 473197753 /nfs/dbraw/zinc/19/77/53/473197753.db2.gz YXIKFJKTLXKQSU-UHFFFAOYSA-N 0 3 325.368 2.859 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)ccc1CN1CCN(c2ccncc2)CC1 ZINC000151155894 473417957 /nfs/dbraw/zinc/41/79/57/473417957.db2.gz JGLNJGPRKKBWOV-UHFFFAOYSA-N 0 3 332.791 2.965 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@@H]1CCCN(C)C1 ZINC000185410411 473420071 /nfs/dbraw/zinc/42/00/71/473420071.db2.gz VKXDDXILFUTQLE-NVXWUHKLSA-N 0 3 333.432 2.716 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000177809280 473440494 /nfs/dbraw/zinc/44/04/94/473440494.db2.gz ICGRKSBEACHSIU-YPMHNXCESA-N 0 3 337.807 2.947 20 5 EFBDHN CCNc1ccc(C(=O)N2CCC[C@@H]3CN(C)CC[C@@H]32)cc1[N+](=O)[O-] ZINC000164068534 473476899 /nfs/dbraw/zinc/47/68/99/473476899.db2.gz WQXUAAOYSBKUNX-ZBFHGGJFSA-N 0 3 346.431 2.583 20 5 EFBDHN Cc1c([C@H](C)NC[C@H]2CN(CC(C)C)CCO2)cccc1[N+](=O)[O-] ZINC000178330620 473492299 /nfs/dbraw/zinc/49/22/99/473492299.db2.gz MCVWTFANVXWQQF-HOTGVXAUSA-N 0 3 335.448 2.911 20 5 EFBDHN Cc1c([C@@H](C)NC[C@H]2CN(CC(C)C)CCO2)cccc1[N+](=O)[O-] ZINC000178330606 473493037 /nfs/dbraw/zinc/49/30/37/473493037.db2.gz MCVWTFANVXWQQF-CVEARBPZSA-N 0 3 335.448 2.911 20 5 EFBDHN CC[C@H](NC[C@H]1CN(CC(C)C)CCO1)c1cccc([N+](=O)[O-])c1 ZINC000178331155 473493372 /nfs/dbraw/zinc/49/33/72/473493372.db2.gz PCUDECDIVNUQEI-ROUUACIJSA-N 0 3 335.448 2.992 20 5 EFBDHN C[C@H](CNC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)N(C)C1CC1 ZINC000151861463 473501186 /nfs/dbraw/zinc/50/11/86/473501186.db2.gz SJYLKFCWHADAJJ-CYBMUJFWSA-N 0 3 346.431 2.752 20 5 EFBDHN CN(C)[C@@H](CNC(=O)Cc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000152045231 473520181 /nfs/dbraw/zinc/52/01/81/473520181.db2.gz HDRKWOZTLUJLTK-KRWDZBQOSA-N 0 3 327.384 2.556 20 5 EFBDHN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CC[C@H](N2CCCC2)C1 ZINC000191395562 473534582 /nfs/dbraw/zinc/53/45/82/473534582.db2.gz RBGJTTSOJKGDTK-AWEZNQCLSA-N 0 3 332.404 2.914 20 5 EFBDHN COCC1=CCN(CCC(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000185872270 473534572 /nfs/dbraw/zinc/53/45/72/473534572.db2.gz FRYURVARIOSLLX-UHFFFAOYSA-N 0 3 333.388 2.510 20 5 EFBDHN COc1cc(CN2CCN(C3CCCC3)CC2)c([N+](=O)[O-])cc1OC ZINC000126969389 473564253 /nfs/dbraw/zinc/56/42/53/473564253.db2.gz CAUJJLZUZRCWHI-UHFFFAOYSA-N 0 3 349.431 2.672 20 5 EFBDHN COc1cc(C(=O)NC[C@@H](CC(C)C)N(C)C)cc([N+](=O)[O-])c1C ZINC000191675717 473567739 /nfs/dbraw/zinc/56/77/39/473567739.db2.gz WNWUJJBHOXCOBU-CQSZACIVSA-N 0 3 337.420 2.618 20 5 EFBDHN CN(C[C@H]1CCCN(C)C1)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000115438126 473568582 /nfs/dbraw/zinc/56/85/82/473568582.db2.gz FQHKCFUCIGHCSK-ZDUSSCGKSA-N 0 3 346.431 2.583 20 5 EFBDHN CN(C[C@@H]1CCCN(C)C1)C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000115442508 473569613 /nfs/dbraw/zinc/56/96/13/473569613.db2.gz BWBPWCYUUJRVFM-LLVKDONJSA-N 0 3 325.796 2.662 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N(C)C[C@@H]2CCCN(C)C2)c1 ZINC000115440554 473569860 /nfs/dbraw/zinc/56/98/60/473569860.db2.gz QBDLPUZBSPQTDR-GFCCVEGCSA-N 0 3 337.445 2.731 20 5 EFBDHN O=C(CN(CC1CC1)CC1CC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000115563121 473581759 /nfs/dbraw/zinc/58/17/59/473581759.db2.gz BIPGLUXFSLXIAI-UHFFFAOYSA-N 0 3 329.400 2.606 20 5 EFBDHN CN1CCC(Nc2ccccc2NC(=O)c2ccc([N+](=O)[O-])o2)CC1 ZINC000170678515 473583415 /nfs/dbraw/zinc/58/34/15/473583415.db2.gz QZEPZEAULRUQMG-UHFFFAOYSA-N 0 3 344.371 2.946 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)[C@H](C2CC2)N2CCCC2)cc1[N+](=O)[O-] ZINC000127649176 473636813 /nfs/dbraw/zinc/63/68/13/473636813.db2.gz ICXKSMORPQZHKF-DYVFJYSZSA-N 0 3 331.416 2.955 20 5 EFBDHN CC[C@@H]1CN(Cc2ccc(Cl)cc2[N+](=O)[O-])CCN1C[C@@H](C)O ZINC000116277965 473645671 /nfs/dbraw/zinc/64/56/71/473645671.db2.gz DXBOELMNBGLTHY-IUODEOHRSA-N 0 3 341.839 2.525 20 5 EFBDHN CC[C@H]1CN(Cc2ccc(Cl)cc2[N+](=O)[O-])CCN1C[C@@H](C)O ZINC000116277968 473646084 /nfs/dbraw/zinc/64/60/84/473646084.db2.gz DXBOELMNBGLTHY-DOMZBBRYSA-N 0 3 341.839 2.525 20 5 EFBDHN C[C@H]1CN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CCCO1 ZINC000170917195 473646383 /nfs/dbraw/zinc/64/63/83/473646383.db2.gz RRFJWMUFEYPWOT-ZDUSSCGKSA-N 0 3 331.372 2.903 20 5 EFBDHN C[C@H]1C[C@H](N(C)C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)CCN1C ZINC000127871177 473658598 /nfs/dbraw/zinc/65/85/98/473658598.db2.gz HUALABBIGQRZSR-NWDGAFQWSA-N 0 3 330.388 2.631 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1OC[C@@H](O)CN(C)Cc1ccccc1 ZINC000154016330 473659233 /nfs/dbraw/zinc/65/92/33/473659233.db2.gz JMXCBSWFWHBPQE-KRWDZBQOSA-N 0 3 330.384 2.775 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCN(CC2CC2)C1 ZINC000154023792 473660374 /nfs/dbraw/zinc/66/03/74/473660374.db2.gz SQMIPSUDAKGBAZ-CYBMUJFWSA-N 0 3 349.456 2.921 20 5 EFBDHN CN(C)CCN(Cc1ccc(F)c(F)c1)c1ncc([N+](=O)[O-])s1 ZINC000192488791 473685219 /nfs/dbraw/zinc/68/52/19/473685219.db2.gz IEBHNODDEJURPW-UHFFFAOYSA-N 0 3 342.371 2.898 20 5 EFBDHN CSc1cccc(C(=O)N(C)[C@H]2CCN(C)C[C@@H]2C)c1[N+](=O)[O-] ZINC000186570408 473691547 /nfs/dbraw/zinc/69/15/47/473691547.db2.gz LYJNBCCRVUJYOO-AAEUAGOBSA-N 0 3 337.445 2.729 20 5 EFBDHN CC(C)(NC[C@@H](O)COc1cccc([N+](=O)[O-])c1)c1cccc(F)c1 ZINC000179572842 473695421 /nfs/dbraw/zinc/69/54/21/473695421.db2.gz NACGJGJFVVHAAO-MRXNPFEDSA-N 0 3 348.374 2.999 20 5 EFBDHN NC(=O)c1ccc(CN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000192600460 473695993 /nfs/dbraw/zinc/69/59/93/473695993.db2.gz CQUFRTQAWVVINA-QGZVFWFLSA-N 0 3 325.368 2.861 20 5 EFBDHN CCn1nc(C)c([N+](=O)[O-])c1NCC1CCN(c2ccncc2)CC1 ZINC000192741059 473716799 /nfs/dbraw/zinc/71/67/99/473716799.db2.gz XUOVKPICZVWBOQ-UHFFFAOYSA-N 0 3 344.419 2.843 20 5 EFBDHN O=C(Nc1ccc([N+](=O)[O-])c2ncccc12)C1CCN(C2CC2)CC1 ZINC000192834426 473735139 /nfs/dbraw/zinc/73/51/39/473735139.db2.gz JFUNKBJSQCIZAT-UHFFFAOYSA-N 0 3 340.383 2.956 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)CCN(C)C1CC1 ZINC000186758548 473750357 /nfs/dbraw/zinc/75/03/57/473750357.db2.gz GEQIERODNCWDPB-OAHLLOKOSA-N 0 3 333.432 2.716 20 5 EFBDHN CN1CCC[C@@H](CNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000173138346 473753338 /nfs/dbraw/zinc/75/33/38/473753338.db2.gz BKYINNRLGNMZGJ-JTQLQIEISA-N 0 3 345.321 2.685 20 5 EFBDHN CSc1cccc(C(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)c1[N+](=O)[O-] ZINC000186865391 473770909 /nfs/dbraw/zinc/77/09/09/473770909.db2.gz LTJCLVVHMIKODL-TZMCWYRMSA-N 0 3 349.456 2.873 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CCCN(C(C)C)CC2)c1 ZINC000281604581 473780002 /nfs/dbraw/zinc/78/00/02/473780002.db2.gz OQOLHQQYZNVRJM-UHFFFAOYSA-N 0 3 349.431 2.615 20 5 EFBDHN NC(=O)C[C@@H]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000180063263 473789186 /nfs/dbraw/zinc/78/91/86/473789186.db2.gz IKYCAVAFEXDFNU-ZDUSSCGKSA-N 0 3 343.383 2.942 20 5 EFBDHN Cc1ccc([C@H](CNC(=O)Cc2cccc([N+](=O)[O-])c2)N(C)C)cc1 ZINC000173284649 473793894 /nfs/dbraw/zinc/79/38/94/473793894.db2.gz HIPLKJLTDYAYMS-SFHVURJKSA-N 0 3 341.411 2.865 20 5 EFBDHN CC1CCN(CCNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)CC1 ZINC000193959078 473823929 /nfs/dbraw/zinc/82/39/29/473823929.db2.gz YZHNNRXWYATIIX-UHFFFAOYSA-N 0 3 332.404 2.623 20 5 EFBDHN CCn1c(C)nc([N+](=O)[O-])c1NC[C@@H](c1cccc(F)c1)N(C)C ZINC000288041795 473831699 /nfs/dbraw/zinc/83/16/99/473831699.db2.gz DMWIEVPWFLOEJG-AWEZNQCLSA-N 0 3 335.383 2.974 20 5 EFBDHN CNC(=O)[C@H](C)CN(C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000180294223 473848470 /nfs/dbraw/zinc/84/84/70/473848470.db2.gz QUADXJGQGRGTIZ-GFCCVEGCSA-N 0 3 331.372 2.669 20 5 EFBDHN O=C(Cc1cccc([N+](=O)[O-])c1)N1CCC[C@H]1CN1CCCCC1 ZINC000173476491 473848517 /nfs/dbraw/zinc/84/85/17/473848517.db2.gz CMFMJFWUQBTPQS-KRWDZBQOSA-N 0 3 331.416 2.614 20 5 EFBDHN C[C@@H](CCN1CCN(C)CC1)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000274513094 473857268 /nfs/dbraw/zinc/85/72/68/473857268.db2.gz VDAGYYYHKNMPDI-AWEZNQCLSA-N 0 3 343.431 2.581 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CCC[C@@H]2C[C@@H](O)c2ccc(F)cc2)c1 ZINC000269704754 473869147 /nfs/dbraw/zinc/86/91/47/473869147.db2.gz ZGLQEJNRDHJYRI-NVXWUHKLSA-N 0 3 348.378 2.519 20 5 EFBDHN Cc1nn(C)c(N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)c1[N+](=O)[O-] ZINC000288208578 473876265 /nfs/dbraw/zinc/87/62/65/473876265.db2.gz LKLYFIUVSHQXPC-DZGCQCFKSA-N 0 3 329.404 2.712 20 5 EFBDHN C[C@@H](NC[C@@H](O)COCc1ccccc1F)c1cccc([N+](=O)[O-])c1 ZINC000180443763 473879706 /nfs/dbraw/zinc/87/97/06/473879706.db2.gz FQTNOOAVONOHKR-CXAGYDPISA-N 0 3 348.374 2.962 20 5 EFBDHN O=[N+]([O-])c1cc(CN[C@@H]2[C@@H]3CCO[C@H]3C23CCC3)c2c(c1)COCO2 ZINC000269936455 473925392 /nfs/dbraw/zinc/92/53/92/473925392.db2.gz OCVBHCRSKCOFDI-USXIJHARSA-N 0 3 346.383 2.509 20 5 EFBDHN CC(C)(CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1)OCCO ZINC000288379764 473925534 /nfs/dbraw/zinc/92/55/34/473925534.db2.gz FXJFVOVRMWOXOZ-UHFFFAOYSA-N 0 3 334.372 2.732 20 5 EFBDHN C[C@H](N[C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])c1nncn1C ZINC000269989489 473944725 /nfs/dbraw/zinc/94/47/25/473944725.db2.gz GDVHZQUGNGZROX-KCQAQPDRSA-N 0 3 329.404 2.785 20 5 EFBDHN CN(Cc1ccccc1)CC(C)(C)NC(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000270014686 473955564 /nfs/dbraw/zinc/95/55/64/473955564.db2.gz SUDAYMSASXBLKA-UHFFFAOYSA-N 0 3 330.388 2.563 20 5 EFBDHN CSc1cccc(C(=O)NC2CCN(C3CC3)CC2)c1[N+](=O)[O-] ZINC000188030222 473958025 /nfs/dbraw/zinc/95/80/25/473958025.db2.gz NNPZLDIPROEIMR-UHFFFAOYSA-N 0 3 335.429 2.673 20 5 EFBDHN CN(C)CCOc1ccc(CCNc2cc(N)ccc2[N+](=O)[O-])cc1 ZINC000282198057 473979036 /nfs/dbraw/zinc/97/90/36/473979036.db2.gz LKQMGFFOUPPQNX-UHFFFAOYSA-N 0 3 344.415 2.772 20 5 EFBDHN CSc1cccc(C(=O)N(C)C[C@@H]2CCCN(C)C2)c1[N+](=O)[O-] ZINC000188164393 474005860 /nfs/dbraw/zinc/00/58/60/474005860.db2.gz SIQNTHXIYJOGMB-GFCCVEGCSA-N 0 3 337.445 2.731 20 5 EFBDHN COc1ccc(CNC2CCN(c3nccs3)CC2)cc1[N+](=O)[O-] ZINC000282277902 474006941 /nfs/dbraw/zinc/00/69/41/474006941.db2.gz QFRBCKADXZPUKK-UHFFFAOYSA-N 0 3 348.428 2.819 20 5 EFBDHN CSc1cccc(C(=O)N[C@H]2C[C@@H](C)N(C3CC3)C2)c1[N+](=O)[O-] ZINC000188188619 474013295 /nfs/dbraw/zinc/01/32/95/474013295.db2.gz ZUXPHDFABWYRLI-MNOVXSKESA-N 0 3 335.429 2.672 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H](N2CCCCC2)C1 ZINC000264517073 474020991 /nfs/dbraw/zinc/02/09/91/474020991.db2.gz VAGURBAFWJURMY-HNNXBMFYSA-N 0 3 332.404 2.995 20 5 EFBDHN C[C@@H]1CCCN(CCNC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)C1 ZINC000282330053 474024119 /nfs/dbraw/zinc/02/41/19/474024119.db2.gz FSFSYBIOOHRRDK-OAHLLOKOSA-N 0 3 348.447 2.511 20 5 EFBDHN O=C(CCN1CCCc2occc2C1)Nc1ccccc1[N+](=O)[O-] ZINC000288762243 474043591 /nfs/dbraw/zinc/04/35/91/474043591.db2.gz IYSFZRPPJFAHHC-UHFFFAOYSA-N 0 3 329.356 2.965 20 5 EFBDHN COCCN1CC[C@@H](NCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000264583323 474049057 /nfs/dbraw/zinc/04/90/57/474049057.db2.gz KAWMFRGEAGXJFK-OAHLLOKOSA-N 0 3 345.399 2.665 20 5 EFBDHN O=C1COc2ccccc2N1CCCNCc1ccccc1[N+](=O)[O-] ZINC000174524193 474056446 /nfs/dbraw/zinc/05/64/46/474056446.db2.gz ODEKKEVGPWFONX-UHFFFAOYSA-N 0 3 341.367 2.500 20 5 EFBDHN CCn1nc(C)c([N+](=O)[O-])c1NC[C@@H](c1cccc(F)c1)N(C)C ZINC000195334480 474060456 /nfs/dbraw/zinc/06/04/56/474060456.db2.gz DIUWPPASFXYHFC-AWEZNQCLSA-N 0 3 335.383 2.974 20 5 EFBDHN CCC(CC)(CCO)NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000282463679 474075057 /nfs/dbraw/zinc/07/50/57/474075057.db2.gz NCPFYJZAPFWFJC-UHFFFAOYSA-N 0 3 343.811 2.718 20 5 EFBDHN COc1cccc(C(=O)N[C@H](C)CN2C[C@H](C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000195450761 474076163 /nfs/dbraw/zinc/07/61/63/474076163.db2.gz WPDOHACISVXPSF-HZSPNIEDSA-N 0 3 349.431 2.700 20 5 EFBDHN Cc1nn(C)c2ncc(CN(C)CCc3cccc([N+](=O)[O-])c3)cc12 ZINC000282495798 474086538 /nfs/dbraw/zinc/08/65/38/474086538.db2.gz QHMLYECQICEWKI-UHFFFAOYSA-N 0 3 339.399 2.859 20 5 EFBDHN C[C@H](CN(C)Cc1ccccc1)NC(=O)c1csc([N+](=O)[O-])c1 ZINC000182069728 474091971 /nfs/dbraw/zinc/09/19/71/474091971.db2.gz LFPACCWOLFEKRG-GFCCVEGCSA-N 0 3 333.413 2.907 20 5 EFBDHN C[C@H](CN(C)Cc1ccccc1)NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000182098595 474098431 /nfs/dbraw/zinc/09/84/31/474098431.db2.gz DVKUFYRVPVFJRY-OAHLLOKOSA-N 0 3 341.411 2.774 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CCC(c3c[nH]c4ncccc34)CC2)c1 ZINC000174864483 474108118 /nfs/dbraw/zinc/10/81/18/474108118.db2.gz PFSAFKNKFSOCIC-UHFFFAOYSA-N 0 3 340.387 2.547 20 5 EFBDHN C[C@@H](c1cccc(O)c1)N(C)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182165010 474112757 /nfs/dbraw/zinc/11/27/57/474112757.db2.gz HQMRLWPMASTTGT-BBRMVZONSA-N 0 3 346.383 2.733 20 5 EFBDHN Cc1ccccc1[C@@H](C)NC[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182176255 474116242 /nfs/dbraw/zinc/11/62/42/474116242.db2.gz PMPFANFFDVAMMF-CABCVRRESA-N 0 3 330.384 2.994 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000264796796 474129555 /nfs/dbraw/zinc/12/95/55/474129555.db2.gz BOUHROGNUKMPHS-GFCCVEGCSA-N 0 3 325.796 2.852 20 5 EFBDHN Cc1nn(C)c(C)c1[C@H]1OCC[C@@H]1NCc1cccc([N+](=O)[O-])c1 ZINC000275298449 474134999 /nfs/dbraw/zinc/13/49/99/474134999.db2.gz MOTQOQPLQVCCHG-RDJZCZTQSA-N 0 3 330.388 2.565 20 5 EFBDHN CO[C@@H]1CCCC[C@@H]1NCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000275299830 474135763 /nfs/dbraw/zinc/13/57/63/474135763.db2.gz ZIBQVCUJCQBPHX-GXTWGEPZSA-N 0 3 341.795 2.734 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000264814383 474136725 /nfs/dbraw/zinc/13/67/25/474136725.db2.gz WFMUPJGRQQWPII-CYBMUJFWSA-N 0 3 330.388 2.680 20 5 EFBDHN COc1cc(C(=O)NC[C@H](C)N2CCC[C@H](C)C2)cc([N+](=O)[O-])c1C ZINC000188717248 474175184 /nfs/dbraw/zinc/17/51/84/474175184.db2.gz ZLCYDHMTHXIKDR-STQMWFEESA-N 0 3 349.431 2.762 20 5 EFBDHN CC(C)N1C[C@H](C)[C@H](NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000247690583 474200685 /nfs/dbraw/zinc/20/06/85/474200685.db2.gz QYFSLOKWZODDBU-SWLSCSKDSA-N 0 3 342.399 2.602 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2noc([C@H]3CCCN3C3CCOCC3)n2)cc1 ZINC000275502498 474211017 /nfs/dbraw/zinc/21/10/17/474211017.db2.gz CCYCZTHRCQRIFE-OAHLLOKOSA-N 0 3 344.371 2.961 20 5 EFBDHN CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)CC1(O)CCOCC1 ZINC000188835953 474212033 /nfs/dbraw/zinc/21/20/33/474212033.db2.gz FJUFAGSBVCPBHA-UHFFFAOYSA-N 0 3 346.383 2.828 20 5 EFBDHN CN(Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)CC1(O)CCOCC1 ZINC000188843781 474214825 /nfs/dbraw/zinc/21/48/25/474214825.db2.gz HZIKHXQTGIPOPV-UHFFFAOYSA-N 0 3 346.383 2.828 20 5 EFBDHN C[C@@H]1CN(Cc2cc(Cl)ccc2[N+](=O)[O-])CCN1CC(C)(C)O ZINC000275519445 474218411 /nfs/dbraw/zinc/21/84/11/474218411.db2.gz IVYOYYCCXZVZLT-GFCCVEGCSA-N 0 3 341.839 2.525 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCCCN2C2CC2)c1 ZINC000282852168 474219736 /nfs/dbraw/zinc/21/97/36/474219736.db2.gz SHCLTTQQUCXHEK-AWEZNQCLSA-N 0 3 347.415 2.740 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NCc1ccnc(OCCN(C)C)c1 ZINC000270735365 474242512 /nfs/dbraw/zinc/24/25/12/474242512.db2.gz SJBOQEZMRAXWFY-UHFFFAOYSA-N 0 3 330.388 2.851 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H]3CCCN3C[C@@H]2CC)c1 ZINC000282925509 474243429 /nfs/dbraw/zinc/24/34/29/474243429.db2.gz WUENZQIBYPHQLY-KBPBESRZSA-N 0 3 347.415 2.692 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@H](N2CCCCC2)C1 ZINC000275610319 474251255 /nfs/dbraw/zinc/25/12/55/474251255.db2.gz IILDIIWRKWRFFR-HNNXBMFYSA-N 0 3 332.404 2.995 20 5 EFBDHN CN(C)C1(CNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)CCC1 ZINC000275639585 474261285 /nfs/dbraw/zinc/26/12/85/474261285.db2.gz NRUJDIGTJMUUOQ-UHFFFAOYSA-N 0 3 346.431 2.753 20 5 EFBDHN C[C@@H]1C[C@@H](Nc2c(Br)cncc2[N+](=O)[O-])CCN1C ZINC000231630157 474264259 /nfs/dbraw/zinc/26/42/59/474264259.db2.gz WFDCYOAPTHQXAZ-BDAKNGLRSA-N 0 3 329.198 2.647 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN[C@@H](CO)c1ccccc1 ZINC000182902791 474282636 /nfs/dbraw/zinc/28/26/36/474282636.db2.gz FEXSHRIXRCLBOY-KRWDZBQOSA-N 0 3 343.383 2.555 20 5 EFBDHN COCCN1CCC(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000189119781 474296365 /nfs/dbraw/zinc/29/63/65/474296365.db2.gz LGKGDIQFSWBBDV-UHFFFAOYSA-N 0 3 349.431 2.559 20 5 EFBDHN O=[N+]([O-])c1cc(I)cc(CNC2CCC2)c1 ZINC000289520016 474306120 /nfs/dbraw/zinc/30/61/20/474306120.db2.gz NTWZDMQTXBVDHR-UHFFFAOYSA-N 0 3 332.141 2.842 20 5 EFBDHN C[C@H](c1cccc(O)c1)N(C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248448298 474327524 /nfs/dbraw/zinc/32/75/24/474327524.db2.gz HQMRLWPMASTTGT-CZUORRHYSA-N 0 3 346.383 2.733 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@H](N2CCCCC2)C1 ZINC000275814530 474327752 /nfs/dbraw/zinc/32/77/52/474327752.db2.gz VXUSFRPWIMPCPW-AWEZNQCLSA-N 0 3 348.403 2.696 20 5 EFBDHN C[S@](=O)C[C@H](NCCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000183120764 474333424 /nfs/dbraw/zinc/33/34/24/474333424.db2.gz OVDHFILXVKWQQR-SBUREZEXSA-N 0 3 332.425 2.847 20 5 EFBDHN C[C@@H]1CC[C@H](NCC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)[C@@H](C)C1 ZINC000248543600 474351472 /nfs/dbraw/zinc/35/14/72/474351472.db2.gz DBVDDQMJXQPIEP-WOPDTQHZSA-N 0 3 349.387 2.676 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000265827634 474352089 /nfs/dbraw/zinc/35/20/89/474352089.db2.gz SDSCTLOVFRKERV-MRXNPFEDSA-N 0 3 333.432 2.863 20 5 EFBDHN CC(C)(C(=O)NCCN1CCCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000265853264 474362051 /nfs/dbraw/zinc/36/20/51/474362051.db2.gz XPQSPJRLJWTGBA-UHFFFAOYSA-N 0 3 333.432 2.865 20 5 EFBDHN C[C@H](C(=O)N1C[C@@H]2CCCN2C[C@H]1C)c1ccc([N+](=O)[O-])cc1F ZINC000248585848 474366997 /nfs/dbraw/zinc/36/69/97/474366997.db2.gz PWYYVGRQRBJEBX-DYEKYZERSA-N 0 3 335.379 2.533 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@@H]1CC[C@H](C)C[C@@H]1C ZINC000248588658 474368027 /nfs/dbraw/zinc/36/80/27/474368027.db2.gz YPSNCKTVCOQUQR-SGMGOOAPSA-N 0 3 335.404 2.956 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])o2)CCN1Cc1ccccc1 ZINC000176126992 474390634 /nfs/dbraw/zinc/39/06/34/474390634.db2.gz PNILHWGXUBTCTA-ZFWWWQNUSA-N 0 3 343.383 2.971 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)NC[C@@H](C)N(C)C2CC2)cc1[N+](=O)[O-] ZINC000176137762 474391483 /nfs/dbraw/zinc/39/14/83/474391483.db2.gz KMOGZVPTXSYSJV-OLZOCXBDSA-N 0 3 334.420 2.746 20 5 EFBDHN C[C@@H]1CN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)[C@@H](C)CN1 ZINC000237385818 474392485 /nfs/dbraw/zinc/39/24/85/474392485.db2.gz MFVMIMPBBNCUNG-MNOVXSKESA-N 0 3 346.412 2.541 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)[C@@H](N)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000237432895 474403475 /nfs/dbraw/zinc/40/34/75/474403475.db2.gz REZBNCIVEWLEAQ-BBRMVZONSA-N 0 3 327.384 2.650 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CCC(c3nc4ccccc4o3)CC2)n1 ZINC000176193676 474405479 /nfs/dbraw/zinc/40/54/79/474405479.db2.gz HPTSCBDDALBONM-UHFFFAOYSA-N 0 3 341.371 2.812 20 5 EFBDHN CC(C)N(CCn1ccc([N+](=O)[O-])n1)Cc1ccc([N+](=O)[O-])cc1 ZINC000176216810 474412650 /nfs/dbraw/zinc/41/26/50/474412650.db2.gz OWZIEHKRJONMEG-UHFFFAOYSA-N 0 3 333.348 2.610 20 5 EFBDHN CN(C)c1cccc([C@@H]2CCCN2CCn2ccc([N+](=O)[O-])n2)c1 ZINC000176248554 474420340 /nfs/dbraw/zinc/42/03/40/474420340.db2.gz DDQHUPMVWRHVQF-INIZCTEOSA-N 0 3 329.404 2.694 20 5 EFBDHN C[C@H](N[C@@H](C)[C@H]1CCOC1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000266292584 474428687 /nfs/dbraw/zinc/42/86/87/474428687.db2.gz KGTRMOALSJVZIG-DCAQKATOSA-N 0 3 341.795 2.590 20 5 EFBDHN CN(C)CC1(NC(=O)Nc2cccc([N+](=O)[O-])c2Cl)CCC1 ZINC000289804480 474435554 /nfs/dbraw/zinc/43/55/54/474435554.db2.gz VDJAIWASYZDUFY-UHFFFAOYSA-N 0 3 326.784 2.854 20 5 EFBDHN COc1cccc(CN(CCN(C)C)c2ccc([N+](=O)[O-])c(C)n2)c1 ZINC000189627892 474451174 /nfs/dbraw/zinc/45/11/74/474451174.db2.gz AERHBYGFFYTVFR-UHFFFAOYSA-N 0 3 344.415 2.875 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@@H]1CN(C2CC2)C[C@@H]1C ZINC000271230146 474454046 /nfs/dbraw/zinc/45/40/46/474454046.db2.gz CYONAWOCDOGREQ-SWLSCSKDSA-N 0 3 331.416 2.733 20 5 EFBDHN COc1cccc(C(=O)N[C@@H](C)CN2C[C@H](C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000248892747 474474603 /nfs/dbraw/zinc/47/46/03/474474603.db2.gz WPDOHACISVXPSF-MJBXVCDLSA-N 0 3 349.431 2.700 20 5 EFBDHN CS[C@@H]1CN(c2ccc([N+](=O)[O-])c3cccnc32)C[C@H]1N(C)C ZINC000271290401 474478177 /nfs/dbraw/zinc/47/81/77/474478177.db2.gz DYASYXPOHBEWFO-HUUCEWRRSA-N 0 3 332.429 2.625 20 5 EFBDHN O=C(NCCCNCc1cccnc1)c1ccc([N+](=O)[O-])cc1Cl ZINC000237811367 474479740 /nfs/dbraw/zinc/47/97/40/474479740.db2.gz FASKXJIAAIJAHT-UHFFFAOYSA-N 0 3 348.790 2.553 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000248920013 474484056 /nfs/dbraw/zinc/48/40/56/474484056.db2.gz WMKJOHFFBRWNDZ-RDTXWAMCSA-N 0 3 339.395 2.845 20 5 EFBDHN COC[C@@]1(CNCc2cccc([N+](=O)[O-])c2)OCCc2ccccc21 ZINC000289979335 474511298 /nfs/dbraw/zinc/51/12/98/474511298.db2.gz WQABCOVNOLJBAP-LJQANCHMSA-N 0 3 342.395 2.799 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NCCN2CCCC[C@@H]2CC)c1 ZINC000283859589 474512889 /nfs/dbraw/zinc/51/28/89/474512889.db2.gz HMASALSBAOOPTM-AWEZNQCLSA-N 0 3 349.431 2.988 20 5 EFBDHN Cc1cccc(C(=O)NCCCCN2C[C@H](C)O[C@@H](C)C2)c1[N+](=O)[O-] ZINC000176694212 474517941 /nfs/dbraw/zinc/51/79/41/474517941.db2.gz ISDHOFIFGRCUQO-GJZGRUSLSA-N 0 3 349.431 2.522 20 5 EFBDHN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CC[C@H]2CCN(C)C[C@H]21 ZINC000276383642 474520424 /nfs/dbraw/zinc/52/04/24/474520424.db2.gz GXJOEEGBJVGYEF-CZUORRHYSA-N 0 3 332.404 2.770 20 5 EFBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CN[C@H]2CCC[C@@H]2CCO)c1 ZINC000189974701 474524139 /nfs/dbraw/zinc/52/41/39/474524139.db2.gz WXWIJBOYIFERQB-MFKMUULPSA-N 0 3 330.331 2.837 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)N2CCC[C@H](N(C)C)C2)cc1[N+](=O)[O-] ZINC000176747116 474525783 /nfs/dbraw/zinc/52/57/83/474525783.db2.gz QMWWKMDNSQPQRU-HIFRSBDPSA-N 0 3 334.420 2.700 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000284031829 474555227 /nfs/dbraw/zinc/55/52/27/474555227.db2.gz LEJYEVRGPGWSIG-NEPJUHHUSA-N 0 3 325.359 2.932 20 5 EFBDHN Cc1cc(F)c(NC(=O)N2C[C@@H]3CCCN3C[C@@H]2C)cc1[N+](=O)[O-] ZINC000284081532 474567235 /nfs/dbraw/zinc/56/72/35/474567235.db2.gz RMAVHXWCLLWXFM-RYUDHWBXSA-N 0 3 336.367 2.743 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC1CCN(C2CC2)CC1 ZINC000184659582 474577303 /nfs/dbraw/zinc/57/73/03/474577303.db2.gz LLHJAUFGDAECER-HNNXBMFYSA-N 0 3 345.443 2.907 20 5 EFBDHN O=C(CN1CCC[C@@H]1C1CCC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000609120989 480114038 /nfs/dbraw/zinc/11/40/38/480114038.db2.gz FFNNDHXDBMTAPF-MRXNPFEDSA-N 0 3 329.400 2.748 20 5 EFBDHN Cc1nn(C)c(N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000267232585 474624706 /nfs/dbraw/zinc/62/47/06/474624706.db2.gz QHBOIZIKDHBAMY-CZUORRHYSA-N 0 3 343.431 2.959 20 5 EFBDHN O=[N+]([O-])c1ccc(S(=O)(=O)CCNC2CCCCCC2)cc1 ZINC000272936311 474645581 /nfs/dbraw/zinc/64/55/81/474645581.db2.gz MOEKMUKBRIEYQA-UHFFFAOYSA-N 0 3 326.418 2.681 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CNCCCn2cncn2)o1 ZINC000609140472 480117688 /nfs/dbraw/zinc/11/76/88/480117688.db2.gz FFMDDIVNNNPDMO-UHFFFAOYSA-N 0 3 327.344 2.626 20 5 EFBDHN C[C@@H](NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)C1=CCN(C)CC1 ZINC000272957012 474650915 /nfs/dbraw/zinc/65/09/15/474650915.db2.gz NDGXUKOWYGBOPG-OLZOCXBDSA-N 0 3 349.456 2.842 20 5 EFBDHN Cn1nccc1N1CCC[C@H](NCc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000278464976 474651062 /nfs/dbraw/zinc/65/10/62/474651062.db2.gz FYDNWNBOOIKXAE-AWEZNQCLSA-N 0 3 349.822 2.740 20 5 EFBDHN C[C@H]1[C@@H](NC(=O)c2ccccc2[N+](=O)[O-])CCN1Cc1ccccc1 ZINC000291730276 474659738 /nfs/dbraw/zinc/65/97/38/474659738.db2.gz IGKCRKROUQGZRZ-YOEHRIQHSA-N 0 3 339.395 2.988 20 5 EFBDHN Cc1cccc([C@@H]2CCN(Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C2)c1 ZINC000273036894 474685658 /nfs/dbraw/zinc/68/56/58/474685658.db2.gz DCPNMRLWQKSSRE-MRXNPFEDSA-N 0 3 339.395 2.992 20 5 EFBDHN Cn1nccc1N1CCC[C@H](NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000278544468 474692802 /nfs/dbraw/zinc/69/28/02/474692802.db2.gz YACHZBAUDUFBHK-ZDUSSCGKSA-N 0 3 349.822 2.740 20 5 EFBDHN Cc1ccc([C@H](C)N[C@@H]2CCCN(c3ccnn3C)C2)cc1[N+](=O)[O-] ZINC000278549515 474695399 /nfs/dbraw/zinc/69/53/99/474695399.db2.gz VSIKJNSYIPTZLN-GOEBONIOSA-N 0 3 343.431 2.956 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1CC[C@]2(C1)CCCN(C)C2 ZINC000292900752 474705457 /nfs/dbraw/zinc/70/54/57/474705457.db2.gz WQWZLAOUBKTYJF-GOSISDBHSA-N 0 3 347.415 2.612 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCCN2CCC[C@H](C)C2)c1 ZINC000344389094 474711535 /nfs/dbraw/zinc/71/15/35/474711535.db2.gz IJJYHXVDAMNVIX-HNNXBMFYSA-N 0 3 349.431 2.520 20 5 EFBDHN CN(Cc1ccccc1)C[C@@H](O)COc1ccc([N+](=O)[O-])cc1F ZINC000305275787 474724825 /nfs/dbraw/zinc/72/48/25/474724825.db2.gz AVFOQBKFVNMJOD-OAHLLOKOSA-N 0 3 334.347 2.606 20 5 EFBDHN COc1ccc(CNC[C@@H](O)CCc2ccccc2)cc1[N+](=O)[O-] ZINC000273126337 474730566 /nfs/dbraw/zinc/73/05/66/474730566.db2.gz LSPUVHMIXLJCKE-INIZCTEOSA-N 0 3 330.384 2.687 20 5 EFBDHN NC(=O)c1ccc(CN2CC[C@H](c3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000268029656 474759278 /nfs/dbraw/zinc/75/92/78/474759278.db2.gz MDGREYIHEJWLTF-AWEZNQCLSA-N 0 3 343.358 2.822 20 5 EFBDHN Cc1nn(C)c(N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000268102774 474798781 /nfs/dbraw/zinc/79/87/81/474798781.db2.gz APAWNEUBJZHCKF-WFASDCNBSA-N 0 3 329.404 2.712 20 5 EFBDHN C[C@H](CNC(=O)NCCc1ccccc1[N+](=O)[O-])N1CCCC[C@@H]1C ZINC000340942988 474802569 /nfs/dbraw/zinc/80/25/69/474802569.db2.gz XMVWTPIKNLTWFJ-LSDHHAIUSA-N 0 3 348.447 2.699 20 5 EFBDHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000268129940 474814341 /nfs/dbraw/zinc/81/43/41/474814341.db2.gz PGIAYDKXCLOTKJ-YMTOWFKASA-N 0 3 338.795 2.852 20 5 EFBDHN Cn1ncc([N+](=O)[O-])c1NC(=O)c1ccc(CN2CCCCC2)cc1 ZINC000278759621 474819381 /nfs/dbraw/zinc/81/93/81/474819381.db2.gz KBUYDFVKLVCJBI-UHFFFAOYSA-N 0 3 343.387 2.567 20 5 EFBDHN Cc1c(CNC[C@@H](O)COCc2ccccc2)cccc1[N+](=O)[O-] ZINC000310072163 474822907 /nfs/dbraw/zinc/82/29/07/474822907.db2.gz NKDDOBHUGDIQIE-QGZVFWFLSA-N 0 3 330.384 2.571 20 5 EFBDHN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H](C1CC1)N1CCCC1 ZINC000345037189 474835966 /nfs/dbraw/zinc/83/59/66/474835966.db2.gz PSRODTUZPMJLSS-OAHLLOKOSA-N 0 3 337.807 2.739 20 5 EFBDHN COC(=O)CCN(C/C=C\c1ccccc1[N+](=O)[O-])C[C@H]1CCCO1 ZINC000255380002 474845961 /nfs/dbraw/zinc/84/59/61/474845961.db2.gz CVTMWMSSTOLBAF-HQQUCIOCSA-N 0 3 348.399 2.652 20 5 EFBDHN C[C@H](C1CCN(C)CC1)N(C)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000273391633 474877168 /nfs/dbraw/zinc/87/71/68/474877168.db2.gz DOHAOQYKHLAGJG-CQSZACIVSA-N 0 3 348.447 2.509 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CN(C2CC2)C[C@H]1C ZINC000268241762 474882677 /nfs/dbraw/zinc/88/26/77/474882677.db2.gz VELVVWIBTZHOCX-WQGACYEGSA-N 0 3 349.456 2.674 20 5 EFBDHN CCOC(=O)c1cc(N2CC[C@@H](N3CCCCC3)C2)ccc1[N+](=O)[O-] ZINC000268250593 474886909 /nfs/dbraw/zinc/88/69/09/474886909.db2.gz ZGKAHNLIKMAFGT-OAHLLOKOSA-N 0 3 347.415 2.836 20 5 EFBDHN Cc1cccc(CN(C)CCC(=O)Nc2ccccc2[N+](=O)[O-])n1 ZINC000337313504 474887094 /nfs/dbraw/zinc/88/70/94/474887094.db2.gz HABRUSFVSQLEGI-UHFFFAOYSA-N 0 3 328.372 2.759 20 5 EFBDHN C[C@H](NCCn1cc(Br)cn1)c1ccc([N+](=O)[O-])cc1 ZINC000285097219 474890814 /nfs/dbraw/zinc/89/08/14/474890814.db2.gz LPORTGAWJANOLL-JTQLQIEISA-N 0 3 339.193 2.905 20 5 EFBDHN CS[C@H]1CN(C(=O)c2cccc(C)c2[N+](=O)[O-])C[C@@H]1N1CCCC1 ZINC000273438405 474896470 /nfs/dbraw/zinc/89/64/70/474896470.db2.gz AQWMRMSHENZOON-GJZGRUSLSA-N 0 3 349.456 2.555 20 5 EFBDHN CC1(C)CC[C@@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000273471175 474916508 /nfs/dbraw/zinc/91/65/08/474916508.db2.gz RYQWEYZAOHHJOY-GFCCVEGCSA-N 0 3 326.418 2.537 20 5 EFBDHN CS[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2C)C[C@@H]1N1CCCC1 ZINC000273475197 474919022 /nfs/dbraw/zinc/91/90/22/474919022.db2.gz HQVXVVMCWWBZGH-HOTGVXAUSA-N 0 3 349.456 2.555 20 5 EFBDHN CC[C@H]1CCC[C@@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000273484194 474923313 /nfs/dbraw/zinc/92/33/13/474923313.db2.gz VDNZAYJWHAPYEQ-WFASDCNBSA-N 0 3 326.418 2.537 20 5 EFBDHN CS[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)C[C@@H]1N1CCCC1 ZINC000273523792 474943806 /nfs/dbraw/zinc/94/38/06/474943806.db2.gz PYNCDRNHTKDHSQ-JKSUJKDBSA-N 0 3 349.456 2.555 20 5 EFBDHN Cc1ccc(NCc2ccncc2OCCN(C)C)c([N+](=O)[O-])c1 ZINC000341077877 474949230 /nfs/dbraw/zinc/94/92/30/474949230.db2.gz YZFLYQIRRGMWHS-UHFFFAOYSA-N 0 3 330.388 2.851 20 5 EFBDHN CCCCN(C)C[C@H](C)Nc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000341111188 474985503 /nfs/dbraw/zinc/98/55/03/474985503.db2.gz DLAXGUSAQYRFOZ-LBPRGKRZSA-N 0 3 343.449 2.531 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2NCCc3ccccc32)c1 ZINC000261606324 474991907 /nfs/dbraw/zinc/99/19/07/474991907.db2.gz CUASBQARVRJNDL-MRXNPFEDSA-N 0 3 325.368 2.520 20 5 EFBDHN O=C(CN[C@H]1CCCC[C@@H]1OC(F)F)Nc1ccccc1[N+](=O)[O-] ZINC000337414668 474992139 /nfs/dbraw/zinc/99/21/39/474992139.db2.gz OXHJPPIFFMXPKG-AAEUAGOBSA-N 0 3 343.330 2.673 20 5 EFBDHN CN1CC=C(CNC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000293472943 474997294 /nfs/dbraw/zinc/99/72/94/474997294.db2.gz MKMWWWCLGNIRQB-UHFFFAOYSA-N 0 3 343.305 2.605 20 5 EFBDHN O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc2c(c1F)CCNC2 ZINC000261626540 475001802 /nfs/dbraw/zinc/00/18/02/475001802.db2.gz AJLHWEHDYDDEOR-UHFFFAOYSA-N 0 3 343.358 2.951 20 5 EFBDHN O=[N+]([O-])c1cnc(N2CCCN(CCCc3ccccc3)CC2)nc1 ZINC000273675019 475007890 /nfs/dbraw/zinc/00/78/90/475007890.db2.gz YFVBEJGBQVVQPN-UHFFFAOYSA-N 0 3 341.415 2.530 20 5 EFBDHN Cc1ccc(C(=O)NCCN[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000285405025 475009132 /nfs/dbraw/zinc/00/91/32/475009132.db2.gz XLMMBBBJIHHDAX-ZDUSSCGKSA-N 0 3 342.399 2.566 20 5 EFBDHN CN1CC[C@]2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4o3)C2)C1 ZINC000292416877 475014007 /nfs/dbraw/zinc/01/40/07/475014007.db2.gz ZYVBEJGHFSLYQW-KRWDZBQOSA-N 0 3 329.356 2.509 20 5 EFBDHN CN(C)CCOc1cccc(NC(=O)c2ccc(F)cc2[N+](=O)[O-])c1 ZINC000327750954 475023836 /nfs/dbraw/zinc/02/38/36/475023836.db2.gz ZWXMXMGANHJYNE-UHFFFAOYSA-N 0 3 347.346 2.927 20 5 EFBDHN COCCN1CC[C@@H](Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000328513552 475030456 /nfs/dbraw/zinc/03/04/56/475030456.db2.gz ORGUEAJHAFKQJF-LLVKDONJSA-N 0 3 333.310 2.746 20 5 EFBDHN CN1CC[C@@]2(CCN(C(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3F)C2)C1 ZINC000292486773 475051394 /nfs/dbraw/zinc/05/13/94/475051394.db2.gz FAGWTNNJPBIEMJ-GOSISDBHSA-N 0 3 349.406 2.566 20 5 EFBDHN Cc1ccc(C(=O)N2CCN(C3CCC3)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000292506069 475061883 /nfs/dbraw/zinc/06/18/83/475061883.db2.gz XSQJOZIVMNHXSB-ZDUSSCGKSA-N 0 3 331.416 2.850 20 5 EFBDHN CCN(CC)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])n1C)c1ccccc1 ZINC000345292771 475066050 /nfs/dbraw/zinc/06/60/50/475066050.db2.gz ILSCGZYVMGORNX-INIZCTEOSA-N 0 3 344.415 2.746 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(C2CCC2)C[C@H](C)C1 ZINC000292528766 475071977 /nfs/dbraw/zinc/07/19/77/475071977.db2.gz ZIKZDPHBFWINNX-ZDUSSCGKSA-N 0 3 331.416 2.850 20 5 EFBDHN CNC(=O)[C@]1(C)CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000281217785 475120476 /nfs/dbraw/zinc/12/04/76/475120476.db2.gz UTKGZVBYGNVFRN-GOSISDBHSA-N 0 3 343.383 2.813 20 5 EFBDHN CCN1CCCC[C@@H]1CNc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000281221183 475122602 /nfs/dbraw/zinc/12/26/02/475122602.db2.gz RFJCNJPAKZNPOT-GFCCVEGCSA-N 0 3 331.376 2.530 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)N1C[C@H](N2CCCC2)C[C@H]1C ZINC000287415619 475137479 /nfs/dbraw/zinc/13/74/79/475137479.db2.gz DIDBMCMUECBHGY-TZMCWYRMSA-N 0 3 348.403 2.694 20 5 EFBDHN CCN1CCCN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000273964787 475139266 /nfs/dbraw/zinc/13/92/66/475139266.db2.gz PYDPGSGJNYLCGX-UHFFFAOYSA-N 0 3 337.395 2.566 20 5 EFBDHN C[C@@H](CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)N(C)C1CC1 ZINC000273996776 475156242 /nfs/dbraw/zinc/15/62/42/475156242.db2.gz YWXZZXHVCRFEES-NSHDSACASA-N 0 3 337.395 2.610 20 5 EFBDHN CCO[C@H]1C[C@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C12CCC2 ZINC000296052104 475180358 /nfs/dbraw/zinc/18/03/58/475180358.db2.gz FTSVUXPECKHHED-HOTGVXAUSA-N 0 3 347.415 2.779 20 5 EFBDHN COc1cc(CN([C@@H](C)CO)C2CCCC2)c([N+](=O)[O-])cc1F ZINC000287561464 475196390 /nfs/dbraw/zinc/19/63/90/475196390.db2.gz BFCGUKNLYBDCLY-NSHDSACASA-N 0 3 326.368 2.868 20 5 EFBDHN O=C(N[C@@H]1CCN(CC2CC2)C1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000609382861 480154469 /nfs/dbraw/zinc/15/44/69/480154469.db2.gz FWSHGWDSMMFPCH-CYBMUJFWSA-N 0 3 329.356 2.555 20 5 EFBDHN CC[C@@H](C)N1CCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000296264632 475245066 /nfs/dbraw/zinc/24/50/66/475245066.db2.gz XZCDEVHBCSMGBO-OAHLLOKOSA-N 0 3 348.447 2.648 20 5 EFBDHN CC[C@H](C)N1CCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000296264627 475245107 /nfs/dbraw/zinc/24/51/07/475245107.db2.gz XZCDEVHBCSMGBO-HNNXBMFYSA-N 0 3 348.447 2.648 20 5 EFBDHN Cc1nc(NC2CCN(CCc3ccccc3)CC2)ncc1[N+](=O)[O-] ZINC000296272806 475247125 /nfs/dbraw/zinc/24/71/25/475247125.db2.gz GXHXIPIKXYLDHP-UHFFFAOYSA-N 0 3 341.415 2.812 20 5 EFBDHN O=C(CCc1cccc([N+](=O)[O-])c1)NC[C@@H]1NCCc2ccccc21 ZINC000262467596 475247355 /nfs/dbraw/zinc/24/73/55/475247355.db2.gz XYDQRBXDTQHZRG-SFHVURJKSA-N 0 3 339.395 2.531 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCN1CCC[C@H]1Cc1ccc(F)cc1 ZINC000361178660 475248363 /nfs/dbraw/zinc/24/83/63/475248363.db2.gz QYPOGEVGNUOYAK-INIZCTEOSA-N 0 3 345.374 2.603 20 5 EFBDHN CCO[C@@H]1C[C@@H](N(C)CCn2ccc([N+](=O)[O-])n2)C12CCCCC2 ZINC000357904922 475249345 /nfs/dbraw/zinc/24/93/45/475249345.db2.gz BNQVIFRCBQOIQY-HUUCEWRRSA-N 0 3 336.436 2.851 20 5 EFBDHN COc1cc(CN2CCC(Cc3nccn3C)CC2)ccc1[N+](=O)[O-] ZINC000352400206 475257907 /nfs/dbraw/zinc/25/79/07/475257907.db2.gz PXQTZKJJZDMCGZ-UHFFFAOYSA-N 0 3 344.415 2.792 20 5 EFBDHN O=C(NC[C@@H]1CCCCN1C1CC1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000347354933 475259337 /nfs/dbraw/zinc/25/93/37/475259337.db2.gz GXKCFNREYLHSCM-AWEZNQCLSA-N 0 3 337.807 2.995 20 5 EFBDHN C[C@H]1[C@@H](O)CCCN1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000296369254 475286085 /nfs/dbraw/zinc/28/60/85/475286085.db2.gz SNIBFFNKGAWAHT-WFASDCNBSA-N 0 3 331.372 2.638 20 5 EFBDHN C[C@H]1[C@H](O)CCCN1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000296369250 475286629 /nfs/dbraw/zinc/28/66/29/475286629.db2.gz SNIBFFNKGAWAHT-SWLSCSKDSA-N 0 3 331.372 2.638 20 5 EFBDHN COCCN(C)CC[C@H](Nc1ncc([N+](=O)[O-])cn1)c1ccccc1 ZINC000354608464 475286982 /nfs/dbraw/zinc/28/69/82/475286982.db2.gz RWTLAPXNEMLGRJ-INIZCTEOSA-N 0 3 345.403 2.506 20 5 EFBDHN CC(C)C[C@H]1CCCN1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000354681854 475335399 /nfs/dbraw/zinc/33/53/99/475335399.db2.gz JWRNWQUGKVVCAP-OAHLLOKOSA-N 0 3 331.416 2.994 20 5 EFBDHN Cc1cc(F)c(NC(=O)N[C@H](C)C2=CCN(C)CC2)cc1[N+](=O)[O-] ZINC000296662047 475417963 /nfs/dbraw/zinc/41/79/63/475417963.db2.gz GOKKFZZWMYUJFO-LLVKDONJSA-N 0 3 336.367 2.814 20 5 EFBDHN C[C@@H]1[C@@H](NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)CCCN1C ZINC000345756433 475424223 /nfs/dbraw/zinc/42/42/23/475424223.db2.gz SLEWFQXVEVGIIG-DOMZBBRYSA-N 0 3 334.420 2.612 20 5 EFBDHN Cc1cc(F)c(NC(=O)N2CC[C@H]3CCN(C)C[C@@H]32)cc1[N+](=O)[O-] ZINC000296685694 475428555 /nfs/dbraw/zinc/42/85/55/475428555.db2.gz JACPPDDIISDMGW-ABAIWWIYSA-N 0 3 336.367 2.600 20 5 EFBDHN CNC(=O)[C@@H]1CCC[C@@H]1NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000345824525 475484543 /nfs/dbraw/zinc/48/45/43/475484543.db2.gz WZUBHVANKLAKAK-CVEARBPZSA-N 0 3 343.383 2.859 20 5 EFBDHN C[C@H]1CN(Cc2c(F)cc([N+](=O)[O-])cc2F)CCN(C2CC2)C1 ZINC000296823687 475492225 /nfs/dbraw/zinc/49/22/25/475492225.db2.gz VVJAUFFSOAJSPF-NSHDSACASA-N 0 3 325.359 2.789 20 5 EFBDHN C[C@H](Cn1cccn1)NCCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000354920102 475521430 /nfs/dbraw/zinc/52/14/30/475521430.db2.gz NCWPMVUNBOFKFY-CYBMUJFWSA-N 0 3 341.371 2.667 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21 ZINC000332184043 475547323 /nfs/dbraw/zinc/54/73/23/475547323.db2.gz ATXJKJVFTFAMPI-GDBMZVCRSA-N 0 3 331.416 2.768 20 5 EFBDHN COc1ccc(NC(=O)CN(CC2CC2)C2CCC2)c([N+](=O)[O-])c1 ZINC000361581637 475566819 /nfs/dbraw/zinc/56/68/19/475566819.db2.gz HHESAPTUJUFRJO-UHFFFAOYSA-N 0 3 333.388 2.806 20 5 EFBDHN CCOc1cccc(NC[C@]2(N(C)C)CCSC2)c1[N+](=O)[O-] ZINC000358294483 475568039 /nfs/dbraw/zinc/56/80/39/475568039.db2.gz YKUDHXXOFRJFTD-OAHLLOKOSA-N 0 3 325.434 2.843 20 5 EFBDHN CCCN1CCC[C@H]1CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000358311911 475581651 /nfs/dbraw/zinc/58/16/51/475581651.db2.gz LLLJYKPIKKGJLN-HNNXBMFYSA-N 0 3 334.420 2.611 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@@H](CO)CCSC)cc1[N+](=O)[O-] ZINC000358315904 475585354 /nfs/dbraw/zinc/58/53/54/475585354.db2.gz HRLKMCXILWDAEH-WCQYABFASA-N 0 3 328.434 2.758 20 5 EFBDHN CN(Cc1ccc(Cl)cc1[N+](=O)[O-])C1(CCO)CCOCC1 ZINC000355006535 475591987 /nfs/dbraw/zinc/59/19/87/475591987.db2.gz OPRKSWXDPMLVMI-UHFFFAOYSA-N 0 3 328.796 2.612 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN[C@@H](CCO)C1CCCCC1 ZINC000355018527 475601690 /nfs/dbraw/zinc/60/16/90/475601690.db2.gz XPCIYFBXTOKZRB-HNNXBMFYSA-N 0 3 349.431 2.763 20 5 EFBDHN CN1CC[C@H]2[C@H](CCCN2C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000332391081 475622823 /nfs/dbraw/zinc/62/28/23/475622823.db2.gz VSBNDZUGFBDNGA-PBHICJAKSA-N 0 3 345.443 2.815 20 5 EFBDHN CN1CC[C@@H]2[C@H](CCCN2C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000332391082 475623125 /nfs/dbraw/zinc/62/31/25/475623125.db2.gz VSBNDZUGFBDNGA-RHSMWYFYSA-N 0 3 345.443 2.815 20 5 EFBDHN CN1CC[C@@H]2[C@@H](CCCN2C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000332391566 475623394 /nfs/dbraw/zinc/62/33/94/475623394.db2.gz VSBNDZUGFBDNGA-WMLDXEAASA-N 0 3 345.443 2.815 20 5 EFBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[C@H](N2CCN(C)CC2)[C@H](C)C1 ZINC000332398325 475624880 /nfs/dbraw/zinc/62/48/80/475624880.db2.gz QRTJQZQGXAGOQZ-RYRKJORJSA-N 0 3 346.475 2.614 20 5 EFBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[C@@H](N2CCN(C)CC2)[C@H](C)C1 ZINC000332394238 475625133 /nfs/dbraw/zinc/62/51/33/475625133.db2.gz NWMSVDZROBHDJZ-GPMSIDNRSA-N 0 3 346.475 2.614 20 5 EFBDHN C[C@@H]1CSC[C@@H]1NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000352803191 475640397 /nfs/dbraw/zinc/64/03/97/475640397.db2.gz XXMXRRRQTVLQGD-KCJUWKMLSA-N 0 3 329.809 2.528 20 5 EFBDHN Cc1ccc([C@@H](CNC(=O)c2ccc([N+](=O)[O-])[nH]2)N2CCCC2)cc1 ZINC000346552981 475653232 /nfs/dbraw/zinc/65/32/32/475653232.db2.gz DEJCUNVUVQHJQY-MRXNPFEDSA-N 0 3 342.399 2.798 20 5 EFBDHN CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)CSc1ccccc1[N+](=O)[O-] ZINC000332577177 475673883 /nfs/dbraw/zinc/67/38/83/475673883.db2.gz GKLSCFCFYHOIFJ-ZIAGYGMSSA-N 0 3 349.456 2.772 20 5 EFBDHN CCNc1ccc(C(=O)N2C[C@@H]3CCCN3C[C@H]2CC)cc1[N+](=O)[O-] ZINC000332655467 475704293 /nfs/dbraw/zinc/70/42/93/475704293.db2.gz VKLSFEZZDSUGEK-CABCVRRESA-N 0 3 346.431 2.725 20 5 EFBDHN CCNc1ccc(C(=O)N2C[C@H]3CCCN3C[C@@H]2CC)cc1[N+](=O)[O-] ZINC000332655474 475704467 /nfs/dbraw/zinc/70/44/67/475704467.db2.gz VKLSFEZZDSUGEK-LSDHHAIUSA-N 0 3 346.431 2.725 20 5 EFBDHN C[C@H](N[C@@H]1CCC[C@@H]1OC(F)F)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000348521499 475721954 /nfs/dbraw/zinc/72/19/54/475721954.db2.gz QIIXKFLQXCINPG-NDMJEZRESA-N 0 3 343.330 2.672 20 5 EFBDHN CN1CCN(CCCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000338276148 475736155 /nfs/dbraw/zinc/73/61/55/475736155.db2.gz AKXYHQMQFSVIQA-UHFFFAOYSA-N 0 3 346.353 2.663 20 5 EFBDHN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@]2(CCN(C)C2)C1 ZINC000297420155 475750188 /nfs/dbraw/zinc/75/01/88/475750188.db2.gz OAOKYVTVLITJIY-KRWDZBQOSA-N 0 3 332.404 2.717 20 5 EFBDHN C[C@@H](CN1CCC[C@H](C)C1)NC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000340095847 475756603 /nfs/dbraw/zinc/75/66/03/475756603.db2.gz TYACZWGSRMVEPM-GJZGRUSLSA-N 0 3 348.447 2.557 20 5 EFBDHN NC(=O)CC1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000297439303 475758853 /nfs/dbraw/zinc/75/88/53/475758853.db2.gz PITDXVMYUTYFPY-UHFFFAOYSA-N 0 3 331.397 2.631 20 5 EFBDHN O=[N+]([O-])c1ccc(CNC[C@@]2(CO)C[C@H]2c2ccccc2)c(F)c1 ZINC000353191903 475759079 /nfs/dbraw/zinc/75/90/79/475759079.db2.gz LAFOVIZMUDXOIF-FUHWJXTLSA-N 0 3 330.359 2.990 20 5 EFBDHN Cc1c(CNC(=O)N[C@H](C)CN2CCCCC2)cccc1[N+](=O)[O-] ZINC000358545196 475760059 /nfs/dbraw/zinc/76/00/59/475760059.db2.gz MHGDKJSGRFDXET-CYBMUJFWSA-N 0 3 334.420 2.577 20 5 EFBDHN Cc1c(CNC(=O)NC[C@@H](C)N2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000358557178 475769295 /nfs/dbraw/zinc/76/92/95/475769295.db2.gz KEBUEKSPXWFUIF-UONOGXRCSA-N 0 3 348.447 2.823 20 5 EFBDHN C[C@@H](CNC(=O)NCCc1cccc([N+](=O)[O-])c1)N1CCCC[C@H]1C ZINC000340118730 475772687 /nfs/dbraw/zinc/77/26/87/475772687.db2.gz VGSTYGBTJNPGKH-CABCVRRESA-N 0 3 348.447 2.699 20 5 EFBDHN CN(C)Cc1cccc(C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000338332632 475796636 /nfs/dbraw/zinc/79/66/36/475796636.db2.gz OORJLUYYTLLHBL-UHFFFAOYSA-N 0 3 341.411 2.971 20 5 EFBDHN C[C@H](C(=O)N(C)CCc1cccc([N+](=O)[O-])c1)N1[C@H](C)CC[C@H]1C ZINC000338334934 475798857 /nfs/dbraw/zinc/79/88/57/475798857.db2.gz UCGHKKGJRRQIOF-RBSFLKMASA-N 0 3 333.432 2.857 20 5 EFBDHN CN(Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)[C@H]1CCCOC1 ZINC000348706947 475826633 /nfs/dbraw/zinc/82/66/33/475826633.db2.gz IICDVADVYQZYJC-INIZCTEOSA-N 0 3 330.388 2.606 20 5 EFBDHN Cc1c(NC(=O)[C@H](C)N[C@@H](C)[C@H]2CCCOC2)cccc1[N+](=O)[O-] ZINC000355341436 475843704 /nfs/dbraw/zinc/84/37/04/475843704.db2.gz JRPJECJLTAESSV-IHRRRGAJSA-N 0 3 335.404 2.635 20 5 EFBDHN Cc1nc(N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000297667691 475850269 /nfs/dbraw/zinc/85/02/69/475850269.db2.gz ZQIHCOJZHOACJH-WFASDCNBSA-N 0 3 327.388 2.768 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](C)N2CCCC[C@H]2C)c1 ZINC000338408868 475875598 /nfs/dbraw/zinc/87/55/98/475875598.db2.gz KPDBSNVIPVVBPK-ZIAGYGMSSA-N 0 3 349.431 2.986 20 5 EFBDHN C[C@@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1)N(C)Cc1ccccc1 ZINC000346847686 475907711 /nfs/dbraw/zinc/90/77/11/475907711.db2.gz MQTYAHSEABALSA-ZDUSSCGKSA-N 0 3 345.374 2.984 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCC1(N(C)C)CCC1 ZINC000353382322 475924408 /nfs/dbraw/zinc/92/44/08/475924408.db2.gz PAQHIXQNUKFFKO-OAHLLOKOSA-N 0 3 333.432 2.764 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCC1(N(C)C)CCC1 ZINC000353382321 475925143 /nfs/dbraw/zinc/92/51/43/475925143.db2.gz PAQHIXQNUKFFKO-HNNXBMFYSA-N 0 3 333.432 2.764 20 5 EFBDHN Cc1cc(CN(C)C)cc(NC(=O)c2cccc([N+](=O)[O-])c2N)c1 ZINC000340337458 475959158 /nfs/dbraw/zinc/95/91/58/475959158.db2.gz QWJGKUVEXMMRMX-UHFFFAOYSA-N 0 3 328.372 2.799 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NCC(C)(C)N2CCCCC2)c1 ZINC000338513493 475971476 /nfs/dbraw/zinc/97/14/76/475971476.db2.gz ZSMAJGKAVPPCFA-UHFFFAOYSA-N 0 3 349.431 2.988 20 5 EFBDHN CCn1ccnc1[C@@H]1OCC[C@@H]1NCc1ccc([N+](=O)[O-])cc1C ZINC000343408096 476037520 /nfs/dbraw/zinc/03/75/20/476037520.db2.gz WZTPICBIQLBOBF-JKSUJKDBSA-N 0 3 330.388 2.739 20 5 EFBDHN COc1c(C(=O)NCC(C)(C)N2CCCCC2)cccc1[N+](=O)[O-] ZINC000353533069 476052663 /nfs/dbraw/zinc/05/26/63/476052663.db2.gz HZXCNGZORYWFKK-UHFFFAOYSA-N 0 3 335.404 2.598 20 5 EFBDHN O=[N+]([O-])c1cc(F)ccc1NC[C@]1(O)CCN(Cc2ccccc2)C1 ZINC000355755261 476059489 /nfs/dbraw/zinc/05/94/89/476059489.db2.gz ODKAQRNTXIRYCB-GOSISDBHSA-N 0 3 345.374 2.783 20 5 EFBDHN C[C@H]1C[C@@H](N2CCCC2)CN1c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000343593042 476090747 /nfs/dbraw/zinc/09/07/47/476090747.db2.gz PBIMYMXOJCPLJT-SWLSCSKDSA-N 0 3 343.387 2.708 20 5 EFBDHN CN1CCC[C@@]2(CCN(C(=O)C(C)(C)c3ccccc3[N+](=O)[O-])C2)C1 ZINC000356265709 476095454 /nfs/dbraw/zinc/09/54/54/476095454.db2.gz XUFFNBSIZMZWJD-LJQANCHMSA-N 0 3 345.443 2.817 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(NC[C@@H]2C[C@@H](O)CN2Cc2ccccc2)c1 ZINC000340573711 476114869 /nfs/dbraw/zinc/11/48/69/476114869.db2.gz MTFJCZTXIFVUSB-DLBZAZTESA-N 0 3 341.411 2.951 20 5 EFBDHN COc1ccc(-c2ccc(CNC[C@@H]3CCOC3)o2)c([N+](=O)[O-])c1 ZINC000338716002 476128801 /nfs/dbraw/zinc/12/88/01/476128801.db2.gz JXUYGNATFJNMHZ-LBPRGKRZSA-N 0 3 332.356 2.990 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CNC[C@@H]2COCCO2)s1 ZINC000338716249 476129076 /nfs/dbraw/zinc/12/90/76/476129076.db2.gz OWBAPOGDXQOGOP-GFCCVEGCSA-N 0 3 334.397 2.828 20 5 EFBDHN COc1ccc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1C ZINC000353705483 476204903 /nfs/dbraw/zinc/20/49/03/476204903.db2.gz FRRDPRFAKKNCIF-HNNXBMFYSA-N 0 3 342.399 2.993 20 5 EFBDHN O=C(Nc1cc(F)cc([N+](=O)[O-])c1)N1CC[C@@H](N2CCCCC2)C1 ZINC000347255206 476208599 /nfs/dbraw/zinc/20/85/99/476208599.db2.gz FJVQNUQYHYLOAA-CQSZACIVSA-N 0 3 336.367 2.826 20 5 EFBDHN O=[N+]([O-])c1cccc(CN[C@H](CO)Cc2c[nH]c3ccccc23)c1 ZINC000344315357 476243273 /nfs/dbraw/zinc/24/32/73/476243273.db2.gz IUGAUYGTQLOBDP-HNNXBMFYSA-N 0 3 325.368 2.769 20 5 EFBDHN COC(=O)COc1ccc(CN[C@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000353756757 476249791 /nfs/dbraw/zinc/24/97/91/476249791.db2.gz GYKYVRCLZBVTCV-CYBMUJFWSA-N 0 3 344.367 2.997 20 5 EFBDHN Cn1c(C(=O)N(CCN2CCCCCC2)C2CCC2)ccc1[N+](=O)[O-] ZINC000359813002 476265287 /nfs/dbraw/zinc/26/52/87/476265287.db2.gz WRFFXFTYJIFIDG-UHFFFAOYSA-N 0 3 348.447 2.804 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(NCCc2ccc(OCCN(C)C)cc2)n1 ZINC000360677091 476338974 /nfs/dbraw/zinc/33/89/74/476338974.db2.gz VBHZTDCILPUEPA-UHFFFAOYSA-N 0 3 344.415 2.893 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCCN(C)[C@H]1C ZINC000360800573 476396241 /nfs/dbraw/zinc/39/62/41/476396241.db2.gz OFJKIOZRJCQXGS-LXZKKBNFSA-N 0 3 333.432 2.762 20 5 EFBDHN O=[N+]([O-])c1ccc(NC[C@@H]2CN3CCC[C@@H]3CO2)cc1C(F)(F)F ZINC000363622883 476465149 /nfs/dbraw/zinc/46/51/49/476465149.db2.gz CVXVXFLVYMYHPV-VXGBXAGGSA-N 0 3 345.321 2.889 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CN(C2CC2)C[C@H]1C ZINC000360944811 476492417 /nfs/dbraw/zinc/49/24/17/476492417.db2.gz PCMNZAKZDNOYCW-DDUZABMNSA-N 0 3 345.443 2.762 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@H]2CCN(C)C[C@H]21 ZINC000360944824 476493432 /nfs/dbraw/zinc/49/34/32/476493432.db2.gz PENLEPBXHMMYCX-SOLBZPMBSA-N 0 3 345.443 2.716 20 5 EFBDHN O=C1O[C@H](CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)CC12CC2 ZINC000369736085 476500732 /nfs/dbraw/zinc/50/07/32/476500732.db2.gz MHQJOCIKKQRFQI-INIZCTEOSA-N 0 3 346.383 2.534 20 5 EFBDHN CS[C@@H]1CN(c2cc([N+](=O)[O-])ccc2C(C)=O)C[C@@H]1N1CCCC1 ZINC000361016494 476545713 /nfs/dbraw/zinc/54/57/13/476545713.db2.gz ZIYAMDSXHNAYKH-DLBZAZTESA-N 0 3 349.456 2.813 20 5 EFBDHN O=[N+]([O-])c1ccc(CNc2cccc(CN3CC[C@@H](O)C3)c2)c(F)c1 ZINC000361074112 476584024 /nfs/dbraw/zinc/58/40/24/476584024.db2.gz ARFPUERFXJLMOD-QGZVFWFLSA-N 0 3 345.374 2.913 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](C)N2CCCC[C@@H]2C)c1 ZINC000354343021 476598475 /nfs/dbraw/zinc/59/84/75/476598475.db2.gz HWNQKGPQORXBMW-QWHCGFSZSA-N 0 3 335.404 2.596 20 5 EFBDHN CC(C)NC(=O)c1ccc(N[C@@H]2CCN(C)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000361100197 476601736 /nfs/dbraw/zinc/60/17/36/476601736.db2.gz XYMQOHYMXHPLJV-GXTWGEPZSA-N 0 3 334.420 2.628 20 5 EFBDHN CNc1c(C(=O)NCC(C)(C)N2CCCCC2)cccc1[N+](=O)[O-] ZINC000361124091 476617612 /nfs/dbraw/zinc/61/76/12/476617612.db2.gz RHHURIBHBRFURS-UHFFFAOYSA-N 0 3 334.420 2.631 20 5 EFBDHN CCc1cnccc1[C@@H](C)NC[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000361129206 476621313 /nfs/dbraw/zinc/62/13/13/476621313.db2.gz DKOGCHYGNBRRJV-CZUORRHYSA-N 0 3 345.399 2.643 20 5 EFBDHN CC1CCC(O)(CN2CCN(c3cccc([N+](=O)[O-])c3)CC2)CC1 ZINC000357833175 476637967 /nfs/dbraw/zinc/63/79/67/476637967.db2.gz CQINSELGAFKNIR-UHFFFAOYSA-N 0 3 333.432 2.658 20 5 EFBDHN C[C@H]1CN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@H](C)N1C ZINC000354436809 476661881 /nfs/dbraw/zinc/66/18/81/476661881.db2.gz CWRWABAWJRRVLJ-KBPBESRZSA-N 0 3 343.431 2.520 20 5 EFBDHN COCCN1CCC(Nc2ccc([N+](=O)[O-])cc2OC(F)F)CC1 ZINC000354501345 476690065 /nfs/dbraw/zinc/69/00/65/476690065.db2.gz DMVYATDBQLFCOW-UHFFFAOYSA-N 0 3 345.346 2.719 20 5 EFBDHN CC(C)N1CCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000413707263 476699814 /nfs/dbraw/zinc/69/98/14/476699814.db2.gz BGXZJAQYKCHJKS-HYVNUMGLSA-N 0 3 331.416 2.687 20 5 EFBDHN CCCCN1CCCC[C@H]1CNC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000354517712 476702275 /nfs/dbraw/zinc/70/22/75/476702275.db2.gz XAYVMGSDWWVSIV-ZDUSSCGKSA-N 0 3 334.420 2.561 20 5 EFBDHN CCCCN1CCCC[C@@H]1CNC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000354517710 476703242 /nfs/dbraw/zinc/70/32/42/476703242.db2.gz XAYVMGSDWWVSIV-CYBMUJFWSA-N 0 3 334.420 2.561 20 5 EFBDHN Cc1cc(N2CC[C@H]3CCN(C)C[C@H]32)c2cccc([N+](=O)[O-])c2n1 ZINC000378508159 476717480 /nfs/dbraw/zinc/71/74/80/476717480.db2.gz OWDSASWMSUMHJU-CXAGYDPISA-N 0 3 326.400 2.982 20 5 EFBDHN COC(=O)[C@@H]1CCCC[C@@]1(C)NCc1ccc([N+](=O)[O-])cc1OC ZINC000430199038 476779385 /nfs/dbraw/zinc/77/93/85/476779385.db2.gz AVTYLFINGRKMKL-WMLDXEAASA-N 0 3 336.388 2.815 20 5 EFBDHN Cc1nn(C)cc1[C@H]1CCCN1CCOc1ccc([N+](=O)[O-])cc1 ZINC000370406876 476794879 /nfs/dbraw/zinc/79/48/79/476794879.db2.gz QILOUMKBRQQNBH-QGZVFWFLSA-N 0 3 330.388 2.853 20 5 EFBDHN CC1(C)CCCN1CCNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000457066972 476857617 /nfs/dbraw/zinc/85/76/17/476857617.db2.gz BGDAERXRXFAFGZ-UHFFFAOYSA-N 0 3 331.372 2.945 20 5 EFBDHN CSc1ccc(C(=O)N(C)[C@H]2CCN(C(C)C)C2)cc1[N+](=O)[O-] ZINC000457084522 476865613 /nfs/dbraw/zinc/86/56/13/476865613.db2.gz LOEGUNPLJRSHMD-ZDUSSCGKSA-N 0 3 337.445 2.871 20 5 EFBDHN CC(C)(C(=O)NCc1ccc([N+](=O)[O-])cc1)[C@H](N)c1ccccc1 ZINC000422965831 476871067 /nfs/dbraw/zinc/87/10/67/476871067.db2.gz PVNWUYJCSQEFQG-MRXNPFEDSA-N 0 3 327.384 2.937 20 5 EFBDHN CC(C)N1CC[C@@H](N(C)C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000457113183 476884143 /nfs/dbraw/zinc/88/41/43/476884143.db2.gz JWCVCNHTVUJGSW-CYBMUJFWSA-N 0 3 325.796 2.803 20 5 EFBDHN COC1(CO)CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000447098475 476954785 /nfs/dbraw/zinc/95/47/85/476954785.db2.gz HNMYKFFNOCHZTD-UHFFFAOYSA-N 0 3 346.383 2.828 20 5 EFBDHN Cc1c(NC(=O)[C@H](C)NC2(C3CC3)CCOCC2)cccc1[N+](=O)[O-] ZINC000375700150 476960219 /nfs/dbraw/zinc/96/02/19/476960219.db2.gz DEYLAKZAIDIEFE-ZDUSSCGKSA-N 0 3 347.415 2.779 20 5 EFBDHN O=C(NCCc1ccccc1[N+](=O)[O-])Nc1ccc2c(c1)CNCC2 ZINC000415900565 476962375 /nfs/dbraw/zinc/96/23/75/476962375.db2.gz UBRCVPXGHDCUJF-UHFFFAOYSA-N 0 3 340.383 2.605 20 5 EFBDHN CC(C)(C(=O)NCCc1ccccc1[N+](=O)[O-])[C@@H](N)c1ccccc1 ZINC000423226989 476968296 /nfs/dbraw/zinc/96/82/96/476968296.db2.gz TVLMYYATBYZBII-KRWDZBQOSA-N 0 3 341.411 2.980 20 5 EFBDHN NCc1cccnc1NC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000415987921 476978134 /nfs/dbraw/zinc/97/81/34/476978134.db2.gz MBJDYEIIIDWALR-UHFFFAOYSA-N 0 3 341.371 2.645 20 5 EFBDHN Cc1ccc(CN[C@@H]2CCCN(C(=O)N3CCCC3)C2)cc1[N+](=O)[O-] ZINC000375757433 476989782 /nfs/dbraw/zinc/98/97/82/476989782.db2.gz ZTSXXXSHORQSIQ-MRXNPFEDSA-N 0 3 346.431 2.673 20 5 EFBDHN C[C@@H](Nc1ccn(C2CCN(C)CC2)n1)c1ccccc1[N+](=O)[O-] ZINC000447412200 476991343 /nfs/dbraw/zinc/99/13/43/476991343.db2.gz FMOQNWQUEFEWOB-CYBMUJFWSA-N 0 3 329.404 2.653 20 5 EFBDHN CN(C)c1cccc(CN[C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)n1 ZINC000447589642 477018459 /nfs/dbraw/zinc/01/84/59/477018459.db2.gz YTHOYUSLKGSGBH-CABCVRRESA-N 0 3 344.419 2.526 20 5 EFBDHN CN(C)CC1(NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)CCC1 ZINC000410817231 477062947 /nfs/dbraw/zinc/06/29/47/477062947.db2.gz IOCHHPCGTGDSEW-UHFFFAOYSA-N 0 3 345.321 2.828 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N[C@@H]1CCN(C)[C@@H](C)C1 ZINC000447810571 477064280 /nfs/dbraw/zinc/06/42/80/477064280.db2.gz JQYUQKQAFWEBDD-VHSXEESVSA-N 0 3 341.795 2.929 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)CCN1C ZINC000431666438 477071407 /nfs/dbraw/zinc/07/14/07/477071407.db2.gz TYLBXHPCNIQZGL-JSGCOSHPSA-N 0 3 334.420 2.612 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NC(C)(C)CN2CCCC2)c1 ZINC000411082966 477108120 /nfs/dbraw/zinc/10/81/20/477108120.db2.gz CAKQRNFILXLLRP-UHFFFAOYSA-N 0 3 335.404 2.598 20 5 EFBDHN CN1CCCC(C)(C)[C@@H]1CNC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000447980457 477109056 /nfs/dbraw/zinc/10/90/56/477109056.db2.gz XAUARRPTNGPOOE-HNNXBMFYSA-N 0 3 334.420 2.514 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)NC(C)(C)CN2CCCC2)c1 ZINC000411089862 477109675 /nfs/dbraw/zinc/10/96/75/477109675.db2.gz XPZFTKRVJZFMAJ-UHFFFAOYSA-N 0 3 337.445 2.921 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H](CO)[C@H]2CCCO2)s1 ZINC000447990195 477110447 /nfs/dbraw/zinc/11/04/47/477110447.db2.gz RDDVGRAFVFGCGZ-GDBMZVCRSA-N 0 3 348.424 2.953 20 5 EFBDHN CN1CCCC(C)(C)[C@@H]1CNC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000447988934 477111220 /nfs/dbraw/zinc/11/12/20/477111220.db2.gz IRKICPODEHTAHM-INIZCTEOSA-N 0 3 348.447 2.557 20 5 EFBDHN CC[C@@H]1CCCCN1CCNC(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000432001427 477136295 /nfs/dbraw/zinc/13/62/95/477136295.db2.gz XJYHIGCBQQKCKK-OAHLLOKOSA-N 0 3 349.431 2.663 20 5 EFBDHN CCN1CCN([C@@H](C)CNc2ccnc3c2cccc3[N+](=O)[O-])CC1 ZINC000432338026 477198200 /nfs/dbraw/zinc/19/82/00/477198200.db2.gz VTAPIXYKSOBHBH-AWEZNQCLSA-N 0 3 343.431 2.581 20 5 EFBDHN C[C@H](CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](C)C1 ZINC000411417146 477227147 /nfs/dbraw/zinc/22/71/47/477227147.db2.gz DXBUAVODJKEPFS-KJWYOANISA-N 0 3 345.443 2.935 20 5 EFBDHN CCc1ccccc1[C@@H](N)CNC(=O)c1cccc([N+](=O)[O-])c1C ZINC000423954611 477231821 /nfs/dbraw/zinc/23/18/21/477231821.db2.gz BVFXQYFGSLIOAG-INIZCTEOSA-N 0 3 327.384 2.895 20 5 EFBDHN Cc1cccc(C(=O)N2C[C@@H](c3cccc(F)c3)[C@H](N)C2)c1[N+](=O)[O-] ZINC000424007062 477258749 /nfs/dbraw/zinc/25/87/49/477258749.db2.gz FSUUHXXIDWEHKE-JKSUJKDBSA-N 0 3 343.358 2.609 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1C(=O)N1C[C@@H](c2ccccc2F)[C@H](N)C1 ZINC000424022339 477263526 /nfs/dbraw/zinc/26/35/26/477263526.db2.gz CYHRELOHKRHJOD-DZGCQCFKSA-N 0 3 343.358 2.609 20 5 EFBDHN CCOc1cc(NCCCN2CCCO[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000432871746 477283656 /nfs/dbraw/zinc/28/36/56/477283656.db2.gz JLXLZDSLAQQEKC-CQSZACIVSA-N 0 3 337.420 2.906 20 5 EFBDHN C[C@@H](CN1CCC[C@H](C)C1)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411604456 477290245 /nfs/dbraw/zinc/29/02/45/477290245.db2.gz NWEDQAKBLCGCNU-DFEHZGFQSA-N 0 3 345.443 2.935 20 5 EFBDHN CC1(C)C[C@@H](NC[C@@H](O)COCC2CC2)c2cc([N+](=O)[O-])ccc21 ZINC000433164194 477311880 /nfs/dbraw/zinc/31/18/80/477311880.db2.gz ZOHAVIZUZDTUCT-RHSMWYFYSA-N 0 3 334.416 2.694 20 5 EFBDHN C[C@H](CN1CCN(C)CC1)N[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433169408 477314427 /nfs/dbraw/zinc/31/44/27/477314427.db2.gz RGUOYJQHLGLRJV-KDOFPFPSSA-N 0 3 346.475 2.543 20 5 EFBDHN CC(=O)c1cc([N+](=O)[O-])ccc1N1CC[C@H](C2CCN(C)CC2)C1 ZINC000376403508 477316789 /nfs/dbraw/zinc/31/67/89/477316789.db2.gz OBCVDDZPQXOURJ-HNNXBMFYSA-N 0 3 331.416 2.966 20 5 EFBDHN CCCc1[nH]nc(C(=O)Nc2ccc(CN(C)C)c(C)c2)c1[N+](=O)[O-] ZINC000458289541 477336627 /nfs/dbraw/zinc/33/66/27/477336627.db2.gz RJOKEVGNOGMOIA-UHFFFAOYSA-N 0 3 345.403 2.893 20 5 EFBDHN COc1cccc(C(=O)NC[C@H](C)N2CCCC[C@H]2C)c1[N+](=O)[O-] ZINC000435541285 477349095 /nfs/dbraw/zinc/34/90/95/477349095.db2.gz HGRHZTIHJBZOBI-OLZOCXBDSA-N 0 3 335.404 2.596 20 5 EFBDHN O=[N+]([O-])c1cnc(NC[C@H]2CCCN(Cc3ccccc3)C2)s1 ZINC000367157969 477370304 /nfs/dbraw/zinc/37/03/04/477370304.db2.gz GQNMWSAROXRGGS-CQSZACIVSA-N 0 3 332.429 2.797 20 5 EFBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1C[C@H](C(N)=O)[C@@H](c2ccccc2)C1 ZINC000411991121 477401963 /nfs/dbraw/zinc/40/19/63/477401963.db2.gz YLSZCMZBHDJCKW-XKQJLSEDSA-N 0 3 339.395 2.857 20 5 EFBDHN CCOc1ccc(C(=O)N[C@@H]2CCN(C3CCCC3)C2)cc1[N+](=O)[O-] ZINC000371597501 477403152 /nfs/dbraw/zinc/40/31/52/477403152.db2.gz QNYJOCNZNBWTDK-CQSZACIVSA-N 0 3 347.415 2.740 20 5 EFBDHN O=[N+]([O-])c1ccc(Cl)cc1NC1CCN([C@H]2CCOC2)CC1 ZINC000367263147 477421056 /nfs/dbraw/zinc/42/10/56/477421056.db2.gz BTMSHZMASDRIDH-ZDUSSCGKSA-N 0 3 325.796 2.913 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N[C@@H](C)C(=O)N1CCCC[C@H]1C ZINC000449112429 477444042 /nfs/dbraw/zinc/44/40/42/477444042.db2.gz CIIJBTVFOGSZAX-KFWWJZLASA-N 0 3 333.432 2.905 20 5 EFBDHN CNC(=O)C[C@H](N[C@@H](C)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000449303321 477534713 /nfs/dbraw/zinc/53/47/13/477534713.db2.gz XVJXLWJGYUJGMA-YOEHRIQHSA-N 0 3 341.411 2.993 20 5 EFBDHN CN(C)[C@@]1(CNc2ccc([N+](=O)[O-])c3ncccc23)CCSC1 ZINC000413173432 477553430 /nfs/dbraw/zinc/55/34/30/477553430.db2.gz PBFWIIFFCVKCCU-MRXNPFEDSA-N 0 3 332.429 2.992 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N[C@@H](CC(N)=O)c1ccccc1 ZINC000449343010 477556325 /nfs/dbraw/zinc/55/63/25/477556325.db2.gz HCWCUSVKEKLLHP-CJNGLKHVSA-N 0 3 327.384 2.732 20 5 EFBDHN CN(C)CCN(Cc1ccc(F)cc1)c1ncc([N+](=O)[O-])cc1F ZINC000413190662 477561787 /nfs/dbraw/zinc/56/17/87/477561787.db2.gz KGYKSPXHNBXXNH-UHFFFAOYSA-N 0 3 336.342 2.836 20 5 EFBDHN C[C@H](CCN1CCN(C)CC1)Nc1ccc([N+](=O)[O-])c2ncccc12 ZINC000413223969 477578138 /nfs/dbraw/zinc/57/81/38/477578138.db2.gz DXTLXQKCXVMZDC-CQSZACIVSA-N 0 3 343.431 2.581 20 5 EFBDHN C[C@@H]1CN(c2nc(-c3ccc([N+](=O)[O-])cc3)no2)CCN(C2CC2)C1 ZINC000450551314 477630181 /nfs/dbraw/zinc/63/01/81/477630181.db2.gz ZLOJZMYLCQPRRL-LBPRGKRZSA-N 0 3 343.387 2.565 20 5 EFBDHN C[C@@H]1CN(CCC2CCN(c3ccc([N+](=O)[O-])nc3)CC2)C[C@H](C)O1 ZINC000426417591 477708246 /nfs/dbraw/zinc/70/82/46/477708246.db2.gz BQQROTGQCRUZKJ-GASCZTMLSA-N 0 3 348.447 2.706 20 5 EFBDHN O=C(N[C@@H]1[C@H]2CN(Cc3ccccc3)C[C@H]21)c1ccc([N+](=O)[O-])s1 ZINC000372329656 477758791 /nfs/dbraw/zinc/75/87/91/477758791.db2.gz COPYPOMVUVMXRU-VIKVFOODSA-N 0 3 343.408 2.517 20 5 EFBDHN O=[N+]([O-])c1ccc(S(=O)(=O)CCNC2CCC(F)(F)CC2)cc1 ZINC000515467105 477826626 /nfs/dbraw/zinc/82/66/26/477826626.db2.gz NFCHQADWCKZCLR-UHFFFAOYSA-N 0 3 348.371 2.536 20 5 EFBDHN Cc1ccccc1CCN(C)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000451168525 477857388 /nfs/dbraw/zinc/85/73/88/477857388.db2.gz VWVYOQBRXYRTGO-KRWDZBQOSA-N 0 3 344.411 2.817 20 5 EFBDHN COc1cc(C(=O)Nc2ccccc2CN(C)C)ccc1[N+](=O)[O-] ZINC000558700034 477922285 /nfs/dbraw/zinc/92/22/85/477922285.db2.gz KOMOCZJHKYQPRK-UHFFFAOYSA-N 0 3 329.356 2.917 20 5 EFBDHN CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N[C@@H]1CCN(C)[C@@H](C)C1 ZINC000462895574 477923280 /nfs/dbraw/zinc/92/32/80/477923280.db2.gz QUUZCHKYXRLESQ-WDEREUQCSA-N 0 3 339.367 2.805 20 5 EFBDHN CCOc1cc(CN[C@H](C)C2(OC)CCOCC2)ccc1[N+](=O)[O-] ZINC000421033771 477923403 /nfs/dbraw/zinc/92/34/03/477923403.db2.gz NBFNMWYBEZLGPY-CYBMUJFWSA-N 0 3 338.404 2.667 20 5 EFBDHN O=[N+]([O-])c1cccc(CNC[C@@]2(CO)C[C@@H]2c2ccc(F)cc2)c1 ZINC000428542746 477925167 /nfs/dbraw/zinc/92/51/67/477925167.db2.gz YFNKFXPMMMOIOL-QZTJIDSGSA-N 0 3 330.359 2.990 20 5 EFBDHN C[C@H]1C[C@@H]1N1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000494373419 477973482 /nfs/dbraw/zinc/97/34/82/477973482.db2.gz XZSJQZZFHMUTDP-XEZPLFJOSA-N 0 3 332.404 2.789 20 5 EFBDHN C[C@@H]1C[C@@H]1N1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000494373420 477974307 /nfs/dbraw/zinc/97/43/07/477974307.db2.gz XZSJQZZFHMUTDP-ZENOOKHLSA-N 0 3 332.404 2.789 20 5 EFBDHN C[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CCCC1 ZINC000516716293 477977922 /nfs/dbraw/zinc/97/79/22/477977922.db2.gz JXEQAEWJOOXQEB-JTQLQIEISA-N 0 3 326.784 2.854 20 5 EFBDHN COC(=O)[C@]1(c2ccccc2)CCN(Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000428787092 477982436 /nfs/dbraw/zinc/98/24/36/477982436.db2.gz UFGVDLBSJXIQBG-LJQANCHMSA-N 0 3 340.379 2.912 20 5 EFBDHN CC(C)CN(CCOc1cccc([N+](=O)[O-])c1)Cc1cnn(C)c1 ZINC000459585931 477991480 /nfs/dbraw/zinc/99/14/80/477991480.db2.gz DBUBXYCSTFLRSJ-UHFFFAOYSA-N 0 3 332.404 2.865 20 5 EFBDHN C[C@H](Cn1cccn1)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494498581 477999472 /nfs/dbraw/zinc/99/94/72/477999472.db2.gz WCCKSBDZOWLAMX-SNVBAGLBSA-N 0 3 328.294 2.988 20 5 EFBDHN CCO[C@@H]1C[C@H](NCC(=O)Nc2c(C)cccc2[N+](=O)[O-])C12CCC2 ZINC000451478618 478040186 /nfs/dbraw/zinc/04/01/86/478040186.db2.gz JXOPERBCNJTFFV-LSDHHAIUSA-N 0 3 347.415 2.779 20 5 EFBDHN CC1(C)[C@H](NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@H]2CCCO[C@H]21 ZINC000451480359 478040905 /nfs/dbraw/zinc/04/09/05/478040905.db2.gz QBRIVVLIVPWSGY-HFBAOOFYSA-N 0 3 330.388 2.764 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCN(C)[C@@H](C)C1 ZINC000439875316 478041110 /nfs/dbraw/zinc/04/11/10/478041110.db2.gz RZIXGNBBZOGOFL-NWDGAFQWSA-N 0 3 336.392 2.598 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCCN1CCCCC1 ZINC000439873775 478042124 /nfs/dbraw/zinc/04/21/24/478042124.db2.gz OFAUSZBZNSEYKK-UHFFFAOYSA-N 0 3 336.392 2.601 20 5 EFBDHN O=C(NCCNc1ccc([N+](=O)[O-])cc1)[C@H]1CCCN1C1CCCC1 ZINC000439897635 478045236 /nfs/dbraw/zinc/04/52/36/478045236.db2.gz HYKMMYPOHQUHDO-QGZVFWFLSA-N 0 3 346.431 2.530 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCCN(C)[C@@H]1C ZINC000439917781 478048576 /nfs/dbraw/zinc/04/85/76/478048576.db2.gz SWUPHEAUMAZZNJ-DGCLKSJQSA-N 0 3 336.392 2.598 20 5 EFBDHN CO[C@@H]1C[C@@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1(C)C ZINC000451506332 478057012 /nfs/dbraw/zinc/05/70/12/478057012.db2.gz RYFMUUPXCWLTAD-CHWSQXEVSA-N 0 3 341.795 2.590 20 5 EFBDHN COc1cc(CN[C@H]2C[C@@H](OC)C23CCC3)c([N+](=O)[O-])cc1OC ZINC000459728877 478061670 /nfs/dbraw/zinc/06/16/70/478061670.db2.gz CRQMRXLSQUCBHT-JKSUJKDBSA-N 0 3 336.388 2.659 20 5 EFBDHN CON1CCC(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000421392076 478069027 /nfs/dbraw/zinc/06/90/27/478069027.db2.gz BLUBJXZAXDFMMS-UHFFFAOYSA-N 0 3 348.428 2.834 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC[C@H](N2CCOCC2)C1 ZINC000517245063 478071641 /nfs/dbraw/zinc/07/16/41/478071641.db2.gz QQZIZCHLVISDRQ-WBVHZDCISA-N 0 3 333.432 2.761 20 5 EFBDHN CC(C)OCC[C@H](O)CN1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451543191 478077429 /nfs/dbraw/zinc/07/74/29/478077429.db2.gz BGGMGNQEUSWRSW-AEFFLSMTSA-N 0 3 336.432 2.950 20 5 EFBDHN COCCN(CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@@H]1CCC[C@H]1C ZINC000487959921 478090596 /nfs/dbraw/zinc/09/05/96/478090596.db2.gz SKKAUVDBHZLVDC-RHSMWYFYSA-N 0 3 349.431 2.979 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCN2CC[C@@H](O)[C@H](C3CCCC3)C2)cc1 ZINC000459792757 478095023 /nfs/dbraw/zinc/09/50/23/478095023.db2.gz JBLXDIQSJSFZNF-ZWKOTPCHSA-N 0 3 334.416 2.847 20 5 EFBDHN COCCN(CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@H]1CCC[C@H]1C ZINC000488001426 478104111 /nfs/dbraw/zinc/10/41/11/478104111.db2.gz JRNMJACNHQHPHS-PBHICJAKSA-N 0 3 349.431 2.695 20 5 EFBDHN COCCN(CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@@H]1CCC[C@H]1C ZINC000488039852 478109220 /nfs/dbraw/zinc/10/92/20/478109220.db2.gz CZSKESKSKIFBCU-CXAGYDPISA-N 0 3 349.431 2.979 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCN[C@@]2(CO)CCCc3ccccc32)cc1 ZINC000440481138 478122797 /nfs/dbraw/zinc/12/27/97/478122797.db2.gz MHEHZDJTBSWIPQ-LJQANCHMSA-N 0 3 342.395 2.787 20 5 EFBDHN COc1cc(CN[C@H]([C@@H](CO)C2CC2)C2CC2)c([N+](=O)[O-])cc1F ZINC000451610348 478123848 /nfs/dbraw/zinc/12/38/48/478123848.db2.gz KFPVIPBJHLWMMM-GUYCJALGSA-N 0 3 338.379 2.629 20 5 EFBDHN CC(C)[C@@H]1CN(Cc2cc([N+](=O)[O-])ccc2OC(F)F)CCN1C ZINC000488557246 478160743 /nfs/dbraw/zinc/16/07/43/478160743.db2.gz KUVSGSQGEQFJCL-AWEZNQCLSA-N 0 3 343.374 2.968 20 5 EFBDHN CC(=O)c1ccc([N+](=O)[O-])cc1N1CCN([C@@H]2C[C@H]2C)C[C@@H](C)C1 ZINC000488722701 478175346 /nfs/dbraw/zinc/17/53/46/478175346.db2.gz VOWFNEJGBVSKMJ-PBFPGSCMSA-N 0 3 331.416 2.964 20 5 EFBDHN CCCN(CCn1cc([N+](=O)[O-])ccc1=O)Cc1ccc(C)cc1 ZINC000534869986 478176758 /nfs/dbraw/zinc/17/67/58/478176758.db2.gz YYLPASJGSHQUCZ-UHFFFAOYSA-N 0 3 329.400 2.977 20 5 EFBDHN CC1=CCN(CCNc2ccc([N+](=O)[O-])cc2N2CCOC2=O)CC1 ZINC000495361776 478182266 /nfs/dbraw/zinc/18/22/66/478182266.db2.gz HZBSBMWKJQJGIP-UHFFFAOYSA-N 0 3 346.387 2.615 20 5 EFBDHN CC(=O)NCC[C@@H]1CCCN(C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000561982505 478210901 /nfs/dbraw/zinc/21/09/01/478210901.db2.gz HMYSWGNCMQRPBW-WHWKNOJMSA-N 0 3 331.416 2.846 20 5 EFBDHN CC[C@@H](C)N1CCN(Cc2cc(OC)c(F)cc2[N+](=O)[O-])CC1 ZINC000451837809 478220080 /nfs/dbraw/zinc/22/00/80/478220080.db2.gz IAKZMCSLBMIHAS-GFCCVEGCSA-N 0 3 325.384 2.659 20 5 EFBDHN COC(=O)c1cc(NC(=O)C(C)C(F)(F)F)c(C)c([N+](=O)[O-])c1 ZINC000489742751 478267824 /nfs/dbraw/zinc/26/78/24/478267824.db2.gz ITINLYZJAAYOSS-SSDOTTSWSA-N 0 3 334.250 2.827 20 5 EFBDHN CCC(C)(C)N1CCN(C(=O)NCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000594210617 478276264 /nfs/dbraw/zinc/27/62/64/478276264.db2.gz AEUZTRKASDONGH-UHFFFAOYSA-N 0 3 334.420 2.611 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1CNC[C@H]1CCCC1(F)F)OCCO2 ZINC000590658512 478277414 /nfs/dbraw/zinc/27/74/14/478277414.db2.gz FTPDLPAHWPRRBG-LLVKDONJSA-N 0 3 328.315 2.891 20 5 EFBDHN CC[C@H](CN1CCCC1)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000590667808 478282530 /nfs/dbraw/zinc/28/25/30/478282530.db2.gz LKASSHZKFSHSFZ-OAHLLOKOSA-N 0 3 347.415 2.548 20 5 EFBDHN CCc1ccccc1[C@H](N)CNC(=O)c1ccc(NC)c([N+](=O)[O-])c1 ZINC000562965279 478396831 /nfs/dbraw/zinc/39/68/31/478396831.db2.gz DYMYMQMDSBDWDU-OAHLLOKOSA-N 0 3 342.399 2.629 20 5 EFBDHN CC(COC(=O)CCC1CCN(C(=O)OC(C)(C)C)CC1)[N+](=O)[O-] ZINC000495907010 478401721 /nfs/dbraw/zinc/40/17/21/478401721.db2.gz XSPMNXHRNAHDSO-LBPRGKRZSA-N 0 3 344.408 2.622 20 5 EFBDHN CC[C@H]1CN(C)CCCN1C(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000597605499 478430414 /nfs/dbraw/zinc/43/04/14/478430414.db2.gz PRKFUCIUFLARLH-HNNXBMFYSA-N 0 3 349.431 2.938 20 5 EFBDHN CCOc1ccc(C(=O)N2CCCN(C)C[C@H]2CC)cc1[N+](=O)[O-] ZINC000597606524 478430539 /nfs/dbraw/zinc/43/05/39/478430539.db2.gz WODJYIGOXLFVNQ-CQSZACIVSA-N 0 3 335.404 2.550 20 5 EFBDHN CN1CCCC(C)(C)[C@H]1CNC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000581766049 478437530 /nfs/dbraw/zinc/43/75/30/478437530.db2.gz SKWATYNQRPDQOD-OAHLLOKOSA-N 0 3 334.420 2.514 20 5 EFBDHN O=[N+]([O-])c1ccc2ncnc(N[C@@H]3CCCN4CCCC[C@@H]34)c2c1 ZINC000594596602 478455157 /nfs/dbraw/zinc/45/51/57/478455157.db2.gz AUHVPCMWJXPXMX-CVEARBPZSA-N 0 3 327.388 2.967 20 5 EFBDHN COC(=O)Cc1ccc(N[C@@H]2CCCN3CCCC[C@@H]23)c([N+](=O)[O-])c1 ZINC000594599221 478459474 /nfs/dbraw/zinc/45/94/74/478459474.db2.gz IGIOQHJBCXEBHH-ZBFHGGJFSA-N 0 3 347.415 2.739 20 5 EFBDHN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCNC2(CCCCC2)C1 ZINC000594628713 478473316 /nfs/dbraw/zinc/47/33/16/478473316.db2.gz CILGVEZCGMQOAG-UHFFFAOYSA-N 0 3 331.416 2.662 20 5 EFBDHN CN1CC[C@]2(C1)CCCN(C(=O)c1ccc(Cl)cc1[N+](=O)[O-])C2 ZINC000597714267 478475362 /nfs/dbraw/zinc/47/53/62/478475362.db2.gz HPECERTXUIMYJX-INIZCTEOSA-N 0 3 337.807 2.806 20 5 EFBDHN CN1CC[C@@]2(C1)CCCN(C(=O)c1cc3cc([N+](=O)[O-])ccc3o1)C2 ZINC000597713671 478475910 /nfs/dbraw/zinc/47/59/10/478475910.db2.gz FKSVXRGAUZOHAE-GOSISDBHSA-N 0 3 343.383 2.899 20 5 EFBDHN CC(C)(C)N1CCCN(C(=O)/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000491302642 478501940 /nfs/dbraw/zinc/50/19/40/478501940.db2.gz BUVOUSVGLZZDDR-KTKRTIGZSA-N 0 3 331.416 2.941 20 5 EFBDHN COC(=O)c1ccc(-c2cccc([C@H]3CNCCO3)c2)c([N+](=O)[O-])c1 ZINC000600784483 478519203 /nfs/dbraw/zinc/51/92/03/478519203.db2.gz KLCPVQLUMMMWNB-QGZVFWFLSA-N 0 3 342.351 2.709 20 5 EFBDHN COC(=O)c1ccc(-c2ccc([C@H]3CNCCO3)cc2)c([N+](=O)[O-])c1 ZINC000600787101 478520314 /nfs/dbraw/zinc/52/03/14/478520314.db2.gz XPCFDTTUVHHKNF-QGZVFWFLSA-N 0 3 342.351 2.709 20 5 EFBDHN COC(=O)c1cc(-c2ccc([C@@H]3CNCCO3)cc2)cc([N+](=O)[O-])c1 ZINC000600788178 478520535 /nfs/dbraw/zinc/52/05/35/478520535.db2.gz JXJPKGUXTZGNPD-KRWDZBQOSA-N 0 3 342.351 2.709 20 5 EFBDHN C[C@@H]1CN(CCN[C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)CCO1 ZINC000591347978 478531395 /nfs/dbraw/zinc/53/13/95/478531395.db2.gz NVTPOCZPXXFENL-RDTXWAMCSA-N 0 3 333.432 2.673 20 5 EFBDHN C[C@H]1CN(CCN[C@H]2CCCCc3ccc([N+](=O)[O-])cc32)CCO1 ZINC000591347977 478531501 /nfs/dbraw/zinc/53/15/01/478531501.db2.gz NVTPOCZPXXFENL-KSSFIOAISA-N 0 3 333.432 2.673 20 5 EFBDHN CN(CC(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)C1CCC1 ZINC000600827100 478536345 /nfs/dbraw/zinc/53/63/45/478536345.db2.gz SBMLZHUKECEDQN-OAHLLOKOSA-N 0 3 331.416 2.785 20 5 EFBDHN CC(COC(=O)C[C@@H]1CCCC[C@H]1NC(=O)OC(C)(C)C)[N+](=O)[O-] ZINC000496106632 478541719 /nfs/dbraw/zinc/54/17/19/478541719.db2.gz YFSWTCLKDIUAPQ-FRRDWIJNSA-N 0 3 344.408 2.668 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2NCc1ccc(OCCO)cc1 ZINC000571225066 478547598 /nfs/dbraw/zinc/54/75/98/478547598.db2.gz RYGKGJHLZQTJCY-KRWDZBQOSA-N 0 3 328.368 2.743 20 5 EFBDHN CN(CC1CCN(C)CC1)C(=O)/C=C\c1ccc(F)cc1[N+](=O)[O-] ZINC000491490473 478564881 /nfs/dbraw/zinc/56/48/81/478564881.db2.gz BCQUFQZNZAFYST-XQRVVYSFSA-N 0 3 335.379 2.547 20 5 EFBDHN COC[C@@H](N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)C ZINC000541597044 478572606 /nfs/dbraw/zinc/57/26/06/478572606.db2.gz KQXFGEIHHPVPFJ-IINYFYTJSA-N 0 3 343.811 2.836 20 5 EFBDHN CC(C)(C)N1CC[C@@H](NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000597921823 478575712 /nfs/dbraw/zinc/57/57/12/478575712.db2.gz CALCXYBMOBYZMV-GFCCVEGCSA-N 0 3 331.372 2.944 20 5 EFBDHN CC(C)(C)N1CC[C@H](NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000597921824 478576335 /nfs/dbraw/zinc/57/63/35/478576335.db2.gz CALCXYBMOBYZMV-LBPRGKRZSA-N 0 3 331.372 2.944 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](NC[C@@H]2C[C@H](F)CN2)c2ccccc2)c1 ZINC000591581212 478584512 /nfs/dbraw/zinc/58/45/12/478584512.db2.gz NYADWPFSWVAZNB-BQFCYCMXSA-N 0 3 329.375 2.974 20 5 EFBDHN CC(C)[C@H]1CCC[C@@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000541741820 478584676 /nfs/dbraw/zinc/58/46/76/478584676.db2.gz ZDBVJGRJEDURSJ-CVEARBPZSA-N 0 3 340.445 2.783 20 5 EFBDHN CN(C)[C@@H](CNC(=O)c1c(F)cccc1[N+](=O)[O-])Cc1ccccc1 ZINC000600964510 478587708 /nfs/dbraw/zinc/58/77/08/478587708.db2.gz CEYGIHDYPNCELC-CQSZACIVSA-N 0 3 345.374 2.637 20 5 EFBDHN Cc1c(CNC(=O)Nc2cccc3c2CCNC3)cccc1[N+](=O)[O-] ZINC000571415483 478592939 /nfs/dbraw/zinc/59/29/39/478592939.db2.gz TVPDMAVSBKOVEH-UHFFFAOYSA-N 0 3 340.383 2.871 20 5 EFBDHN CSCC1(CCNCc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1 ZINC000594962116 478606503 /nfs/dbraw/zinc/60/65/03/478606503.db2.gz BGZLVUIRCDUZNM-UHFFFAOYSA-N 0 3 338.429 2.989 20 5 EFBDHN C[C@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000601014021 478614557 /nfs/dbraw/zinc/61/45/57/478614557.db2.gz SQNAMWLLYBAPEI-JHJVBQTASA-N 0 3 337.395 2.830 20 5 EFBDHN CCC[C@@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)c1ccccn1 ZINC000591734503 478615953 /nfs/dbraw/zinc/61/59/53/478615953.db2.gz HPFGAFUNRSYEFN-DOTOQJQBSA-N 0 3 345.399 2.861 20 5 EFBDHN CC(C)(NC(=O)C[C@H](N)Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000563700024 478618564 /nfs/dbraw/zinc/61/85/64/478618564.db2.gz HNCDKTMAFBVQDJ-MRXNPFEDSA-N 0 3 341.411 2.906 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@H]1CC(=O)N(C(C)(C)C)C1 ZINC000594993367 478621241 /nfs/dbraw/zinc/62/12/41/478621241.db2.gz PQJJHQCNZJFPPD-CYBMUJFWSA-N 0 3 349.431 2.730 20 5 EFBDHN CCc1ccc([C@H](CO)NCCOc2ccccc2[N+](=O)[O-])cc1 ZINC000541985064 478621911 /nfs/dbraw/zinc/62/19/11/478621911.db2.gz REMOZPSYBPPHFJ-INIZCTEOSA-N 0 3 330.384 2.859 20 5 EFBDHN O=C(CCN[C@H]1COCc2ccccc21)Nc1ccccc1[N+](=O)[O-] ZINC000591770823 478626497 /nfs/dbraw/zinc/62/64/97/478626497.db2.gz LCSFSABQLVKEQM-INIZCTEOSA-N 0 3 341.367 2.785 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NCCc1cn2c(n1)SCC2 ZINC000595034415 478635560 /nfs/dbraw/zinc/63/55/60/478635560.db2.gz XVMDSRDINHPBOS-NSHDSACASA-N 0 3 348.428 2.799 20 5 EFBDHN CCNC(=O)C1(CN[C@H](C)c2ccc([N+](=O)[O-])cc2OC)CCC1 ZINC000595040090 478638043 /nfs/dbraw/zinc/63/80/43/478638043.db2.gz GTKXCYOMQQUXNH-GFCCVEGCSA-N 0 3 335.404 2.560 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@H](O)Cc1cccc(F)c1 ZINC000595041369 478638894 /nfs/dbraw/zinc/63/88/94/478638894.db2.gz KOBDQLQRECTMGT-MLGOLLRUSA-N 0 3 348.374 2.997 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H]1CCN(CC(F)F)C1 ZINC000595044160 478639297 /nfs/dbraw/zinc/63/92/97/478639297.db2.gz IXWGBIUHSPKMNQ-WDEREUQCSA-N 0 3 329.347 2.593 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)N[C@@H]1CCN(CC(F)F)C1 ZINC000595044140 478639350 /nfs/dbraw/zinc/63/93/50/478639350.db2.gz IXWGBIUHSPKMNQ-GHMZBOCLSA-N 0 3 329.347 2.593 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@]1(O)CCN(Cc2ccccc2)C1 ZINC000601068833 478639415 /nfs/dbraw/zinc/63/94/15/478639415.db2.gz IWJYCHQXRPITNU-GOSISDBHSA-N 0 3 328.368 2.611 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@]2(O)CCN(Cc3ccccc3)C2)c1 ZINC000601069301 478640103 /nfs/dbraw/zinc/64/01/03/478640103.db2.gz LFUPWFMJYZKVRA-SFHVURJKSA-N 0 3 328.368 2.611 20 5 EFBDHN O=[N+]([O-])c1cccc(F)c1OC[C@@]1(O)CCN(Cc2ccccc2)C1 ZINC000601071237 478640757 /nfs/dbraw/zinc/64/07/57/478640757.db2.gz YLCSTHPMRFAIJU-GOSISDBHSA-N 0 3 346.358 2.750 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@@H]1CCCN(C(C)=O)C1 ZINC000595046657 478640747 /nfs/dbraw/zinc/64/07/47/478640747.db2.gz CUWPEYXJCRAPHM-JSGCOSHPSA-N 0 3 335.404 2.513 20 5 EFBDHN CCn1cc(CN[C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])nn1 ZINC000595068323 478649188 /nfs/dbraw/zinc/64/91/88/478649188.db2.gz JRFJKWZJKNGGPU-XJKSGUPXSA-N 0 3 329.404 2.707 20 5 EFBDHN CC(C)(CN[C@@H]1CCc2c1cccc2[N+](=O)[O-])[C@@]1(O)CCCOC1 ZINC000595095644 478657544 /nfs/dbraw/zinc/65/75/44/478657544.db2.gz SCVLXYAPDJUTEU-CRAIPNDOSA-N 0 3 334.416 2.739 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@H]1CC(=O)N(C(C)(C)C)C1 ZINC000595098587 478658934 /nfs/dbraw/zinc/65/89/34/478658934.db2.gz BZCBWMCCEMFRHZ-QWHCGFSZSA-N 0 3 349.431 2.901 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC1CCN([C@H]2CCOC2)CC1 ZINC000595100798 478660597 /nfs/dbraw/zinc/66/05/97/478660597.db2.gz JAOFEKWVYUNTRG-BBRMVZONSA-N 0 3 349.431 2.507 20 5 EFBDHN COc1ccccc1C[C@@](C)(CO)NCc1cccc([N+](=O)[O-])c1 ZINC000601154164 478692398 /nfs/dbraw/zinc/69/23/98/478692398.db2.gz ZBEQVKQKNYFJME-SFHVURJKSA-N 0 3 330.384 2.687 20 5 EFBDHN CN(CCc1ccccc1)[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])o2)C1 ZINC000598194003 478698951 /nfs/dbraw/zinc/69/89/51/478698951.db2.gz CXFQDQOMRUVSHV-OAHLLOKOSA-N 0 3 343.383 2.577 20 5 EFBDHN C[C@H](C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21)c1cccc([N+](=O)[O-])c1 ZINC000564316105 478720656 /nfs/dbraw/zinc/72/06/56/478720656.db2.gz ZNZIWJAFLBKBAK-QRTARXTBSA-N 0 3 331.416 2.641 20 5 EFBDHN C[C@H](C(=O)N1CCC[C@H]2CN(C)CC[C@H]21)c1cccc([N+](=O)[O-])c1 ZINC000564316100 478720743 /nfs/dbraw/zinc/72/07/43/478720743.db2.gz ZNZIWJAFLBKBAK-JLJPHGGASA-N 0 3 331.416 2.641 20 5 EFBDHN C[C@H](C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21)c1cccc([N+](=O)[O-])c1 ZINC000564316103 478720902 /nfs/dbraw/zinc/72/09/02/478720902.db2.gz ZNZIWJAFLBKBAK-LXZKKBNFSA-N 0 3 331.416 2.641 20 5 EFBDHN C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1CNc1cc[n-]c(=O)c1[N+](=O)[O-] ZINC000601211047 478724951 /nfs/dbraw/zinc/72/49/51/478724951.db2.gz VRHJJUQSCDPTTC-HIFRSBDPSA-N 0 3 342.399 2.875 20 5 EFBDHN C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNc1cc[n-]c(=O)c1[N+](=O)[O-] ZINC000601211047 478724960 /nfs/dbraw/zinc/72/49/60/478724960.db2.gz VRHJJUQSCDPTTC-HIFRSBDPSA-N 0 3 342.399 2.875 20 5 EFBDHN C[C@@]1(NC(=O)c2cccc([N+](=O)[O-])c2)CCN(Cc2ccccc2)C1 ZINC000564338454 478727295 /nfs/dbraw/zinc/72/72/95/478727295.db2.gz VNPCIMPJIWTSHF-LJQANCHMSA-N 0 3 339.395 2.989 20 5 EFBDHN Cc1cc(OCC(=O)N[C@@H](C)CN2CCC(C)CC2)ccc1[N+](=O)[O-] ZINC000598259983 478729329 /nfs/dbraw/zinc/72/93/29/478729329.db2.gz HXPMLVVHIPCWEL-HNNXBMFYSA-N 0 3 349.431 2.519 20 5 EFBDHN C[C@H](CN1CCC(C)CC1)NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000598261551 478730864 /nfs/dbraw/zinc/73/08/64/478730864.db2.gz GZYXQENHRWZWAC-OAHLLOKOSA-N 0 3 349.431 2.600 20 5 EFBDHN C[C@H](CN1CCC(C)CC1)NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000598264744 478731624 /nfs/dbraw/zinc/73/16/24/478731624.db2.gz QLIWQMVKNDAIOR-CYBMUJFWSA-N 0 3 344.415 2.926 20 5 EFBDHN CCOc1ccc(C(=O)N[C@@H](C)CN2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000598266427 478733548 /nfs/dbraw/zinc/73/35/48/478733548.db2.gz XVQWLMHFYWHIOI-AWEZNQCLSA-N 0 3 349.431 2.844 20 5 EFBDHN C[C@@H](CN1CCC(C)CC1)NC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000598265918 478733601 /nfs/dbraw/zinc/73/36/01/478733601.db2.gz VZLWESDLAZPYSE-HNNXBMFYSA-N 0 3 333.432 2.764 20 5 EFBDHN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H](N2CCCC2)C1 ZINC000564446480 478744722 /nfs/dbraw/zinc/74/47/22/478744722.db2.gz MUHUXLYMVFTZJE-HNNXBMFYSA-N 0 3 332.404 2.859 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1CN(CCN(C)C)Cc1ccccn1 ZINC000583032599 478748755 /nfs/dbraw/zinc/74/87/55/478748755.db2.gz OHXFBTZHDNCBMW-UHFFFAOYSA-N 0 3 344.415 2.562 20 5 EFBDHN CCCN1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)C1 ZINC000598343006 478776786 /nfs/dbraw/zinc/77/67/86/478776786.db2.gz RGWOQEQRZJPXON-AWEZNQCLSA-N 0 3 335.404 2.596 20 5 EFBDHN C[C@H](C(=O)N1CCN(C2CC2)C[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000572354136 478813710 /nfs/dbraw/zinc/81/37/10/478813710.db2.gz KEDVJDZIJGKDDR-KBPBESRZSA-N 0 3 331.416 2.641 20 5 EFBDHN C[C@@H](C(=O)N1CCN(C2CC2)C[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000572354138 478813760 /nfs/dbraw/zinc/81/37/60/478813760.db2.gz KEDVJDZIJGKDDR-UONOGXRCSA-N 0 3 331.416 2.641 20 5 EFBDHN Cc1noc(CN2C[C@H](c3ccccc3)[C@@H]3COCC[C@H]32)c1[N+](=O)[O-] ZINC000595493554 478819565 /nfs/dbraw/zinc/81/95/65/478819565.db2.gz SHQGAQJULHJKNV-OWCLPIDISA-N 0 3 343.383 2.896 20 5 EFBDHN CN(C)CCN(Cc1ccccn1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595508997 478827783 /nfs/dbraw/zinc/82/77/83/478827783.db2.gz NDCLGWZFJKAJTN-UHFFFAOYSA-N 0 3 332.379 2.693 20 5 EFBDHN Cc1ccc(CCNCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000564854904 478832216 /nfs/dbraw/zinc/83/22/16/478832216.db2.gz PXGURVZIXIYNBV-UHFFFAOYSA-N 0 3 348.424 2.509 20 5 EFBDHN CCN1CCCN(Cc2cc(OC)c(F)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000595534577 478838579 /nfs/dbraw/zinc/83/85/79/478838579.db2.gz COVYXMGVEGDNAL-GFCCVEGCSA-N 0 3 325.384 2.659 20 5 EFBDHN CCN1CCCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H](C)C1 ZINC000595535942 478838753 /nfs/dbraw/zinc/83/87/53/478838753.db2.gz KEKSLDAHOMCING-CYBMUJFWSA-N 0 3 345.403 2.561 20 5 EFBDHN CN(CCOc1ccc([N+](=O)[O-])cc1)[C@H](CO)Cc1ccccc1 ZINC000595595168 478874126 /nfs/dbraw/zinc/87/41/26/478874126.db2.gz HQIUVPQIOMWCFR-KRWDZBQOSA-N 0 3 330.384 2.509 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCN1CC[C@H](C)C1 ZINC000545201456 478897457 /nfs/dbraw/zinc/89/74/57/478897457.db2.gz BQNDMOUJIPNAES-GOEBONIOSA-N 0 3 333.432 2.622 20 5 EFBDHN CC(C)[C@@H]1CN(C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)CCN1 ZINC000598571000 478902714 /nfs/dbraw/zinc/90/27/14/478902714.db2.gz AZGXORUHPSAPDE-DOMZBBRYSA-N 0 3 337.445 2.532 20 5 EFBDHN CC(C)[C@@H]1CN(C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)CCN1 ZINC000598571002 478902806 /nfs/dbraw/zinc/90/28/06/478902806.db2.gz AZGXORUHPSAPDE-WFASDCNBSA-N 0 3 337.445 2.532 20 5 EFBDHN CN(CCC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)c1ccncc1 ZINC000545245764 478907068 /nfs/dbraw/zinc/90/70/68/478907068.db2.gz ZHCHNNVXAXQVBI-UHFFFAOYSA-N 0 3 348.790 2.786 20 5 EFBDHN O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2N[C@@H](CCO)c2ccco2)n1 ZINC000583673726 478910836 /nfs/dbraw/zinc/91/08/36/478910836.db2.gz STRJMUFWILCLFP-MELADBBJSA-N 0 3 334.376 2.581 20 5 EFBDHN O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2N[C@@H](CCO)c2ccco2)n1 ZINC000583673725 478911425 /nfs/dbraw/zinc/91/14/25/478911425.db2.gz STRJMUFWILCLFP-HZSPNIEDSA-N 0 3 334.376 2.581 20 5 EFBDHN C[C@H](C1CCN(C)CC1)N(C)C(=O)/C=C\c1ccccc1[N+](=O)[O-] ZINC000492323017 478929529 /nfs/dbraw/zinc/92/95/29/478929529.db2.gz UGRJVIMXOXOWCF-QIAWRQBBSA-N 0 3 331.416 2.797 20 5 EFBDHN CCOC(=O)c1cc(N[C@@H]2C[C@@H](C)N(C3CC3)C2)ccc1[N+](=O)[O-] ZINC000583784957 478939690 /nfs/dbraw/zinc/93/96/90/478939690.db2.gz FHDXADKLTPIWFM-DGCLKSJQSA-N 0 3 333.388 2.809 20 5 EFBDHN CC(C)Oc1nc(N2CCN([C@H]3C[C@@H]3C)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000565227073 478957183 /nfs/dbraw/zinc/95/71/83/478957183.db2.gz VAFUGCGZJJJMOX-DZKIICNBSA-N 0 3 348.447 2.944 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C\CN1CCC[C@@H](N2CCOCC2)CC1 ZINC000565373407 478992549 /nfs/dbraw/zinc/99/25/49/478992549.db2.gz VBCZCESZNTWYMC-VDNIUXDYSA-N 0 3 345.443 2.795 20 5 EFBDHN CCCN(C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12)[C@@H]1CCN(C)C1 ZINC000592829257 479062505 /nfs/dbraw/zinc/06/25/05/479062505.db2.gz MGCAZIDDVXRTDZ-GFCCVEGCSA-N 0 3 330.388 2.632 20 5 EFBDHN CCCN(C(=O)CCOc1cc(C)ccc1[N+](=O)[O-])[C@@H]1CCN(C)C1 ZINC000592831476 479065023 /nfs/dbraw/zinc/06/50/23/479065023.db2.gz MVAVEEQHORMHOL-OAHLLOKOSA-N 0 3 349.431 2.615 20 5 EFBDHN CCCN(C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)[C@@H]1CCN(C)C1 ZINC000592831498 479065241 /nfs/dbraw/zinc/06/52/41/479065241.db2.gz NOQPCAVVHTZZHQ-CYBMUJFWSA-N 0 3 330.388 2.632 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H]1CCCN(c2ccnn2C)C1 ZINC000584271633 479071592 /nfs/dbraw/zinc/07/15/92/479071592.db2.gz COPZDWYQMGTPJL-CABCVRRESA-N 0 3 343.431 2.956 20 5 EFBDHN CN1CCN(CCOc2ccc([N+](=O)[O-])cc2)CC12CCCCC2 ZINC000573455663 479072651 /nfs/dbraw/zinc/07/26/51/479072651.db2.gz MILBMEYEFXNXHA-UHFFFAOYSA-N 0 3 333.432 2.924 20 5 EFBDHN CN1CCC(n2ncc3cc(-c4ccc([N+](=O)[O-])nc4)cnc32)CC1 ZINC000598930632 479089310 /nfs/dbraw/zinc/08/93/10/479089310.db2.gz ZBAFOYKYDURYOC-UHFFFAOYSA-N 0 3 338.371 2.668 20 5 EFBDHN NC(=O)c1cc(NC[C@H](c2ccco2)N2CCCC2)ccc1[N+](=O)[O-] ZINC000596055595 479111204 /nfs/dbraw/zinc/11/12/04/479111204.db2.gz SERXCEJATDUMII-OAHLLOKOSA-N 0 3 344.371 2.536 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN3CCN(C4CCCCC4)CC3)nc2c1 ZINC000573667051 479115445 /nfs/dbraw/zinc/11/54/45/479115445.db2.gz XLDRCGZCPIBRBA-UHFFFAOYSA-N 0 3 343.431 2.921 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCC(N2CCOC[C@@H]2C)CC1 ZINC000573664534 479115491 /nfs/dbraw/zinc/11/54/91/479115491.db2.gz FCDABZKMQZGEFX-LSDHHAIUSA-N 0 3 333.432 2.841 20 5 EFBDHN CN(C)[C@H](CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-])c1ccccc1 ZINC000593003604 479120563 /nfs/dbraw/zinc/12/05/63/479120563.db2.gz TVLAFTYGUDMNIQ-QGZVFWFLSA-N 0 3 345.374 2.696 20 5 EFBDHN O=C1CCCN1CCNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000573690110 479122591 /nfs/dbraw/zinc/12/25/91/479122591.db2.gz RYMQDTGSZNFWSS-UHFFFAOYSA-N 0 3 329.356 2.567 20 5 EFBDHN C[C@@H](CNc1cc[nH]c(=O)c1[N+](=O)[O-])N1CCc2ccccc2C1 ZINC000596075725 479123429 /nfs/dbraw/zinc/12/34/29/479123429.db2.gz PDEJKEMJVHGGQE-LBPRGKRZSA-N 0 3 328.372 2.554 20 5 EFBDHN COc1ccc(CNCCn2ccc(C(F)(F)F)n2)cc1[N+](=O)[O-] ZINC000602017936 479140499 /nfs/dbraw/zinc/14/04/99/479140499.db2.gz UDILQUUVXUSEPX-UHFFFAOYSA-N 0 3 344.293 2.609 20 5 EFBDHN C[C@H](CSc1ccccc1)N(C)CCn1cc([N+](=O)[O-])ccc1=O ZINC000593046083 479141111 /nfs/dbraw/zinc/14/11/11/479141111.db2.gz MVCACUPPWITZMU-CQSZACIVSA-N 0 3 347.440 2.869 20 5 EFBDHN O=c1[n-]ccc(NC[C@@H]2CC[N@H+](CCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000596106386 479142179 /nfs/dbraw/zinc/14/21/79/479142179.db2.gz AFBBVDDIBHILEL-HNNXBMFYSA-N 0 3 342.399 2.672 20 5 EFBDHN O=c1[n-]ccc(NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000596106386 479142188 /nfs/dbraw/zinc/14/21/88/479142188.db2.gz AFBBVDDIBHILEL-HNNXBMFYSA-N 0 3 342.399 2.672 20 5 EFBDHN CN1CCC[C@@]2(CCN(C(=O)/C=C/c3ccc(F)cc3[N+](=O)[O-])C2)C1 ZINC000493751573 479144967 /nfs/dbraw/zinc/14/49/67/479144967.db2.gz VMFPWURZCUXHOK-MJICGBHWSA-N 0 3 347.390 2.691 20 5 EFBDHN CC[C@@H]1CO[C@@H](CC)CN1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000593056936 479148744 /nfs/dbraw/zinc/14/87/44/479148744.db2.gz BMGWDODWSQFXEK-ZBFHGGJFSA-N 0 3 335.404 2.813 20 5 EFBDHN O=c1[n-]ccc(NC[C@H]2CCC[N@@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000596130128 479154979 /nfs/dbraw/zinc/15/49/79/479154979.db2.gz VIQXHGVHMITTBL-CQSZACIVSA-N 0 3 328.372 2.772 20 5 EFBDHN O=c1[n-]ccc(NC[C@H]2CCC[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000596130128 479154983 /nfs/dbraw/zinc/15/49/83/479154983.db2.gz VIQXHGVHMITTBL-CQSZACIVSA-N 0 3 328.372 2.772 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)NC1(C2CCC2)CC1 ZINC000593078881 479160448 /nfs/dbraw/zinc/16/04/48/479160448.db2.gz CLQFMDIHBQNBQX-NSHDSACASA-N 0 3 333.388 2.853 20 5 EFBDHN Cc1cc(N2CC[C@@H](N3CCN(C(C)C)CC3)C2)c([N+](=O)[O-])s1 ZINC000596157908 479169830 /nfs/dbraw/zinc/16/98/30/479169830.db2.gz JREOJHIRCPBCCY-CQSZACIVSA-N 0 3 338.477 2.569 20 5 EFBDHN CC(C)[C@H]1CN(c2ncc([N+](=O)[O-])cn2)CCN1Cc1ccccc1 ZINC000599143053 479179069 /nfs/dbraw/zinc/17/90/69/479179069.db2.gz OMEHLNHLKUMZLM-QGZVFWFLSA-N 0 3 341.415 2.732 20 5 EFBDHN CN1CCCC(C)(C)[C@H]1CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000593144028 479202504 /nfs/dbraw/zinc/20/25/04/479202504.db2.gz SBZJBTAVCHVLJG-OAHLLOKOSA-N 0 3 337.395 2.513 20 5 EFBDHN CN1CCN(CCNc2ccc(C(F)F)cc2[N+](=O)[O-])CC1(C)C ZINC000596223291 479209933 /nfs/dbraw/zinc/20/99/33/479209933.db2.gz OVFXOECGNFXIKS-UHFFFAOYSA-N 0 3 342.390 2.970 20 5 EFBDHN CC[C@@H](C)N[C@H](CNc1ccc([N+](=O)[O-])c(C(N)=O)c1)c1ccco1 ZINC000596231245 479213273 /nfs/dbraw/zinc/21/32/73/479213273.db2.gz OIQXFPIFADAYJQ-BXUZGUMPSA-N 0 3 346.387 2.828 20 5 EFBDHN Cc1ccc2c(c1)CC[C@H]2NC[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000556860030 479229252 /nfs/dbraw/zinc/22/92/52/479229252.db2.gz TXZWKWJWHVWNFK-VQIMIIECSA-N 0 3 342.395 2.920 20 5 EFBDHN CC(C)c1n[nH]c(C(=O)N2CCCN(C3CCCC3)CC2)c1[N+](=O)[O-] ZINC000610923261 479233108 /nfs/dbraw/zinc/23/31/08/479233108.db2.gz GCFSAMFZEOHVGR-UHFFFAOYSA-N 0 3 349.435 2.532 20 5 EFBDHN CC(C)c1[nH]nc(C(=O)N2CCCN(C3CCCC3)CC2)c1[N+](=O)[O-] ZINC000610923261 479233114 /nfs/dbraw/zinc/23/31/14/479233114.db2.gz GCFSAMFZEOHVGR-UHFFFAOYSA-N 0 3 349.435 2.532 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCCN(c2ccncc2)CC1 ZINC000603081848 479237652 /nfs/dbraw/zinc/23/76/52/479237652.db2.gz DKBXJPBQJHXQOV-UHFFFAOYSA-N 0 3 340.383 2.651 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCNC1(c2ccc(F)cc2)CCC1 ZINC000611185408 479306219 /nfs/dbraw/zinc/30/62/19/479306219.db2.gz BUYWAUBSHNQHNJ-UHFFFAOYSA-N 0 3 331.347 2.565 20 5 EFBDHN CC[C@@H](CN1CCCC1)NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000611196127 479308126 /nfs/dbraw/zinc/30/81/26/479308126.db2.gz RSCIHAIKUOADPR-LBPRGKRZSA-N 0 3 330.388 2.680 20 5 EFBDHN CCN(C[C@@H]1CCOC1)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000611205221 479310459 /nfs/dbraw/zinc/31/04/59/479310459.db2.gz OECLQSIQGJJXSO-KGLIPLIRSA-N 0 3 335.404 2.589 20 5 EFBDHN O=[N+]([O-])c1sc(CNCCCn2ccnc2)cc1Br ZINC000602502942 479370903 /nfs/dbraw/zinc/37/09/03/479370903.db2.gz JGCIJWVDNWHDEK-UHFFFAOYSA-N 0 3 345.222 2.795 20 5 EFBDHN COC(=O)c1cnc(N[C@@H]2CCN(C3CCCCC3)C2)c([N+](=O)[O-])c1 ZINC000596481047 479312700 /nfs/dbraw/zinc/31/27/00/479312700.db2.gz WMIJNXUFSORYAJ-CYBMUJFWSA-N 0 3 348.403 2.595 20 5 EFBDHN COc1ccc2c(c1)ncc([N+](=O)[O-])c2N1CC[C@H](N2CCCC2)C1 ZINC000574602439 479314986 /nfs/dbraw/zinc/31/49/86/479314986.db2.gz UNAIPCNPSJFFQB-ZDUSSCGKSA-N 0 3 342.399 2.826 20 5 EFBDHN C[C@@H]1CN(C[C@H](O)COc2ccccc2[N+](=O)[O-])C[C@H](C)C1(F)F ZINC000599514188 479319252 /nfs/dbraw/zinc/31/92/52/479319252.db2.gz DZXICRSCZBEJQM-XQQFMLRXSA-N 0 3 344.358 2.558 20 5 EFBDHN CC(C)[C@H]1C[C@@H](NCc2cc3c(cc2[N+](=O)[O-])OCCO3)CCO1 ZINC000611314635 479346644 /nfs/dbraw/zinc/34/66/44/479346644.db2.gz WRNNQMVGFVLYHD-DZGCQCFKSA-N 0 3 336.388 2.659 20 5 EFBDHN C[C@H](NC1CCN(c2ccc([N+](=O)[O-])nc2)CC1)c1ccccn1 ZINC000602501239 479370169 /nfs/dbraw/zinc/37/01/69/479370169.db2.gz BWNXCCDPZZFXAI-ZDUSSCGKSA-N 0 3 327.388 2.704 20 5 EFBDHN Cc1nc(N(C)CCCN(C)Cc2ccncc2)ccc1[N+](=O)[O-] ZINC000603400098 479371166 /nfs/dbraw/zinc/37/11/66/479371166.db2.gz JRPUAYUORMHIJT-UHFFFAOYSA-N 0 3 329.404 2.652 20 5 EFBDHN CN(CCCN(C)c1ncc(Cl)cc1[N+](=O)[O-])Cc1ccncc1 ZINC000603403497 479372264 /nfs/dbraw/zinc/37/22/64/479372264.db2.gz WEVQTTXLLJUHDA-UHFFFAOYSA-N 0 3 349.822 2.997 20 5 EFBDHN CN(CCCN(C)c1c(Cl)cncc1[N+](=O)[O-])Cc1ccncc1 ZINC000603402986 479373009 /nfs/dbraw/zinc/37/30/09/479373009.db2.gz UBWTZTHXIWNIFH-UHFFFAOYSA-N 0 3 349.822 2.997 20 5 EFBDHN CC(=O)c1ccc(NC2CCN(C3CCOCC3)CC2)c([N+](=O)[O-])c1 ZINC000603407973 479375968 /nfs/dbraw/zinc/37/59/68/479375968.db2.gz JZQMGGHMUQEGKO-UHFFFAOYSA-N 0 3 347.415 2.853 20 5 EFBDHN COc1cc(C[C@H](C)NCc2ccc(OC)c([N+](=O)[O-])c2)ccn1 ZINC000602529001 479382843 /nfs/dbraw/zinc/38/28/43/479382843.db2.gz PTQIWHNINRGDFB-LBPRGKRZSA-N 0 3 331.372 2.728 20 5 EFBDHN COC[C@@H](C)N(CCn1cc([N+](=O)[O-])cn1)[C@@H]1CCc2ccccc21 ZINC000599682510 479388552 /nfs/dbraw/zinc/38/85/52/479388552.db2.gz KVRNIQQDJAQTJH-RDTXWAMCSA-N 0 3 344.415 2.816 20 5 EFBDHN Cc1cc(C(=O)N2CCCc3cccc(CN)c32)cc([N+](=O)[O-])c1 ZINC000602540845 479388806 /nfs/dbraw/zinc/38/88/06/479388806.db2.gz WHALKAJJYIVGID-UHFFFAOYSA-N 0 3 325.368 2.955 20 5 EFBDHN COC[C@H](C)N(CCn1cc([N+](=O)[O-])cn1)[C@H]1CCc2ccccc21 ZINC000599682509 479389227 /nfs/dbraw/zinc/38/92/27/479389227.db2.gz KVRNIQQDJAQTJH-KSSFIOAISA-N 0 3 344.415 2.816 20 5 EFBDHN Cc1ccc(C(=O)N2CCCc3cccc(CN)c32)cc1[N+](=O)[O-] ZINC000602542133 479389703 /nfs/dbraw/zinc/38/97/03/479389703.db2.gz UGCFYXJRUQUVNU-UHFFFAOYSA-N 0 3 325.368 2.955 20 5 EFBDHN COc1cc(C[C@@H](C)NCc2cc([N+](=O)[O-])ccc2OC)ccn1 ZINC000602554895 479394264 /nfs/dbraw/zinc/39/42/64/479394264.db2.gz ZUGIMTGGXCYXET-GFCCVEGCSA-N 0 3 331.372 2.728 20 5 EFBDHN C[C@H](O)C[C@H](C)CNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602557774 479397089 /nfs/dbraw/zinc/39/70/89/479397089.db2.gz ILKUPTNOTDRITE-YUMQZZPRSA-N 0 3 337.239 2.915 20 5 EFBDHN C[C@H](NCc1cc(Br)c([N+](=O)[O-])s1)[C@H]1CCOC1 ZINC000602558993 479397428 /nfs/dbraw/zinc/39/74/28/479397428.db2.gz RQZDBAZRVGUVSI-YUMQZZPRSA-N 0 3 335.223 2.933 20 5 EFBDHN C[C@@H](CC[S@@](C)=O)NCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602569272 479401838 /nfs/dbraw/zinc/40/18/38/479401838.db2.gz OQKNLSLGCYRIDN-GTUYJWLHSA-N 0 3 338.351 2.860 20 5 EFBDHN CCn1nc(C)c(CN[C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c1C ZINC000575127160 479407854 /nfs/dbraw/zinc/40/78/54/479407854.db2.gz WCEUNUZBLFWJLI-HOTGVXAUSA-N 0 3 346.435 2.898 20 5 EFBDHN C[C@H]1CCN(CCNCc2cc(Br)c([N+](=O)[O-])s2)C1 ZINC000602592316 479413636 /nfs/dbraw/zinc/41/36/36/479413636.db2.gz COJORFFERGSXQB-VIFPVBQESA-N 0 3 348.266 2.850 20 5 EFBDHN C[C@H](NC1CCN(c2ccc([N+](=O)[O-])nc2)CC1)c1cncc(F)c1 ZINC000602595488 479416254 /nfs/dbraw/zinc/41/62/54/479416254.db2.gz BCXFCMLOTJZEEX-LBPRGKRZSA-N 0 3 345.378 2.844 20 5 EFBDHN O=[N+]([O-])c1sc(CN[C@@H]2CCCC[C@H]2O)cc1Br ZINC000602619862 479427660 /nfs/dbraw/zinc/42/76/60/479427660.db2.gz IRWCPTWVCDXPJT-NXEZZACHSA-N 0 3 335.223 2.812 20 5 EFBDHN CC1(C)C[C@@H](NCC[C@@]2(O)CCCOC2)c2cc([N+](=O)[O-])ccc21 ZINC000593719541 479433662 /nfs/dbraw/zinc/43/36/62/479433662.db2.gz FIORSQBHJQLCHZ-AEFFLSMTSA-N 0 3 334.416 2.838 20 5 EFBDHN Cc1c(CN2CCCN(C[C@@H]3CCCO3)CC2)cccc1[N+](=O)[O-] ZINC000603848824 479437277 /nfs/dbraw/zinc/43/72/77/479437277.db2.gz XONJFUQQSGDGCD-KRWDZBQOSA-N 0 3 333.432 2.590 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN(C)Cc1ccccc1N1CCCC1 ZINC000611698202 479448827 /nfs/dbraw/zinc/44/88/27/479448827.db2.gz ZOHDNZAMXPLRTK-UHFFFAOYSA-N 0 3 343.431 2.832 20 5 EFBDHN CO[C@H]1COCC[C@H]1CNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602674866 479468192 /nfs/dbraw/zinc/46/81/92/479468192.db2.gz GXMBPGMRWUUUFN-FZMZJTMJSA-N 0 3 348.321 2.755 20 5 EFBDHN CCCN1CC[C@@H](NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000596882372 479471436 /nfs/dbraw/zinc/47/14/36/479471436.db2.gz QMSIVOJKUWWBQP-OAHLLOKOSA-N 0 3 346.431 2.753 20 5 EFBDHN CN(C)[C@H](CNc1c(Cl)cncc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000589107372 479479409 /nfs/dbraw/zinc/47/94/09/479479409.db2.gz SEXCKOBGZIQTGT-CYBMUJFWSA-N 0 3 338.770 2.919 20 5 EFBDHN CCN(C(=O)c1ccc([N+](=O)[O-])cc1Cl)C1CCN(C)CC1 ZINC000599985807 479488406 /nfs/dbraw/zinc/48/84/06/479488406.db2.gz JHTPSXYUPZSYJZ-UHFFFAOYSA-N 0 3 325.796 2.805 20 5 EFBDHN CCN(C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)C1CCN(C)CC1 ZINC000599986466 479488713 /nfs/dbraw/zinc/48/87/13/479488713.db2.gz UHIIVPUILOXKCU-UHFFFAOYSA-N 0 3 330.388 2.632 20 5 EFBDHN CCN1C[C@H](CNCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1=O ZINC000602709097 479494132 /nfs/dbraw/zinc/49/41/32/479494132.db2.gz AIIUIASPFGZFOV-JTQLQIEISA-N 0 3 345.321 2.572 20 5 EFBDHN O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2NCc2ccccc2CO)n1 ZINC000618564660 479494350 /nfs/dbraw/zinc/49/43/50/479494350.db2.gz BJDRXOMGGFLQOM-HZPDHXFCSA-N 0 3 330.388 2.557 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CNCc1ccc(CC(N)=O)cc1 ZINC000589320770 479512648 /nfs/dbraw/zinc/51/26/48/479512648.db2.gz MGNQEZJHHFDACO-NTEUORMPSA-N 0 3 339.395 2.816 20 5 EFBDHN O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)c1cc([N+](=O)[O-])c[nH]1 ZINC000604472166 479523114 /nfs/dbraw/zinc/52/31/14/479523114.db2.gz GPHDBFIONRMPGZ-OAHLLOKOSA-N 0 3 342.399 2.565 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN[C@@H](CN2CCCCC2)c2ccccc2)c1 ZINC000611938131 479527299 /nfs/dbraw/zinc/52/72/99/479527299.db2.gz KETSNOSJKMYTPK-SFHVURJKSA-N 0 3 343.431 2.608 20 5 EFBDHN Cc1ccncc1[C@@H](C)NCCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000611938537 479527408 /nfs/dbraw/zinc/52/74/08/479527408.db2.gz FKZLTLYMEZRILN-CYBMUJFWSA-N 0 3 328.372 2.978 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN[C@H](CN2CCCCC2)c2ccccc2)c1 ZINC000611938130 479527918 /nfs/dbraw/zinc/52/79/18/479527918.db2.gz KETSNOSJKMYTPK-GOSISDBHSA-N 0 3 343.431 2.608 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN1CCC[C@@H]1Cc1ccc(F)cc1 ZINC000602766876 479537657 /nfs/dbraw/zinc/53/76/57/479537657.db2.gz GDNPKFVDMWUCGS-MRXNPFEDSA-N 0 3 332.379 2.946 20 5 EFBDHN COc1ccc([C@H]2CCN(CCn3c(C)ncc3[N+](=O)[O-])C2)cc1 ZINC000602770143 479541671 /nfs/dbraw/zinc/54/16/71/479541671.db2.gz NANBIQAFVOQKCO-HNNXBMFYSA-N 0 3 330.388 2.598 20 5 EFBDHN COc1ccc2c(c1)CCCN(CCn1c(C)ncc1[N+](=O)[O-])C2 ZINC000602772696 479543137 /nfs/dbraw/zinc/54/31/37/479543137.db2.gz NKVZIPWZRIQWPW-UHFFFAOYSA-N 0 3 330.388 2.557 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN(CCc1ccc(F)cc1)C1CC1 ZINC000602779547 479546485 /nfs/dbraw/zinc/54/64/85/479546485.db2.gz IDPLXZKZNWGIGV-UHFFFAOYSA-N 0 3 332.379 2.946 20 5 EFBDHN CCc1csc(CC2CCN(CCn3ccc([N+](=O)[O-])n3)CC2)n1 ZINC000594019679 479551812 /nfs/dbraw/zinc/55/18/12/479551812.db2.gz QDVFHSIMYJOTQM-UHFFFAOYSA-N 0 3 349.460 2.765 20 5 EFBDHN O=C(CCN1CCC[C@@H](OC2CCC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000594026544 479555558 /nfs/dbraw/zinc/55/55/58/479555558.db2.gz LUBFEFXIDUXGCH-OAHLLOKOSA-N 0 3 347.415 2.957 20 5 EFBDHN COc1cc(C)c([C@@H](C)NCCn2c(C)ncc2[N+](=O)[O-])cc1OC ZINC000602802603 479564337 /nfs/dbraw/zinc/56/43/37/479564337.db2.gz RCWMHJTUWZUNAS-GFCCVEGCSA-N 0 3 348.403 2.776 20 5 EFBDHN CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@@]1(CO)CCOC1 ZINC000600178639 479565988 /nfs/dbraw/zinc/56/59/88/479565988.db2.gz NGMLNIJFBRTSGX-QGZVFWFLSA-N 0 3 348.424 2.907 20 5 EFBDHN COc1ccc(CN[C@@H]2CC[C@@](O)(C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000589939145 479583432 /nfs/dbraw/zinc/58/34/32/479583432.db2.gz ULUSQKAMMFWZLT-MFKMUULPSA-N 0 3 334.294 2.539 20 5 EFBDHN C[C@H]1CCN(C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC12CCC2 ZINC000612113925 479587850 /nfs/dbraw/zinc/58/78/50/479587850.db2.gz ZOTKLJDLUZZBJV-LSDHHAIUSA-N 0 3 334.416 2.847 20 5 EFBDHN CC1(C)CN(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)[C@@H]2CCC[C@H]21 ZINC000590203731 479617084 /nfs/dbraw/zinc/61/70/84/479617084.db2.gz QPFJBCSMGLAYFW-NVXWUHKLSA-N 0 3 343.427 2.994 20 5 EFBDHN COc1cccc(C2(NCCn3c(C)ncc3[N+](=O)[O-])CCC2)c1 ZINC000602903262 479621954 /nfs/dbraw/zinc/62/19/54/479621954.db2.gz NWFUCZOMBBJMED-UHFFFAOYSA-N 0 3 330.388 2.777 20 5 EFBDHN O=C(N[C@@H]1CCCN2CCCC[C@@H]12)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000594195113 479626096 /nfs/dbraw/zinc/62/60/96/479626096.db2.gz CCGQMLURLYMMEX-MLHJIOFPSA-N 0 3 343.427 2.831 20 5 EFBDHN O=C(CSc1ccc([N+](=O)[O-])cc1)N[C@H]1CCCN2CCCC[C@@H]12 ZINC000594197187 479628438 /nfs/dbraw/zinc/62/84/38/479628438.db2.gz AVOBTWQILAGKSR-HOTGVXAUSA-N 0 3 349.456 2.820 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C/CN(CCN1CCOCC1)CC1CC1 ZINC000597223449 479629184 /nfs/dbraw/zinc/62/91/84/479629184.db2.gz OYXUUXSCWQNURG-HWKANZROSA-N 0 3 345.443 2.652 20 5 EFBDHN CCNc1ccc(C(=O)N[C@H]2CCCN3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC000594200264 479630633 /nfs/dbraw/zinc/63/06/33/479630633.db2.gz KHQRSRYOEQBXGE-JKSUJKDBSA-N 0 3 346.431 2.773 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC[C@H](CN2CCCC2=O)C1 ZINC000597228824 479632217 /nfs/dbraw/zinc/63/22/17/479632217.db2.gz OZDWPRTYMDKJPQ-MJSCBBHESA-N 0 3 343.427 2.942 20 5 EFBDHN CCOC(=O)CC1(NC/C=C/c2ccccc2[N+](=O)[O-])CCOCC1 ZINC000597236895 479637100 /nfs/dbraw/zinc/63/71/00/479637100.db2.gz YJESHDXNDPTNMD-FNORWQNLSA-N 0 3 348.399 2.700 20 5 EFBDHN C[C@H]1[C@@H](N(C)C)CCN1C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000615303171 479652081 /nfs/dbraw/zinc/65/20/81/479652081.db2.gz GGEZNBMHAWKDNJ-DJJJIMSYSA-N 0 3 349.434 2.846 20 5 EFBDHN C[C@H]1[C@H](N(C)C)CCN1C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000615303174 479652471 /nfs/dbraw/zinc/65/24/71/479652471.db2.gz GGEZNBMHAWKDNJ-ORAYPTAESA-N 0 3 349.434 2.846 20 5 EFBDHN CC[C@@H]1CN(C)CCCN1C(=O)CCOc1cc(C)ccc1[N+](=O)[O-] ZINC000590538043 479657365 /nfs/dbraw/zinc/65/73/65/479657365.db2.gz OGTKBPHCRQNAHF-OAHLLOKOSA-N 0 3 349.431 2.615 20 5 EFBDHN C[C@H](N[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)[C@@H]1CN(C)CCO1 ZINC000618986664 479660269 /nfs/dbraw/zinc/66/02/69/479660269.db2.gz BCHIKYMPBHVCBK-ZLIFDBKOSA-N 0 3 333.432 2.626 20 5 EFBDHN CC[C@@H](CN1CCCC1)NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000609833689 480211321 /nfs/dbraw/zinc/21/13/21/480211321.db2.gz UOWUJPFSJQZGSK-ZDUSSCGKSA-N 0 3 337.445 2.678 20 5 EFBDHN C[C@@H]1CCCCC[C@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000614191513 480220634 /nfs/dbraw/zinc/22/06/34/480220634.db2.gz HDAMIGQVZQGRIK-CZUORRHYSA-N 0 3 340.445 2.927 20 5 EFBDHN C[C@@H](NC[C@@H]1CCCN1c1cccnn1)c1ccccc1[N+](=O)[O-] ZINC000610342232 480283894 /nfs/dbraw/zinc/28/38/94/480283894.db2.gz ALKLNQLSDNIRLK-KGLIPLIRSA-N 0 3 327.388 2.704 20 5 EFBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCCN(C[C@@H]2CCCO2)CC1 ZINC000610391579 480295773 /nfs/dbraw/zinc/29/57/73/480295773.db2.gz DGPPAXSXEHOGAP-HOTGVXAUSA-N 0 3 333.432 2.843 20 5 EFBDHN Cc1ccc([C@@H](C)NCc2ccc(CC(N)=O)cc2)cc1[N+](=O)[O-] ZINC000610517935 480327343 /nfs/dbraw/zinc/32/73/43/480327343.db2.gz WMPMNXXJHHPHJQ-CYBMUJFWSA-N 0 3 327.384 2.782 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N[C@H]2CCN(CC3CC3)C2)cc1[N+](=O)[O-] ZINC000610595835 480346828 /nfs/dbraw/zinc/34/68/28/480346828.db2.gz MSPQCYJOFUIQGF-BBRMVZONSA-N 0 3 346.431 2.748 20 5 EFBDHN CC[C@H](CN1CCCC1)NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000610719284 480373751 /nfs/dbraw/zinc/37/37/51/480373751.db2.gz PKTOBLVMZZUZFV-DZGCQCFKSA-N 0 3 334.420 2.829 20 5 EFBDHN C[C@H](NCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C1CCOCC1 ZINC000179844410 533825025 /nfs/dbraw/zinc/82/50/25/533825025.db2.gz NVBDBHUWBCPYGY-JTQLQIEISA-N 0 3 341.795 2.591 20 5 EFBDHN C[C@H](NCCn1cc([N+](=O)[O-])cn1)c1ccc(OC(F)F)cc1 ZINC000131004284 533877939 /nfs/dbraw/zinc/87/79/39/533877939.db2.gz UZSLZMLAIIILAI-JTQLQIEISA-N 0 3 326.303 2.744 20 5 EFBDHN CC(C)(C)N1C[C@@H](N[C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1=O ZINC000090177807 518718761 /nfs/dbraw/zinc/71/87/61/518718761.db2.gz RSDAIHHNGZHDGS-HOTGVXAUSA-N 0 3 345.443 2.905 20 5 EFBDHN CCOc1ccc(C(=O)NC[C@@H](CC(C)C)N(C)C)cc1[N+](=O)[O-] ZINC000075851011 520908041 /nfs/dbraw/zinc/90/80/41/520908041.db2.gz HFSJICJSZXKSEF-CQSZACIVSA-N 0 3 337.420 2.700 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000177799177 521722131 /nfs/dbraw/zinc/72/21/31/521722131.db2.gz WLVVVPZKDQIUDW-KGLIPLIRSA-N 0 3 337.807 2.947 20 5 EFBDHN COc1cc(OC)c(CNCCc2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000194415409 522793502 /nfs/dbraw/zinc/79/35/02/522793502.db2.gz IHFGDLCBGIGBQI-UHFFFAOYSA-N 0 3 346.383 2.953 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)CCN[C@@H](C)c1cccnc1 ZINC000181629550 522976451 /nfs/dbraw/zinc/97/64/51/522976451.db2.gz RXRBAUSAWGEHSY-LBPRGKRZSA-N 0 3 344.371 2.678 20 5 EFBDHN COCc1cccc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000179237236 523042387 /nfs/dbraw/zinc/04/23/87/523042387.db2.gz GTMLUBOXIMVBLA-MRXNPFEDSA-N 0 3 342.399 2.823 20 5 EFBDHN O=C(c1ccccc1)N1CCC(NCc2cccc([N+](=O)[O-])c2)CC1 ZINC000191622978 534743250 /nfs/dbraw/zinc/74/32/50/534743250.db2.gz VECGLBDZIQPMFF-UHFFFAOYSA-N 0 3 339.395 2.989 20 5 EFBDHN Cc1ccc(CN(C)C)cc1NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000181161648 524386625 /nfs/dbraw/zinc/38/66/25/524386625.db2.gz MSWXNIKYCZLBNL-UHFFFAOYSA-N 0 3 328.372 2.799 20 5 EFBDHN C[C@H](CNC(=O)NCCCCc1ccc([N+](=O)[O-])cc1)N(C)C1CC1 ZINC000120179074 524412270 /nfs/dbraw/zinc/41/22/70/524412270.db2.gz URKXKYDYFDIBOH-CQSZACIVSA-N 0 3 348.447 2.699 20 5 EFBDHN Cc1ccc(CN(CCO)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000181962378 524413222 /nfs/dbraw/zinc/41/32/22/524413222.db2.gz ZEFVKAXCVVZUJD-UHFFFAOYSA-N 0 3 330.384 2.777 20 5 EFBDHN COc1ccc(NC(=O)CN[C@@H]2CC[C@H](C)C[C@H]2C)c([N+](=O)[O-])c1 ZINC000119384363 524500851 /nfs/dbraw/zinc/50/08/51/524500851.db2.gz NUVMKBMJTXMUBM-OUCADQQQSA-N 0 3 335.404 2.956 20 5 EFBDHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000119717711 524630539 /nfs/dbraw/zinc/63/05/39/524630539.db2.gz YTURNJMEDXITEW-KSSFIOAISA-N 0 3 339.395 2.845 20 5 EFBDHN C[C@@H](NC(=O)N1CC[C@H](N2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000066186116 525178931 /nfs/dbraw/zinc/17/89/31/525178931.db2.gz CVOPWZZWFSIVKD-CJNGLKHVSA-N 0 3 332.404 2.536 20 5 EFBDHN C[C@H](NCCNC(=O)c1ccccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000178648759 525354090 /nfs/dbraw/zinc/35/40/90/525354090.db2.gz FJLPGZLPXAFORI-LBPRGKRZSA-N 0 3 331.347 2.815 20 5 EFBDHN C[S@@](=O)C[C@H](NCCOc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000183130990 525368914 /nfs/dbraw/zinc/36/89/14/525368914.db2.gz HNJSKUFDXQXAKN-BXKMTCNYSA-N 0 3 348.424 2.683 20 5 EFBDHN C[C@@H](NCCNC(=O)c1c(F)cccc1F)c1cccc([N+](=O)[O-])c1 ZINC000173410787 525451389 /nfs/dbraw/zinc/45/13/89/525451389.db2.gz NXWHIGQKSMMIDY-LLVKDONJSA-N 0 3 349.337 2.954 20 5 EFBDHN C[C@@H](NCCc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)NC(=O)CO2 ZINC000194415218 525463624 /nfs/dbraw/zinc/46/36/24/525463624.db2.gz AFSMNWHHMKTZDH-GFCCVEGCSA-N 0 3 341.367 2.819 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@@]3(CO)CCOC3)s2)cc1 ZINC000184194872 534881461 /nfs/dbraw/zinc/88/14/61/534881461.db2.gz RTLVNCCGOKWYEJ-MRXNPFEDSA-N 0 3 334.397 2.564 20 5 EFBDHN CSc1ccc(C(=O)N2CC[C@H]3CC[C@@H](C2)N3C)cc1[N+](=O)[O-] ZINC000245465364 525959911 /nfs/dbraw/zinc/95/99/11/525959911.db2.gz YJXHBHAKJLDATQ-OLZOCXBDSA-N 0 3 335.429 2.625 20 5 EFBDHN CCCN1CCC[C@H]1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000341366479 534899056 /nfs/dbraw/zinc/89/90/56/534899056.db2.gz HPDDGYKMNPOLKH-AWEZNQCLSA-N 0 3 325.796 2.739 20 5 EFBDHN CCCN1CCC[C@H]1CNC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000343556995 534906246 /nfs/dbraw/zinc/90/62/46/534906246.db2.gz SNIIVTNQPZOQEI-JSGCOSHPSA-N 0 3 337.395 2.828 20 5 EFBDHN O=C(CCN(Cc1cccc([N+](=O)[O-])c1)C1CC1)N1CCCCC1 ZINC000153229856 526475871 /nfs/dbraw/zinc/47/58/71/526475871.db2.gz OUQGMGBUMCXJKB-UHFFFAOYSA-N 0 3 331.416 2.962 20 5 EFBDHN O=C(CCN1CCC[C@H](c2cc[nH]n2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000193860437 526485377 /nfs/dbraw/zinc/48/53/77/526485377.db2.gz IBVCINXVUIPXQI-ZDUSSCGKSA-N 0 3 343.387 2.526 20 5 EFBDHN O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000193771815 526537653 /nfs/dbraw/zinc/53/76/53/526537653.db2.gz YGCPWQKOOJEVCH-INIZCTEOSA-N 0 3 339.395 2.847 20 5 EFBDHN O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000193776899 526538882 /nfs/dbraw/zinc/53/88/82/526538882.db2.gz DADCGALLNGLTLX-INIZCTEOSA-N 0 3 339.395 2.847 20 5 EFBDHN CC(C)(C)[C@@H](CCO)NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000183653077 526615206 /nfs/dbraw/zinc/61/52/06/526615206.db2.gz NEODERXRNJOLGO-CYBMUJFWSA-N 0 3 343.811 2.573 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCc3nnc[n-]3)s2)cc1 ZINC000119132884 527342706 /nfs/dbraw/zinc/34/27/06/527342706.db2.gz YAEDPNQRWBHFIW-UHFFFAOYSA-N 0 3 329.385 2.774 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2nc(CN3CC[C@H](N4CCCC4)C3)co2)cc1 ZINC000089892673 527342788 /nfs/dbraw/zinc/34/27/88/527342788.db2.gz RUHODRXIAAIMRI-KRWDZBQOSA-N 0 3 342.399 2.920 20 5 EFBDHN Cn1ccnc1C[C@H]1CCCN(CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000090003486 527444513 /nfs/dbraw/zinc/44/45/13/527444513.db2.gz JZOQZIIONZNGTJ-OAHLLOKOSA-N 0 3 344.415 2.662 20 5 EFBDHN O=C(NC1CC1)[C@H](NCCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000066388402 527490134 /nfs/dbraw/zinc/49/01/34/527490134.db2.gz OHWQRUIQMNYMPG-GOSISDBHSA-N 0 3 339.395 2.747 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000177817071 527896101 /nfs/dbraw/zinc/89/61/01/527896101.db2.gz DXHWLGMWAYPCEG-OLZOCXBDSA-N 0 3 337.807 2.947 20 5 EFBDHN CC(C)C[C@H](CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12)N(C)C ZINC000154673118 528529620 /nfs/dbraw/zinc/52/96/20/528529620.db2.gz XJTJHWPXZULYJO-CYBMUJFWSA-N 0 3 344.415 2.849 20 5 EFBDHN CCOc1ccc([C@@H](C)NCCCO[C@@H]2CCOC2)cc1[N+](=O)[O-] ZINC000154220154 528595145 /nfs/dbraw/zinc/59/51/45/528595145.db2.gz WPHVRXRDUJTXGI-UKRRQHHQSA-N 0 3 338.404 2.840 20 5 EFBDHN CCOc1ccccc1[C@H](CC)NCCn1cc([N+](=O)[O-])ccc1=O ZINC000179733907 528761032 /nfs/dbraw/zinc/76/10/32/528761032.db2.gz JWJZIKHOAYWFGP-INIZCTEOSA-N 0 3 345.399 2.896 20 5 EFBDHN CC(C)Oc1cc(C(=O)N(C)CCN(C)C2CC2)ccc1[N+](=O)[O-] ZINC000412248998 534941305 /nfs/dbraw/zinc/94/13/05/534941305.db2.gz CCXRCCOUHFRBBG-UHFFFAOYSA-N 0 3 335.404 2.548 20 5 EFBDHN CC(C)Oc1cc(C(=O)N(C)[C@H]2CCN(C)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000412120653 534942747 /nfs/dbraw/zinc/94/27/47/534942747.db2.gz DUGVLCUYDZYSNC-ZFWWWQNUSA-N 0 3 349.431 2.794 20 5 EFBDHN CC(C)Oc1cc(C(=O)N2CC[C@@H]3CCN(C)C[C@H]32)ccc1[N+](=O)[O-] ZINC000412248103 534944441 /nfs/dbraw/zinc/94/44/41/534944441.db2.gz KUASJZUTFBWFEH-XJKSGUPXSA-N 0 3 347.415 2.548 20 5 EFBDHN CC(C)Oc1cc(C(=O)N[C@@H]2CN(C3CC3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000412182376 534949539 /nfs/dbraw/zinc/94/95/39/534949539.db2.gz JTRSIHYJORCMFI-SWLSCSKDSA-N 0 3 347.415 2.595 20 5 EFBDHN CC(C)Oc1cc(C(=O)N[C@H]2CN(C3CC3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000412182370 534952185 /nfs/dbraw/zinc/95/21/85/534952185.db2.gz JTRSIHYJORCMFI-DOMZBBRYSA-N 0 3 347.415 2.595 20 5 EFBDHN CC(C)CN(CCN(C)C)C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412193227 535051544 /nfs/dbraw/zinc/05/15/44/535051544.db2.gz AENXQRFZBPPCSK-DLBZAZTESA-N 0 3 333.432 2.745 20 5 EFBDHN CCN1CCC(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)CC1 ZINC000264152051 535465763 /nfs/dbraw/zinc/46/57/63/535465763.db2.gz ZOTRXRAERKAYPF-UHFFFAOYSA-N 0 3 348.447 2.999 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000347776215 535488637 /nfs/dbraw/zinc/48/86/37/535488637.db2.gz LCPPDXHZJAECQJ-CQSZACIVSA-N 0 3 331.372 2.945 20 5 EFBDHN CCO[C@@H]1C[C@H](O)C12CCN([C@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000266505856 535522957 /nfs/dbraw/zinc/52/29/57/535522957.db2.gz BWSBXMGKQMMSJL-XOKHGSTOSA-N 0 3 334.416 2.908 20 5 EFBDHN CC[C@@H](NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1CC1(C)C ZINC000414124019 535804039 /nfs/dbraw/zinc/80/40/39/535804039.db2.gz BQTJADXJILWWST-HUUCEWRRSA-N 0 3 340.445 2.783 20 5 EFBDHN CC[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2Cl)CCN1C[C@H](C)O ZINC000248425157 535863948 /nfs/dbraw/zinc/86/39/48/535863948.db2.gz NUXNLHOSOXBIDF-GXTWGEPZSA-N 0 3 341.839 2.525 20 5 EFBDHN CC[C@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@H]1CC1(C)C ZINC000419324266 535896453 /nfs/dbraw/zinc/89/64/53/535896453.db2.gz VKYFOXIXLNZGSP-OLZOCXBDSA-N 0 3 335.404 2.956 20 5 EFBDHN CN(C)CCOc1ccc(CCNc2ncccc2[N+](=O)[O-])cc1 ZINC000264077018 535903709 /nfs/dbraw/zinc/90/37/09/535903709.db2.gz HGWNVLBXLLPYLP-UHFFFAOYSA-N 0 3 330.388 2.585 20 5 EFBDHN CC[C@]1(C)CCN(Cc2ccc(OCC(=O)OC)c([N+](=O)[O-])c2)C1 ZINC000355729777 535911122 /nfs/dbraw/zinc/91/11/22/535911122.db2.gz GFHVLVDJCSIKMC-QGZVFWFLSA-N 0 3 336.388 2.769 20 5 EFBDHN CCc1cnccc1[C@H](C)NC[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000343748545 536105330 /nfs/dbraw/zinc/10/53/30/536105330.db2.gz IAWHJKBHZBKLBJ-DZGCQCFKSA-N 0 3 345.399 2.643 20 5 EFBDHN CN(C)C1(CNCc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000418118055 536113110 /nfs/dbraw/zinc/11/31/10/536113110.db2.gz VBWCEHXGHDFSTD-UHFFFAOYSA-N 0 3 332.429 2.902 20 5 EFBDHN CN1CCC[C@@]2(CCN(C(=O)c3cc4cccc([N+](=O)[O-])c4[nH]3)C2)C1 ZINC000356315892 536381617 /nfs/dbraw/zinc/38/16/17/536381617.db2.gz SGKRWGSEAKXHHJ-GOSISDBHSA-N 0 3 342.399 2.634 20 5 EFBDHN CN1CCC[C@]2(CCN(C(=O)CSc3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000356259123 536392981 /nfs/dbraw/zinc/39/29/81/536392981.db2.gz WTJPHPRYGZFLKV-KRWDZBQOSA-N 0 3 349.456 2.631 20 5 EFBDHN COC(=O)COc1ccc(CNc2cc(C)cc(C)n2)cc1[N+](=O)[O-] ZINC000352317277 536477164 /nfs/dbraw/zinc/47/71/64/536477164.db2.gz FMTUTXYTNAWXTP-UHFFFAOYSA-N 0 3 345.355 2.771 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(C2CCC2)C[C@@H](C)C1 ZINC000344725628 536951086 /nfs/dbraw/zinc/95/10/86/536951086.db2.gz GZDKYXVQCUSABT-CYBMUJFWSA-N 0 3 347.415 2.550 20 5 EFBDHN O=C(N[C@H](CO)CN1CCCC1)c1cc2ccccc2c2cccnc12 ZINC000673529833 547911115 /nfs/dbraw/zinc/91/11/15/547911115.db2.gz DHPBRNDDKQAMEZ-INIZCTEOSA-N 0 3 349.434 2.575 20 5 EFBDHN O=[N+]([O-])c1ccc([C@H](O)CNCCOc2ccccc2Cl)cc1 ZINC000754250189 575410675 /nfs/dbraw/zinc/41/06/75/575410675.db2.gz FEKZPZCJNNFFIO-OAHLLOKOSA-N 0 3 336.775 2.950 20 5 EFBDHN Cc1cccc(C)c1OCCNC[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000754251500 575410694 /nfs/dbraw/zinc/41/06/94/575410694.db2.gz URJRXMYTNHZHJM-KRWDZBQOSA-N 0 3 330.384 2.914 20 5 EFBDHN O=[N+]([O-])c1ccc([C@H](O)CNCCOc2cccc(Cl)c2)cc1 ZINC000754251395 575410731 /nfs/dbraw/zinc/41/07/31/575410731.db2.gz SLWTWEXPZGBLCT-MRXNPFEDSA-N 0 3 336.775 2.950 20 5 EFBDHN O=C(CCN[C@H](CCO)c1cccs1)Nc1ccc([N+](=O)[O-])cc1 ZINC000754382081 575427969 /nfs/dbraw/zinc/42/79/69/575427969.db2.gz FGHWLCMHNQTJJC-CQSZACIVSA-N 0 3 349.412 2.698 20 5 EFBDHN COCC[C@H](NC[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(C)o1 ZINC000754547522 575450467 /nfs/dbraw/zinc/45/04/67/575450467.db2.gz WGPFKAHBNULHCG-HOTGVXAUSA-N 0 3 334.372 2.897 20 5 EFBDHN C[C@H](NCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CCCOC1 ZINC000754568709 575454017 /nfs/dbraw/zinc/45/40/17/575454017.db2.gz ODHPGRCGXUJHQR-WDEREUQCSA-N 0 3 341.795 2.591 20 5 EFBDHN O=[N+]([O-])c1ccc([C@@H](O)CN2CCC(c3ccncc3)CC2)cc1 ZINC000759935086 575957906 /nfs/dbraw/zinc/95/79/06/575957906.db2.gz COGNIZMKCCFHKM-SFHVURJKSA-N 0 3 327.384 2.903 20 5 EFBDHN C[C@@H](C[C@@H](O)c1ccco1)NCc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000763523895 576380088 /nfs/dbraw/zinc/38/00/88/576380088.db2.gz KANIVDYSCZVFHO-SMDDNHRTSA-N 0 3 348.355 2.561 20 5 EFBDHN C[C@H]1CN(C[C@H](O)COc2cccc([N+](=O)[O-])c2)Cc2ccccc21 ZINC000763629767 576383283 /nfs/dbraw/zinc/38/32/83/576383283.db2.gz SJCWQHBBSLJMOP-YOEHRIQHSA-N 0 3 342.395 2.954 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCN1CCC[C@@H]1C ZINC000765747599 577072173 /nfs/dbraw/zinc/07/21/73/577072173.db2.gz ZCMJZKSLUCTNHV-HOCLYGCPSA-N 0 3 333.432 2.764 20 5 EFBDHN Cc1nn(C)cc1[C@H](C)NC1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000765756209 577073271 /nfs/dbraw/zinc/07/32/71/577073271.db2.gz BOUMXVSSILRKQA-ZDUSSCGKSA-N 0 3 343.431 2.956 20 5 EFBDHN C[C@H](NC[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc([S@@](C)=O)cc1 ZINC000765848572 577082695 /nfs/dbraw/zinc/08/26/95/577082695.db2.gz HPJXZEDQXKGLCG-PCJQFBCGSA-N 0 3 348.424 2.716 20 5 EFBDHN O=[N+]([O-])c1ccc(Cl)cc1CNCCc1cn2c(n1)SCC2 ZINC000767190653 577199386 /nfs/dbraw/zinc/19/93/86/577199386.db2.gz ZQKQKMGSVTXUGZ-UHFFFAOYSA-N 0 3 338.820 2.883 20 5 EFBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])NCC(=O)N(CC)CC ZINC000768098101 577254339 /nfs/dbraw/zinc/25/43/39/577254339.db2.gz RPSGBGZPLONBTN-ZDUSSCGKSA-N 0 3 339.461 2.924 20 5 EFBDHN CC[C@@H](CN1CCCC1)NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000768711956 577296643 /nfs/dbraw/zinc/29/66/43/577296643.db2.gz KYCWDXUSVCEOCS-LBPRGKRZSA-N 0 3 325.796 2.852 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@H]2CCN(Cc3ccc4c(c3)COC4)C2)nc1 ZINC000769464327 577363908 /nfs/dbraw/zinc/36/39/08/577363908.db2.gz VHKNTSBYUUSGQW-INIZCTEOSA-N 0 3 340.383 2.706 20 5 EFBDHN C[C@@H](CN1CCOCC1)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000726607254 577374716 /nfs/dbraw/zinc/37/47/16/577374716.db2.gz LOEBPDUPLPWAOJ-AWEZNQCLSA-N 0 3 345.399 2.665 20 5 EFBDHN CCN1CCCN(C(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000774040243 581479981 /nfs/dbraw/zinc/47/99/81/581479981.db2.gz WDTKDONAMSOSAQ-UHFFFAOYSA-N 0 3 326.784 2.808 20 5 EFBDHN O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2NCc2ccccc2[N+](=O)[O-])n1 ZINC000774224037 581487554 /nfs/dbraw/zinc/48/75/54/581487554.db2.gz GRRLFHZLBKYXAR-ZFWWWQNUSA-N 0 3 345.359 2.973 20 5 EFBDHN O=[N+]([O-])c1cc2cnn(CN3CC[C@H](N4CC=CC4)C3)c2c(Cl)c1 ZINC000774636117 581495940 /nfs/dbraw/zinc/49/59/40/581495940.db2.gz LJHTVQZKNJTOEI-ZDUSSCGKSA-N 0 3 347.806 2.502 20 5 EFBDHN COc1ccc([C@@H](O)CN[C@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000850424823 1250481067 /nfs/dbraw/zinc/48/10/67/1250481067.db2.gz MAZKJXWKIINQGQ-PXAZEXFGSA-N 0 3 346.383 2.996 20 5 EFBDHN CC([C@H](OC(=O)Cn1cc(C2CC2)cn1)c1ccccc1F)[N+](=O)[O-] ZINC000851107934 1250800643 /nfs/dbraw/zinc/80/06/43/1250800643.db2.gz FRUSORKQRGHYOR-GTNSWQLSSA-N 0 3 347.346 2.849 20 5 EFBDHN CC1(CC(=O)N2CCC(NCc3csc([N+](=O)[O-])c3)CC2)CC1 ZINC000996813280 1256132506 /nfs/dbraw/zinc/13/25/06/1256132506.db2.gz FQJSHDNNVIGTFV-UHFFFAOYSA-N 0 3 337.445 2.927 20 5 EFBDHN CC(F)(F)C(=O)N1CCC(CNCc2csc([N+](=O)[O-])c2)CC1 ZINC000997470334 1257667552 /nfs/dbraw/zinc/66/75/52/1257667552.db2.gz KVDFWJQGOQMEJD-UHFFFAOYSA-N 0 3 347.387 2.640 20 5 EFBDHN CC(C)N(C)CC(=O)NCCC1(CNc2ccc([N+](=O)[O-])cc2)CC1 ZINC001089943599 1260820014 /nfs/dbraw/zinc/82/00/14/1260820014.db2.gz JVIYWTUKODQSHO-UHFFFAOYSA-N 0 3 348.447 2.633 20 5 EFBDHN Cc1scc(C(=O)NCCNCc2cccc([N+](=O)[O-])c2)c1C ZINC001128116156 1261254967 /nfs/dbraw/zinc/25/49/67/1261254967.db2.gz FMGMGPNRZSACPO-UHFFFAOYSA-N 0 3 333.413 2.793 20 5 EFBDHN COc1cc(C[NH2+]CCc2nc3c(s2)CCC3)c([N+](=O)[O-])cc1[O-] ZINC000922718701 1266649565 /nfs/dbraw/zinc/64/95/65/1266649565.db2.gz XODXTIGGXUKFAY-UHFFFAOYSA-N 0 3 349.412 2.587 20 5 EFBDHN CCN(C[C@H]1CCOC1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000738082234 1268321489 /nfs/dbraw/zinc/32/14/89/1268321489.db2.gz PKSCGBCFVOLHHQ-CQSZACIVSA-N 0 3 330.388 2.774 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCN1CCC[C@@H]1C ZINC000742239978 1269952933 /nfs/dbraw/zinc/95/29/33/1269952933.db2.gz PFLXGFJZZVBFOE-QWHCGFSZSA-N 0 3 337.445 2.676 20 5 EFBDHN O=C(NC[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1)[C@H]1C[C@H]2C[C@H]2C1 ZINC001086172385 1270342169 /nfs/dbraw/zinc/34/21/69/1270342169.db2.gz WGVWXGWKZWJLEI-DQWFCTHYSA-N 0 3 343.427 2.625 20 5 EFBDHN O=C(NC[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1)C1CC2(CC2)C1 ZINC001086474194 1271676684 /nfs/dbraw/zinc/67/66/84/1271676684.db2.gz QJUUUSBLGYYDJS-SAZUREKKSA-N 0 3 343.427 2.769 20 5 EFBDHN O=C(CN[C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(C(F)(F)F)cc1 ZINC001168976264 1272546581 /nfs/dbraw/zinc/54/65/81/1272546581.db2.gz CDYPMNVSXKOWPX-GWCFXTLKSA-N 0 3 330.306 2.923 20 5 EFBDHN O=[N+]([O-])C[C@@H]1CC[C@@H](N2CCN(c3ccc(F)c(F)c3)CC2)C1 ZINC001169007425 1272581208 /nfs/dbraw/zinc/58/12/08/1272581208.db2.gz NQPWCQVTRIREFS-CHWSQXEVSA-N 0 3 325.359 2.532 20 5 EFBDHN O=c1[nH]c2ccccc2n1C1CCN([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169012424 1272584384 /nfs/dbraw/zinc/58/43/84/1272584384.db2.gz QAKHLYNOILAQRJ-UKRRQHHQSA-N 0 3 344.415 2.824 20 5 EFBDHN CC(C)(C)OC(=O)N1C[C@@H]2[C@@H]1CCCN2[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169011848 1272585006 /nfs/dbraw/zinc/58/50/06/1272585006.db2.gz MTVVVWVVGADXIA-CBBWQLFWSA-N 0 3 339.436 2.516 20 5 EFBDHN O=[N+]([O-])C[C@H]1CC[C@@H](N2CCN(Cc3ccccc3Cl)CC2)C1 ZINC001169028416 1272592527 /nfs/dbraw/zinc/59/25/27/1272592527.db2.gz RYEJZPHRRUPMCI-GOEBONIOSA-N 0 3 337.851 2.903 20 5 EFBDHN CC[C@H]1CN([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CCN1C(=O)OC(C)(C)C ZINC001169034581 1272596788 /nfs/dbraw/zinc/59/67/88/1272596788.db2.gz IAYMXWPTDIBTGT-ILXRZTDVSA-N 0 3 341.452 2.763 20 5 EFBDHN O=[N+]([O-])C[C@H]1CC[C@@H](N2CCN(Cc3ccc(Cl)cc3)CC2)C1 ZINC001169037556 1272604133 /nfs/dbraw/zinc/60/41/33/1272604133.db2.gz SMIBNSRVQDYCMB-DOTOQJQBSA-N 0 3 337.851 2.903 20 5 EFBDHN CC(C)N(C)Cc1cnc2n1CCN([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)[C@H]2C ZINC001169025752 1272621479 /nfs/dbraw/zinc/62/14/79/1272621479.db2.gz UTFUHWNZPNVFMJ-ARFHVFGLSA-N 0 3 349.479 2.545 20 5 EFBDHN C[C@H](c1ccc(F)cc1)N1CCN([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169056793 1272632315 /nfs/dbraw/zinc/63/23/15/1272632315.db2.gz SOWAWFFDLTUABG-IIDMSEBBSA-N 0 3 335.423 2.950 20 5 EFBDHN O=C(C1CC1)N1CCC2(CCN(Cc3ccccc3[N+](=O)[O-])C2)CC1 ZINC001035148644 1273644772 /nfs/dbraw/zinc/64/47/72/1273644772.db2.gz ICVZLWOKIZHCSW-UHFFFAOYSA-N 0 3 343.427 2.819 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(NCCCN(C)C(=O)CN(C)C(C)C)c1 ZINC001109463732 1274308314 /nfs/dbraw/zinc/30/83/14/1274308314.db2.gz VKDCVMALEORASU-UHFFFAOYSA-N 0 3 336.436 2.504 20 5 EFBDHN O=C(CC1(C(F)(F)F)CC1)NCCNCc1cccc([N+](=O)[O-])c1 ZINC001129229272 1275150290 /nfs/dbraw/zinc/15/02/90/1275150290.db2.gz BFNCCBFCLCUJKW-UHFFFAOYSA-N 0 3 345.321 2.533 20 5 EFBDHN Cc1cc(NC[C@@H]2CN3CCC[C@@H]3CO2)c(Cl)cc1[N+](=O)[O-] ZINC000785808014 1275193901 /nfs/dbraw/zinc/19/39/01/1275193901.db2.gz WMKCNYUQFCYMQH-VXGBXAGGSA-N 0 3 325.796 2.832 20 5 EFBDHN C[C@@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc(N2CCNC2=O)cc1 ZINC000786833567 1275537479 /nfs/dbraw/zinc/53/74/79/1275537479.db2.gz LIPHOJISLWGUNR-CYBMUJFWSA-N 0 3 340.383 2.975 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CNCC(=O)NCc1ccccc1 ZINC000786810205 1275549506 /nfs/dbraw/zinc/54/95/06/1275549506.db2.gz SILNQULOICOMSR-GDNBJRDFSA-N 0 3 339.395 2.904 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CNCC(=O)NCc1ccccc1 ZINC000786810206 1275549517 /nfs/dbraw/zinc/54/95/17/1275549517.db2.gz SILNQULOICOMSR-XNTDXEJSSA-N 0 3 339.395 2.904 20 5 EFBDHN COc1ccc(C[C@H](C)NCC(=O)NC2CCCCC2)c([N+](=O)[O-])c1 ZINC001170296610 1278980983 /nfs/dbraw/zinc/98/09/83/1278980983.db2.gz GLJIYQINVOXZJA-ZDUSSCGKSA-N 0 3 349.431 2.573 20 5 EFBDHN COc1ccc(C[C@@H](C)NCc2cn(CC3CC3)cn2)c([N+](=O)[O-])c1 ZINC001170325215 1279016465 /nfs/dbraw/zinc/01/64/65/1279016465.db2.gz STVYVEFPKHKXMA-CYBMUJFWSA-N 0 3 344.415 2.931 20 5 EFBDHN CCOc1cc(CN[C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])ncn1 ZINC001170325342 1279015889 /nfs/dbraw/zinc/01/58/89/1279015889.db2.gz UCKJORSWFNQQQN-LBPRGKRZSA-N 0 3 346.387 2.513 20 5 EFBDHN C[C@@H](N[C@H]1CCN(C(=O)C2CCCC2)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788634481 1276250278 /nfs/dbraw/zinc/25/02/78/1276250278.db2.gz ZGCPTTBWDRJLAY-DOMZBBRYSA-N 0 3 346.431 2.619 20 5 EFBDHN C[C@@H](NCc1ccc(-n2cncn2)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788665483 1276264817 /nfs/dbraw/zinc/26/48/17/1276264817.db2.gz OEAIRCIXCIHBOI-GFCCVEGCSA-N 0 3 338.371 2.609 20 5 EFBDHN COc1ccc(C[C@H](C)N2CCc3c(cc[nH]c3=O)C2)c([N+](=O)[O-])c1 ZINC001170354857 1279035031 /nfs/dbraw/zinc/03/50/31/1279035031.db2.gz QNOOLYNDKFBBTE-LBPRGKRZSA-N 0 3 343.383 2.693 20 5 EFBDHN CC(C)Oc1ccc(CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000818962705 1276551698 /nfs/dbraw/zinc/55/16/98/1276551698.db2.gz WAJUHTHWDIAPDR-MRXNPFEDSA-N 0 3 331.372 2.600 20 5 EFBDHN CCC(=O)Nc1cccc(CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000818963732 1276552453 /nfs/dbraw/zinc/55/24/53/1276552453.db2.gz ZDCSRXTXQFMUMG-KRWDZBQOSA-N 0 3 343.383 2.767 20 5 EFBDHN CCCOc1ccc(CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000819040047 1276577681 /nfs/dbraw/zinc/57/76/81/1276577681.db2.gz TXWHRMFHNVBLRH-MRXNPFEDSA-N 0 3 331.372 2.602 20 5 EFBDHN COc1ccc2c(c1)OCC[C@@H]2NC[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819103899 1276609349 /nfs/dbraw/zinc/60/93/49/1276609349.db2.gz MIUUMNAOIUJEAO-IRXDYDNUSA-N 0 3 344.367 2.750 20 5 EFBDHN Cc1cccc(F)c1CNC[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000819113574 1276637087 /nfs/dbraw/zinc/63/70/87/1276637087.db2.gz SEBROFXWFQRVBE-AWEZNQCLSA-N 0 3 334.347 2.572 20 5 EFBDHN Cc1cccc(F)c1CNC[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000819114205 1276637745 /nfs/dbraw/zinc/63/77/45/1276637745.db2.gz ZDUMGJNWNXEGJM-CYBMUJFWSA-N 0 3 334.347 2.572 20 5 EFBDHN CCCCn1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c(C)n1 ZINC000819205054 1276676793 /nfs/dbraw/zinc/67/67/93/1276676793.db2.gz HEDMRTKKQACLKT-QGZVFWFLSA-N 0 3 332.404 2.723 20 5 EFBDHN O=[N+]([O-])c1ccc([C@H](O)CN[C@H]2CCOc3c(F)cccc32)cc1 ZINC000819252365 1276686146 /nfs/dbraw/zinc/68/61/46/1276686146.db2.gz RKXAKNCRMGDUEV-JKSUJKDBSA-N 0 3 332.331 2.881 20 5 EFBDHN COC(=O)COc1ccc(CN2CCCCCCC2)cc1[N+](=O)[O-] ZINC000789482251 1276746873 /nfs/dbraw/zinc/74/68/73/1276746873.db2.gz ZUMYQBQANFQGAD-UHFFFAOYSA-N 0 3 336.388 2.913 20 5 EFBDHN C[C@@H]1CCCN1CCNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000746878040 1277242768 /nfs/dbraw/zinc/24/27/68/1277242768.db2.gz QQJZAEVWTSUMJR-SNVBAGLBSA-N 0 3 345.321 2.828 20 5 EFBDHN COCCN(Cn1nc(C)c2cc([N+](=O)[O-])cnc21)[C@@H]1CC[C@@H](C)C1 ZINC000790476367 1277585233 /nfs/dbraw/zinc/58/52/33/1277585233.db2.gz CITWHNJQANCTHB-TZMCWYRMSA-N 0 3 347.419 2.742 20 5 EFBDHN CN1CCCC(C)(C)[C@@H]1CNC(=O)c1cc(F)c([N+](=O)[O-])cc1F ZINC000791060770 1277933856 /nfs/dbraw/zinc/93/38/56/1277933856.db2.gz MPGWWVAZMRPRGP-AWEZNQCLSA-N 0 3 341.358 2.723 20 5 EFBDHN COc1ccc(C[C@H](C)NCc2cccnc2OC)c([N+](=O)[O-])c1 ZINC001170306989 1279030650 /nfs/dbraw/zinc/03/06/50/1279030650.db2.gz CLTMRVSKBLSDNY-LBPRGKRZSA-N 0 3 331.372 2.728 20 5 EFBDHN CCC(=O)NC1CCN([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC001170344674 1279049666 /nfs/dbraw/zinc/04/96/66/1279049666.db2.gz FCGYWBXNVZEQAM-CYBMUJFWSA-N 0 3 349.431 2.525 20 5 EFBDHN CCC(=O)NC1CCN([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC001170344676 1279050589 /nfs/dbraw/zinc/05/05/89/1279050589.db2.gz FCGYWBXNVZEQAM-ZDUSSCGKSA-N 0 3 349.431 2.525 20 5 EFBDHN O=[N+]([O-])c1cc(F)c(Cl)cc1NC[C@H]1CCCN1CCCO ZINC000845554229 1279721383 /nfs/dbraw/zinc/72/13/83/1279721383.db2.gz GESLVLFCYOHCSD-SNVBAGLBSA-N 0 3 331.775 2.646 20 5 EFBDHN Cc1cc(C)n(CCC(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])n1 ZINC000845872236 1279901127 /nfs/dbraw/zinc/90/11/27/1279901127.db2.gz FEJUIXXQDPPYML-GUYCJALGSA-N 0 3 349.362 2.979 20 5 EFBDHN Cc1ccc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])c(=O)[nH]1 ZINC000845873966 1279902136 /nfs/dbraw/zinc/90/21/36/1279902136.db2.gz GEDFPKLAYVZMJW-QMTHXVAHSA-N 0 3 334.303 2.798 20 5 EFBDHN Cc1noc(C)c1CC(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845874257 1279902181 /nfs/dbraw/zinc/90/21/81/1279902181.db2.gz YOSXERZPWDCNNL-QFYYESIMSA-N 0 3 336.319 2.923 20 5 EFBDHN CC([C@H](OC(=O)c1cc(C2CC2)[nH]n1)c1ccccc1F)[N+](=O)[O-] ZINC000845874983 1279902240 /nfs/dbraw/zinc/90/22/40/1279902240.db2.gz KLKFGXZQIJVFBH-VFZGTOFNSA-N 0 3 333.319 2.990 20 5 EFBDHN CC([C@@H](OC(=O)COCc1ccccn1)c1ccccc1F)[N+](=O)[O-] ZINC000845878650 1279903382 /nfs/dbraw/zinc/90/33/82/1279903382.db2.gz HYTKANBKZRODSR-SJKOYZFVSA-N 0 3 348.330 2.687 20 5 EFBDHN COc1ccc(CC(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])nc1 ZINC000845877130 1279903640 /nfs/dbraw/zinc/90/36/40/1279903640.db2.gz FBCQOGATXIVKJJ-APPDUMDISA-N 0 3 348.330 2.722 20 5 EFBDHN CCOC1CC(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])C1 ZINC000845880016 1279904878 /nfs/dbraw/zinc/90/48/78/1279904878.db2.gz JXEWPDWTBFUAIU-ZIULKBFBSA-N 0 3 325.336 2.890 20 5 EFBDHN CC([C@H](OC(=O)[C@@H]1CCc2n[nH]cc2C1)c1ccccc1F)[N+](=O)[O-] ZINC000845882035 1279906521 /nfs/dbraw/zinc/90/65/21/1279906521.db2.gz NMUJXVBPKQRZOH-UVWXRNBGSA-N 0 3 347.346 2.603 20 5 EFBDHN CC([C@@H](OC(=O)CCOCC(F)F)c1ccccc1F)[N+](=O)[O-] ZINC000845884400 1279907303 /nfs/dbraw/zinc/90/73/03/1279907303.db2.gz YZCVNIKZUASUQE-LKFCYVNXSA-N 0 3 335.278 2.747 20 5 EFBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCC[C@]1(O)CCCOC1 ZINC000846110742 1280020011 /nfs/dbraw/zinc/02/00/11/1280020011.db2.gz ZNYNOPTUPBZZPO-CQSZACIVSA-N 0 3 349.214 2.923 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCC(=O)NC(C)C ZINC000872021437 1287402645 /nfs/dbraw/zinc/40/26/45/1287402645.db2.gz PLEQPZQVCDZTEJ-LLVKDONJSA-N 0 3 325.434 2.882 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H](O)COCC1CC1 ZINC000872030325 1287406137 /nfs/dbraw/zinc/40/61/37/1287406137.db2.gz CWRNYXHGPARZFA-SMDDNHRTSA-N 0 3 340.445 2.755 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H]1CCc2nc(C)nn2C1 ZINC000872031989 1287406678 /nfs/dbraw/zinc/40/66/78/1287406678.db2.gz OSCRHGCAHIGKFY-ZYHUDNBSSA-N 0 3 347.444 2.882 20 5 EFBDHN COCCN1CC[C@@H](N[C@@H](C)c2cc([N+](=O)[O-])ccc2SC)C1 ZINC000872035315 1287407434 /nfs/dbraw/zinc/40/74/34/1287407434.db2.gz LTWSQXOIKMIOAT-QWHCGFSZSA-N 0 3 339.461 2.688 20 5 EFBDHN CCC(=O)N1CC[C@@H](N[C@H](C)c2cc([N+](=O)[O-])ccc2SC)C1 ZINC000872044391 1287409302 /nfs/dbraw/zinc/40/93/02/1287409302.db2.gz UPFRYGORJZJQTN-VXGBXAGGSA-N 0 3 337.445 2.978 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H](O)C1CCOCC1 ZINC000872046958 1287410954 /nfs/dbraw/zinc/41/09/54/1287410954.db2.gz AFGCFJMWCFOLPM-ABAIWWIYSA-N 0 3 340.445 2.755 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@]1(O)CCO[C@H]1C ZINC000872066090 1287417531 /nfs/dbraw/zinc/41/75/31/1287417531.db2.gz DMMQBQGLMUOVHW-ZIBATOQPSA-N 0 3 326.418 2.507 20 5 EFBDHN CCN(CC)CC(=O)NC[C@H]1C[C@@H](Nc2ccc(C)cc2[N+](=O)[O-])C1 ZINC001091350326 1280384539 /nfs/dbraw/zinc/38/45/39/1280384539.db2.gz LVZPHANVUCSGQC-GASCZTMLSA-N 0 3 348.447 2.552 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCC1([S@](C)=O)CC1 ZINC000872069057 1287418670 /nfs/dbraw/zinc/41/86/70/1287418670.db2.gz LMCXNSQJXOKNGR-CWKPULSASA-N 0 3 328.459 2.878 20 5 EFBDHN O=C(NCCNCc1ccc([N+](=O)[O-])cc1)c1cscc1Cl ZINC001130003444 1280408335 /nfs/dbraw/zinc/40/83/35/1280408335.db2.gz GTCISQHHCQWJTO-UHFFFAOYSA-N 0 3 339.804 2.829 20 5 EFBDHN CCc1ccccc1CC(=O)NCCNCc1ccc([N+](=O)[O-])cc1 ZINC001130147728 1280496805 /nfs/dbraw/zinc/49/68/05/1280496805.db2.gz NYKAPRNYDHECSC-UHFFFAOYSA-N 0 3 341.411 2.606 20 5 EFBDHN C[C@@H](NCCn1ccc(C(F)(F)F)n1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000872108617 1287431411 /nfs/dbraw/zinc/43/14/11/1287431411.db2.gz BFFXARLQKTZGCO-SECBINFHSA-N 0 3 343.309 2.743 20 5 EFBDHN CN1CCN(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC12CCCCC2 ZINC000846940467 1280628869 /nfs/dbraw/zinc/62/88/69/1280628869.db2.gz KSERJJDUDWFOSV-QGZVFWFLSA-N 0 3 333.432 2.579 20 5 EFBDHN CCN(CC)CC(=O)NC[C@H]1C[C@H](Nc2ccc(C)cc2[N+](=O)[O-])C1 ZINC001091458998 1280736813 /nfs/dbraw/zinc/73/68/13/1280736813.db2.gz LVZPHANVUCSGQC-SHTZXODSSA-N 0 3 348.447 2.552 20 5 EFBDHN CCc1cc(C)c(C(=O)NCCCNCc2ccccc2[N+](=O)[O-])o1 ZINC001171278018 1280938388 /nfs/dbraw/zinc/93/83/88/1280938388.db2.gz CNHWRAOTOWAMOE-UHFFFAOYSA-N 0 3 345.399 2.968 20 5 EFBDHN CC(C)(CC(F)(F)F)C(=O)NCCNCc1ccc([N+](=O)[O-])cc1 ZINC001146819215 1281040772 /nfs/dbraw/zinc/04/07/72/1281040772.db2.gz MUDAKIHYCIMMFI-UHFFFAOYSA-N 0 3 347.337 2.779 20 5 EFBDHN CCCc1occc1C(=O)NCCNCc1cccc([N+](=O)[O-])c1 ZINC001147749923 1281265260 /nfs/dbraw/zinc/26/52/60/1281265260.db2.gz XJXNNXIIFQQLIN-UHFFFAOYSA-N 0 3 331.372 2.660 20 5 EFBDHN O=C(NCCNCc1cccc([N+](=O)[O-])c1)c1c[nH]c2ccccc12 ZINC001130929381 1281303869 /nfs/dbraw/zinc/30/38/69/1281303869.db2.gz XGPSLGWIHOXWAP-UHFFFAOYSA-N 0 3 338.367 2.596 20 5 EFBDHN CC[C@@H](C)N[C@H](CNC(=O)c1ccc(N)c([N+](=O)[O-])c1)c1ccco1 ZINC000807681124 1281387747 /nfs/dbraw/zinc/38/77/47/1281387747.db2.gz ZBQGCJMVGSYAMV-BXUZGUMPSA-N 0 3 346.387 2.629 20 5 EFBDHN O=C(NCCNCc1ccc([N+](=O)[O-])cc1)c1cc2ccsc2[nH]1 ZINC001132093168 1282907760 /nfs/dbraw/zinc/90/77/60/1282907760.db2.gz NYJDSFDRMCJBPD-UHFFFAOYSA-N 0 3 344.396 2.657 20 5 EFBDHN C[C@@H](NCc1cccc(-n2cncn2)c1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815581913 1287612139 /nfs/dbraw/zinc/61/21/39/1287612139.db2.gz SHYBPTZJJJQVRD-GFCCVEGCSA-N 0 3 338.371 2.609 20 5 EFBDHN CC(C)(C(=O)NCCNCc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC001132331751 1283342645 /nfs/dbraw/zinc/34/26/45/1283342645.db2.gz WHUPZXDWMJKZPO-UHFFFAOYSA-N 0 3 347.440 2.840 20 5 EFBDHN CN(C)C(=O)CCCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811475823 1284362285 /nfs/dbraw/zinc/36/22/85/1284362285.db2.gz LHASBJWXYPIUSX-UHFFFAOYSA-N 0 3 334.203 2.860 20 5 EFBDHN O=C(NCCNCc1cccc([N+](=O)[O-])c1)c1coc(C(F)F)c1 ZINC001132936422 1284465818 /nfs/dbraw/zinc/46/58/18/1284465818.db2.gz POTRIHNGGGWKEM-UHFFFAOYSA-N 0 3 339.298 2.645 20 5 EFBDHN CCCCCCN(C)CC(=O)NCCNc1ccc([N+](=O)[O-])cc1 ZINC001093802385 1284533531 /nfs/dbraw/zinc/53/35/31/1284533531.db2.gz GPEIFWVARHCYET-UHFFFAOYSA-N 0 3 336.436 2.635 20 5 EFBDHN O=C(NCCCNCc1ccccc1[N+](=O)[O-])C(C1CC1)C1CC1 ZINC001170660924 1284896958 /nfs/dbraw/zinc/89/69/58/1284896958.db2.gz CPGYGXUYEPAHNA-UHFFFAOYSA-N 0 3 331.416 2.627 20 5 EFBDHN CC(COC(=O)[C@@H]1C[C@H]1c1cccc(Br)c1)[N+](=O)[O-] ZINC000813099872 1285650289 /nfs/dbraw/zinc/65/02/89/1285650289.db2.gz FUJTZGKMNCFQQA-JFUSQASVSA-N 0 3 328.162 2.761 20 5 EFBDHN CC(COC(=O)c1ccc(NC(=O)c2cccs2)cc1)[N+](=O)[O-] ZINC000813101887 1285651392 /nfs/dbraw/zinc/65/13/92/1285651392.db2.gz KUCWOLPNVYJWRN-JTQLQIEISA-N 0 3 334.353 2.822 20 5 EFBDHN CC(C)C(=O)Nc1ccc(Cl)c(C(=O)OCC(C)[N+](=O)[O-])c1 ZINC000813100637 1285651715 /nfs/dbraw/zinc/65/17/15/1285651715.db2.gz UTSGIIWFKCOURS-VIFPVBQESA-N 0 3 328.752 2.757 20 5 EFBDHN CC(COC(=O)c1cnc(-c2ccc(F)c(F)c2)s1)[N+](=O)[O-] ZINC000813105091 1285655278 /nfs/dbraw/zinc/65/52/78/1285655278.db2.gz VLHOSRXIXPZIQF-ZETCQYMHSA-N 0 3 328.296 2.910 20 5 EFBDHN CC(COC(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1)[N+](=O)[O-] ZINC000813107440 1285678628 /nfs/dbraw/zinc/67/86/28/1285678628.db2.gz NKHSMVAGBBXVFU-NSHDSACASA-N 0 3 346.314 2.900 20 5 EFBDHN Cc1noc(C)c1COc1ccc(CC(=O)OCC(C)[N+](=O)[O-])cc1 ZINC000813107619 1285679033 /nfs/dbraw/zinc/67/90/33/1285679033.db2.gz PGYYFYMIIJGZFI-NSHDSACASA-N 0 3 348.355 2.621 20 5 EFBDHN COc1ccccc1OCc1ccc(C(=O)OCC(C)[N+](=O)[O-])o1 ZINC000813109179 1285682914 /nfs/dbraw/zinc/68/29/14/1285682914.db2.gz GPVCHIIBEMBQKS-NSHDSACASA-N 0 3 335.312 2.689 20 5 EFBDHN CC(COC(=O)COc1ccc2oc3c(c2c1)CCCC3)[N+](=O)[O-] ZINC000813112798 1285683820 /nfs/dbraw/zinc/68/38/20/1285683820.db2.gz LLMXQDZGAXYDPB-LLVKDONJSA-N 0 3 333.340 2.899 20 5 EFBDHN CC(COC(=O)[C@@H]1CCCN(c2nc3ccccc3s2)C1)[N+](=O)[O-] ZINC000813111494 1285684347 /nfs/dbraw/zinc/68/43/47/1285684347.db2.gz IOBBQZWWDPOPQL-VXGBXAGGSA-N 0 3 349.412 2.721 20 5 EFBDHN COc1ccc(C(=O)c2ccccc2C(=O)OCC(C)[N+](=O)[O-])cc1 ZINC000813113696 1285684454 /nfs/dbraw/zinc/68/44/54/1285684454.db2.gz HYOZBKAJHJLYST-GFCCVEGCSA-N 0 3 343.335 2.748 20 5 EFBDHN CCc1ccc(-n2nc(C(=O)OCC(C)[N+](=O)[O-])c3c2CCC3)cc1 ZINC000813114932 1285685660 /nfs/dbraw/zinc/68/56/60/1285685660.db2.gz YBDDZPGCLZDIMT-GFCCVEGCSA-N 0 3 343.383 2.745 20 5 EFBDHN CCN1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2SC)[C@H](C)C1 ZINC000822569164 1289035740 /nfs/dbraw/zinc/03/57/40/1289035740.db2.gz PRVQQJXBPZXVKL-GFCCVEGCSA-N 0 3 337.445 2.873 20 5 EFBDHN CC(C)c1ccc(C(=O)NCCNCc2cccc([N+](=O)[O-])c2)nc1 ZINC001133833746 1286002229 /nfs/dbraw/zinc/00/22/29/1286002229.db2.gz FPEXUIQRRNWTOG-UHFFFAOYSA-N 0 3 342.399 2.633 20 5 EFBDHN C[C@H]1CN(c2c([N+](=O)[O-])cccc2[N+](=O)[O-])CCN(C2CCC2)C1 ZINC000813630055 1286017035 /nfs/dbraw/zinc/01/70/35/1286017035.db2.gz GUTGPCTZTBJRMP-GFCCVEGCSA-N 0 3 334.376 2.814 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)CC[C@H](NCc1cc3n(n1)CCCO3)CC2 ZINC001172910351 1286352459 /nfs/dbraw/zinc/35/24/59/1286352459.db2.gz XVYJXUUIGQGDJO-OAHLLOKOSA-N 0 3 342.399 2.611 20 5 EFBDHN C[C@H](CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)N1CCCCC1 ZINC000822663177 1289069287 /nfs/dbraw/zinc/06/92/87/1289069287.db2.gz MSLBOOJXRFGAMT-CQSZACIVSA-N 0 3 347.415 2.548 20 5 EFBDHN O=C(NCCNCc1ccc([N+](=O)[O-])cc1)c1cccc2[nH]ccc21 ZINC001134180768 1286424692 /nfs/dbraw/zinc/42/46/92/1286424692.db2.gz BJXACUMWIXDENF-UHFFFAOYSA-N 0 3 338.367 2.596 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)NCc2cccnc2OC)c1F ZINC001173175525 1286451048 /nfs/dbraw/zinc/45/10/48/1286451048.db2.gz DCWNQQYNVIRAER-LLVKDONJSA-N 0 3 349.362 2.867 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)N[C@H](C)c2cnccn2)c1F ZINC001173191442 1286458098 /nfs/dbraw/zinc/45/80/98/1286458098.db2.gz LGXWPRKDPXEDDJ-GHMZBOCLSA-N 0 3 334.351 2.814 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)N(C)[C@H]2CCCOC2)c1F ZINC001173193809 1286459299 /nfs/dbraw/zinc/45/92/99/1286459299.db2.gz QYBDJBKYDGAPOL-NEPJUHHUSA-N 0 3 326.368 2.784 20 5 EFBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1C[C@@H](OCC2CC2)[C@H]2COC[C@H]21 ZINC001173226331 1286480886 /nfs/dbraw/zinc/48/08/86/1286480886.db2.gz ILVYGOLMOFDQCC-NOENWEJRSA-N 0 3 346.427 2.652 20 5 EFBDHN Cc1nccnc1O[C@H]1CCN([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173238362 1286495869 /nfs/dbraw/zinc/49/58/69/1286495869.db2.gz QMBWHBHPICUOOT-GUYCJALGSA-N 0 3 342.399 2.778 20 5 EFBDHN CCOC(=O)NC1CCN([C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173238596 1286496294 /nfs/dbraw/zinc/49/62/94/1286496294.db2.gz VYDTUXMNMUEFFY-CYBMUJFWSA-N 0 3 335.404 2.736 20 5 EFBDHN CC(C)C(=O)N[C@@H]1CCCN([C@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173238724 1286497277 /nfs/dbraw/zinc/49/72/77/1286497277.db2.gz WUHJLOTXYODMQI-GDBMZVCRSA-N 0 3 333.432 2.762 20 5 EFBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](Oc2ncccn2)C1 ZINC001173238990 1286497624 /nfs/dbraw/zinc/49/76/24/1286497624.db2.gz ZTMCOVWLCLXMJS-RHSMWYFYSA-N 0 3 342.399 2.859 20 5 EFBDHN C[C@H](N[C@H]1CSC[C@@H]1C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000796402223 1299218794 /nfs/dbraw/zinc/21/87/94/1299218794.db2.gz HXLDSYQPEVFHJH-RVBZMBCESA-N 0 3 343.836 2.916 20 5 EFBDHN NC(=O)CC1(CNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000817410464 1288590509 /nfs/dbraw/zinc/59/05/09/1288590509.db2.gz CENOJZPGCJHSSD-UHFFFAOYSA-N 0 3 332.187 2.647 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1N[C@@H]1CCc3ccc(O)cc3C1)CNC2 ZINC001171034166 1289464283 /nfs/dbraw/zinc/46/42/83/1289464283.db2.gz YPXLPYBONGTOHE-OAHLLOKOSA-N 0 3 325.368 2.873 20 5 EFBDHN Cc1c(CNC[C@@H](O)COc2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000873020889 1289524331 /nfs/dbraw/zinc/52/43/31/1289524331.db2.gz DOSMMRKGXCTQQX-OAHLLOKOSA-N 0 3 334.347 2.572 20 5 EFBDHN COc1ccc(OC)c([C@@H](O)[C@@H](C)NCc2ccc([N+](=O)[O-])cc2)c1 ZINC000873195548 1289633762 /nfs/dbraw/zinc/63/37/62/1289633762.db2.gz NSKYTZOTCUHSCA-XIKOKIGWSA-N 0 3 346.383 2.824 20 5 EFBDHN COc1ccc(OC)c([C@@H](O)[C@@H](C)NCc2cccc([N+](=O)[O-])c2)c1 ZINC000873196465 1289634986 /nfs/dbraw/zinc/63/49/86/1289634986.db2.gz SIFCGYSLNMEGPJ-XIKOKIGWSA-N 0 3 346.383 2.824 20 5 EFBDHN CC[C@H](NCCn1cc([N+](=O)[O-])ccc1=O)c1ccccc1OC ZINC000775065304 1291058369 /nfs/dbraw/zinc/05/83/69/1291058369.db2.gz MXCGKFNPTZYROY-HNNXBMFYSA-N 0 3 331.372 2.506 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1CCC(CC(=O)N(C)C)CC1 ZINC000877188944 1291159707 /nfs/dbraw/zinc/15/97/07/1291159707.db2.gz JVILTVLJRZEIOG-UHFFFAOYSA-N 0 3 333.432 2.902 20 5 EFBDHN C[C@@H](NCCCS(=O)(=O)C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000878355896 1291642824 /nfs/dbraw/zinc/64/28/24/1291642824.db2.gz OFFLSFYUUUTLOC-GFCCVEGCSA-N 0 3 328.434 2.849 20 5 EFBDHN CN(CCc1ccccc1[N+](=O)[O-])C[C@@H](O)CC1(O)CCCCC1 ZINC000878598674 1291728944 /nfs/dbraw/zinc/72/89/44/1291728944.db2.gz LSQOYOGNHITYGH-INIZCTEOSA-N 0 3 336.432 2.515 20 5 EFBDHN CN(CCc1ccccc1[N+](=O)[O-])C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000796113926 1291986565 /nfs/dbraw/zinc/98/65/65/1291986565.db2.gz PWFDCAUSKGBYMN-QGZVFWFLSA-N 0 3 345.355 2.711 20 5 EFBDHN COc1ccc([C@H]2CN(Cc3c(F)cccc3[N+](=O)[O-])CCN2)cc1 ZINC000879522446 1292170218 /nfs/dbraw/zinc/17/02/18/1292170218.db2.gz XNECJTNOQXKCKP-QGZVFWFLSA-N 0 3 345.374 2.889 20 5 EFBDHN CCNC(=O)OC[C@@H]1CCCCN1CCc1ccc([N+](=O)[O-])cc1 ZINC000796164683 1292198093 /nfs/dbraw/zinc/19/80/93/1292198093.db2.gz MVBWAIAKGKPAHK-INIZCTEOSA-N 0 3 335.404 2.738 20 5 EFBDHN CCN1CCN(Cc2ccc(Br)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000796315143 1292867898 /nfs/dbraw/zinc/86/78/98/1292867898.db2.gz FEOHTKUETDKLSX-LLVKDONJSA-N 0 3 342.237 2.883 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CNC2(c3ccc4c(c3)OCO4)CC2)c1 ZINC000775554688 1293094560 /nfs/dbraw/zinc/09/45/60/1293094560.db2.gz ZEXFKXCGAVAFSE-OAHLLOKOSA-N 0 3 342.351 2.636 20 5 EFBDHN Cc1occc1C(=O)NCCCN(C)Cc1ccc([N+](=O)[O-])cc1 ZINC001233733638 1312980716 /nfs/dbraw/zinc/98/07/16/1312980716.db2.gz OSTNRIGJNKRWKI-UHFFFAOYSA-N 0 3 331.372 2.748 20 5 EFBDHN Cc1cccc(C(=O)NCCCN(C)Cc2cccc([N+](=O)[O-])c2)n1 ZINC001234061603 1313049628 /nfs/dbraw/zinc/04/96/28/1313049628.db2.gz OCBHOAHIJGMPNQ-UHFFFAOYSA-N 0 3 342.399 2.550 20 5 EFBDHN CCOC(=O)Cc1ccc([N+](=O)[O-])c(OC2CCN(C3CC3)CC2)c1 ZINC001234409777 1313122045 /nfs/dbraw/zinc/12/20/45/1313122045.db2.gz GXJZYZVVRCRWCS-UHFFFAOYSA-N 0 3 348.399 2.706 20 5 EFBDHN CC1(C)CCN(CCNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000890082646 1295894980 /nfs/dbraw/zinc/89/49/80/1295894980.db2.gz YBWLOWOGNBGSOZ-UHFFFAOYSA-N 0 3 325.796 2.710 20 5 EFBDHN CC(C)N1CCN(Cc2ccc(Br)c([N+](=O)[O-])c2)CC1 ZINC000098012831 1296293790 /nfs/dbraw/zinc/29/37/90/1296293790.db2.gz KUOYZADKNFBVNV-UHFFFAOYSA-N 0 3 342.237 2.883 20 5 EFBDHN CN(Cc1ccc2c(c1)OCCO2)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776271165 1297331086 /nfs/dbraw/zinc/33/10/86/1297331086.db2.gz IFVVMYKFHBATRV-MRXNPFEDSA-N 0 3 344.367 2.531 20 5 EFBDHN CN(Cc1ccc2c(c1)OCCO2)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776271164 1297331360 /nfs/dbraw/zinc/33/13/60/1297331360.db2.gz IFVVMYKFHBATRV-INIZCTEOSA-N 0 3 344.367 2.531 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN[C@H]2CC3(CCC3)Oc3ccccc32)n1 ZINC000932215025 1297410585 /nfs/dbraw/zinc/41/05/85/1297410585.db2.gz BTPNTKWUZCYBTD-AWEZNQCLSA-N 0 3 328.372 2.827 20 5 EFBDHN CC[C@@H](CN1CCCC1)NC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000778284383 1297591397 /nfs/dbraw/zinc/59/13/97/1297591397.db2.gz STWLJSHAYRJAIR-ZDUSSCGKSA-N 0 3 341.358 2.677 20 5 EFBDHN O=[N+]([O-])c1cc(CN(CCOCCO)C2CCC2)ccc1Cl ZINC000852290108 1299634081 /nfs/dbraw/zinc/63/40/81/1299634081.db2.gz JGIMCXNMWDUUAO-UHFFFAOYSA-N 0 3 328.796 2.612 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CNCc2cnccc2C(F)(F)F)c1 ZINC000853135147 1300020458 /nfs/dbraw/zinc/02/04/58/1300020458.db2.gz ZZIHPXRVZUDPJX-CQSZACIVSA-N 0 3 341.289 2.832 20 5 EFBDHN Cc1cc(F)cc(C(=O)N[C@@H](C)CN2CCC(C)CC2)c1[N+](=O)[O-] ZINC000855897849 1301163190 /nfs/dbraw/zinc/16/31/90/1301163190.db2.gz HMZCXKMLFAIZSW-ZDUSSCGKSA-N 0 3 337.395 2.893 20 5 EFBDHN Cc1cc(F)cc(C(=O)N[C@H](C)CN2CCC(C)CC2)c1[N+](=O)[O-] ZINC000855897846 1301163752 /nfs/dbraw/zinc/16/37/52/1301163752.db2.gz HMZCXKMLFAIZSW-CYBMUJFWSA-N 0 3 337.395 2.893 20 5 EFBDHN CC[C@@H](C)CN(CC)CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000748260806 1313840461 /nfs/dbraw/zinc/84/04/61/1313840461.db2.gz CFGIRYYEOXAYJV-CYBMUJFWSA-N 0 3 348.403 2.689 20 5 EFBDHN CCN(CC1CCC1)CN1CCN(c2ccccc2[N+](=O)[O-])C1=O ZINC000794684178 1302924139 /nfs/dbraw/zinc/92/41/39/1302924139.db2.gz TYZQBDYNMKJVOZ-UHFFFAOYSA-N 0 3 332.404 2.916 20 5 EFBDHN O=[N+]([O-])c1ccc(F)cc1OC[C@@]1(O)CCN(Cc2ccccc2)C1 ZINC000865344348 1303223510 /nfs/dbraw/zinc/22/35/10/1303223510.db2.gz GJDDSHNZFFAAJL-GOSISDBHSA-N 0 3 346.358 2.750 20 5 EFBDHN Cc1nn(CN(C[C@@H]2CCOC2)C2CC2)c2cc([N+](=O)[O-])ccc12 ZINC000121102026 1303670256 /nfs/dbraw/zinc/67/02/56/1303670256.db2.gz OFNPNLLAWZCRBM-ZDUSSCGKSA-N 0 3 330.388 2.711 20 5 EFBDHN CN(CC(=O)N[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2)C1)CC(C)(C)C ZINC001097256102 1313932007 /nfs/dbraw/zinc/93/20/07/1313932007.db2.gz WFFNXBAQBZNUKV-GASCZTMLSA-N 0 3 348.447 2.632 20 5 EFBDHN Cc1ccccc1OCCN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000122278111 1304436330 /nfs/dbraw/zinc/43/63/30/1304436330.db2.gz JXTPYEZYQQBOPU-HNNXBMFYSA-N 0 3 342.399 2.863 20 5 EFBDHN CCn1ncc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])c1C ZINC000870453629 1305330253 /nfs/dbraw/zinc/33/02/53/1305330253.db2.gz BLEPUAVZHWUIPF-NHYWBVRUSA-N 0 3 335.335 2.914 20 5 EFBDHN O=[N+]([O-])c1cc(O[C@@H]2CNCCC2(F)F)cc(C(F)(F)F)c1 ZINC001218454189 1315198950 /nfs/dbraw/zinc/19/89/50/1315198950.db2.gz OVYCBXLBYMZCEC-SNVBAGLBSA-N 0 3 326.221 2.990 20 5 EFBDHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC000901026724 1309225791 /nfs/dbraw/zinc/22/57/91/1309225791.db2.gz OULWIOJUCNTWIC-PRHODGIISA-N 0 3 341.770 2.600 20 5 EFBDHN CCOC(=O)c1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000749692858 1311038178 /nfs/dbraw/zinc/03/81/78/1311038178.db2.gz SZDLOSUUQGMNQE-QGZVFWFLSA-N 0 3 344.367 2.595 20 5 EFBDHN C[C@@H](Nc1cc2ccc(Cl)nc2cc1[N+](=O)[O-])[C@H]1CNCCO1 ZINC001159500661 1311527587 /nfs/dbraw/zinc/52/75/87/1311527587.db2.gz FHNQLYVJVZFBJW-YMTOWFKASA-N 0 3 336.779 2.585 20 5 EFBDHN C[C@@H](Nc1nc2ccccc2c(Cl)c1[N+](=O)[O-])[C@@H]1CNCCO1 ZINC001159501080 1311528252 /nfs/dbraw/zinc/52/82/52/1311528252.db2.gz YESHNSCFFFWBAS-SKDRFNHKSA-N 0 3 336.779 2.585 20 5 EFBDHN O=[N+]([O-])c1c([O-])ccnc1O[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001225661796 1311561227 /nfs/dbraw/zinc/56/12/27/1311561227.db2.gz PJGYZHOBXACYEB-AWEZNQCLSA-N 0 3 329.356 2.739 20 5 EFBDHN O=[N+]([O-])c1c([O-])ccnc1O[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001225661796 1311561230 /nfs/dbraw/zinc/56/12/30/1311561230.db2.gz PJGYZHOBXACYEB-AWEZNQCLSA-N 0 3 329.356 2.739 20 5 EFBDHN CN1CCC(Oc2cc([N+](=O)[O-])c(F)cc2Br)CC1 ZINC001225757511 1311573631 /nfs/dbraw/zinc/57/36/31/1311573631.db2.gz QRBIFHQAFRWASJ-UHFFFAOYSA-N 0 3 333.157 2.969 20 5 EFBDHN CN(Cc1c2ccccc2cc2ccccc21)C(=O)[C@@H]1CNCCN1C ZINC001160739645 1311772438 /nfs/dbraw/zinc/77/24/38/1311772438.db2.gz VJMFECDURUZKIJ-NRFANRHFSA-N 0 3 347.462 2.855 20 5 EFBDHN C[NH+](C)CC[C@H](Oc1ncc([N+](=O)[O-])c2nc[n-]c21)c1cccs1 ZINC001227693249 1311840629 /nfs/dbraw/zinc/84/06/29/1311840629.db2.gz QGVYYXCZUIZZJN-NSHDSACASA-N 0 3 347.400 2.999 20 5 EFBDHN Cc1nn(CN2CCN(C)C[C@@H]2CC(C)C)c2ccc([N+](=O)[O-])cc12 ZINC000902542581 1311854302 /nfs/dbraw/zinc/85/43/02/1311854302.db2.gz NUCSUOUJOJFSPP-INIZCTEOSA-N 0 3 345.447 2.873 20 5 EFBDHN COCCN1CCC(Oc2ccc([N+](=O)[O-])c3cccnc23)CC1 ZINC001228139322 1311905691 /nfs/dbraw/zinc/90/56/91/1311905691.db2.gz QVGSWIMFDSMIFV-UHFFFAOYSA-N 0 3 331.372 2.633 20 5 EFBDHN CN1CCN(CCCNc2ccc(C(C)(C)C)cc2[N+](=O)[O-])CC1 ZINC001161708528 1311956439 /nfs/dbraw/zinc/95/64/39/1311956439.db2.gz MXXCMVZKCXFCQM-UHFFFAOYSA-N 0 3 334.464 2.942 20 5 EFBDHN COCCC[NH+]1CCC(Oc2nc3cc(C)c([N+](=O)[O-])cc3[n-]2)CC1 ZINC001228677823 1311980198 /nfs/dbraw/zinc/98/01/98/1311980198.db2.gz SWBRCQBCUABDLR-UHFFFAOYSA-N 0 3 348.403 2.659 20 5 EFBDHN COCCC[NH+]1CCC(Oc2nc3cc([N+](=O)[O-])c(C)cc3[n-]2)CC1 ZINC001228677823 1311980201 /nfs/dbraw/zinc/98/02/01/1311980201.db2.gz SWBRCQBCUABDLR-UHFFFAOYSA-N 0 3 348.403 2.659 20 5 EFBDHN CC(C)CC(=O)N1C[C@H]2CN(Cc3ccc([N+](=O)[O-])cc3)C[C@H]2C1 ZINC001048649223 1312005292 /nfs/dbraw/zinc/00/52/92/1312005292.db2.gz JIMRPSGUNWGQOU-IYBDPMFKSA-N 0 3 331.416 2.531 20 5 EFBDHN Cc1ccc(C(=O)NCCCNCc2ccccc2[N+](=O)[O-])cc1F ZINC001162075981 1312042547 /nfs/dbraw/zinc/04/25/47/1312042547.db2.gz UGJWOYOSJCGOIP-UHFFFAOYSA-N 0 3 345.374 2.952 20 5 EFBDHN O=C(CCC1CC1)N1C[C@H]2CN(Cc3ccc([N+](=O)[O-])cc3)C[C@H]2C1 ZINC001048730920 1312083765 /nfs/dbraw/zinc/08/37/65/1312083765.db2.gz YMWWAGOAAFLTLX-CALCHBBNSA-N 0 3 343.427 2.675 20 5 EFBDHN C[C@@H]([C@H](Oc1cc[n+]([O-])cc1[N+](=O)[O-])c1ccccc1)N1CCCC1 ZINC001229453080 1312098997 /nfs/dbraw/zinc/09/89/97/1312098997.db2.gz BPJRPOXIBPOWQI-KSSFIOAISA-N 0 3 343.383 2.833 20 5 EFBDHN CC(C)=C(F)C(=O)N1C[C@H]2CN(Cc3ccc([N+](=O)[O-])cc3)C[C@H]2C1 ZINC001048761919 1312114656 /nfs/dbraw/zinc/11/46/56/1312114656.db2.gz YDRDXZOZFOZDOC-GASCZTMLSA-N 0 3 347.390 2.748 20 5 EFBDHN CC(=O)N(CCNCc1ccc([N+](=O)[O-])cc1)CCc1ccccc1 ZINC001162639203 1312141039 /nfs/dbraw/zinc/14/10/39/1312141039.db2.gz QAUSXTOJFGZHSN-UHFFFAOYSA-N 0 3 341.411 2.776 20 5 EFBDHN CCN1CCC(Oc2c([N+](=O)[O-])cc(C)c(OC)c2[N+](=O)[O-])CC1 ZINC001229869710 1312151901 /nfs/dbraw/zinc/15/19/01/1312151901.db2.gz HQJDEBOARPXLKH-UHFFFAOYSA-N 0 3 339.348 2.683 20 5 EFBDHN COC(=O)c1ccc(C)c([N+](=O)[O-])c1O[C@H]1CCCN(C(C)C)C1 ZINC001229901148 1312157118 /nfs/dbraw/zinc/15/71/18/1312157118.db2.gz XNRSUBKAFORLLL-ZDUSSCGKSA-N 0 3 336.388 2.941 20 5 EFBDHN COc1nc(C)c(-n2c3ccccc3nc2[C@H](C)N)cc1[N+](=O)[O-] ZINC001162766870 1312171728 /nfs/dbraw/zinc/17/17/28/1312171728.db2.gz QWBRSOQGQCUJSY-VIFPVBQESA-N 0 3 327.344 2.665 20 5 EFBDHN Cc1c(Br)cnc(O[C@@H]2CCN(C(C)C)C2)c1[N+](=O)[O-] ZINC001230038224 1312175577 /nfs/dbraw/zinc/17/55/77/1312175577.db2.gz RYAVXZKHISAUMQ-SNVBAGLBSA-N 0 3 344.209 2.922 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2ccc(N[C@H]3CN4CCC3CC4)nn2)c1 ZINC001163388522 1312302056 /nfs/dbraw/zinc/30/20/56/1312302056.db2.gz YMIRBNYSTDJSIJ-INIZCTEOSA-N 0 3 325.372 2.558 20 5 EFBDHN O=[N+]([O-])c1ccc(Oc2ncc(N[C@H]3CN4CCC3CC4)cn2)cc1 ZINC001163393238 1312303131 /nfs/dbraw/zinc/30/31/31/1312303131.db2.gz RUPFZOZYGZCBTE-INIZCTEOSA-N 0 3 341.371 2.683 20 5 EFBDHN O=[N+]([O-])c1cccc2c(N[C@H]3CCCC[C@@]34CNCCO4)ccnc21 ZINC001163649787 1312354245 /nfs/dbraw/zinc/35/42/45/1312354245.db2.gz DZQWKRGYSORHSJ-FUHWJXTLSA-N 0 3 342.399 2.856 20 5 EFBDHN CCC1(C(=O)N2C[C@H]3CN(Cc4ccc([N+](=O)[O-])cc4)C[C@H]3C2)CC1 ZINC001049034276 1312384734 /nfs/dbraw/zinc/38/47/34/1312384734.db2.gz JDMWKUHWMFXYGF-IYBDPMFKSA-N 0 3 343.427 2.675 20 5 EFBDHN CN(C)c1ccnc(CN[C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000903199490 1312455853 /nfs/dbraw/zinc/45/58/53/1312455853.db2.gz ZKRORKXNVZIHPZ-HZPDHXFCSA-N 0 3 344.419 2.526 20 5 EFBDHN CN(CCCNC(=O)c1cccs1)Cc1ccc([N+](=O)[O-])cc1 ZINC001231397969 1312487983 /nfs/dbraw/zinc/48/79/83/1312487983.db2.gz PYEFTYUXXGQDQQ-UHFFFAOYSA-N 0 3 333.413 2.908 20 5 EFBDHN O=[N+]([O-])c1ccc2nc(Cl)cc(-n3ncc4c3CCNC4)c2c1 ZINC001165220127 1312589432 /nfs/dbraw/zinc/58/94/32/1312589432.db2.gz FVKFRIVTYMNHBT-UHFFFAOYSA-N 0 3 329.747 2.628 20 5 EFBDHN Cc1cc(C(=O)NCCCNCc2ccccc2[N+](=O)[O-])ccc1F ZINC001165560292 1312646967 /nfs/dbraw/zinc/64/69/67/1312646967.db2.gz UWWMGRJXTOXAFY-UHFFFAOYSA-N 0 3 345.374 2.952 20 5 EFBDHN Cc1ccc(C(=O)N[C@H]2C[C@H](NCc3ccccc3[N+](=O)[O-])C2)o1 ZINC001019967497 1314551493 /nfs/dbraw/zinc/55/14/93/1314551493.db2.gz NUXSARJWWWKVCO-HDJSIYSDSA-N 0 3 329.356 2.547 20 5 EFBDHN Cc1cc(C)c(C(=O)N[C@H]2C[C@H](NCc3ccccc3[N+](=O)[O-])C2)o1 ZINC001020054285 1314590000 /nfs/dbraw/zinc/59/00/00/1314590000.db2.gz KAUDNLDCOYXLCJ-SHTZXODSSA-N 0 3 343.383 2.855 20 5 EFBDHN CN(C)Cc1ccc(-c2noc(-c3cncc([N+](=O)[O-])c3)n2)cc1 ZINC001213823914 1314609083 /nfs/dbraw/zinc/60/90/83/1314609083.db2.gz OTOJYRWTNFLMHG-UHFFFAOYSA-N 0 3 325.328 2.768 20 5 EFBDHN O=C(Cc1ccccc1)N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001020304294 1314722439 /nfs/dbraw/zinc/72/24/39/1314722439.db2.gz YCXWCCJHMHIYQT-QAQDUYKDSA-N 0 3 339.395 2.574 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(-c2nc(-c3ccc4c(n3)CCNC4)no2)c1 ZINC001215374591 1314826528 /nfs/dbraw/zinc/82/65/28/1314826528.db2.gz QQLRGCATKLGTTD-UHFFFAOYSA-N 0 3 337.339 2.661 20 5 EFBDHN COCCn1c(C)c(C)c2cc(C(=O)OCC(C)[N+](=O)[O-])ccc21 ZINC000813110740 1315166301 /nfs/dbraw/zinc/16/63/01/1315166301.db2.gz IKLFRWGFNQXGJH-NSHDSACASA-N 0 3 334.372 2.727 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(C)cc1O[C@@H]1CNCc2ccccc21 ZINC001218489611 1315204764 /nfs/dbraw/zinc/20/47/64/1315204764.db2.gz PIWGCJHOJFHMCE-QGZVFWFLSA-N 0 3 342.351 2.913 20 5 EFBDHN C[C@@H]1CCN[C@@H](C(=O)n2c3ccccc3cc3c(=O)c(N)ccc2-3)C1 ZINC001219254104 1315294595 /nfs/dbraw/zinc/29/45/95/1315294595.db2.gz UHDBERLXZLHKGD-MLGOLLRUSA-N 0 3 335.407 2.717 20 5 EFBDHN Cc1cc2cc3ccc(N(C)C)cc3nc2cc1NC[C@H](O)CO ZINC001252066452 1315409337 /nfs/dbraw/zinc/40/93/37/1315409337.db2.gz AJQZQMIZXMGBGK-INIZCTEOSA-N 0 3 325.412 2.528 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCC(NC3(c4cccnn4)CC3)CC2)cc1 ZINC001254466679 1315706802 /nfs/dbraw/zinc/70/68/02/1315706802.db2.gz LFOCNXJYGVQGJJ-UHFFFAOYSA-N 0 3 339.399 2.633 20 5 EFBDHN C[C@H]1CCN(C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CCC1=O ZINC001254473547 1315707667 /nfs/dbraw/zinc/70/76/67/1315707667.db2.gz FDFKEGPPQADGGO-AWEZNQCLSA-N 0 3 331.416 2.865 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCC(N3CCOC[C@@H]3C3CC3)CC2)cc1 ZINC001254481171 1315708673 /nfs/dbraw/zinc/70/86/73/1315708673.db2.gz VZLJJBSSLYTJEZ-GOSISDBHSA-N 0 3 331.416 2.674 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCC(N3CCOC[C@H]3C3CC3)CC2)cc1 ZINC001254481394 1315708727 /nfs/dbraw/zinc/70/87/27/1315708727.db2.gz VZLJJBSSLYTJEZ-SFHVURJKSA-N 0 3 331.416 2.674 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])NC1CN(C(=O)OC(C)(C)C)C1 ZINC001254532251 1315720457 /nfs/dbraw/zinc/72/04/57/1315720457.db2.gz LZXTWRGBZVWRIN-LBPRGKRZSA-N 0 3 335.404 2.735 20 5 EFBDHN CCOC(=O)c1cccc(CN[C@@H](C)Cc2ccccc2[N+](=O)[O-])n1 ZINC001254539116 1315721464 /nfs/dbraw/zinc/72/14/64/1315721464.db2.gz FVFHBVUIEUWIBR-ZDUSSCGKSA-N 0 3 343.383 2.887 20 5 EFBDHN COc1ccccc1[C@@H](CO)N[C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC001254548816 1315722404 /nfs/dbraw/zinc/72/24/04/1315722404.db2.gz MKYLNNAFPJBRDA-CZUORRHYSA-N 0 3 330.384 2.858 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N1CCC2(CCCC(=O)N2)CC1 ZINC001254556393 1315723398 /nfs/dbraw/zinc/72/33/98/1315723398.db2.gz KUBBTZNQEFZRMW-AWEZNQCLSA-N 0 3 331.416 2.661 20 5 EFBDHN CCNC(=O)OC1CCN([C@@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC001254563917 1315724140 /nfs/dbraw/zinc/72/41/40/1315724140.db2.gz GIUSYUMKHGVKKK-ZDUSSCGKSA-N 0 3 335.404 2.736 20 5 EFBDHN Cc1cncnc1O[C@@H]1CCN([C@H](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC001254571291 1315725163 /nfs/dbraw/zinc/72/51/63/1315725163.db2.gz RUGFDMLFAMEMQP-GDBMZVCRSA-N 0 3 342.399 2.778 20 5 EFBDHN Cc1cncnc1O[C@H]1CCN([C@@H](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC001254571293 1315725276 /nfs/dbraw/zinc/72/52/76/1315725276.db2.gz RUGFDMLFAMEMQP-HOCLYGCPSA-N 0 3 342.399 2.778 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N1CC[C@H](Oc2ncc(F)cn2)C1 ZINC001254569986 1315725494 /nfs/dbraw/zinc/72/54/94/1315725494.db2.gz LMQMUQKNFLKNLQ-WFASDCNBSA-N 0 3 346.362 2.608 20 5 EFBDHN N[C@H]([C@H]1CCCN([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1)C(F)(F)F ZINC001254587793 1315727875 /nfs/dbraw/zinc/72/78/75/1315727875.db2.gz BAQIGYIIKPTHNE-TUKIKUTGSA-N 0 3 343.349 2.664 20 5 EFBDHN Cc1nc([C@H]2CCCN([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)no1 ZINC001254593565 1315728494 /nfs/dbraw/zinc/72/84/94/1315728494.db2.gz NBBPMVVETTUBNH-BBRMVZONSA-N 0 3 328.372 2.633 20 5 EFBDHN Cc1nc([C@H]2CCCN([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)no1 ZINC001254593568 1315729068 /nfs/dbraw/zinc/72/90/68/1315729068.db2.gz NBBPMVVETTUBNH-XJKSGUPXSA-N 0 3 328.372 2.633 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@@H](N1CC[C@H](N3CCCCC3)[C@@H](F)C1)C2 ZINC001254610559 1315731330 /nfs/dbraw/zinc/73/13/30/1315731330.db2.gz NMNBDFFDQPXVLR-FHWLQOOXSA-N 0 3 347.434 2.960 20 5 EFBDHN COc1cc(N2CCC(NCc3cnoc3C)CC2)ccc1[N+](=O)[O-] ZINC001256084185 1315902834 /nfs/dbraw/zinc/90/28/34/1315902834.db2.gz VKOFZCGJHFMDOO-UHFFFAOYSA-N 0 3 346.387 2.658 20 5 EFBDHN CN(C)C[C@H](NC[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC001262562628 1316472521 /nfs/dbraw/zinc/47/25/21/1316472521.db2.gz GXWOQDQTDQUIEF-ZWKOTPCHSA-N 0 3 347.390 2.660 20 5 EFBDHN CS[C@@H]1CC[C@@H](N(C)Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C1 ZINC001319404372 1328874058 /nfs/dbraw/zinc/87/40/58/1328874058.db2.gz NGSRCEXEUGVIKP-DGCLKSJQSA-N 0 3 335.433 2.821 20 5 EFBDHN CN(Cc1cc(C(C)(C)C)[nH]n1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001320875482 1329313340 /nfs/dbraw/zinc/31/33/40/1329313340.db2.gz CPQWWGALLKNNSE-HNNXBMFYSA-N 0 3 332.404 2.781 20 5 EFBDHN Cc1cncc([N+](=O)[O-])c1N[C@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC001322535499 1329465751 /nfs/dbraw/zinc/46/57/51/1329465751.db2.gz RWPUAGASXBOVFR-HOCLYGCPSA-N 0 3 326.400 2.795 20 5 EFBDHN Cc1cncc([N+](=O)[O-])c1N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC001324270459 1329612405 /nfs/dbraw/zinc/61/24/05/1329612405.db2.gz ANQGLFZDVYJIST-GOEBONIOSA-N 0 3 326.400 2.968 20 5 EFBDHN CCN1CCN(c2ncnc3c(Cl)cc([N+](=O)[O-])cc32)[C@H](C)C1 ZINC001327679447 1330507742 /nfs/dbraw/zinc/50/77/42/1330507742.db2.gz QGLZHMKEGFXQDD-SNVBAGLBSA-N 0 3 335.795 2.722 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)ccc1CNC[C@@H](CO)CC1CCOCC1 ZINC001333808592 1331218019 /nfs/dbraw/zinc/21/80/19/1331218019.db2.gz NFTPWKCENQNAIS-ZDUSSCGKSA-N 0 3 342.823 2.763 20 5 EFBDHN O=C(Nc1cccc(C[NH+]2CCCC2)c1)c1cc([N+](=O)[O-])c[n-]c1=O ZINC001337338440 1331563444 /nfs/dbraw/zinc/56/34/44/1331563444.db2.gz HOXXIMHTXLSZQX-UHFFFAOYSA-N 0 3 342.355 2.544 20 5 EFBDHN CC(C)Oc1cc(C(=O)NC[C@H]2CCCCN2C)ccc1[N+](=O)[O-] ZINC001340856707 1332213295 /nfs/dbraw/zinc/21/32/95/1332213295.db2.gz IUXPGKXZCMOQSP-CQSZACIVSA-N 0 3 335.404 2.596 20 5 EFBDHN COc1cc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])ccn1 ZINC001343829623 1332384283 /nfs/dbraw/zinc/38/42/83/1332384283.db2.gz IOCWYVATSAGWIS-BMIGLBTASA-N 0 3 334.303 2.793 20 5 EFBDHN COc1cc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])ccn1 ZINC001343829627 1332384358 /nfs/dbraw/zinc/38/43/58/1332384358.db2.gz IOCWYVATSAGWIS-BONVTDFDSA-N 0 3 334.303 2.793 20 5 EFBDHN CC(C)N1CCC[C@@H]1C(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC001344024860 1332398080 /nfs/dbraw/zinc/39/80/80/1332398080.db2.gz ZANSQLJRTOUHMA-DAXOMENPSA-N 0 3 338.379 2.948 20 5 EFBDHN CC([C@H](OC(=O)COCc1ccncc1)c1ccccc1F)[N+](=O)[O-] ZINC001345037048 1332503626 /nfs/dbraw/zinc/50/36/26/1332503626.db2.gz PUHIJDYVTQIBTE-SJCJKPOMSA-N 0 3 348.330 2.687 20 5 EFBDHN CCCN1CC[C@H](NC(=O)c2cc(Cl)c(C)cc2[N+](=O)[O-])C1 ZINC001347869422 1332779734 /nfs/dbraw/zinc/77/97/34/1332779734.db2.gz UZQCZYZHIFUOJQ-NSHDSACASA-N 0 3 325.796 2.771 20 5 EFBDHN COc1ncccc1C(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC001348939651 1332886332 /nfs/dbraw/zinc/88/63/32/1332886332.db2.gz LISLPWCBZZBHEA-HZMBPMFUSA-N 0 3 334.303 2.793 20 5 EFBDHN O=C(N[C@@H]1CCCN2CCCC[C@H]12)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000847253406 1333448125 /nfs/dbraw/zinc/44/81/25/1333448125.db2.gz DESIUWQQWXLIHP-UKRRQHHQSA-N 0 3 337.807 2.995 20 5 EFBDHN O=C(N[C@@H]1CCCN2CCCC[C@H]12)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000847253613 1333448188 /nfs/dbraw/zinc/44/81/88/1333448188.db2.gz JLBHWGGGLKMGAL-ZIAGYGMSSA-N 0 3 337.807 2.995 20 5 EFBDHN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N[C@H]1CCCN2CCCC[C@@H]12 ZINC000848352217 1334686019 /nfs/dbraw/zinc/68/60/19/1334686019.db2.gz NLBOFJLYZGLKGW-KBPBESRZSA-N 0 3 335.379 2.789 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2N[C@@H](CO)C[C@@H](O)c1ccccc1 ZINC000848537105 1334782001 /nfs/dbraw/zinc/78/20/01/1334782001.db2.gz ZRRCGRRGTDPNMP-DKSSEZFCSA-N 0 3 342.395 2.656 20 5 EFBDHN COC(=O)Cc1ccccc1CNCc1ccc(C)c([N+](=O)[O-])c1 ZINC000848578748 1334805816 /nfs/dbraw/zinc/80/58/16/1334805816.db2.gz JFYJGNQDLHDSMQ-UHFFFAOYSA-N 0 3 328.368 2.909 20 5 EFBDHN Cc1cocc1C(=O)N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001020474690 713052626 /nfs/dbraw/zinc/05/26/26/713052626.db2.gz GDAVICUKRUYAPS-HDJSIYSDSA-N 0 3 329.356 2.547 20 5 EFBDHN O=C(N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1)c1ccc(F)s1 ZINC001021123474 713586787 /nfs/dbraw/zinc/58/67/87/713586787.db2.gz IYGYQWDYOBSRIJ-HAQNSBGRSA-N 0 3 349.387 2.846 20 5 EFBDHN O=C(N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1)c1ccsc1 ZINC001021812804 714508364 /nfs/dbraw/zinc/50/83/64/714508364.db2.gz ZFBLUBNIYYTMTQ-OKILXGFUSA-N 0 3 331.397 2.707 20 5 EFBDHN CCc1[nH]ccc1C(=O)N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001022041877 714687001 /nfs/dbraw/zinc/68/70/01/714687001.db2.gz WRTKAZCGLRQEPX-OKILXGFUSA-N 0 3 342.399 2.536 20 5 EFBDHN O=C(N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1)C1C=CC=CC=C1 ZINC001022146635 714824187 /nfs/dbraw/zinc/82/41/87/714824187.db2.gz GSCORLFFQGBKTO-CALCHBBNSA-N 0 3 339.395 2.630 20 5 EFBDHN O=C(N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1)C12CCC(CC1)C2 ZINC001022289493 714970993 /nfs/dbraw/zinc/97/09/93/714970993.db2.gz ZILIHCIBNZAZQA-XFROLERWSA-N 0 3 343.427 2.912 20 5 EFBDHN C[C@H]1CCCN(CCNc2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])C1 ZINC000891836976 715051630 /nfs/dbraw/zinc/05/16/30/715051630.db2.gz BLLIJUJRQYLBSJ-ZDUSSCGKSA-N 0 3 344.415 2.591 20 5 EFBDHN O=C(N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1)c1ccc(F)s1 ZINC001023156592 716177032 /nfs/dbraw/zinc/17/70/32/716177032.db2.gz IYGYQWDYOBSRIJ-TXEJJXNPSA-N 0 3 349.387 2.846 20 5 EFBDHN COc1c([O-])ccc(C[N@@H+]2CCC[C@H]2[C@H]2CCCOC2)c1[N+](=O)[O-] ZINC000895081953 723233742 /nfs/dbraw/zinc/23/37/42/723233742.db2.gz LRQYJCGUGLWVBN-KBPBESRZSA-N 0 3 336.388 2.700 20 5 EFBDHN COc1c([O-])ccc(C[N@H+]2CCC[C@H]2[C@H]2CCCOC2)c1[N+](=O)[O-] ZINC000895081953 723233743 /nfs/dbraw/zinc/23/37/43/723233743.db2.gz LRQYJCGUGLWVBN-KBPBESRZSA-N 0 3 336.388 2.700 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]C[C@@H](C)c2ncc(C)s2)c1[N+](=O)[O-] ZINC000893577489 717639097 /nfs/dbraw/zinc/63/90/97/717639097.db2.gz ZYDQYUALTNZZDN-SECBINFHSA-N 0 3 337.401 2.967 20 5 EFBDHN COc1c(O)ccc(CNCCCOc2ccccc2)c1[N+](=O)[O-] ZINC000892472219 717745656 /nfs/dbraw/zinc/74/56/56/717745656.db2.gz SVUDWBBEYKAYIN-UHFFFAOYSA-N 0 3 332.356 2.868 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]CCCOc2ccccc2)c1[N+](=O)[O-] ZINC000892472219 717745659 /nfs/dbraw/zinc/74/56/59/717745659.db2.gz SVUDWBBEYKAYIN-UHFFFAOYSA-N 0 3 332.356 2.868 20 5 EFBDHN COc1ccc(CN[C@@H]2COc3c(cccc3OC)C2)cc1[N+](=O)[O-] ZINC000106469370 718059317 /nfs/dbraw/zinc/05/93/17/718059317.db2.gz YFQOCDYZLFJXOH-AWEZNQCLSA-N 0 3 344.367 2.705 20 5 EFBDHN COc1c(O)ccc(CN[C@@H](C)COc2ccccc2)c1[N+](=O)[O-] ZINC000892693279 718738340 /nfs/dbraw/zinc/73/83/40/718738340.db2.gz GLSJVGCATUPUSK-LBPRGKRZSA-N 0 3 332.356 2.866 20 5 EFBDHN C[C@@H]1CN(c2cc([N+](=O)[O-])cc3c(Cl)ncnc32)[C@H](C)CN1C ZINC001164638493 719256396 /nfs/dbraw/zinc/25/63/96/719256396.db2.gz ZZBJMTKPQZGBGA-NXEZZACHSA-N 0 3 335.795 2.720 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2cnn(CN(C[C@H]3CCOC3)C3CC3)c2)cc1 ZINC000103457803 719302460 /nfs/dbraw/zinc/30/24/60/719302460.db2.gz FAFQHGDEEYEYLY-CQSZACIVSA-N 0 3 342.399 2.917 20 5 EFBDHN COc1c([O-])ccc(C[NH2+][C@@H](C)CCc2cccn2C)c1[N+](=O)[O-] ZINC000892954494 719333033 /nfs/dbraw/zinc/33/30/33/719333033.db2.gz ZZVHEKQZZDYTFO-LBPRGKRZSA-N 0 3 333.388 2.758 20 5 EFBDHN CC(COC(=O)C1=Cc2ccccc2O[C@H]1C(F)(F)F)[N+](=O)[O-] ZINC000893045569 719527960 /nfs/dbraw/zinc/52/79/60/719527960.db2.gz XXRJMGVIAFVTSM-QPUJVOFHSA-N 0 3 331.246 2.602 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]CCc2ccc(Cl)nc2)c1[N+](=O)[O-] ZINC000893103847 719658603 /nfs/dbraw/zinc/65/86/03/719658603.db2.gz OQCLBCAPDZKWNM-UHFFFAOYSA-N 0 3 337.763 2.690 20 5 EFBDHN CC(C)C(=O)N1CCC(CN(C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC001029937642 724624654 /nfs/dbraw/zinc/62/46/54/724624654.db2.gz VECJHRWKGZWPQO-UHFFFAOYSA-N 0 3 333.432 2.921 20 5 EFBDHN Cn1c2ccccc2c(NC(C)(C)CN2CCCC2)c([N+](=O)[O-])c1=O ZINC000894129412 720808734 /nfs/dbraw/zinc/80/87/34/720808734.db2.gz NVUWJXHXANRWMQ-UHFFFAOYSA-N 0 3 344.415 2.733 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN[C@@H]3CCc4ccccc4OC3)nc2c1 ZINC000338323220 721073292 /nfs/dbraw/zinc/07/32/92/721073292.db2.gz RWGSKAIJAOLERR-CYBMUJFWSA-N 0 3 338.367 2.955 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN[C@H]3CCc4ccccc4OC3)nc2c1 ZINC000338323224 721073487 /nfs/dbraw/zinc/07/34/87/721073487.db2.gz RWGSKAIJAOLERR-ZDUSSCGKSA-N 0 3 338.367 2.955 20 5 EFBDHN COc1c([O-])ccc(C[NH2+][C@@H]2CCCC23CCOCC3)c1[N+](=O)[O-] ZINC000894256588 721763844 /nfs/dbraw/zinc/76/38/44/721763844.db2.gz HQZIRTARODUKHW-CQSZACIVSA-N 0 3 336.388 2.748 20 5 EFBDHN O=[N+]([O-])c1cccc2ncnc(N3CCN(C4CCCC4)CC3)c21 ZINC000611564879 721861500 /nfs/dbraw/zinc/86/15/00/721861500.db2.gz QCYQGLXEAGYWJC-UHFFFAOYSA-N 0 3 327.388 2.603 20 5 EFBDHN COc1c([O-])ccc(C[N@@H+]2CCCCC[C@H]2C[C@@H](C)O)c1[N+](=O)[O-] ZINC000894412212 722719556 /nfs/dbraw/zinc/71/95/56/722719556.db2.gz ILFKRBVISLJIME-OCCSQVGLSA-N 0 3 338.404 2.825 20 5 EFBDHN COc1c([O-])ccc(C[N@H+]2CCCCC[C@H]2C[C@@H](C)O)c1[N+](=O)[O-] ZINC000894412212 722719558 /nfs/dbraw/zinc/71/95/58/722719558.db2.gz ILFKRBVISLJIME-OCCSQVGLSA-N 0 3 338.404 2.825 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]CC2(c3ccccn3)CCC2)c1[N+](=O)[O-] ZINC000894426418 722733548 /nfs/dbraw/zinc/73/35/48/722733548.db2.gz PCUVTWVMMSZZPJ-UHFFFAOYSA-N 0 3 343.383 2.916 20 5 EFBDHN COc1c(O)ccc(CNC[C@@]2(C)CC2(Cl)Cl)c1[N+](=O)[O-] ZINC000894714126 722824101 /nfs/dbraw/zinc/82/41/01/722824101.db2.gz CQVFKPZIKWIQEQ-GFCCVEGCSA-N 0 3 335.187 2.983 20 5 EFBDHN CCc1cccc(NC(=O)CNCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000895039397 723057461 /nfs/dbraw/zinc/05/74/61/723057461.db2.gz DPFXHUGZKXFIFI-UHFFFAOYSA-N 0 3 327.384 2.928 20 5 EFBDHN C[C@@H](CNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)N1CCCCC1 ZINC000917840224 728794377 /nfs/dbraw/zinc/79/43/77/728794377.db2.gz QPQLMJHMHCTKKY-LBPRGKRZSA-N 0 3 331.372 2.945 20 5 EFBDHN CC(C)C[C@@H]1CN(C)CCN1c1ncnc2sc([N+](=O)[O-])cc21 ZINC000896649984 723422863 /nfs/dbraw/zinc/42/28/63/723422863.db2.gz APDNAWUINHUEQQ-LLVKDONJSA-N 0 3 335.433 2.766 20 5 EFBDHN COc1c(O)ccc(CN[C@@H]2COc3cc(F)ccc3C2)c1[N+](=O)[O-] ZINC000895383837 724095844 /nfs/dbraw/zinc/09/58/44/724095844.db2.gz MLDIDOUPOKLWEG-ZDUSSCGKSA-N 0 3 348.330 2.541 20 5 EFBDHN CN(CN1CCN(c2ccccc2[N+](=O)[O-])C1=O)C(C1CC1)C1CC1 ZINC000154727978 728877933 /nfs/dbraw/zinc/87/79/33/728877933.db2.gz DFBMOYFGGNENTO-UHFFFAOYSA-N 0 3 344.415 2.915 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN1C[C@@H]2[C@H](O)CC[C@@H]2C1 ZINC000895780900 724317999 /nfs/dbraw/zinc/31/79/99/724317999.db2.gz ZGJPHJBEFSFPMO-LJWDBELGSA-N 0 3 330.306 2.816 20 5 EFBDHN COc1cc(C[NH2+]CC(C)(C)C2CCOCC2)c([N+](=O)[O-])cc1[O-] ZINC000897450820 726212932 /nfs/dbraw/zinc/21/29/32/726212932.db2.gz HREAHAYHPFJXJV-UHFFFAOYSA-N 0 3 338.404 2.851 20 5 EFBDHN CN(CCc1ccccc1[N+](=O)[O-])C(=O)C(C)(C)N1CCCCC1 ZINC000908123939 727095969 /nfs/dbraw/zinc/09/59/69/727095969.db2.gz HKNAMDSZXJMOQD-UHFFFAOYSA-N 0 3 333.432 2.860 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCCN(CC)C[C@@H]1C ZINC000910278965 727426715 /nfs/dbraw/zinc/42/67/15/727426715.db2.gz HSTOGKMVMQKVOZ-ZDUSSCGKSA-N 0 3 335.404 2.550 20 5 EFBDHN CCN1CCCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000910280213 727426736 /nfs/dbraw/zinc/42/67/36/727426736.db2.gz AHPZHJFVFXRYAA-LLVKDONJSA-N 0 3 325.796 2.805 20 5 EFBDHN CCN1CCCN(C(=O)c2cc(SC)ccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000910293289 727430939 /nfs/dbraw/zinc/43/09/39/727430939.db2.gz NJEWPZYQJAQNML-LBPRGKRZSA-N 0 3 337.445 2.873 20 5 EFBDHN O=[N+]([O-])c1ccc(NC[C@H](c2ccco2)N2CCCC2)c2nonc21 ZINC000912730330 727738683 /nfs/dbraw/zinc/73/86/83/727738683.db2.gz BJSUTIUAPGXFKZ-CYBMUJFWSA-N 0 3 343.343 2.973 20 5 EFBDHN COc1ccc(CNC[C@@H](O)c2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000917416759 727805305 /nfs/dbraw/zinc/80/53/05/727805305.db2.gz MPLQKBIFLAJXEA-OAHLLOKOSA-N 0 3 338.310 2.705 20 5 EFBDHN C[C@H]1CCCN(CCNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000129613284 727956619 /nfs/dbraw/zinc/95/66/19/727956619.db2.gz GILGTGAIPCLWDY-NSHDSACASA-N 0 3 325.796 2.710 20 5 EFBDHN CN1CCN(Cc2ccc(Br)c([N+](=O)[O-])c2)CC1(C)C ZINC000157814452 728217989 /nfs/dbraw/zinc/21/79/89/728217989.db2.gz AEAQBRMOLVGCBF-UHFFFAOYSA-N 0 3 342.237 2.883 20 5 EFBDHN COc1ccc(OC)c([C@@H](O)CN[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173307951 728622087 /nfs/dbraw/zinc/62/20/87/728622087.db2.gz VPXDWNZCTFIJDM-SJCJKPOMSA-N 0 3 346.383 2.996 20 5 EFBDHN CCN1CCN(c2ccc(Nc3ncccc3[N+](=O)[O-])cc2)CC1 ZINC000920959422 729246863 /nfs/dbraw/zinc/24/68/63/729246863.db2.gz MMTJOGDPNNHCBJ-UHFFFAOYSA-N 0 3 327.388 2.875 20 5 EFBDHN C[C@@H]1[C@H](C)NC[C@H](C)N1C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC001576880899 1089504512 /nfs/dbraw/zinc/50/45/12/1089504512.db2.gz SAPLCIZYMUDRLP-LPEHRKFASA-N 0 3 345.321 2.825 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc2c(c1)OCCNC2 ZINC001579642545 1090649606 /nfs/dbraw/zinc/64/96/06/1090649606.db2.gz KGRWIBUTEMIVDS-UHFFFAOYSA-N 0 3 327.340 2.638 20 5 EFBDHN O=C(Nc1ccc([C@@H]2CNCCO2)cc1)c1cc(F)cc([N+](=O)[O-])c1 ZINC001580765776 1091001470 /nfs/dbraw/zinc/00/14/70/1091001470.db2.gz SYWJDHUMBNZXSU-INIZCTEOSA-N 0 3 345.330 2.647 20 5 EFBDHN CCCN(C)CC(=O)NCC1(Nc2ccc([N+](=O)[O-])cc2)CCCC1 ZINC001104401011 1092634052 /nfs/dbraw/zinc/63/40/52/1092634052.db2.gz MYIHHHQYXJUMJH-UHFFFAOYSA-N 0 3 348.447 2.778 20 5 EFBDHN CC(C)(C)[C@H]1CC[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001589103774 1093032856 /nfs/dbraw/zinc/03/28/56/1093032856.db2.gz WMGFLVIPIMHQMP-NSHDSACASA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)(C)[C@H]1CC[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001589103774 1093032863 /nfs/dbraw/zinc/03/28/63/1093032863.db2.gz WMGFLVIPIMHQMP-NSHDSACASA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)(C)[C@H]1CC[N@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001589103774 1093032870 /nfs/dbraw/zinc/03/28/70/1093032870.db2.gz WMGFLVIPIMHQMP-NSHDSACASA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)(C)[C@H]1CC[N@@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001589103774 1093032873 /nfs/dbraw/zinc/03/28/73/1093032873.db2.gz WMGFLVIPIMHQMP-NSHDSACASA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)C[C@@H]1CC[N@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001589573127 1093108903 /nfs/dbraw/zinc/10/89/03/1093108903.db2.gz UUFVSWPSZLNRTL-LBPRGKRZSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001589573127 1093108910 /nfs/dbraw/zinc/10/89/10/1093108910.db2.gz UUFVSWPSZLNRTL-LBPRGKRZSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)C[C@@H]1CC[N@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001589573127 1093108912 /nfs/dbraw/zinc/10/89/12/1093108912.db2.gz UUFVSWPSZLNRTL-LBPRGKRZSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)C[C@@H]1CC[N@@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001589573127 1093108916 /nfs/dbraw/zinc/10/89/16/1093108916.db2.gz UUFVSWPSZLNRTL-LBPRGKRZSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)C[C@H]1CC[N@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001589573123 1093109266 /nfs/dbraw/zinc/10/92/66/1093109266.db2.gz UUFVSWPSZLNRTL-GFCCVEGCSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)C[C@H]1CC[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001589573123 1093109269 /nfs/dbraw/zinc/10/92/69/1093109269.db2.gz UUFVSWPSZLNRTL-GFCCVEGCSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)C[C@H]1CC[N@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001589573123 1093109270 /nfs/dbraw/zinc/10/92/70/1093109270.db2.gz UUFVSWPSZLNRTL-GFCCVEGCSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)C[C@H]1CC[N@@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001589573123 1093109272 /nfs/dbraw/zinc/10/92/72/1093109272.db2.gz UUFVSWPSZLNRTL-GFCCVEGCSA-N 0 3 330.392 2.643 20 5 EFBDHN C[C@H]1CC[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])CC1(C)C ZINC001590272351 1093354862 /nfs/dbraw/zinc/35/48/62/1093354862.db2.gz QVULXVRYCQPDGJ-NSHDSACASA-N 0 3 330.392 2.643 20 5 EFBDHN C[C@H]1CC[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])CC1(C)C ZINC001590272351 1093354868 /nfs/dbraw/zinc/35/48/68/1093354868.db2.gz QVULXVRYCQPDGJ-NSHDSACASA-N 0 3 330.392 2.643 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[N@@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC001593483130 1094326556 /nfs/dbraw/zinc/32/65/56/1094326556.db2.gz VRYFJFRJMKTTET-FZMZJTMJSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC001593483130 1094326564 /nfs/dbraw/zinc/32/65/64/1094326564.db2.gz VRYFJFRJMKTTET-FZMZJTMJSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[N@@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC001593483130 1094326574 /nfs/dbraw/zinc/32/65/74/1094326574.db2.gz VRYFJFRJMKTTET-FZMZJTMJSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC001593483130 1094326580 /nfs/dbraw/zinc/32/65/80/1094326580.db2.gz VRYFJFRJMKTTET-FZMZJTMJSA-N 0 3 328.376 2.539 20 5 EFBDHN Cc1cc(Br)cc([N+](=O)[O-])c1O[C@@H]1CCNC[C@H]1F ZINC001218071412 1095532498 /nfs/dbraw/zinc/53/24/98/1095532498.db2.gz PJYDUJACJAAWPU-MWLCHTKSSA-N 0 3 333.157 2.745 20 5 EFBDHN COc1c(O)ccc(CN[C@H]2CCCO[C@H]2CC(C)C)c1[N+](=O)[O-] ZINC000893684297 1095877047 /nfs/dbraw/zinc/87/70/47/1095877047.db2.gz AJADBTQMSGEJEA-ZFWWWQNUSA-N 0 3 338.404 2.992 20 5 EFBDHN COc1c(O)ccc(CN[C@H]2CCCO[C@@H]2CC(C)C)c1[N+](=O)[O-] ZINC000893684294 1095877088 /nfs/dbraw/zinc/87/70/88/1095877088.db2.gz AJADBTQMSGEJEA-DZGCQCFKSA-N 0 3 338.404 2.992 20 5 EFBDHN CS(=O)(=O)CCCCCNCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000893684689 1095894390 /nfs/dbraw/zinc/89/43/90/1095894390.db2.gz DLNIZUBBTRKFPT-UHFFFAOYSA-N 0 3 334.825 2.553 20 5 EFBDHN C[C@@H]1CC[C@@]2(CC[N@H+](Cc3c(-c4nnn[n-]4)cccc3[N+](=O)[O-])C2)C1 ZINC001603880084 1096654082 /nfs/dbraw/zinc/65/40/82/1096654082.db2.gz DQHFHPDLBUPIBT-SJKOYZFVSA-N 0 3 342.403 2.787 20 5 EFBDHN C[C@@H]1CC[C@@]2(CC[N@@H+](Cc3c(-c4nnn[n-]4)cccc3[N+](=O)[O-])C2)C1 ZINC001603880084 1096654085 /nfs/dbraw/zinc/65/40/85/1096654085.db2.gz DQHFHPDLBUPIBT-SJKOYZFVSA-N 0 3 342.403 2.787 20 5 EFBDHN C[C@@H]1CC[C@@]2(CC[N@H+](Cc3c(-c4nn[n-]n4)cccc3[N+](=O)[O-])C2)C1 ZINC001603880084 1096654088 /nfs/dbraw/zinc/65/40/88/1096654088.db2.gz DQHFHPDLBUPIBT-SJKOYZFVSA-N 0 3 342.403 2.787 20 5 EFBDHN C[C@@H]1CC[C@@]2(CC[N@@H+](Cc3c(-c4nn[n-]n4)cccc3[N+](=O)[O-])C2)C1 ZINC001603880084 1096654089 /nfs/dbraw/zinc/65/40/89/1096654089.db2.gz DQHFHPDLBUPIBT-SJKOYZFVSA-N 0 3 342.403 2.787 20 5 EFBDHN C[C@@H]1CCC[C@@H](C)C1[NH2+]Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001603884207 1096656944 /nfs/dbraw/zinc/65/69/44/1096656944.db2.gz JKNKZMDGLPRXTH-GHMZBOCLSA-N 0 3 330.392 2.689 20 5 EFBDHN C[C@@H]1CCC[C@@H](C)C1[NH2+]Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001603884207 1096656947 /nfs/dbraw/zinc/65/69/47/1096656947.db2.gz JKNKZMDGLPRXTH-GHMZBOCLSA-N 0 3 330.392 2.689 20 5 EFBDHN C[C@@H]1CCCC[C@@H]1[N@H+](C)Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001603891562 1096662524 /nfs/dbraw/zinc/66/25/24/1096662524.db2.gz STQDPUBYFYCEGQ-RISCZKNCSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001603891562 1096662530 /nfs/dbraw/zinc/66/25/30/1096662530.db2.gz STQDPUBYFYCEGQ-RISCZKNCSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCCC[C@@H]1[N@H+](C)Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001603891562 1096662535 /nfs/dbraw/zinc/66/25/35/1096662535.db2.gz STQDPUBYFYCEGQ-RISCZKNCSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001603891562 1096662543 /nfs/dbraw/zinc/66/25/43/1096662543.db2.gz STQDPUBYFYCEGQ-RISCZKNCSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1C[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])CC(C)(C)C1 ZINC001603937316 1096674600 /nfs/dbraw/zinc/67/46/00/1096674600.db2.gz RKUCNMDLCAPHKI-NSHDSACASA-N 0 3 330.392 2.643 20 5 EFBDHN C[C@@H]1C[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])CC(C)(C)C1 ZINC001603937316 1096674604 /nfs/dbraw/zinc/67/46/04/1096674604.db2.gz RKUCNMDLCAPHKI-NSHDSACASA-N 0 3 330.392 2.643 20 5 EFBDHN O=[N+]([O-])c1cc(O[C@@H]2CN3CCC2CC3)ccc1Br ZINC001225503958 1097446572 /nfs/dbraw/zinc/44/65/72/1097446572.db2.gz IYCCKQDTVMXLKO-CYBMUJFWSA-N 0 3 327.178 2.830 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[N@@H+]1CC[C@@H]2CCCC[C@@H]21 ZINC001607083867 1097509607 /nfs/dbraw/zinc/50/96/07/1097509607.db2.gz PIDHQEIJAJJYFI-FZMZJTMJSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[N@H+]1CC[C@@H]2CCCC[C@@H]21 ZINC001607083867 1097509611 /nfs/dbraw/zinc/50/96/11/1097509611.db2.gz PIDHQEIJAJJYFI-FZMZJTMJSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[N@@H+]1CC[C@@H]2CCCC[C@@H]21 ZINC001607083867 1097509617 /nfs/dbraw/zinc/50/96/17/1097509617.db2.gz PIDHQEIJAJJYFI-FZMZJTMJSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[N@H+]1CC[C@@H]2CCCC[C@@H]21 ZINC001607083867 1097509623 /nfs/dbraw/zinc/50/96/23/1097509623.db2.gz PIDHQEIJAJJYFI-FZMZJTMJSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[N@H+](CCC1CC1)CC1CC1 ZINC001607084271 1097509695 /nfs/dbraw/zinc/50/96/95/1097509695.db2.gz XJZKJLRRWQPQMC-UHFFFAOYSA-N 0 3 342.403 2.787 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[N@@H+](CCC1CC1)CC1CC1 ZINC001607084271 1097509700 /nfs/dbraw/zinc/50/97/00/1097509700.db2.gz XJZKJLRRWQPQMC-UHFFFAOYSA-N 0 3 342.403 2.787 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[N@H+](CCC1CC1)CC1CC1 ZINC001607084271 1097509706 /nfs/dbraw/zinc/50/97/06/1097509706.db2.gz XJZKJLRRWQPQMC-UHFFFAOYSA-N 0 3 342.403 2.787 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[N@@H+](CCC1CC1)CC1CC1 ZINC001607084271 1097509714 /nfs/dbraw/zinc/50/97/14/1097509714.db2.gz XJZKJLRRWQPQMC-UHFFFAOYSA-N 0 3 342.403 2.787 20 5 EFBDHN C[C@@H]1CC[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])CC12CCC2 ZINC001609167780 1098180849 /nfs/dbraw/zinc/18/08/49/1098180849.db2.gz AVONRLVIXCZSFK-GFCCVEGCSA-N 0 3 342.403 2.787 20 5 EFBDHN C[C@@H]1CC[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])CC12CCC2 ZINC001609167780 1098180854 /nfs/dbraw/zinc/18/08/54/1098180854.db2.gz AVONRLVIXCZSFK-GFCCVEGCSA-N 0 3 342.403 2.787 20 5 EFBDHN C[C@@H]1CC[N@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])CC12CCC2 ZINC001609167780 1098180857 /nfs/dbraw/zinc/18/08/57/1098180857.db2.gz AVONRLVIXCZSFK-GFCCVEGCSA-N 0 3 342.403 2.787 20 5 EFBDHN C[C@@H]1CC[N@@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])CC12CCC2 ZINC001609167780 1098180859 /nfs/dbraw/zinc/18/08/59/1098180859.db2.gz AVONRLVIXCZSFK-GFCCVEGCSA-N 0 3 342.403 2.787 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[NH+]1C2CCCC1CCC2 ZINC001609600088 1098394519 /nfs/dbraw/zinc/39/45/19/1098394519.db2.gz PPUPGZHIQCMBET-UHFFFAOYSA-N 0 3 328.376 2.682 20 5 EFBDHN CN1Cc2cc(N(C(=N)N)c3ccc(F)cc3)cc([N+](=O)[O-])c2N1 ZINC001168001068 1099913027 /nfs/dbraw/zinc/91/30/27/1099913027.db2.gz UISFCTWUPCWSRU-UHFFFAOYSA-N 0 3 330.323 2.538 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCOc3c(F)cccc32)c1 ZINC000905642340 1103457822 /nfs/dbraw/zinc/45/78/22/1103457822.db2.gz AIWFSUQVPLZNIW-CVEARBPZSA-N 0 3 332.331 2.881 20 5 EFBDHN CC1(C)[C@H](O)C[C@H]1NCc1ccc(Br)c([N+](=O)[O-])c1 ZINC000128098400 1108634303 /nfs/dbraw/zinc/63/43/03/1108634303.db2.gz GTPRJMAKAADKTP-VXGBXAGGSA-N 0 3 329.194 2.606 20 5 EFBDHN CCN(CCNc1ccc([N+](=O)[O-])cc1)C(=O)CN1CCC(C)CC1 ZINC001106818234 1111879815 /nfs/dbraw/zinc/87/98/15/1111879815.db2.gz ZTQOSILLOIDEJG-UHFFFAOYSA-N 0 3 348.447 2.587 20 5 EFBDHN COc1ccc(CN2CCC[C@H](c3nccn3C)C2)cc1[N+](=O)[O-] ZINC000444804671 1112128886 /nfs/dbraw/zinc/12/88/86/1112128886.db2.gz QBBHVPOPCFXKCG-AWEZNQCLSA-N 0 3 330.388 2.717 20 5 EFBDHN CNC(=O)c1ccc(CN(C)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000052073637 214114744 /nfs/dbraw/zinc/11/47/44/214114744.db2.gz XFTSCWIFCMJAMI-UHFFFAOYSA-N 0 3 327.384 2.629 20 5 EFBDHN CCCCNC(=O)C1CCN(CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000052642339 214137818 /nfs/dbraw/zinc/13/78/18/214137818.db2.gz FVLBURKDIGGEOO-UHFFFAOYSA-N 0 3 333.432 2.766 20 5 EFBDHN CN(C)C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc2O1 ZINC000370503802 282139835 /nfs/dbraw/zinc/13/98/35/282139835.db2.gz YUMMGAOAQNATJA-HNNXBMFYSA-N 0 3 341.367 2.564 20 5 EFBDHN COc1ccc(C(=O)N[C@H](C)CN2C[C@H](C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000055748526 214340460 /nfs/dbraw/zinc/34/04/60/214340460.db2.gz SYJSCJPMOSPWHZ-HZSPNIEDSA-N 0 3 349.431 2.700 20 5 EFBDHN Cc1ncc(C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])c(=O)[n-]1 ZINC000346812363 282156802 /nfs/dbraw/zinc/15/68/02/282156802.db2.gz WMBSXFBFBVFNNB-CJNGLKHVSA-N 0 3 342.399 2.900 20 5 EFBDHN CC[C@H](NCCn1cc([N+](=O)[O-])ccc1=O)c1ccc(OC)cc1 ZINC000181807505 529609263 /nfs/dbraw/zinc/60/92/63/529609263.db2.gz WIWPARORZCJQSW-INIZCTEOSA-N 0 3 331.372 2.506 20 5 EFBDHN CN1CCC(N(Cc2ccccc2)C(=O)c2ccc([N+](=O)[O-])o2)CC1 ZINC000175022666 530049682 /nfs/dbraw/zinc/04/96/82/530049682.db2.gz LBGLJRCLIVHRBF-UHFFFAOYSA-N 0 3 343.383 2.924 20 5 EFBDHN COc1cccc(C(=O)NCCN[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000178641989 232329173 /nfs/dbraw/zinc/32/91/73/232329173.db2.gz ICUSFZNLQAUOAJ-ZDUSSCGKSA-N 0 3 343.383 2.684 20 5 EFBDHN O=C(NC1CCN(Cc2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000003135783 209968915 /nfs/dbraw/zinc/96/89/15/209968915.db2.gz PWFSCSIWVZZFET-UHFFFAOYSA-N 0 3 339.395 2.989 20 5 EFBDHN COc1cc(CNCCCO)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000067697362 215189776 /nfs/dbraw/zinc/18/97/76/215189776.db2.gz DGNOYSFVWAOUPG-UHFFFAOYSA-N 0 3 346.383 2.654 20 5 EFBDHN COc1ccc(CC(=O)Nc2ccc(CN(C)C)cc2)cc1[N+](=O)[O-] ZINC000067904861 215246809 /nfs/dbraw/zinc/24/68/09/215246809.db2.gz WYBZZPCVCQSFIY-UHFFFAOYSA-N 0 3 343.383 2.846 20 5 EFBDHN CN(CC1CCN(C)CC1)C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000103453142 219302284 /nfs/dbraw/zinc/30/22/84/219302284.db2.gz BQJWNTJGIGURCN-UHFFFAOYSA-N 0 3 325.796 2.662 20 5 EFBDHN NC(=O)c1ccc(CN[C@@H](Cc2ccccc2)C2CC2)c([N+](=O)[O-])c1 ZINC000181546222 234226249 /nfs/dbraw/zinc/22/62/49/234226249.db2.gz NGOKEKIZVPFUTK-KRWDZBQOSA-N 0 3 339.395 2.805 20 5 EFBDHN Cc1ccc([C@H](C)NCCCS(=O)(=O)C(C)C)cc1[N+](=O)[O-] ZINC000181828334 234340649 /nfs/dbraw/zinc/34/06/49/234340649.db2.gz MVFHOWPXNSRTJU-ZDUSSCGKSA-N 0 3 328.434 2.767 20 5 EFBDHN O=[N+]([O-])c1ccc(CCNCc2nccn2CC(F)(F)F)cc1 ZINC000105448120 219496124 /nfs/dbraw/zinc/49/61/24/219496124.db2.gz UUNZASBWBSGZFI-UHFFFAOYSA-N 0 3 328.294 2.686 20 5 EFBDHN Cc1c([C@@H](C)NCCC(=O)Nc2ccc([N+](=O)[O-])cc2C)cnn1C ZINC000183438353 235076906 /nfs/dbraw/zinc/07/69/06/235076906.db2.gz QXXLUGXMKNAQGC-GFCCVEGCSA-N 0 3 345.403 2.625 20 5 EFBDHN Cc1ccc([C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N)N(C)C)cc1 ZINC000184330675 235369190 /nfs/dbraw/zinc/36/91/90/235369190.db2.gz WAMSLNONFJOOTM-KRWDZBQOSA-N 0 3 342.399 2.518 20 5 EFBDHN CCCN(CCN1CCCC1)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000352871578 283242263 /nfs/dbraw/zinc/24/22/63/283242263.db2.gz BQQJTUMGIOOADA-UHFFFAOYSA-N 0 3 348.447 2.650 20 5 EFBDHN C[C@H](NCCn1cc([N+](=O)[O-])cn1)c1cccc(N2CCCC2)c1 ZINC000181855775 299301584 /nfs/dbraw/zinc/30/15/84/299301584.db2.gz WGYIRXJSUPSMOA-AWEZNQCLSA-N 0 3 329.404 2.742 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@H](CO)Cc1ccccc1 ZINC000131493853 223239251 /nfs/dbraw/zinc/23/92/51/223239251.db2.gz VGAVTKGEILDDCA-INIZCTEOSA-N 0 3 330.384 2.687 20 5 EFBDHN C[C@H]1[C@@H](N2CCCC2)CCN1C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000376486114 291283661 /nfs/dbraw/zinc/28/36/61/291283661.db2.gz GVEWLDUNSYLIMN-FZMZJTMJSA-N 0 3 337.807 2.947 20 5 EFBDHN COCCN1[C@H](C)CN(c2ccc([N+](=O)[O-])c3cnccc32)C[C@@H]1C ZINC000132035584 223294153 /nfs/dbraw/zinc/29/41/53/223294153.db2.gz SFDONYVLSUOAPR-OKILXGFUSA-N 0 3 344.415 2.688 20 5 EFBDHN COc1ccc(OCCN2CCN(C3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC000173514545 239194882 /nfs/dbraw/zinc/19/48/82/239194882.db2.gz IYAUHXRCWJOEMM-UHFFFAOYSA-N 0 3 349.431 2.542 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CN2CCC(c3ccncc3)CC2)c1 ZINC000191676697 239245431 /nfs/dbraw/zinc/24/54/31/239245431.db2.gz VGZMDXNJBUUSTB-SFHVURJKSA-N 0 3 327.384 2.903 20 5 EFBDHN CCOC(=O)N1CC[C@@H](N[C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000193300170 240098959 /nfs/dbraw/zinc/09/89/59/240098959.db2.gz UOTUNZATNUSQRL-CJNGLKHVSA-N 0 3 333.388 2.793 20 5 EFBDHN COc1cccc(C(=O)N(CCN(C)C)C2CCCC2)c1[N+](=O)[O-] ZINC000194617586 240165859 /nfs/dbraw/zinc/16/58/59/240165859.db2.gz CIZCZHSNBUUQED-UHFFFAOYSA-N 0 3 335.404 2.550 20 5 EFBDHN COc1cccc(C(=O)NCc2cccc(CN(C)C)c2)c1[N+](=O)[O-] ZINC000195385152 240224270 /nfs/dbraw/zinc/22/42/70/240224270.db2.gz LXHCAXVGRMXSLE-UHFFFAOYSA-N 0 3 343.383 2.595 20 5 EFBDHN CN(C)C(=O)CCNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000237149242 242500796 /nfs/dbraw/zinc/50/07/96/242500796.db2.gz DRLPWEXJVBZENY-UHFFFAOYSA-N 0 3 333.413 2.891 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC[C@@H](Cn2ccnn2)C1 ZINC000245538506 243127543 /nfs/dbraw/zinc/12/75/43/243127543.db2.gz ZEAOYNJBTRHQQN-HUUCEWRRSA-N 0 3 329.404 2.968 20 5 EFBDHN CN1CC[C@H]2[C@@H](CCCN2C(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000246365670 243237123 /nfs/dbraw/zinc/23/71/23/243237123.db2.gz ADOYLCFBNZVWFD-BBRMVZONSA-N 0 3 349.456 2.630 20 5 EFBDHN C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412338157 243274673 /nfs/dbraw/zinc/27/46/73/243274673.db2.gz NJYYZIDBEYGQIE-XFKAJCMBSA-N 0 3 343.427 2.784 20 5 EFBDHN CN(C)C(=O)[C@@H]1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000414502312 244199079 /nfs/dbraw/zinc/19/90/79/244199079.db2.gz UCGRSKSERBOFNX-CYBMUJFWSA-N 0 3 343.383 2.765 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CNCCC(C)(C)S(C)(=O)=O ZINC000414515756 244206750 /nfs/dbraw/zinc/20/67/50/244206750.db2.gz MUQMRRVVIIXAJP-JLHYYAGUSA-N 0 3 340.445 2.801 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H](CO)[C@@H]2CCCOC2)o1 ZINC000414557381 244233617 /nfs/dbraw/zinc/23/36/17/244233617.db2.gz NNVQSSWVUKFEIH-CZUORRHYSA-N 0 3 346.383 2.732 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1NCCc2ccccc21 ZINC000414654651 244277605 /nfs/dbraw/zinc/27/76/05/244277605.db2.gz GIDYMTUXUDMOHC-QGZVFWFLSA-N 0 3 340.383 2.912 20 5 EFBDHN C[C@@H](CNC(=O)c1ccccc1[N+](=O)[O-])N(C)Cc1ccccc1 ZINC000110349675 220031409 /nfs/dbraw/zinc/03/14/09/220031409.db2.gz XZAZVPFNIUCDRQ-AWEZNQCLSA-N 0 3 327.384 2.845 20 5 EFBDHN C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1F)N(C)Cc1ccccc1 ZINC000110347656 220031531 /nfs/dbraw/zinc/03/15/31/220031531.db2.gz FTRJMXQRKWXSNM-ZDUSSCGKSA-N 0 3 345.374 2.984 20 5 EFBDHN C[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1F)N(C)Cc1ccccc1 ZINC000110347661 220031901 /nfs/dbraw/zinc/03/19/01/220031901.db2.gz FTRJMXQRKWXSNM-CYBMUJFWSA-N 0 3 345.374 2.984 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000110993086 220088947 /nfs/dbraw/zinc/08/89/47/220088947.db2.gz YMIHKLNLWUJCMQ-GFCCVEGCSA-N 0 3 325.796 2.852 20 5 EFBDHN CN1C[C@H](NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1=O ZINC000263741394 245609508 /nfs/dbraw/zinc/60/95/08/245609508.db2.gz NRAQFBQTQPIJAH-LLVKDONJSA-N 0 3 331.397 2.644 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)C[C@@H]1CCCN1C ZINC000421710680 246074082 /nfs/dbraw/zinc/07/40/82/246074082.db2.gz LVBALALEBUWPBN-WBVHZDCISA-N 0 3 333.432 2.716 20 5 EFBDHN COc1ccc(CNC2CCN(CC(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000264326260 246355413 /nfs/dbraw/zinc/35/54/13/246355413.db2.gz ITTSPYCTAVWLCR-UHFFFAOYSA-N 0 3 347.337 2.720 20 5 EFBDHN COCC(C)(C)N1CCN(c2ccc([N+](=O)[O-])c3cnccc32)CC1 ZINC000425275682 247024367 /nfs/dbraw/zinc/02/43/67/247024367.db2.gz UEYLYMNXSBCSFS-UHFFFAOYSA-N 0 3 344.415 2.690 20 5 EFBDHN COc1ccc(CN2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc1C ZINC000426002952 247225459 /nfs/dbraw/zinc/22/54/59/247225459.db2.gz QPKDKNVYLGMUBF-UHFFFAOYSA-N 0 3 330.388 2.945 20 5 EFBDHN COC(=O)COc1ccc(CN(C)[C@H]2CC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000433054350 248008460 /nfs/dbraw/zinc/00/84/60/248008460.db2.gz UTTLBUUMIZUCDN-OCCSQVGLSA-N 0 3 336.388 2.767 20 5 EFBDHN O=C1CCC[C@@H](CNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)N1 ZINC000433194185 248026166 /nfs/dbraw/zinc/02/61/66/248026166.db2.gz MECKDXBWGWUJBM-ZDUSSCGKSA-N 0 3 329.356 2.613 20 5 EFBDHN C[C@H](NC(=O)NC[C@H]1CCCCN1C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000433566145 248072592 /nfs/dbraw/zinc/07/25/92/248072592.db2.gz YJHNFAVZKYAXNH-SUMWQHHRSA-N 0 3 346.431 2.972 20 5 EFBDHN CCn1cc([C@H]2OCCC[C@@H]2NCc2cccc([N+](=O)[O-])c2)cn1 ZINC000433945387 248105593 /nfs/dbraw/zinc/10/55/93/248105593.db2.gz GEALOEWGEBFWPU-DLBZAZTESA-N 0 3 330.388 2.821 20 5 EFBDHN C[C@@H](N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCOC1 ZINC000266280934 248220481 /nfs/dbraw/zinc/22/04/81/248220481.db2.gz GMTVTIGOHLHYIE-OUAUKWLOSA-N 0 3 341.795 2.590 20 5 EFBDHN COc1cccc(C(=O)NC[C@H](C)N2CCCC[C@@H]2C)c1[N+](=O)[O-] ZINC000435541287 248248375 /nfs/dbraw/zinc/24/83/75/248248375.db2.gz HGRHZTIHJBZOBI-STQMWFEESA-N 0 3 335.404 2.596 20 5 EFBDHN CO[C@@]1(C)C[C@H](NCc2cc([N+](=O)[O-])cc3c2OCOC3)C1(C)C ZINC000266644054 248395421 /nfs/dbraw/zinc/39/54/21/248395421.db2.gz VOICUWZZKFBYLC-YOEHRIQHSA-N 0 3 336.388 2.755 20 5 EFBDHN C[C@H](N[C@@H]1[C@H]2CCCO[C@@H]2C1(C)C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000439650016 249847328 /nfs/dbraw/zinc/84/73/28/249847328.db2.gz REXSYVFHTJSHKM-SRMUXQRQSA-N 0 3 347.415 2.715 20 5 EFBDHN CN1CCC[C@@H](CNc2c(Br)cncc2[N+](=O)[O-])C1 ZINC000091483085 218011983 /nfs/dbraw/zinc/01/19/83/218011983.db2.gz GKPIXLJMHSSZOE-VIFPVBQESA-N 0 3 329.198 2.506 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C/CN1CCC[C@H](Cn2ccnn2)C1 ZINC000092069819 218115237 /nfs/dbraw/zinc/11/52/37/218115237.db2.gz KYYHAVVYMPWDRU-SZTZYQKNSA-N 0 3 327.388 2.612 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1 ZINC000092429305 218141431 /nfs/dbraw/zinc/14/14/31/218141431.db2.gz MHQGYWPXCLXAHE-GXTWGEPZSA-N 0 3 331.416 2.875 20 5 EFBDHN Cc1ccc(C(=O)NCc2ccccc2CN(C)C)cc1[N+](=O)[O-] ZINC000009917016 211132807 /nfs/dbraw/zinc/13/28/07/211132807.db2.gz ZXXSCNFYPUFUAH-UHFFFAOYSA-N 0 3 327.384 2.895 20 5 EFBDHN COCCN(CCO)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000093005613 218184629 /nfs/dbraw/zinc/18/46/29/218184629.db2.gz YNQBJBRJAYTJCE-UHFFFAOYSA-N 0 3 336.413 2.764 20 5 EFBDHN C[C@H]1CCN(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@@H](C)C1 ZINC000443642988 250215160 /nfs/dbraw/zinc/21/51/60/250215160.db2.gz QDGLIIKNVDUWBI-KBPBESRZSA-N 0 3 331.416 2.852 20 5 EFBDHN CCCCN1CCCC[C@@H]1CNC(=O)c1cccc(OC)c1[N+](=O)[O-] ZINC000444138801 250263908 /nfs/dbraw/zinc/26/39/08/250263908.db2.gz FQVSBVHOBBQSPQ-CQSZACIVSA-N 0 3 349.431 2.988 20 5 EFBDHN CCCCN1CCCC[C@H]1CNC(=O)c1cccc(OC)c1[N+](=O)[O-] ZINC000444138800 250264340 /nfs/dbraw/zinc/26/43/40/250264340.db2.gz FQVSBVHOBBQSPQ-AWEZNQCLSA-N 0 3 349.431 2.988 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCCN1CCC(C)CC1 ZINC000093969733 218258112 /nfs/dbraw/zinc/25/81/12/218258112.db2.gz SFUABWIWXWUDCJ-UHFFFAOYSA-N 0 3 333.432 2.982 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN[C@H]3CCCC[C@@H]3n3cccn3)nc2c1 ZINC000444685648 250328141 /nfs/dbraw/zinc/32/81/41/250328141.db2.gz OWKJZKDMMMIMNU-HOCLYGCPSA-N 0 3 340.387 2.941 20 5 EFBDHN CCC[C@@]1(CO)CCCN1CCOc1ccc(OC)cc1[N+](=O)[O-] ZINC000444772103 250345081 /nfs/dbraw/zinc/34/50/81/250345081.db2.gz TVXGPWYCRBGJDW-KRWDZBQOSA-N 0 3 338.404 2.609 20 5 EFBDHN Cc1cc(CN(C)C[C@H](O)COc2cccc([N+](=O)[O-])c2)ccc1F ZINC000444739257 250336535 /nfs/dbraw/zinc/33/65/35/250336535.db2.gz VSDWXPONBQCAFT-INIZCTEOSA-N 0 3 348.374 2.914 20 5 EFBDHN O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2NCc2cccc3c2OCO3)n1 ZINC000447541979 250574350 /nfs/dbraw/zinc/57/43/50/250574350.db2.gz NMGNSZLLSXRWMI-KGLIPLIRSA-N 0 3 344.371 2.794 20 5 EFBDHN COc1ccc(OCCN2CCC[C@H](c3ncc[nH]3)C2)c([N+](=O)[O-])c1 ZINC000267377013 251000021 /nfs/dbraw/zinc/00/00/21/251000021.db2.gz AHLBCWJOCWRIRJ-ZDUSSCGKSA-N 0 3 346.387 2.585 20 5 EFBDHN Cc1cc(CN[C@@H](C)CC(=O)Nc2cccc([N+](=O)[O-])c2)ccn1 ZINC000449405288 251015293 /nfs/dbraw/zinc/01/52/93/251015293.db2.gz XZWXOOOAJDLNOV-ZDUSSCGKSA-N 0 3 328.372 2.805 20 5 EFBDHN CN1CC[C@@H]2CN(Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C[C@@H]21 ZINC000449515611 251048678 /nfs/dbraw/zinc/04/86/78/251048678.db2.gz AIJJCMXDEMSHHF-DYVFJYSZSA-N 0 3 327.384 2.991 20 5 EFBDHN CC[C@@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])s1)C(=O)NC ZINC000449782457 251155339 /nfs/dbraw/zinc/15/53/39/251155339.db2.gz YIGHCEKAHUPORK-CYBMUJFWSA-N 0 3 333.413 2.938 20 5 EFBDHN Cn1cc(CN2CC[C@@H](CCCO)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000449794115 251158225 /nfs/dbraw/zinc/15/82/25/251158225.db2.gz ZTOAXYCJDOFDBS-CQSZACIVSA-N 0 3 344.415 2.590 20 5 EFBDHN C[C@@H]1C[C@H](NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CCN1C ZINC000449942138 251207574 /nfs/dbraw/zinc/20/75/74/251207574.db2.gz RVYXYIHVGROIBC-MWLCHTKSSA-N 0 3 345.321 2.826 20 5 EFBDHN CCN1CCN([C@H](C)CNc2nccc3c2cccc3[N+](=O)[O-])CC1 ZINC000450255400 251316709 /nfs/dbraw/zinc/31/67/09/251316709.db2.gz BKWFNMIAJNYGFU-CQSZACIVSA-N 0 3 343.431 2.581 20 5 EFBDHN Cc1nc(N[C@H]2CCN([C@H](C)c3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000450273272 251324475 /nfs/dbraw/zinc/32/44/75/251324475.db2.gz GEEUHHFPKUUHDI-HIFRSBDPSA-N 0 3 327.388 2.941 20 5 EFBDHN Cc1nc(N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000450273271 251324492 /nfs/dbraw/zinc/32/44/92/251324492.db2.gz GEEUHHFPKUUHDI-DZGCQCFKSA-N 0 3 327.388 2.941 20 5 EFBDHN CCc1ccc([C@H](CNc2ncc([N+](=O)[O-])c(C)n2)N(C)C)cc1 ZINC000450215844 251301462 /nfs/dbraw/zinc/30/14/62/251301462.db2.gz ONFQEJBDRGQZKF-INIZCTEOSA-N 0 3 329.404 2.970 20 5 EFBDHN CN(C)CCOC1CCN(c2nccc3cc([N+](=O)[O-])ccc32)CC1 ZINC000450327209 251347158 /nfs/dbraw/zinc/34/71/58/251347158.db2.gz AYRHFKKCCBQLOC-UHFFFAOYSA-N 0 3 344.415 2.690 20 5 EFBDHN CCO[C@@H]1C[C@H](NCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C12CCC2 ZINC000451481510 251578603 /nfs/dbraw/zinc/57/86/03/251578603.db2.gz RHHGYGYSEZBQRY-JKSUJKDBSA-N 0 3 347.415 2.779 20 5 EFBDHN O=[N+]([O-])c1c(N2CCC[C@@H]2CN2CCCCC2)nc2sccn21 ZINC000160446974 285077822 /nfs/dbraw/zinc/07/78/22/285077822.db2.gz WVPXJIANIZOPKW-GFCCVEGCSA-N 0 3 335.433 2.759 20 5 EFBDHN O=[N+]([O-])c1ccc(CNC[C@@]2(CO)C[C@H]2c2ccc(F)cc2)cc1 ZINC000428541797 285115164 /nfs/dbraw/zinc/11/51/64/285115164.db2.gz CTOONODKUWZKFK-ZWKOTPCHSA-N 0 3 330.359 2.990 20 5 EFBDHN C[C@@H](C(=O)N(C)CC1CCN(C)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000185186862 533171363 /nfs/dbraw/zinc/17/13/63/533171363.db2.gz HNJIVEYHRFAXAP-GFCCVEGCSA-N 0 3 337.395 2.638 20 5 EFBDHN Cc1cc(F)cc(C(=O)N2C[C@@H](c3ccccc3)[C@H](N)C2)c1[N+](=O)[O-] ZINC000262110670 291913798 /nfs/dbraw/zinc/91/37/98/291913798.db2.gz AVYBRLIWLZLLBW-JKSUJKDBSA-N 0 3 343.358 2.609 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@@H]2CCN(C(=O)CC)C2)cc1[N+](=O)[O-] ZINC000154265600 224228721 /nfs/dbraw/zinc/22/87/21/224228721.db2.gz ZWHWISMIWZZMLZ-GXTWGEPZSA-N 0 3 335.404 2.655 20 5 EFBDHN C[C@H]1CCCN(CCNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000117756514 221086495 /nfs/dbraw/zinc/08/64/95/221086495.db2.gz RPFAMNVZGXWMMN-LBPRGKRZSA-N 0 3 339.823 2.639 20 5 EFBDHN CC1CCN(CCNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000117756272 221086506 /nfs/dbraw/zinc/08/65/06/221086506.db2.gz GSCVSOOPDGDFNF-UHFFFAOYSA-N 0 3 339.823 2.639 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@H]1CC(C)(C)OC1(C)C ZINC000119662148 221370402 /nfs/dbraw/zinc/37/04/02/221370402.db2.gz HYARGTVJWLCQSJ-AWEZNQCLSA-N 0 3 335.404 2.777 20 5 EFBDHN C[C@@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)[C@H](c1ccccc1)N(C)C ZINC000186496870 533289579 /nfs/dbraw/zinc/28/95/79/533289579.db2.gz QCFCJODTXAVOMO-SJKOYZFVSA-N 0 3 342.399 2.598 20 5 EFBDHN C[C@@H](NCCn1cc([N+](=O)[O-])cn1)c1ccc(OC(F)F)cc1 ZINC000131004495 533407257 /nfs/dbraw/zinc/40/72/57/533407257.db2.gz UZSLZMLAIIILAI-SNVBAGLBSA-N 0 3 326.303 2.744 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CNCc1cccc(C(N)=O)c1 ZINC000344877051 533409093 /nfs/dbraw/zinc/40/90/93/533409093.db2.gz PAXWQHYXOJLHOD-MDWZMJQESA-N 0 3 325.368 2.887 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN[C@@H]1CC(=O)N2CCCC[C@@H]12 ZINC000337848345 533409183 /nfs/dbraw/zinc/40/91/83/533409183.db2.gz ILCVTXSAYJSAAK-FIRJTHROSA-N 0 3 329.400 2.741 20 5 EFBDHN C[C@@H](N[C@@H]1CC(C)(C)OC1(C)C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000132624054 533516579 /nfs/dbraw/zinc/51/65/79/533516579.db2.gz UMUKNXALUVFCQT-BXUZGUMPSA-N 0 3 335.404 2.858 20 5 EFBDHN C[C@@H](N[C@H]1CC(C)(C)OC1(C)C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000132624490 533540210 /nfs/dbraw/zinc/54/02/10/533540210.db2.gz UMUKNXALUVFCQT-RISCZKNCSA-N 0 3 335.404 2.858 20 5 EFBDHN COc1c(CN[C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)c(C)nn1C ZINC000162386651 141370626 /nfs/dbraw/zinc/37/06/26/141370626.db2.gz ONUJLTYKGJOJOT-INIZCTEOSA-N 0 3 344.415 2.756 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCN(C2CCOCC2)CC1 ZINC000182822077 141376575 /nfs/dbraw/zinc/37/65/75/141376575.db2.gz LGVFFBOZTMIEKU-HNNXBMFYSA-N 0 3 333.432 2.761 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCCN(C)[C@@H]1C ZINC000343438775 141997915 /nfs/dbraw/zinc/99/79/15/141997915.db2.gz LOPVKZNEJNOOJE-BXUZGUMPSA-N 0 3 337.445 2.919 20 5 EFBDHN CO[C@@H]1[C@H](C)[C@@H](N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1(C)C ZINC000344487100 142026302 /nfs/dbraw/zinc/02/63/02/142026302.db2.gz UNGBAMPMAYFOCT-BAESOJJISA-N 0 3 335.404 2.571 20 5 EFBDHN CO[C@@H]1[C@H](C)[C@@H](N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1(C)C ZINC000344485851 142026338 /nfs/dbraw/zinc/02/63/38/142026338.db2.gz YEZJINXIYMJGRP-NOXHYTERSA-N 0 3 349.431 2.879 20 5 EFBDHN CN1CCCC(C)(C)[C@@H]1CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000344603954 142047220 /nfs/dbraw/zinc/04/72/20/142047220.db2.gz JFIBYNSDOWGVPT-HNNXBMFYSA-N 0 3 344.415 2.926 20 5 EFBDHN COc1ccc(-c2ccc(CN[C@H](CO)C(C)C)o2)c([N+](=O)[O-])c1 ZINC000344688996 142061415 /nfs/dbraw/zinc/06/14/15/142061415.db2.gz CQWBRCUDBRQOKW-OAHLLOKOSA-N 0 3 334.372 2.970 20 5 EFBDHN CCCN(CCN1CCCC1)C(=O)c1cc(OCC)ccc1[N+](=O)[O-] ZINC000344737991 142070267 /nfs/dbraw/zinc/07/02/67/142070267.db2.gz AVEJNCMVDBSHLZ-UHFFFAOYSA-N 0 3 349.431 2.942 20 5 EFBDHN C[C@H](NC(=O)C(C)(C)c1ccccc1[N+](=O)[O-])C1=CCN(C)CC1 ZINC000346109629 142148069 /nfs/dbraw/zinc/14/80/69/142148069.db2.gz OZZUTSSOBLTADS-ZDUSSCGKSA-N 0 3 331.416 2.639 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CCN(C)C2)C1 ZINC000346303002 142186468 /nfs/dbraw/zinc/18/64/68/142186468.db2.gz WGWIJAMNLPTRME-QGZVFWFLSA-N 0 3 349.456 2.875 20 5 EFBDHN CCN(CCN1CCCCCC1)C(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000346350907 142193463 /nfs/dbraw/zinc/19/34/63/142193463.db2.gz MLRKXWRQVBWDEX-UHFFFAOYSA-N 0 3 349.431 2.942 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000346414180 142201291 /nfs/dbraw/zinc/20/12/91/142201291.db2.gz GPWHCNUGFYSSAD-ZDUSSCGKSA-N 0 3 330.388 2.680 20 5 EFBDHN CN(CCn1cc([N+](=O)[O-])cn1)[C@H]1C[C@@H](Oc2ccccc2)C1(C)C ZINC000347490095 142225189 /nfs/dbraw/zinc/22/51/89/142225189.db2.gz ZEOXFMNPTJKWDB-DLBZAZTESA-N 0 3 344.415 2.969 20 5 EFBDHN CN(CCn1cc([N+](=O)[O-])cn1)[C@@H]1C[C@H](Oc2ccccc2)C1(C)C ZINC000347490098 142225446 /nfs/dbraw/zinc/22/54/46/142225446.db2.gz ZEOXFMNPTJKWDB-SJORKVTESA-N 0 3 344.415 2.969 20 5 EFBDHN COc1cc([C@@H](C)NCCC(=O)Nc2ccc([N+](=O)[O-])cc2)ccn1 ZINC000347665840 142254034 /nfs/dbraw/zinc/25/40/34/142254034.db2.gz FOKGDBRHHYSMRO-GFCCVEGCSA-N 0 3 344.371 2.678 20 5 EFBDHN Cc1ccncc1CCCN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000347847515 142281228 /nfs/dbraw/zinc/28/12/28/142281228.db2.gz GOMIQIOSBATOAZ-INIZCTEOSA-N 0 3 341.415 2.812 20 5 EFBDHN COCC[C@@H](NCCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000347926459 142294509 /nfs/dbraw/zinc/29/45/09/142294509.db2.gz HMPNFYXFDXOWRI-OAHLLOKOSA-N 0 3 347.371 2.884 20 5 EFBDHN C[C@@H](NCCc1ccccc1[N+](=O)[O-])c1ccc(S(C)(=O)=O)cc1 ZINC000348074880 142317355 /nfs/dbraw/zinc/31/73/55/142317355.db2.gz LJRSRBXMMBRQNS-CYBMUJFWSA-N 0 3 348.424 2.892 20 5 EFBDHN C[C@H]1CC(NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C[C@H](C)C1 ZINC000349664508 142345300 /nfs/dbraw/zinc/34/53/00/142345300.db2.gz MBFWLVTZEFUVSG-CHWSQXEVSA-N 0 3 340.445 2.783 20 5 EFBDHN O=[N+]([O-])c1ccc(S(=O)(=O)CCN[C@H]2CCC[C@@H]2C2CC2)cc1 ZINC000349661903 142345333 /nfs/dbraw/zinc/34/53/33/142345333.db2.gz GZPVWYARGBJPLN-CVEARBPZSA-N 0 3 338.429 2.537 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CCN1C ZINC000341194627 145010017 /nfs/dbraw/zinc/01/00/17/145010017.db2.gz HULKDMDYXIXDRB-VHSXEESVSA-N 0 3 326.784 2.852 20 5 EFBDHN CC[C@H](C(=O)NCc1ccc([N+](=O)[O-])cc1Cl)N(CC)CC ZINC000341341224 145036319 /nfs/dbraw/zinc/03/63/19/145036319.db2.gz FZHCCAMCVDGSDG-CQSZACIVSA-N 0 3 327.812 2.985 20 5 EFBDHN C[C@H](c1ccccc1)N1CCC(NC(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 ZINC000341381842 145042708 /nfs/dbraw/zinc/04/27/08/145042708.db2.gz FLORIMKXMAGUAF-CYBMUJFWSA-N 0 3 342.399 2.878 20 5 EFBDHN CCCN(CCN1CCCC1)C(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000342211315 145081078 /nfs/dbraw/zinc/08/10/78/145081078.db2.gz NZMAQPVBTSPESG-UHFFFAOYSA-N 0 3 349.431 2.616 20 5 EFBDHN C[C@H](CNc1cccc(C(N)=O)c1[N+](=O)[O-])N(C)Cc1ccccc1 ZINC000342232285 145084511 /nfs/dbraw/zinc/08/45/11/145084511.db2.gz XUFYQSOGKPCCNT-CYBMUJFWSA-N 0 3 342.399 2.626 20 5 EFBDHN CCCN(CCN1CCCC1)C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000342272230 145091192 /nfs/dbraw/zinc/09/11/92/145091192.db2.gz ZAYXTARERILHOP-UHFFFAOYSA-N 0 3 349.431 2.698 20 5 EFBDHN C[C@H]1CCCC[C@H]1CNCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000342350430 145106674 /nfs/dbraw/zinc/10/66/74/145106674.db2.gz YGTAXCXHLQLMBE-KBPBESRZSA-N 0 3 340.445 2.784 20 5 EFBDHN O=[N+]([O-])c1cccc(F)c1NC[C@@]1(O)CCN(Cc2ccccc2)C1 ZINC000342369556 145110029 /nfs/dbraw/zinc/11/00/29/145110029.db2.gz GUYHWVSDTIJNJQ-SFHVURJKSA-N 0 3 345.374 2.783 20 5 EFBDHN C[C@H](CN(C)Cc1ccccc1)NC(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000342422190 145122113 /nfs/dbraw/zinc/12/21/13/145122113.db2.gz CEQOZTAGINHTBT-CYBMUJFWSA-N 0 3 345.374 2.984 20 5 EFBDHN CCCN(CCN1CCCCC1)C(=O)c1cccc([N+](=O)[O-])c1NC ZINC000342787532 145193147 /nfs/dbraw/zinc/19/31/47/145193147.db2.gz UQTZBZSDQHTNLJ-UHFFFAOYSA-N 0 3 348.447 2.975 20 5 EFBDHN CCCN(CCN1CCCCC1)C(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000342793184 145194404 /nfs/dbraw/zinc/19/44/04/145194404.db2.gz YSXMNVYPLLQXAY-UHFFFAOYSA-N 0 3 333.432 2.862 20 5 EFBDHN C[C@@H]1CCCN(CCNC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C1 ZINC000342918229 145221175 /nfs/dbraw/zinc/22/11/75/145221175.db2.gz YVWLAEZFYSJVTK-GFCCVEGCSA-N 0 3 330.388 2.538 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CN1CC[C@@H]1Cc1ccccc1 ZINC000343563510 145239579 /nfs/dbraw/zinc/23/95/79/145239579.db2.gz ZMSCVGHZUXCLPN-IAGOWNOFSA-N 0 3 342.395 2.652 20 5 EFBDHN CCCN1CCC[C@@H]1CNC(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000343569086 145241230 /nfs/dbraw/zinc/24/12/30/145241230.db2.gz LUEJLLSHSFLENG-CQSZACIVSA-N 0 3 335.404 2.516 20 5 EFBDHN CCCN1CCC[C@@H]1CNC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000343581214 145244440 /nfs/dbraw/zinc/24/44/40/145244440.db2.gz WKDWJIOFWNYPIT-CQSZACIVSA-N 0 3 337.445 2.678 20 5 EFBDHN CCCN1CCC[C@@H]1CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000343584596 145245391 /nfs/dbraw/zinc/24/53/91/145245391.db2.gz ZYZKAPCTAWQGIR-GFCCVEGCSA-N 0 3 325.796 2.852 20 5 EFBDHN CCCN(CCN1CCN(CC)CC1)Cc1csc([N+](=O)[O-])c1 ZINC000344117225 145372179 /nfs/dbraw/zinc/37/21/79/145372179.db2.gz BMLMJZBBAIAIMH-UHFFFAOYSA-N 0 3 340.493 2.506 20 5 EFBDHN CN(C)[C@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1)c1ccccc1 ZINC000344189381 145388863 /nfs/dbraw/zinc/38/88/63/145388863.db2.gz MPBZOLLTUJFNEX-MRXNPFEDSA-N 0 3 331.347 2.767 20 5 EFBDHN C[C@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000344215645 145394583 /nfs/dbraw/zinc/39/45/83/145394583.db2.gz QBUIDVCQRYBJGC-JHJVBQTASA-N 0 3 337.395 2.830 20 5 EFBDHN C[C@@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000344215649 145394832 /nfs/dbraw/zinc/39/48/32/145394832.db2.gz QBUIDVCQRYBJGC-XQQFMLRXSA-N 0 3 337.395 2.830 20 5 EFBDHN CN(C)CCN(Cc1ccc(F)cc1F)c1ccc([N+](=O)[O-])cn1 ZINC000347197695 145811629 /nfs/dbraw/zinc/81/16/29/145811629.db2.gz LWHGVORHMPJYMD-UHFFFAOYSA-N 0 3 336.342 2.836 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC[C@@H]1C1CCOCC1 ZINC000348915699 146023725 /nfs/dbraw/zinc/02/37/25/146023725.db2.gz CMZZLDRDUTZNAP-QGZVFWFLSA-N 0 3 347.415 2.733 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@@H]1CCCN(C)C1=O ZINC000349201476 146065750 /nfs/dbraw/zinc/06/57/50/146065750.db2.gz LANLXKBYJZENNW-CHWSQXEVSA-N 0 3 337.445 2.676 20 5 EFBDHN COCCN(CCN(C)C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000349303003 146077514 /nfs/dbraw/zinc/07/75/14/146077514.db2.gz YNOYHMDXCSNPSV-UHFFFAOYSA-N 0 3 347.415 2.865 20 5 EFBDHN CCOc1ncccc1CN[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000351505115 146133253 /nfs/dbraw/zinc/13/32/53/146133253.db2.gz ZPPSOLISPKKWTF-LSDHHAIUSA-N 0 3 345.403 2.859 20 5 EFBDHN C[C@H]1C[C@H](N2CCCC2)CN1C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000351744750 146193063 /nfs/dbraw/zinc/19/30/63/146193063.db2.gz XCIHQYYXDXASGC-NHYWBVRUSA-N 0 3 336.367 2.824 20 5 EFBDHN C[C@H]1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CCC1(F)F ZINC000352010192 146264345 /nfs/dbraw/zinc/26/43/45/146264345.db2.gz ZTAVCKUVVZRYJN-NSHDSACASA-N 0 3 327.331 2.901 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@H](N2CCOCC2)[C@@H]1C ZINC000352018179 146266280 /nfs/dbraw/zinc/26/62/80/146266280.db2.gz OHFVKDHSXBHEMY-MPGHIAIKSA-N 0 3 333.432 2.759 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](NC[C@@H](O)[C@@H]2CCOC2)c2ccccc2)c1 ZINC000352846539 146331934 /nfs/dbraw/zinc/33/19/34/146331934.db2.gz ABWVWFQSFBPIFN-BHIYHBOVSA-N 0 3 342.395 2.671 20 5 EFBDHN C[C@H](O)C[C@H]1CCCCCN1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000352892203 146342509 /nfs/dbraw/zinc/34/25/09/146342509.db2.gz ISXBVRJXQHBNCZ-WMLDXEAASA-N 0 3 349.431 2.573 20 5 EFBDHN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](C)N(C)C ZINC000356323076 147212003 /nfs/dbraw/zinc/21/20/03/147212003.db2.gz IUXWEJXBVCYEOP-NSHDSACASA-N 0 3 325.434 2.777 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(CCN(C)C)C1CC1 ZINC000356875317 147359938 /nfs/dbraw/zinc/35/99/38/147359938.db2.gz ASRJPYWTDXKZFT-LBPRGKRZSA-N 0 3 337.445 2.628 20 5 EFBDHN CNc1c(C(=O)N[C@@H](C)CN2CCCCCC2)cccc1[N+](=O)[O-] ZINC000359314636 148053638 /nfs/dbraw/zinc/05/36/38/148053638.db2.gz CQPMFLALDRXYKQ-ZDUSSCGKSA-N 0 3 334.420 2.631 20 5 EFBDHN CC[C@@H](C)N[C@@H](CNC(=O)Cc1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000359530686 148111625 /nfs/dbraw/zinc/11/16/25/148111625.db2.gz DKNJSTASPUCXTB-CJNGLKHVSA-N 0 3 345.399 2.976 20 5 EFBDHN Cc1c(CNC(=O)N(C)[C@@H](C)C2CCN(C)CC2)cccc1[N+](=O)[O-] ZINC000359549611 148118692 /nfs/dbraw/zinc/11/86/92/148118692.db2.gz FCNYZXOEYBHFKS-AWEZNQCLSA-N 0 3 348.447 2.775 20 5 EFBDHN Cc1c(CNC(=O)N(CCN(C)C)CC(C)C)cccc1[N+](=O)[O-] ZINC000359553249 148121070 /nfs/dbraw/zinc/12/10/70/148121070.db2.gz RNTBCENPCUFECN-UHFFFAOYSA-N 0 3 336.436 2.632 20 5 EFBDHN CN(C)C[C@@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000359806363 148193872 /nfs/dbraw/zinc/19/38/72/148193872.db2.gz OOCMBJJAJQUIFA-MRXNPFEDSA-N 0 3 349.337 2.906 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@@H](CO)Cc1ccc(F)cc1 ZINC000359818374 148197420 /nfs/dbraw/zinc/19/74/20/148197420.db2.gz OGBRPDIKFJUVCH-MRXNPFEDSA-N 0 3 348.374 2.826 20 5 EFBDHN C[C@H]1[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2)CCN1Cc1ccccc1 ZINC000359832153 148201584 /nfs/dbraw/zinc/20/15/84/148201584.db2.gz LJGJLLKFSJBKIZ-KSSFIOAISA-N 0 3 339.395 2.988 20 5 EFBDHN Cc1cc(NC(C)(C)CCN2CCN(C)CC2)c(F)cc1[N+](=O)[O-] ZINC000360066261 148263967 /nfs/dbraw/zinc/26/39/67/148263967.db2.gz OHUPMMQWACRLSG-UHFFFAOYSA-N 0 3 338.427 2.870 20 5 EFBDHN Cc1cc(NCCCN2CCCO[C@@H](C)C2)c(F)cc1[N+](=O)[O-] ZINC000360070653 148264476 /nfs/dbraw/zinc/26/44/76/148264476.db2.gz IJWDYTTWLQSDHV-ZDUSSCGKSA-N 0 3 325.384 2.955 20 5 EFBDHN CN(C[C@@H]1CCCN(C)C1)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000360090473 148269502 /nfs/dbraw/zinc/26/95/02/148269502.db2.gz WRKGKMDJNWMPTR-GFCCVEGCSA-N 0 3 331.372 2.755 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@H]2CCN(CCCc3ccncc3)C2)nc1 ZINC000360490352 148374170 /nfs/dbraw/zinc/37/41/70/148374170.db2.gz JYBBUZFUFNEMPH-HNNXBMFYSA-N 0 3 327.388 2.504 20 5 EFBDHN Cc1cc(NC[C@H]2CN3CCC[C@H]3CO2)c2cccc([N+](=O)[O-])c2n1 ZINC000364031898 149052057 /nfs/dbraw/zinc/05/20/57/149052057.db2.gz CMIOYAUELJDUMG-KBPBESRZSA-N 0 3 342.399 2.727 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)C2(N)Cc3ccccc3C2)cc1[N+](=O)[O-] ZINC000364867549 149263598 /nfs/dbraw/zinc/26/35/98/149263598.db2.gz PQSAYXPJZSLQCK-ZDUSSCGKSA-N 0 3 339.395 2.577 20 5 EFBDHN Cc1ccc(N2CCC(C)(CN3CCN(C)CC3)CC2)c([N+](=O)[O-])c1 ZINC000364940050 149280474 /nfs/dbraw/zinc/28/04/74/149280474.db2.gz BGAGSEDXFUUBHT-UHFFFAOYSA-N 0 3 346.475 2.757 20 5 EFBDHN O=[N+]([O-])c1ccn(C2CCN(CC3=Cc4ccccc4OC3)CC2)n1 ZINC000365115295 149319975 /nfs/dbraw/zinc/31/99/75/149319975.db2.gz GAVMSCQHWDNXKO-UHFFFAOYSA-N 0 3 340.383 2.904 20 5 EFBDHN NC(=O)C[C@@H]1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000368131480 150046537 /nfs/dbraw/zinc/04/65/37/150046537.db2.gz AKCJCFLVRAHPMV-LBPRGKRZSA-N 0 3 329.356 2.552 20 5 EFBDHN O=C(CCN1CCC[C@H](OCC2CC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000368412223 150113182 /nfs/dbraw/zinc/11/31/82/150113182.db2.gz RFDRNTNOOZMOPA-HNNXBMFYSA-N 0 3 347.415 2.814 20 5 EFBDHN COC[C@H]1CCCCN(Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1 ZINC000368659497 150173173 /nfs/dbraw/zinc/17/31/73/150173173.db2.gz OLJDWGSLXCTRRN-ZDUSSCGKSA-N 0 3 338.404 2.861 20 5 EFBDHN Cc1c(NC(=O)CCN2CCOCC3(CCC3)C2)cccc1[N+](=O)[O-] ZINC000368834972 150217030 /nfs/dbraw/zinc/21/70/30/150217030.db2.gz PDEJDMXWUDANHJ-UHFFFAOYSA-N 0 3 347.415 2.734 20 5 EFBDHN CN1CCC(N2CC[C@H](Nc3ccc([N+](=O)[O-])cc3Cl)C2)CC1 ZINC000369265127 150314828 /nfs/dbraw/zinc/31/48/28/150314828.db2.gz DUXHCTXCOPXZBH-LBPRGKRZSA-N 0 3 338.839 2.829 20 5 EFBDHN Cc1nn(C)cc1[C@H]1CCCN1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000372729626 151052086 /nfs/dbraw/zinc/05/20/86/151052086.db2.gz VYOVMONDLHDHSQ-IAGOWNOFSA-N 0 3 330.388 2.507 20 5 EFBDHN COc1cc(C(=O)N2CCCC23CCN(C)CC3)cc([N+](=O)[O-])c1C ZINC000372777068 151060862 /nfs/dbraw/zinc/06/08/62/151060862.db2.gz SVAGEVVXDLSACM-UHFFFAOYSA-N 0 3 347.415 2.612 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCN1CCC[C@@H]1/C=C/c1ccccc1 ZINC000378602582 152124734 /nfs/dbraw/zinc/12/47/34/152124734.db2.gz XRMIMTZPEWEQJI-KBOKABMXSA-N 0 3 339.395 2.934 20 5 EFBDHN CC[C@@H]1CN([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CCN1C[C@H](C)O ZINC000245516341 287207561 /nfs/dbraw/zinc/20/75/61/287207561.db2.gz FUVLGVOVVQUHBN-HRCADAONSA-N 0 3 335.448 2.741 20 5 EFBDHN C[C@H](NC(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000122156676 222025371 /nfs/dbraw/zinc/02/53/71/222025371.db2.gz PDVNJEULZIUHHN-SGMGOOAPSA-N 0 3 332.404 2.580 20 5 EFBDHN C[C@H](NC(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000122156461 222025763 /nfs/dbraw/zinc/02/57/63/222025763.db2.gz PDVNJEULZIUHHN-MBNYWOFBSA-N 0 3 332.404 2.580 20 5 EFBDHN C[C@H](NC(=O)N[C@H]1C[C@H](C)N(C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000122156286 222025773 /nfs/dbraw/zinc/02/57/73/222025773.db2.gz PDVNJEULZIUHHN-OBJOEFQTSA-N 0 3 332.404 2.580 20 5 EFBDHN C[C@H]1CCCN(CCNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000123495326 222287482 /nfs/dbraw/zinc/28/74/82/222287482.db2.gz SFVCLVLQHVFNSH-ZDUSSCGKSA-N 0 3 342.399 2.605 20 5 EFBDHN COc1ccc(OC)c([C@H](O)CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000125032055 222511765 /nfs/dbraw/zinc/51/17/65/222511765.db2.gz DIGHBXPMTHQKGR-YVEFUNNKSA-N 0 3 346.383 2.996 20 5 EFBDHN COc1cccc(NCCCCN2C[C@@H](C)O[C@H](C)C2)c1[N+](=O)[O-] ZINC000185543616 265044176 /nfs/dbraw/zinc/04/41/76/265044176.db2.gz KMWQBRKKIRXYLE-ZIAGYGMSSA-N 0 3 337.420 2.905 20 5 EFBDHN C[C@@H](CNC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)N(C)C1CC1 ZINC000185823505 265049312 /nfs/dbraw/zinc/04/93/12/265049312.db2.gz CRKJLHFSAIZRKA-JTQLQIEISA-N 0 3 340.811 2.530 20 5 EFBDHN CCOC(=O)N1CCC([C@@H](C)NCc2ccccc2[N+](=O)[O-])CC1 ZINC000186421988 265067228 /nfs/dbraw/zinc/06/72/28/265067228.db2.gz XNNCGYGFLGYJRS-CYBMUJFWSA-N 0 3 335.404 2.941 20 5 EFBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CNCCCOC(F)F)c1 ZINC000193662542 265340125 /nfs/dbraw/zinc/34/01/25/265340125.db2.gz SCRMHWIFXSMFHP-UHFFFAOYSA-N 0 3 326.246 2.915 20 5 EFBDHN CN(C)CCOc1ccccc1CNC(=O)c1csc([N+](=O)[O-])c1 ZINC000194962112 265397300 /nfs/dbraw/zinc/39/73/00/265397300.db2.gz FJWILIPCZOUKQQ-UHFFFAOYSA-N 0 3 349.412 2.527 20 5 EFBDHN C[C@H](NCCn1cc(Br)cn1)c1cccc([N+](=O)[O-])c1 ZINC000271626405 266026106 /nfs/dbraw/zinc/02/61/06/266026106.db2.gz DRQSYTBPGLSSGQ-JTQLQIEISA-N 0 3 339.193 2.905 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N2CC[C@H]3CCN(C)C[C@H]32)cc1[N+](=O)[O-] ZINC000272416659 266259070 /nfs/dbraw/zinc/25/90/70/266259070.db2.gz AQJUZUUPLVDTPB-JJRVBVJISA-N 0 3 346.431 2.700 20 5 EFBDHN CC[C@@H](NCc1ccc(OC)c([N+](=O)[O-])c1)C1(C(=O)OC)CCC1 ZINC000272608082 266324580 /nfs/dbraw/zinc/32/45/80/266324580.db2.gz YURPTJWYMYAFNK-OAHLLOKOSA-N 0 3 336.388 2.815 20 5 EFBDHN CC[C@@H](C)[N@H+](C)CC[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272627046 266332732 /nfs/dbraw/zinc/33/27/32/266332732.db2.gz ZEOPGUATOPJHCC-LLVKDONJSA-N 0 3 329.347 2.533 20 5 EFBDHN CC[C@@H](C)[N@@H+](C)CC[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272627046 266332736 /nfs/dbraw/zinc/33/27/36/266332736.db2.gz ZEOPGUATOPJHCC-LLVKDONJSA-N 0 3 329.347 2.533 20 5 EFBDHN C[C@@H](NC(=O)N[C@H](C)C1=CCN(C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000272724893 266364987 /nfs/dbraw/zinc/36/49/87/266364987.db2.gz JQVSEYZPDWXTLL-CHWSQXEVSA-N 0 3 332.404 2.605 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)C2=CCN(C)CC2)c1 ZINC000272813492 266388444 /nfs/dbraw/zinc/38/84/44/266388444.db2.gz WIRDZLJDLDXYAA-NSHDSACASA-N 0 3 335.429 2.697 20 5 EFBDHN CS[C@@H]1CN(C(=O)c2ccc(C)c([N+](=O)[O-])c2)C[C@H]1N1CCCC1 ZINC000273545221 266516787 /nfs/dbraw/zinc/51/67/87/266516787.db2.gz UNKISNZTVXEPJI-HZPDHXFCSA-N 0 3 349.456 2.555 20 5 EFBDHN CN(C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)[C@@H]1CCCN(C)C1 ZINC000273826890 266560145 /nfs/dbraw/zinc/56/01/45/266560145.db2.gz GPRYNARPXHPLHA-CYBMUJFWSA-N 0 3 337.395 2.564 20 5 EFBDHN CCc1ccc([C@@H](O)CNCc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000276555146 267012184 /nfs/dbraw/zinc/01/21/84/267012184.db2.gz FVISXRZOKWATIU-KRWDZBQOSA-N 0 3 330.384 2.989 20 5 EFBDHN COc1cc(C(=O)N(C)[C@H](C)C2CCN(C)CC2)cc([N+](=O)[O-])c1C ZINC000276762663 267044026 /nfs/dbraw/zinc/04/40/26/267044026.db2.gz GHBLAPBFQALWOX-CYBMUJFWSA-N 0 3 349.431 2.714 20 5 EFBDHN CO[C@H]1CCCC[C@H]1NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000276940784 267081983 /nfs/dbraw/zinc/08/19/83/267081983.db2.gz JVOQZVFDDTZHHE-OCCSQVGLSA-N 0 3 341.795 2.734 20 5 EFBDHN C[C@@H]1CN(C2CC2)C[C@H]1Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000277510740 267189324 /nfs/dbraw/zinc/18/93/24/267189324.db2.gz ACMAUKBKEAVJCW-LDYMZIIASA-N 0 3 330.310 2.903 20 5 EFBDHN CCNC(=O)C1(CNCc2ccc([N+](=O)[O-])cc2Cl)CCC1 ZINC000277547277 267194844 /nfs/dbraw/zinc/19/48/44/267194844.db2.gz ZRYASDISCOLUOA-UHFFFAOYSA-N 0 3 325.796 2.644 20 5 EFBDHN CCC[C@]1(CO)CCCN1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000277795502 267265629 /nfs/dbraw/zinc/26/56/29/267265629.db2.gz OYTOHHKMEGWSQS-QGZVFWFLSA-N 0 3 346.387 2.772 20 5 EFBDHN Cc1c(CC(=O)NC[C@@H]2CCCCN2C2CC2)cccc1[N+](=O)[O-] ZINC000277972979 267312472 /nfs/dbraw/zinc/31/24/72/267312472.db2.gz QEFAOKUZYCBVOT-INIZCTEOSA-N 0 3 331.416 2.579 20 5 EFBDHN Cn1nccc1N1CCC[C@@H](NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000278544461 267475399 /nfs/dbraw/zinc/47/53/99/267475399.db2.gz YACHZBAUDUFBHK-CYBMUJFWSA-N 0 3 349.822 2.740 20 5 EFBDHN CS[C@@H]1CN(C(=O)c2c(C)cccc2[N+](=O)[O-])C[C@@H]1N1CCCC1 ZINC000278829811 267572065 /nfs/dbraw/zinc/57/20/65/267572065.db2.gz VDIFWQDNEZOYOD-LSDHHAIUSA-N 0 3 349.456 2.555 20 5 EFBDHN CS[C@H]1CN(C(=O)c2c(C)cccc2[N+](=O)[O-])C[C@H]1N1CCCC1 ZINC000278829795 267573231 /nfs/dbraw/zinc/57/32/31/267573231.db2.gz VDIFWQDNEZOYOD-CABCVRRESA-N 0 3 349.456 2.555 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)NCCN2CCCCC2)cc1[N+](=O)[O-] ZINC000175648511 273030097 /nfs/dbraw/zinc/03/00/97/273030097.db2.gz MTFVYOJTPZOLPW-AWEZNQCLSA-N 0 3 334.420 2.749 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CCC[C@H]2C[C@H](O)c2ccco2)c1 ZINC000269642206 273086988 /nfs/dbraw/zinc/08/69/88/273086988.db2.gz JSRNQHOTULLMKC-BHYGNILZSA-N 0 3 346.383 2.809 20 5 EFBDHN O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@H]1CCCN1C1CCCC1 ZINC000269739779 273089826 /nfs/dbraw/zinc/08/98/26/273089826.db2.gz WRJSYXXOSYPRIL-QGZVFWFLSA-N 0 3 331.416 2.661 20 5 EFBDHN CCO[C@@H]1C[C@@H](NC/C=C/c2ccccc2[N+](=O)[O-])[C@]12CCCO2 ZINC000273638701 273116024 /nfs/dbraw/zinc/11/60/24/273116024.db2.gz UFDQREVPNDGJAU-SGWXJNRHSA-N 0 3 332.400 2.924 20 5 EFBDHN CCN(CCNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)C1CC1 ZINC000273814035 273120459 /nfs/dbraw/zinc/12/04/59/273120459.db2.gz BHPQOOMKSNPGJL-UHFFFAOYSA-N 0 3 337.395 2.612 20 5 EFBDHN CC(C)O[C@H]1C[C@H](NCC(=O)Nc2ccccc2[N+](=O)[O-])C1(C)C ZINC000274308305 273131560 /nfs/dbraw/zinc/13/15/60/273131560.db2.gz SSBZUCNVKAIXIV-GJZGRUSLSA-N 0 3 335.404 2.715 20 5 EFBDHN C[C@H](N[C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])c1ncnn1C ZINC000276737436 273142032 /nfs/dbraw/zinc/14/20/32/273142032.db2.gz YZLHPTBASAFHNO-YDHLFZDLSA-N 0 3 329.404 2.785 20 5 EFBDHN CC1(C)CCN(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCS1 ZINC000279814008 273256340 /nfs/dbraw/zinc/25/63/40/273256340.db2.gz XYONOGXXTCLFQS-CQSZACIVSA-N 0 3 340.445 2.552 20 5 EFBDHN COC(=O)C[C@@H]1CC[C@H](NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@@H]1C ZINC000280604878 273346028 /nfs/dbraw/zinc/34/60/28/273346028.db2.gz OITDCCKTFNAGJW-MDZLAQPJSA-N 0 3 346.387 2.539 20 5 EFBDHN CCC(=O)c1ccc(NCC2(N(C)C)CCOCC2)c([N+](=O)[O-])c1 ZINC000280659997 273352472 /nfs/dbraw/zinc/35/24/72/273352472.db2.gz GPJAPLPIYAUCMR-UHFFFAOYSA-N 0 3 335.404 2.710 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCC(C)=C(C)C1 ZINC000280750287 273362876 /nfs/dbraw/zinc/36/28/76/273362876.db2.gz NHUAHOWTEDFKAG-UHFFFAOYSA-N 0 3 333.388 2.974 20 5 EFBDHN CN(C)CC1(NC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CCC1 ZINC000281448433 273436284 /nfs/dbraw/zinc/43/62/84/273436284.db2.gz SHTZMDHTSVGECM-UHFFFAOYSA-N 0 3 326.784 2.854 20 5 EFBDHN COc1ccc([C@@H](O)CN[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000284018923 273787105 /nfs/dbraw/zinc/78/71/05/273787105.db2.gz IRNDSBIDWOHZHV-GTNSWQLSSA-N 0 3 331.372 2.570 20 5 EFBDHN CN(C)[C@H]1Cc2ccccc2N(C(=O)c2cc(F)cc([N+](=O)[O-])c2)C1 ZINC000344285459 273820248 /nfs/dbraw/zinc/82/02/48/273820248.db2.gz RMBGMLYZSILYIS-INIZCTEOSA-N 0 3 343.358 2.867 20 5 EFBDHN C[C@H](NCCOCC(F)(F)C(F)F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000285168397 273953988 /nfs/dbraw/zinc/95/39/88/273953988.db2.gz MUUILENUSLUNAX-QMMMGPOBSA-N 0 3 339.289 2.745 20 5 EFBDHN C[C@@H](NCCc1ccccc1[N+](=O)[O-])c1ccc(N)c([N+](=O)[O-])c1 ZINC000285195334 273958708 /nfs/dbraw/zinc/95/87/08/273958708.db2.gz NXMBNCOPDINVQY-LLVKDONJSA-N 0 3 330.344 2.979 20 5 EFBDHN CCC[C@]1(NCC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CCOC1 ZINC000285365995 273986524 /nfs/dbraw/zinc/98/65/24/273986524.db2.gz AQTLLUCOFFVLTE-HNNXBMFYSA-N 0 3 341.795 2.736 20 5 EFBDHN CCc1ccc([C@@H](O)CNCc2cc(OC)c(O)cc2[N+](=O)[O-])cc1 ZINC000285545715 274022382 /nfs/dbraw/zinc/02/23/82/274022382.db2.gz QHUGTZYIJFDZBY-KRWDZBQOSA-N 0 3 346.383 2.695 20 5 EFBDHN C[C@@H]1COCC[C@@H]1CNCc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000285617823 274038832 /nfs/dbraw/zinc/03/88/32/274038832.db2.gz WGUSRGAGMZTARD-GHMZBOCLSA-N 0 3 330.331 2.958 20 5 EFBDHN C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000285624590 274040306 /nfs/dbraw/zinc/04/03/06/274040306.db2.gz KNIOSLJWPCZQFH-WCQYABFASA-N 0 3 336.367 2.824 20 5 EFBDHN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)[C@@H]1CCCN1C1CCCC1 ZINC000285696525 274055443 /nfs/dbraw/zinc/05/54/43/274055443.db2.gz HIGQKNKUGWUFMW-HNNXBMFYSA-N 0 3 343.387 2.817 20 5 EFBDHN CCCN(CCN1CCCC1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000285825276 274081942 /nfs/dbraw/zinc/08/19/42/274081942.db2.gz GWYXZAVYLPOPER-UHFFFAOYSA-N 0 3 349.431 2.769 20 5 EFBDHN COc1ccc([C@H](CN(C)C)NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000285890773 274095036 /nfs/dbraw/zinc/09/50/36/274095036.db2.gz CLCKVVBFNLCFFQ-KRWDZBQOSA-N 0 3 343.383 2.636 20 5 EFBDHN CC(C)C[C@@H](CNc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1)N(C)C ZINC000286099938 274133499 /nfs/dbraw/zinc/13/34/99/274133499.db2.gz LCGJWQIPGGYICR-LBPRGKRZSA-N 0 3 333.392 2.632 20 5 EFBDHN CCS[C@@H]1CCC[C@H]1NCC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000286325435 274178657 /nfs/dbraw/zinc/17/86/57/274178657.db2.gz WWJAANXRPUQNOM-GDBMZVCRSA-N 0 3 349.456 2.748 20 5 EFBDHN O=[N+]([O-])c1cc(F)c(CN2CC[C@H](N3CCCCC3)C2)c(F)c1 ZINC000286409517 274195084 /nfs/dbraw/zinc/19/50/84/274195084.db2.gz LTWFXLITMAUFMY-LBPRGKRZSA-N 0 3 325.359 2.933 20 5 EFBDHN C[C@@H](NCCC(=O)Nc1cc([N+](=O)[O-])ccc1F)c1ccccn1 ZINC000130186447 274246333 /nfs/dbraw/zinc/24/63/33/274246333.db2.gz GZQVZNAMKFJGJP-LLVKDONJSA-N 0 3 332.335 2.808 20 5 EFBDHN C[C@@H]1CCCC[C@@H]1N(C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000192629727 274287072 /nfs/dbraw/zinc/28/70/72/274287072.db2.gz JLGBTXJUOUJHEK-CJNGLKHVSA-N 0 3 331.416 2.994 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)N1C[C@H](N2CCCC2)C[C@@H]1C ZINC000286926252 274302299 /nfs/dbraw/zinc/30/22/99/274302299.db2.gz LDSZADVGJUBYOT-GXTWGEPZSA-N 0 3 348.403 2.694 20 5 EFBDHN CN(C)C1(CNc2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)CCCCC1 ZINC000287044507 274328801 /nfs/dbraw/zinc/32/88/01/274328801.db2.gz RMYODERTQDKIJY-UHFFFAOYSA-N 0 3 345.403 2.920 20 5 EFBDHN CS[C@H]1CN(c2c(F)cccc2[N+](=O)[O-])C[C@@H]1N1CCCC1 ZINC000287107542 274344441 /nfs/dbraw/zinc/34/44/41/274344441.db2.gz ZLOBGVCQSWODIC-KBPBESRZSA-N 0 3 325.409 2.750 20 5 EFBDHN CCC[C@H](NC[C@H]1CCCS(=O)(=O)C1)c1cccc([N+](=O)[O-])c1 ZINC000287149209 274354260 /nfs/dbraw/zinc/35/42/60/274354260.db2.gz SQXUQCYHTNJIPH-CJNGLKHVSA-N 0 3 340.445 2.850 20 5 EFBDHN C[C@H]1[C@@H](N2CCCC2)CCN1C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000287173761 274360229 /nfs/dbraw/zinc/36/02/29/274360229.db2.gz OHWYGGBJJJOBEI-NHYWBVRUSA-N 0 3 337.807 2.947 20 5 EFBDHN C[C@@H]1C[C@@H](NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CCN1C ZINC000449942137 274391349 /nfs/dbraw/zinc/39/13/49/274391349.db2.gz RVYXYIHVGROIBC-KOLCDFICSA-N 0 3 345.321 2.826 20 5 EFBDHN C[C@H](N[C@H]1CCCN(C(=O)N2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000287495635 274432487 /nfs/dbraw/zinc/43/24/87/274432487.db2.gz NMVBWAQSXBXQJE-HOCLYGCPSA-N 0 3 346.431 2.926 20 5 EFBDHN C[C@H](NCCCn1c2cc([N+](=O)[O-])ccc2oc1=O)c1ccccn1 ZINC000361146170 274512514 /nfs/dbraw/zinc/51/25/14/274512514.db2.gz AMOGBJFACZWZFO-LBPRGKRZSA-N 0 3 342.355 2.639 20 5 EFBDHN C[C@H]1C[C@H](N2CCCC2)CN1C(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000288560591 274618290 /nfs/dbraw/zinc/61/82/90/274618290.db2.gz WFCIUTILTCCGQD-AAEUAGOBSA-N 0 3 337.807 2.947 20 5 EFBDHN C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000288560600 274618367 /nfs/dbraw/zinc/61/83/67/274618367.db2.gz WFCIUTILTCCGQD-WCQYABFASA-N 0 3 337.807 2.947 20 5 EFBDHN Cn1cc(N2CC[C@H](N[C@H]3CCCc4ccc([N+](=O)[O-])cc43)C2)cn1 ZINC000375717200 274893160 /nfs/dbraw/zinc/89/31/60/274893160.db2.gz DEVRJAZTOLMQAR-KSSFIOAISA-N 0 3 341.415 2.574 20 5 EFBDHN O=C1C[C@H](N[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)[C@H]2CCCCN12 ZINC000367203079 275020874 /nfs/dbraw/zinc/02/08/74/275020874.db2.gz BPZFEAPNFGLJHF-IXDOHACOSA-N 0 3 329.400 2.715 20 5 EFBDHN CC1(C)C[C@@H](NCCN2C[C@H]3CC[C@@H](C2)O3)c2cc([N+](=O)[O-])ccc21 ZINC000453331966 276143108 /nfs/dbraw/zinc/14/31/08/276143108.db2.gz HZCHDRKDEXECKF-RVKKMQEKSA-N 0 3 345.443 2.770 20 5 EFBDHN CCn1nc(C)c([N+](=O)[O-])c1NC[C@@H](c1ccc(F)cc1)N(C)C ZINC000192513914 276722219 /nfs/dbraw/zinc/72/22/19/276722219.db2.gz ITTFGCMCOUKGPS-AWEZNQCLSA-N 0 3 335.383 2.974 20 5 EFBDHN CN(C)[C@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000003444734 276854024 /nfs/dbraw/zinc/85/40/24/276854024.db2.gz UZYWUDBJEZPKHL-QGZVFWFLSA-N 0 3 327.384 2.556 20 5 EFBDHN CN1CC[C@H]2[C@@H](CCCN2C(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000246261803 277181508 /nfs/dbraw/zinc/18/15/08/277181508.db2.gz LBUZLMRJUXIPHA-AAEUAGOBSA-N 0 3 337.807 2.805 20 5 EFBDHN CC(C)C[C@@H](CNC(=O)c1cc(Cl)ccc1[N+](=O)[O-])N(C)C ZINC000132485962 277440406 /nfs/dbraw/zinc/44/04/06/277440406.db2.gz ANPJHUBEQCFRIJ-LBPRGKRZSA-N 0 3 327.812 2.954 20 5 EFBDHN CC(C)c1ccc(CN[C@@H]2CC(=O)N3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC000337845145 278037550 /nfs/dbraw/zinc/03/75/50/278037550.db2.gz HLUUYQBKRZSFTE-HZPDHXFCSA-N 0 3 331.416 2.961 20 5 EFBDHN CS[C@@H]1CN(c2ccc([N+](=O)[O-])c3ncccc32)C[C@H]1N(C)C ZINC000413211925 278157114 /nfs/dbraw/zinc/15/71/14/278157114.db2.gz QLZHUTPCUXSSCQ-HUUCEWRRSA-N 0 3 332.429 2.625 20 5 EFBDHN C[C@@H](NCCc1nnc2n1CCCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000126698306 278349089 /nfs/dbraw/zinc/34/90/89/278349089.db2.gz OLHRLMKGXRMMTN-CYBMUJFWSA-N 0 3 329.404 2.806 20 5 EFBDHN C[C@H](CNC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N(C)C1CC1 ZINC000079966182 279345059 /nfs/dbraw/zinc/34/50/59/279345059.db2.gz CKDSBCBTUBIYMX-SECBINFHSA-N 0 3 345.321 2.826 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N[C@H](C)C(=O)N1CCCC[C@H]1C ZINC000449112431 279382344 /nfs/dbraw/zinc/38/23/44/279382344.db2.gz CIIJBTVFOGSZAX-RBSFLKMASA-N 0 3 333.432 2.905 20 5 EFBDHN CCOC(CCC[NH2+]Cc1cc(OC)c([O-])cc1[N+](=O)[O-])OCC ZINC000263651938 279648971 /nfs/dbraw/zinc/64/89/71/279648971.db2.gz DLPCGSZOQQYFFG-UHFFFAOYSA-N 0 3 342.392 2.578 20 5 EFBDHN Cc1cc(N2CCN(c3ncc[nH]3)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000357658148 280560508 /nfs/dbraw/zinc/56/05/08/280560508.db2.gz HQAPMMMQXBLSQP-UHFFFAOYSA-N 0 3 338.371 2.501 20 5 EFBDHN CC(C)c1ccc(CN2CCNC[C@H]2c2nccn2C)cc1[N+](=O)[O-] ZINC000262120481 280604949 /nfs/dbraw/zinc/60/49/49/280604949.db2.gz XGJLBCLBBLKMHJ-KRWDZBQOSA-N 0 3 343.431 2.598 20 5 EFBDHN Cc1ccc(C(=O)N(CCN(C)C)Cc2ccccn2)cc1[N+](=O)[O-] ZINC000337254301 280762502 /nfs/dbraw/zinc/76/25/02/280762502.db2.gz QCVANDXCGRYMOR-UHFFFAOYSA-N 0 3 342.399 2.502 20 5 EFBDHN CC1CCN(CCNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000080073214 292797980 /nfs/dbraw/zinc/79/79/80/292797980.db2.gz QOYIUHUKNIXAQT-UHFFFAOYSA-N 0 3 348.447 2.861 20 5 EFBDHN CC(C)(NC(=O)NC1CCN(C2CC2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000080063524 292798231 /nfs/dbraw/zinc/79/82/31/292798231.db2.gz NALMWXOUKVZWEU-UHFFFAOYSA-N 0 3 346.431 2.756 20 5 EFBDHN CN(C)C[C@H]1CCCCN1C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000117788832 292892448 /nfs/dbraw/zinc/89/24/48/292892448.db2.gz KYIRZLGLYHGNGO-CQSZACIVSA-N 0 3 339.823 2.733 20 5 EFBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CNC[C@@H]2CCCC[C@H]2O)c1 ZINC000124307968 292996373 /nfs/dbraw/zinc/99/63/73/292996373.db2.gz NKIWHVMHEYTXSL-GXFFZTMASA-N 0 3 330.331 2.837 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)CN1C1CC1 ZINC000130368205 293163356 /nfs/dbraw/zinc/16/33/56/293163356.db2.gz FPDADWFUYDDANY-JSGCOSHPSA-N 0 3 346.431 2.754 20 5 EFBDHN C[C@H]1CCCN1C(=O)CCN(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000130403043 293164718 /nfs/dbraw/zinc/16/47/18/293164718.db2.gz PFYPPQHPHWISQE-AWEZNQCLSA-N 0 3 331.416 2.960 20 5 EFBDHN CN(C)[C@H](CNC(=O)c1ccc(F)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000131781731 293207902 /nfs/dbraw/zinc/20/79/02/293207902.db2.gz XEKGUYYNAUZSKC-HNNXBMFYSA-N 0 3 345.374 2.637 20 5 EFBDHN COc1cc(C(=O)NC[C@H](c2ccccc2)N(C)C)ccc1[N+](=O)[O-] ZINC000133235897 293250782 /nfs/dbraw/zinc/25/07/82/293250782.db2.gz YENDSIGMQXSZJM-MRXNPFEDSA-N 0 3 343.383 2.636 20 5 EFBDHN COc1ccc(CNC[C@@]2(CO)C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000289997713 293970143 /nfs/dbraw/zinc/97/01/43/293970143.db2.gz XWOGIMZCNBEBLN-QFBILLFUSA-N 0 3 342.395 2.859 20 5 EFBDHN COCC(C)(C)CCC[NH2+]Cc1cc(OC)c([O-])cc1[N+](=O)[O-] ZINC000290198476 294025456 /nfs/dbraw/zinc/02/54/56/294025456.db2.gz UMQNVTBCCNHJEH-UHFFFAOYSA-N 0 3 326.393 2.851 20 5 EFBDHN CN(CCN(C)C1CC1)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000290318744 294055565 /nfs/dbraw/zinc/05/55/65/294055565.db2.gz CTLPWFNYQFDUSZ-UHFFFAOYSA-N 0 3 343.431 2.521 20 5 EFBDHN CN(C)C[C@H](NC(=O)Cc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000290429151 294084350 /nfs/dbraw/zinc/08/43/50/294084350.db2.gz KAQRDZWUGOPBKI-INIZCTEOSA-N 0 3 345.374 2.696 20 5 EFBDHN CN(C)CCOc1ccccc1CNc1ccc(N)cc1[N+](=O)[O-] ZINC000290636458 294141928 /nfs/dbraw/zinc/14/19/28/294141928.db2.gz NGMQRGZBCMQILM-UHFFFAOYSA-N 0 3 330.388 2.730 20 5 EFBDHN CCCN(CC)C[C@@H](C)Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000290645148 294144963 /nfs/dbraw/zinc/14/49/63/294144963.db2.gz GCNIMLIGRJYRRO-SNVBAGLBSA-N 0 3 349.478 2.592 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CN1CC2(CCC2)[C@@H]1C1CC1 ZINC000290851333 294203019 /nfs/dbraw/zinc/20/30/19/294203019.db2.gz XJMBZEUBIYFJAT-PBHICJAKSA-N 0 3 332.400 2.599 20 5 EFBDHN CC(C)NC(=O)c1ccc(N[C@H]2C[C@@H](C)N(C3CC3)C2)c([N+](=O)[O-])c1 ZINC000290865972 294206909 /nfs/dbraw/zinc/20/69/09/294206909.db2.gz ZDURZDMPSMLDMU-OCCSQVGLSA-N 0 3 346.431 2.770 20 5 EFBDHN CCN1CCN(C[C@@H](C)CNc2cc(C)c([N+](=O)[O-])cc2F)CC1 ZINC000290867897 294207296 /nfs/dbraw/zinc/20/72/96/294207296.db2.gz ARHUBULQVYSEAP-ZDUSSCGKSA-N 0 3 338.427 2.728 20 5 EFBDHN C[C@@H]1C[C@H](Nc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CN1C1CC1 ZINC000290871278 294208123 /nfs/dbraw/zinc/20/81/23/294208123.db2.gz ZSTQVZSJAGDHPD-RISCZKNCSA-N 0 3 344.415 2.524 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CNC[C@H]2CC[C@@H](CO)O2)s1 ZINC000292855296 294805467 /nfs/dbraw/zinc/80/54/67/294805467.db2.gz ZNTGIGYHHQFBBE-OLZOCXBDSA-N 0 3 348.424 2.953 20 5 EFBDHN C[C@H](NCCC(=O)NC1CCCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000293228454 294914016 /nfs/dbraw/zinc/91/40/16/294914016.db2.gz AQSPJPXXRCJTEW-LBPRGKRZSA-N 0 3 334.420 2.667 20 5 EFBDHN C[C@H](Cn1cccn1)NCc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000293305940 294935335 /nfs/dbraw/zinc/93/53/35/294935335.db2.gz ZVLQNRKOLCIJGP-SNVBAGLBSA-N 0 3 328.294 2.988 20 5 EFBDHN C[C@@H]1C[C@@H](NC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])CN1C1CC1 ZINC000293585662 295005738 /nfs/dbraw/zinc/00/57/38/295005738.db2.gz XEUQXUKILJJSKT-CHWSQXEVSA-N 0 3 346.431 2.754 20 5 EFBDHN C[C@H](NCCN(C)C(=O)OC(C)(C)C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000293620189 295012475 /nfs/dbraw/zinc/01/24/75/295012475.db2.gz HADMFFKIMJCPDP-NSHDSACASA-N 0 3 338.408 2.695 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCN(C3CCC3)C[C@H](C)C2)c1 ZINC000293700854 295031163 /nfs/dbraw/zinc/03/11/63/295031163.db2.gz NGRRSUDYRMPVRG-AWEZNQCLSA-N 0 3 331.416 2.850 20 5 EFBDHN Cc1cccc(OC[C@H](O)CN[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000293913839 295077919 /nfs/dbraw/zinc/07/79/19/295077919.db2.gz WZYSZGBQVDXBNC-DZGCQCFKSA-N 0 3 345.399 2.576 20 5 EFBDHN Cn1cc(CN2CCC[C@@H](CO)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000294132867 295116329 /nfs/dbraw/zinc/11/63/29/295116329.db2.gz UOAFASDBTNFUJU-CQSZACIVSA-N 0 3 344.415 2.590 20 5 EFBDHN CCc1ccc([C@@H](CNC(=O)CCC(C)(C)[N+](=O)[O-])N(C)C)cc1 ZINC000294239614 295133414 /nfs/dbraw/zinc/13/34/14/295133414.db2.gz CECVQKSYGBTMQP-MRXNPFEDSA-N 0 3 335.448 2.803 20 5 EFBDHN CN(CCc1cccc([N+](=O)[O-])c1)C[C@H](O)Cc1ccc(F)cc1 ZINC000294263461 295137336 /nfs/dbraw/zinc/13/73/36/295137336.db2.gz VEJBUNRSGKEKOT-GOSISDBHSA-N 0 3 332.375 2.812 20 5 EFBDHN CC(C)N(CCNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)C(C)C ZINC000294273901 295139224 /nfs/dbraw/zinc/13/92/24/295139224.db2.gz DXPXSODZGSBRAW-UHFFFAOYSA-N 0 3 349.431 2.793 20 5 EFBDHN CN(CCNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000294452567 295169442 /nfs/dbraw/zinc/16/94/42/295169442.db2.gz DDCBXFAECYCDHA-UHFFFAOYSA-N 0 3 347.415 2.548 20 5 EFBDHN NC(=O)[C@@H]1CCCC[C@H]1NCc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000294563294 295186612 /nfs/dbraw/zinc/18/66/12/295186612.db2.gz LQOSBMHRKWGICR-DGCLKSJQSA-N 0 3 345.321 2.747 20 5 EFBDHN COc1ccc2c(c1)ncc([N+](=O)[O-])c2N1CC[C@@H]2CCN(C)C[C@H]21 ZINC000294827079 295233460 /nfs/dbraw/zinc/23/34/60/295233460.db2.gz AHHYOADWMVNVLC-YVEFUNNKSA-N 0 3 342.399 2.682 20 5 EFBDHN CN(CCc1cccc([N+](=O)[O-])c1)Cc1ccc2c(c1)NC(=O)CO2 ZINC000294832891 295234311 /nfs/dbraw/zinc/23/43/11/295234311.db2.gz YPOSSCFHWNVHDH-UHFFFAOYSA-N 0 3 341.367 2.600 20 5 EFBDHN COc1ccc([C@H]2CCCN2CCn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC000159728477 295249533 /nfs/dbraw/zinc/24/95/33/295249533.db2.gz ZDRFRSDFNZOFPF-QGZVFWFLSA-N 0 3 343.383 2.602 20 5 EFBDHN CCOc1cc(CN2CCN(C3CC3)C[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000294950720 295249936 /nfs/dbraw/zinc/24/99/36/295249936.db2.gz ASSWXNGUPLCOGC-AWEZNQCLSA-N 0 3 333.432 2.910 20 5 EFBDHN CCN1CCC(NC(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)CC1 ZINC000294954435 295250678 /nfs/dbraw/zinc/25/06/78/295250678.db2.gz DKWYASHATIAQFB-UHFFFAOYSA-N 0 3 325.796 2.771 20 5 EFBDHN C[C@H]1CN(c2ncnc3sc([N+](=O)[O-])cc32)CCN(C2CC2)C1 ZINC000295015930 295257933 /nfs/dbraw/zinc/25/79/33/295257933.db2.gz UIPVLNHRMQGHJO-SNVBAGLBSA-N 0 3 333.417 2.520 20 5 EFBDHN C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)CCC(C)(C)[N+](=O)[O-] ZINC000295124837 295271004 /nfs/dbraw/zinc/27/10/04/295271004.db2.gz HLIPLWKORXNSKP-DOTOQJQBSA-N 0 3 347.459 2.849 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)CCC(C)(C)[N+](=O)[O-] ZINC000295124845 295271072 /nfs/dbraw/zinc/27/10/72/295271072.db2.gz HLIPLWKORXNSKP-NVXWUHKLSA-N 0 3 347.459 2.849 20 5 EFBDHN CC(C)C[C@@H](CN1CCCC1)NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000295403643 295313895 /nfs/dbraw/zinc/31/38/95/295313895.db2.gz ITSDIFVSPWMBJB-INIZCTEOSA-N 0 3 333.432 2.764 20 5 EFBDHN CSc1ccc(C(=O)N2CCN(C3CC3)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000295437501 295320620 /nfs/dbraw/zinc/32/06/20/295320620.db2.gz VJHNZSAIZZANDA-LBPRGKRZSA-N 0 3 349.456 2.873 20 5 EFBDHN Cc1cc(Cl)c(C(=O)N(C)[C@@H]2CCN(C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000295756050 295371285 /nfs/dbraw/zinc/37/12/85/295371285.db2.gz HJGPMKVLDLDGKF-BXUZGUMPSA-N 0 3 339.823 2.969 20 5 EFBDHN C[C@@H]1[C@H](N2CCCC2)CCN1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000295762717 295372128 /nfs/dbraw/zinc/37/21/28/295372128.db2.gz PFKSWTXONFZDOJ-BXUZGUMPSA-N 0 3 337.807 2.947 20 5 EFBDHN CO[C@@]1(C)C[C@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1(C)C ZINC000295821612 295381228 /nfs/dbraw/zinc/38/12/28/295381228.db2.gz BXMCCRJYDLXSQC-YOEHRIQHSA-N 0 3 335.404 2.635 20 5 EFBDHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)CCC(C)(C)[N+](=O)[O-] ZINC000295862754 295387820 /nfs/dbraw/zinc/38/78/20/295387820.db2.gz OMMPGDPASFQXJP-INIZCTEOSA-N 0 3 347.459 2.945 20 5 EFBDHN CC[C@H](C)N1CCN([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000296164002 295434609 /nfs/dbraw/zinc/43/46/09/295434609.db2.gz SXGZWHJKKIEXNX-ZFWWWQNUSA-N 0 3 348.447 2.646 20 5 EFBDHN Cc1ccccc1[C@@H]1CCCN1CCn1cc([N+](=O)[O-])ccc1=O ZINC000159765024 302150197 /nfs/dbraw/zinc/15/01/97/302150197.db2.gz UCYBWAZOEWMVOB-KRWDZBQOSA-N 0 3 327.384 2.902 20 5 EFBDHN COc1cc(CNCCCF)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000136517487 310664242 /nfs/dbraw/zinc/66/42/42/310664242.db2.gz NROOYGNCKABVLJ-UHFFFAOYSA-N 0 3 340.273 2.994 20 5 EFBDHN Cc1cc(C(=O)NCc2ccccc2CN(C)C)cc([N+](=O)[O-])c1 ZINC000149903450 310674145 /nfs/dbraw/zinc/67/41/45/310674145.db2.gz QSMGNJUFVOCBFS-UHFFFAOYSA-N 0 3 327.384 2.895 20 5 EFBDHN Cc1cc(Cl)c(C(=O)NC2(CN(C)C)CCC2)cc1[N+](=O)[O-] ZINC000298720384 311017430 /nfs/dbraw/zinc/01/74/30/311017430.db2.gz RTSXOWVJOQXEHO-UHFFFAOYSA-N 0 3 325.796 2.771 20 5 EFBDHN O=C(NC[C@@H]1CCCN(Cc2cccs2)C1)c1ccc([N+](=O)[O-])[nH]1 ZINC000299440330 311085056 /nfs/dbraw/zinc/08/50/56/311085056.db2.gz JKYIJVMIDWBGFF-LBPRGKRZSA-N 0 3 348.428 2.626 20 5 EFBDHN CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H](c1ccccc1)N(C)C ZINC000301129582 311120714 /nfs/dbraw/zinc/12/07/14/311120714.db2.gz ZHRNMXPCVHCPDO-QGZVFWFLSA-N 0 3 342.399 2.669 20 5 EFBDHN C[C@H](c1ccccc1)N1CCC(Nc2ncc([N+](=O)[O-])c(N)n2)CC1 ZINC000301327058 311131410 /nfs/dbraw/zinc/13/14/10/311131410.db2.gz ZQTZWLJCUNVHIW-GFCCVEGCSA-N 0 3 342.403 2.605 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC[C@@H](O)CN1CCc2ccccc2C1 ZINC000301495909 311140721 /nfs/dbraw/zinc/14/07/21/311140721.db2.gz AYVCWMVJGQTQJV-GOSISDBHSA-N 0 3 341.411 2.734 20 5 EFBDHN Cc1nn(C)c(N2CCN(C3CCC(C(C)C)CC3)CC2)c1[N+](=O)[O-] ZINC000301576094 311145590 /nfs/dbraw/zinc/14/55/90/311145590.db2.gz QEBXFNBIWHCWJN-UHFFFAOYSA-N 0 3 349.479 2.974 20 5 EFBDHN CC1CCN(C[C@H](O)CNc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000301573903 311145660 /nfs/dbraw/zinc/14/56/60/311145660.db2.gz ZCJMTBVKACRBQT-CYBMUJFWSA-N 0 3 327.812 2.753 20 5 EFBDHN Cc1cc(N(C)[C@H]2CCCN(C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000301839432 311161756 /nfs/dbraw/zinc/16/17/56/311161756.db2.gz XLJQUKAPZXJFLH-INIZCTEOSA-N 0 3 341.415 2.891 20 5 EFBDHN CCOc1cccc(N2CCC(CN3CCOCC3)CC2)c1[N+](=O)[O-] ZINC000302102036 311177963 /nfs/dbraw/zinc/17/79/63/311177963.db2.gz LQUAJRIGHOCKMJ-UHFFFAOYSA-N 0 3 349.431 2.542 20 5 EFBDHN Cc1cc(NCCNC(=O)c2ccco2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302176202 311182449 /nfs/dbraw/zinc/18/24/49/311182449.db2.gz MYWAKIYIXNBFFJ-UHFFFAOYSA-N 0 3 340.339 2.886 20 5 EFBDHN COC(=O)c1cc(NCCN2CC=C(C)CC2)cc(C)c1[N+](=O)[O-] ZINC000302183441 311183140 /nfs/dbraw/zinc/18/31/40/311183140.db2.gz ZQTXQVIDNUPPIE-UHFFFAOYSA-N 0 3 333.388 2.754 20 5 EFBDHN Cc1cccc(NC[C@@H](O)CN2CCc3ccccc3C2)c1[N+](=O)[O-] ZINC000302478427 311190893 /nfs/dbraw/zinc/19/08/93/311190893.db2.gz FWABTCSGLYCSBZ-QGZVFWFLSA-N 0 3 341.411 2.734 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN(CCCO)[C@@H]2CCCc3ccccc32)c1 ZINC000304736919 311213257 /nfs/dbraw/zinc/21/32/57/311213257.db2.gz AGJMNGBKKZGDBD-GOSISDBHSA-N 0 3 344.415 2.553 20 5 EFBDHN C[C@@H](NC(=O)[C@@H]1CNCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000325645745 311243338 /nfs/dbraw/zinc/24/33/38/311243338.db2.gz XJRCYPTUJRREGT-SJKOYZFVSA-N 0 3 325.368 2.659 20 5 EFBDHN CCN1C[C@H](C)N(CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C[C@H]1C ZINC000330559380 311321806 /nfs/dbraw/zinc/32/18/06/311321806.db2.gz IGCDXVODJZSDHL-CABCVRRESA-N 0 3 348.447 2.646 20 5 EFBDHN COc1cccc(C(=O)N(C)C2CCN(C(C)C)CC2)c1[N+](=O)[O-] ZINC000331218294 311361476 /nfs/dbraw/zinc/36/14/76/311361476.db2.gz HFNWUSKMIGZOMA-UHFFFAOYSA-N 0 3 335.404 2.548 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN[C@H]1CC(C)(C)OC1(C)C ZINC000331292618 311365251 /nfs/dbraw/zinc/36/52/51/311365251.db2.gz LKUXNWKQVZLSKW-ZDUSSCGKSA-N 0 3 335.404 2.777 20 5 EFBDHN C[C@H](C(=O)N1CC[C@@H](N2CCCCC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000332655252 311531745 /nfs/dbraw/zinc/53/17/45/311531745.db2.gz JEUMJOGNKRKHPZ-DZGCQCFKSA-N 0 3 349.406 2.924 20 5 EFBDHN CNC(=O)[C@@H]1CCC[C@@H]1N[C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417309773 312207009 /nfs/dbraw/zinc/20/70/09/312207009.db2.gz KAPOYHLJOYUMAV-PVAVHDDUSA-N 0 3 331.416 2.867 20 5 EFBDHN C[C@@H]1COCCN1CCN[C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417317977 312208349 /nfs/dbraw/zinc/20/83/49/312208349.db2.gz XTCWELBZRWJJNH-RDTXWAMCSA-N 0 3 333.432 2.673 20 5 EFBDHN COc1ccc2c(c1)ncc([N+](=O)[O-])c2N(C)C[C@H]1CCCN1C ZINC000420640204 312377700 /nfs/dbraw/zinc/37/77/00/312377700.db2.gz SOVVJRSTLMQQFH-GFCCVEGCSA-N 0 3 330.388 2.682 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NCc2ccc3c(c2)CNC3)c1 ZINC000423597627 312436455 /nfs/dbraw/zinc/43/64/55/312436455.db2.gz ULRILTKLGQMCNL-UHFFFAOYSA-N 0 3 341.367 2.527 20 5 EFBDHN C[C@H]1NCCN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])[C@H]1C ZINC000423614957 312439442 /nfs/dbraw/zinc/43/94/42/312439442.db2.gz QRJBSRXIOBWRAZ-ZJUUUORDSA-N 0 3 343.836 2.549 20 5 EFBDHN Cc1c(C(=O)N2C[C@@H](c3ccccc3F)[C@H](N)C2)cccc1[N+](=O)[O-] ZINC000424042376 312502039 /nfs/dbraw/zinc/50/20/39/312502039.db2.gz WUTZZFGKHOSLPK-GOEBONIOSA-N 0 3 343.358 2.609 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1C[C@H](N)Cc2ccccc21 ZINC000424084087 312509556 /nfs/dbraw/zinc/50/95/56/312509556.db2.gz XFGIZMNCTUGLOJ-CQSZACIVSA-N 0 3 325.368 2.742 20 5 EFBDHN C[C@@H]1CN(CCC2CCN(c3ccc([N+](=O)[O-])nc3)CC2)C[C@@H](C)O1 ZINC000426417593 312517988 /nfs/dbraw/zinc/51/79/88/312517988.db2.gz BQQROTGQCRUZKJ-HUUCEWRRSA-N 0 3 348.447 2.706 20 5 EFBDHN CS[C@H]1CN(c2ccnc3c2cccc3[N+](=O)[O-])C[C@@H]1N(C)C ZINC000432331676 312556976 /nfs/dbraw/zinc/55/69/76/312556976.db2.gz PIFSQGDPFOFLCF-GJZGRUSLSA-N 0 3 332.429 2.625 20 5 EFBDHN C[C@H]1COCCN1CCN[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433168297 312597279 /nfs/dbraw/zinc/59/72/79/312597279.db2.gz MGIKHNCTDZULCR-SUMWQHHRSA-N 0 3 333.432 2.628 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N[C@@H](CC(N)=O)c1ccccc1 ZINC000449343009 312686403 /nfs/dbraw/zinc/68/64/03/312686403.db2.gz HCWCUSVKEKLLHP-BBRMVZONSA-N 0 3 327.384 2.732 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CN1CC(C2CCCCC2)C1 ZINC000453007973 312845071 /nfs/dbraw/zinc/84/50/71/312845071.db2.gz DFIYWWBTHCONIG-MRXNPFEDSA-N 0 3 334.416 2.847 20 5 EFBDHN O=[N+]([O-])c1ccc(S(=O)(=O)CCN[C@H](C2CC2)C2CCC2)cc1 ZINC000453192122 312876945 /nfs/dbraw/zinc/87/69/45/312876945.db2.gz ITNYOVPEGYKYEN-INIZCTEOSA-N 0 3 338.429 2.537 20 5 EFBDHN CN(Cc1ccccc1)C1(CNC(=O)c2ccc([N+](=O)[O-])[nH]2)CCC1 ZINC000456116396 313030670 /nfs/dbraw/zinc/03/06/70/313030670.db2.gz DLGSZWJCQSTBBC-UHFFFAOYSA-N 0 3 342.399 2.707 20 5 EFBDHN CCOC(=O)c1cc(N2CCN(CC(C)C)CC2)ccc1[N+](=O)[O-] ZINC000469912465 313127483 /nfs/dbraw/zinc/12/74/83/313127483.db2.gz ZQOCSMIVGOAVES-UHFFFAOYSA-N 0 3 335.404 2.550 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCN(C[C@H]2CCOC2)CC1 ZINC000470184819 313130352 /nfs/dbraw/zinc/13/03/52/313130352.db2.gz XRBJDRWRDXFOLF-QIPHDZALSA-N 0 3 345.443 2.652 20 5 EFBDHN O=C(/C=C\c1ccc(F)cc1[N+](=O)[O-])N1CC[C@H](N2CCCCC2)C1 ZINC000491559890 313764667 /nfs/dbraw/zinc/76/46/67/313764667.db2.gz CAQSPLSOSKSSJB-WRLNGNIRSA-N 0 3 347.390 2.834 20 5 EFBDHN C[C@H](N[C@@]1(C)CCO[C@H]1C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000494276824 314568623 /nfs/dbraw/zinc/56/86/23/314568623.db2.gz LUPNKTPNBRQBIH-YHAQOWFVSA-N 0 3 341.795 2.732 20 5 EFBDHN COC(=O)N1CCC([C@H](C)NCc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000496668722 315151344 /nfs/dbraw/zinc/15/13/44/315151344.db2.gz SPLXDQFKCLNIFY-NSHDSACASA-N 0 3 339.367 2.690 20 5 EFBDHN CC(COC(=O)c1ccc(CNC(=O)OC(C)(C)C)cc1)[N+](=O)[O-] ZINC000496777193 315192093 /nfs/dbraw/zinc/19/20/93/315192093.db2.gz QPKHILKQNPTSPS-NSHDSACASA-N 0 3 338.360 2.533 20 5 EFBDHN C[C@H](CC(N)=O)NCc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000498372061 315403337 /nfs/dbraw/zinc/40/33/37/315403337.db2.gz GYPLXJKFWHWRLQ-CYBMUJFWSA-N 0 3 342.399 2.716 20 5 EFBDHN C[C@H](N[C@@H]1CSC[C@H]1C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000507263515 315480600 /nfs/dbraw/zinc/48/06/00/315480600.db2.gz BMIOUJVRVRVCNZ-VYUIOLGVSA-N 0 3 343.836 2.916 20 5 EFBDHN CC(C)(C(=O)N1C[C@H](N)Cc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000518169338 315798994 /nfs/dbraw/zinc/79/89/94/315798994.db2.gz RZAWLXROBTWMLP-OAHLLOKOSA-N 0 3 339.395 2.789 20 5 EFBDHN CCCC1(CNCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000521863294 316048115 /nfs/dbraw/zinc/04/81/15/316048115.db2.gz XKARPAZAMCWTQQ-UHFFFAOYSA-N 0 3 340.445 2.929 20 5 EFBDHN C[C@@H]1CCN(CCNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000524771143 316173560 /nfs/dbraw/zinc/17/35/60/316173560.db2.gz FKIIEZIOMDTSPC-SNVBAGLBSA-N 0 3 326.784 2.712 20 5 EFBDHN C[C@H]1CCN(CCNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000524771142 316173609 /nfs/dbraw/zinc/17/36/09/316173609.db2.gz FKIIEZIOMDTSPC-JTQLQIEISA-N 0 3 326.784 2.712 20 5 EFBDHN COc1ccc(CN(C)C)cc1NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000525675930 316225665 /nfs/dbraw/zinc/22/56/65/316225665.db2.gz OPOJWKVGOUDDFK-UHFFFAOYSA-N 0 3 343.383 2.846 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(N2CC[C@H](N3CCN(C(C)C)CC3)C2)c1 ZINC000531836325 317321370 /nfs/dbraw/zinc/32/13/70/317321370.db2.gz SGMCAQHBFFGXNJ-INIZCTEOSA-N 0 3 332.448 2.508 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H](O)COc1ccccc1 ZINC000532198685 317368877 /nfs/dbraw/zinc/36/88/77/317368877.db2.gz MQKBLYAPAAZHRO-GOEBONIOSA-N 0 3 330.384 2.994 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCN(C[C@H]3C[C@@H]3c3ccccc3)CC2)cn1 ZINC000535785712 317611351 /nfs/dbraw/zinc/61/13/51/317611351.db2.gz BOOTXQAUDMGIJU-SJLPKXTDSA-N 0 3 338.411 2.916 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H]1CCC[C@H](S(C)(=O)=O)C1 ZINC000537985031 317687155 /nfs/dbraw/zinc/68/71/55/317687155.db2.gz QBERBCNFOFJBGY-YDHLFZDLSA-N 0 3 340.445 2.910 20 5 EFBDHN Cc1c([C@H](C)N[C@H]2CCC[C@@H](S(C)(=O)=O)C2)cccc1[N+](=O)[O-] ZINC000537981484 317687261 /nfs/dbraw/zinc/68/72/61/317687261.db2.gz NMVCJWUTBIFQIE-MELADBBJSA-N 0 3 340.445 2.910 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CNCc1cccc(Cl)c1 ZINC000551558965 318210088 /nfs/dbraw/zinc/21/00/88/318210088.db2.gz RAAXYNJPPYVGLC-CQSZACIVSA-N 0 3 336.775 2.778 20 5 EFBDHN Cc1ccc2c(c1)CC[C@H]2NC[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000556860029 318415969 /nfs/dbraw/zinc/41/59/69/318415969.db2.gz TXZWKWJWHVWNFK-QFBILLFUSA-N 0 3 342.395 2.920 20 5 EFBDHN C[C@H](C(=O)N1C[C@@H](N2CCCC2)C[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000557118338 318427914 /nfs/dbraw/zinc/42/79/14/318427914.db2.gz YHCJSZLGQNHUJH-ZQIUZPCESA-N 0 3 331.416 2.784 20 5 EFBDHN COC(=O)CC1(NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)CCCCC1 ZINC000562541326 318661232 /nfs/dbraw/zinc/66/12/32/318661232.db2.gz XQYHHNNVOCJWMW-UHFFFAOYSA-N 0 3 346.387 2.827 20 5 EFBDHN Cc1ccc2c(c1)CC[C@@H]2NC[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000563748585 318813565 /nfs/dbraw/zinc/81/35/65/318813565.db2.gz VSACKMPHKQTIBG-WBVHZDCISA-N 0 3 342.395 2.920 20 5 EFBDHN CC(C)(C)[C@@H]1NC(=O)CC[C@H]1N[C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000566475082 319082061 /nfs/dbraw/zinc/08/20/61/319082061.db2.gz JTYUFAYKWZKELT-CKEIUWERSA-N 0 3 331.416 2.865 20 5 EFBDHN Cc1ccc(CN2CCC[C@H](N3CCOCC3)CC2)cc1[N+](=O)[O-] ZINC000567179650 319146661 /nfs/dbraw/zinc/14/66/61/319146661.db2.gz NROSLARFTSWYTH-KRWDZBQOSA-N 0 3 333.432 2.590 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)[C@H]2CNCc3ccccc32)cc1[N+](=O)[O-] ZINC000568390430 319279378 /nfs/dbraw/zinc/27/93/78/319279378.db2.gz MUTRUIITOKUGCE-GUYCJALGSA-N 0 3 339.395 2.967 20 5 EFBDHN CC(C)C[C@@H](CN[C@H]1CCc2c1cccc2[N+](=O)[O-])N1CCOCC1 ZINC000568780306 319318817 /nfs/dbraw/zinc/31/88/17/319318817.db2.gz WIKLXTFATWPLRJ-YJBOKZPZSA-N 0 3 347.459 2.919 20 5 EFBDHN C[C@]1(NC(=O)c2ccc([N+](=O)[O-])cc2)CCN(Cc2ccccc2)C1 ZINC000568891546 319329113 /nfs/dbraw/zinc/32/91/13/319329113.db2.gz UYQSSOCZMFAWGN-IBGZPJMESA-N 0 3 339.395 2.989 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN[C@H]1CCc2ccc(F)cc21 ZINC000571516013 319581190 /nfs/dbraw/zinc/58/11/90/319581190.db2.gz GVHUGURDMKAXIP-HOCLYGCPSA-N 0 3 346.358 2.751 20 5 EFBDHN C[C@H](C(=O)NC[C@H](C)N1CCC(C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000573654080 319785226 /nfs/dbraw/zinc/78/52/26/319785226.db2.gz DKNQEVILYRMNDR-GJZGRUSLSA-N 0 3 333.432 2.935 20 5 EFBDHN Cc1noc([C@@H]2CC[C@H](CN[C@@H]3CCc4c3cccc4[N+](=O)[O-])O2)n1 ZINC000576530245 320024378 /nfs/dbraw/zinc/02/43/78/320024378.db2.gz VMWVVFNFDRECFG-XFJVYGCCSA-N 0 3 344.371 2.783 20 5 EFBDHN CCC(C)(C)[C@@H](C)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000577351594 320101973 /nfs/dbraw/zinc/10/19/73/320101973.db2.gz VKHCURSHGPDUJG-GFCCVEGCSA-N 0 3 328.434 2.783 20 5 EFBDHN C[C@H]1CC[C@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000577385500 320106219 /nfs/dbraw/zinc/10/62/19/320106219.db2.gz HUUFZJUKEWAEJV-JOCQHMNTSA-N 0 3 326.418 2.537 20 5 EFBDHN Cc1cccc(OC[C@@H](O)CN[C@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000577963420 320160480 /nfs/dbraw/zinc/16/04/80/320160480.db2.gz ZCIPBBRCQFIIEN-KSSFIOAISA-N 0 3 342.395 2.920 20 5 EFBDHN CCC[C@H](NC[C@@H]1CC[C@H](C(=O)N(C)C)O1)c1cccc([N+](=O)[O-])c1 ZINC000183471427 323336860 /nfs/dbraw/zinc/33/68/60/323336860.db2.gz NYIHFTOFASGZJN-YESZJQIVSA-N 0 3 349.431 2.661 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@H](CCO)C1CCCCC1 ZINC000183713231 323345993 /nfs/dbraw/zinc/34/59/93/323345993.db2.gz GMOKKTXWZUZTGM-MRXNPFEDSA-N 0 3 349.431 2.763 20 5 EFBDHN C[C@H](CN1CCCCC1)NC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000184923709 323378223 /nfs/dbraw/zinc/37/82/23/323378223.db2.gz ZLSGLFHMKIBZJB-OLZOCXBDSA-N 0 3 337.395 2.828 20 5 EFBDHN Cc1cccc2c1CC[C@H]2NC[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000578859592 323826635 /nfs/dbraw/zinc/82/66/35/323826635.db2.gz FFJWFZRPNPTCHY-WMLDXEAASA-N 0 3 342.395 2.920 20 5 EFBDHN CN(C)CCn1cc(Nc2ccc([N+](=O)[O-])c3cnccc23)cn1 ZINC000141125219 473251836 /nfs/dbraw/zinc/25/18/36/473251836.db2.gz MLRZPSMFHNPQRM-UHFFFAOYSA-N 0 3 326.360 2.645 20 5 EFBDHN COc1ccc(OCCN2CCSC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000190410937 473263915 /nfs/dbraw/zinc/26/39/15/473263915.db2.gz OGDUFKAEGJIPQA-GFCCVEGCSA-N 0 3 326.418 2.667 20 5 EFBDHN CN(C)CCN(Cc1ccccc1)C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000124585504 473268470 /nfs/dbraw/zinc/26/84/70/473268470.db2.gz TYFJVHMFRRTJFS-UHFFFAOYSA-N 0 3 343.387 2.586 20 5 EFBDHN CN(C)C[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000124817953 473307512 /nfs/dbraw/zinc/30/75/12/473307512.db2.gz LAPDSMKBJHTLPN-QGZVFWFLSA-N 0 3 345.374 2.696 20 5 EFBDHN Cc1ccc(C(=O)NCCCCN2C[C@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000083026342 473312718 /nfs/dbraw/zinc/31/27/18/473312718.db2.gz FUTDPFISTPECFV-GJZGRUSLSA-N 0 3 349.431 2.522 20 5 EFBDHN Cc1c(C(=O)NCCCCN2C[C@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000083026345 473312909 /nfs/dbraw/zinc/31/29/09/473312909.db2.gz UNYJSLXWKHKROB-KBPBESRZSA-N 0 3 349.431 2.522 20 5 EFBDHN Cc1cc(C(=O)NCCCCN2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000083026500 473312926 /nfs/dbraw/zinc/31/29/26/473312926.db2.gz DKLOJAGREUQPBM-GASCZTMLSA-N 0 3 349.431 2.522 20 5 EFBDHN Cc1cc(C(=O)NCCCCN2C[C@@H](C)O[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000083026502 473313252 /nfs/dbraw/zinc/31/32/52/473313252.db2.gz DKLOJAGREUQPBM-HUUCEWRRSA-N 0 3 349.431 2.522 20 5 EFBDHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1ccccc1[N+](=O)[O-] ZINC000112821431 473317648 /nfs/dbraw/zinc/31/76/48/473317648.db2.gz SIYWJLAJFVNLKP-UHFFFAOYSA-N 0 3 345.374 2.938 20 5 EFBDHN CC(C)[C@@H](CCO)N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000162259679 473322807 /nfs/dbraw/zinc/32/28/07/473322807.db2.gz NUWRHZSXVPYYMR-ZWNOBZJWSA-N 0 3 343.811 2.572 20 5 EFBDHN CNC(=O)[C@H]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000125056458 473348720 /nfs/dbraw/zinc/34/87/20/473348720.db2.gz AIHHIKZNEWGSPK-AWEZNQCLSA-N 0 3 343.383 2.813 20 5 EFBDHN Cc1ccc(CN(C)C)cc1NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000177330394 473356211 /nfs/dbraw/zinc/35/62/11/473356211.db2.gz LKIIQIMMTBPKOC-UHFFFAOYSA-N 0 3 343.383 2.982 20 5 EFBDHN C[C@@H](C(=O)N(C)C[C@H]1CCCN(C)C1)c1ccc([N+](=O)[O-])cc1F ZINC000185246600 473376638 /nfs/dbraw/zinc/37/66/38/473376638.db2.gz JWLAIZVJSCUGDX-OLZOCXBDSA-N 0 3 337.395 2.638 20 5 EFBDHN Cc1ccccc1C1(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])CC1 ZINC000592140092 478791883 /nfs/dbraw/zinc/79/18/83/478791883.db2.gz YZIBOVPFNNGZDZ-OAHLLOKOSA-N 0 3 342.395 2.922 20 5 EFBDHN O=C(NCc1ccccc1)[C@@H]1CCN(Cc2cccc([N+](=O)[O-])c2)C1 ZINC000592154760 478800636 /nfs/dbraw/zinc/80/06/36/478800636.db2.gz JFHITMBQUOJNKM-QGZVFWFLSA-N 0 3 339.395 2.733 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1N1CCN(C2CCN(C)CC2)[C@H](C)C1 ZINC000505704867 478879352 /nfs/dbraw/zinc/87/93/52/478879352.db2.gz GHUATRKUMWPOAI-OAHLLOKOSA-N 0 3 332.448 2.508 20 5 EFBDHN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCN(c2ccncc2)CC1 ZINC000008097875 471661621 /nfs/dbraw/zinc/66/16/21/471661621.db2.gz PVDHZAJCQWONLP-UHFFFAOYSA-N 0 3 346.774 2.606 20 5 EFBDHN Cc1ccc([C@H](CNC(=O)c2ccccc2[N+](=O)[O-])N(C)C)cc1 ZINC000010017879 471726248 /nfs/dbraw/zinc/72/62/48/471726248.db2.gz DWPPVSHLGOOQHW-KRWDZBQOSA-N 0 3 327.384 2.936 20 5 EFBDHN Cc1ccc([C@@H](CNC(=O)c2cccc([N+](=O)[O-])c2)N(C)C)cc1 ZINC000010017822 471726355 /nfs/dbraw/zinc/72/63/55/471726355.db2.gz RRSZAOKZHIQJAF-QGZVFWFLSA-N 0 3 327.384 2.936 20 5 EFBDHN COc1ccc(C(=O)NCc2ccc(CN(C)C)cc2)cc1[N+](=O)[O-] ZINC000015140325 471891626 /nfs/dbraw/zinc/89/16/26/471891626.db2.gz ACPVSWSPZTWUMI-UHFFFAOYSA-N 0 3 343.383 2.595 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000016599683 471943317 /nfs/dbraw/zinc/94/33/17/471943317.db2.gz NBTMSZDEFJWEBM-INIZCTEOSA-N 0 3 343.383 2.636 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000067022406 471982966 /nfs/dbraw/zinc/98/29/66/471982966.db2.gz MBVPSLSRJADTOV-KRWDZBQOSA-N 0 3 327.384 2.936 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000067140050 471995954 /nfs/dbraw/zinc/99/59/54/471995954.db2.gz IGLLXLLHBKOBGS-KRWDZBQOSA-N 0 3 341.411 2.806 20 5 EFBDHN Cc1ccc([C@H](CNC(=O)c2ccc([N+](=O)[O-])s2)N(C)C)cc1 ZINC000067269056 472012767 /nfs/dbraw/zinc/01/27/67/472012767.db2.gz DQAREKLUQOSQRO-ZDUSSCGKSA-N 0 3 333.413 2.997 20 5 EFBDHN CC1CCN(C[C@H](O)CNc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000067373278 472024680 /nfs/dbraw/zinc/02/46/80/472024680.db2.gz UTYTXLUYXBSGDA-CYBMUJFWSA-N 0 3 327.812 2.753 20 5 EFBDHN CN(C)Cc1ccccc1NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000024812013 472068706 /nfs/dbraw/zinc/06/87/06/472068706.db2.gz JJBHLMGZDQVZSX-UHFFFAOYSA-N 0 3 329.356 2.674 20 5 EFBDHN Cc1ncc([N+](=O)[O-])cc1C(=O)NCC(C)(C)N1CCC[C@H](C)C1 ZINC000054286707 472072958 /nfs/dbraw/zinc/07/29/58/472072958.db2.gz XGFLFTIOVWLDOB-LBPRGKRZSA-N 0 3 334.420 2.539 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)CN2C[C@H](C)C[C@H](C)C2)c1 ZINC000067806624 472091992 /nfs/dbraw/zinc/09/19/92/472091992.db2.gz ULZMMYUERSUDCY-HZSPNIEDSA-N 0 3 349.431 2.700 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCN(CC(C)C)CC1 ZINC000041894491 472094132 /nfs/dbraw/zinc/09/41/32/472094132.db2.gz HPUQPEWABSVVHS-UHFFFAOYSA-N 0 3 348.447 2.505 20 5 EFBDHN Cc1ccccc1CN(C)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000026712106 472145744 /nfs/dbraw/zinc/14/57/44/472145744.db2.gz BTTGMSZZRQXCOP-KRWDZBQOSA-N 0 3 330.384 2.775 20 5 EFBDHN CNc1ccc(C(=O)N2CCC[C@@H]2CN2CCCCC2)cc1[N+](=O)[O-] ZINC000075506432 472147698 /nfs/dbraw/zinc/14/76/98/472147698.db2.gz MCQOCMGFEMRKLL-OAHLLOKOSA-N 0 3 346.431 2.727 20 5 EFBDHN CCCc1[nH]nc(C(=O)Nc2cccc(CN(C)C)c2)c1[N+](=O)[O-] ZINC000075609884 472168331 /nfs/dbraw/zinc/16/83/31/472168331.db2.gz VOWCQYQPSGPRCG-UHFFFAOYSA-N 0 3 331.376 2.584 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H](N(C)C)C1 ZINC000068341922 472172431 /nfs/dbraw/zinc/17/24/31/472172431.db2.gz RQRKAUGGWYPPPG-OCCSQVGLSA-N 0 3 337.445 2.628 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCC(CN2CCOCC2)CC1 ZINC000075639731 472175341 /nfs/dbraw/zinc/17/53/41/472175341.db2.gz IHDUGAZMSMTIEQ-OAHLLOKOSA-N 0 3 333.432 2.700 20 5 EFBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC(CN2CCOCC2)CC1 ZINC000075639727 472175857 /nfs/dbraw/zinc/17/58/57/472175857.db2.gz IHDUGAZMSMTIEQ-HNNXBMFYSA-N 0 3 333.432 2.700 20 5 EFBDHN CSc1ccc(C(=O)N[C@@H](C)CN2CCCCC2)cc1[N+](=O)[O-] ZINC000027744849 472193676 /nfs/dbraw/zinc/19/36/76/472193676.db2.gz CWBWONWFJROXSX-LBPRGKRZSA-N 0 3 337.445 2.921 20 5 EFBDHN COc1ccc(C(=O)NC[C@H](C)N2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000043084801 472196811 /nfs/dbraw/zinc/19/68/11/472196811.db2.gz VQQFTMFHGKAGNI-OLZOCXBDSA-N 0 3 335.404 2.596 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCN(c2ccncc2)CC1 ZINC000043149657 472205943 /nfs/dbraw/zinc/20/59/43/472205943.db2.gz IZVOPWDZUYTLJW-UHFFFAOYSA-N 0 3 341.371 2.652 20 5 EFBDHN Cc1ccc(NC(=O)N2CCN(c3ccncc3)CC2)cc1[N+](=O)[O-] ZINC000043148242 472206192 /nfs/dbraw/zinc/20/61/92/472206192.db2.gz SFVCDXQRHJQFSS-UHFFFAOYSA-N 0 3 341.371 2.652 20 5 EFBDHN Cc1c(C(=O)N[C@H](C)CN2C[C@@H](C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000055748362 472232538 /nfs/dbraw/zinc/23/25/38/472232538.db2.gz HGDNXQRYDKJWKL-MELADBBJSA-N 0 3 333.432 2.999 20 5 EFBDHN CCn1ccc(CN(C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000616785313 479975938 /nfs/dbraw/zinc/97/59/38/479975938.db2.gz NJPBTTOBBGLZAB-UHFFFAOYSA-N 0 3 330.388 2.877 20 5 EFBDHN CCN1CCC(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)CC1 ZINC000029607056 472284489 /nfs/dbraw/zinc/28/44/89/472284489.db2.gz CRIWKXOBTRTGDJ-GFCCVEGCSA-N 0 3 337.445 2.676 20 5 EFBDHN C[C@H](NC(=O)NC1CCN(C2CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000056382383 472314259 /nfs/dbraw/zinc/31/42/59/472314259.db2.gz GRPZQVJBBPZQMB-LBPRGKRZSA-N 0 3 332.404 2.582 20 5 EFBDHN CN(C)CCN(Cc1ccco1)C(=O)c1ccc([N+](=O)[O-])cc1F ZINC000088250814 472352056 /nfs/dbraw/zinc/35/20/56/472352056.db2.gz ANLLRMJXDYVSOJ-UHFFFAOYSA-N 0 3 335.335 2.531 20 5 EFBDHN CN(C)CCN(Cc1ccco1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000088330051 472356692 /nfs/dbraw/zinc/35/66/92/472356692.db2.gz IMHBABNWTFETIU-UHFFFAOYSA-N 0 3 332.360 2.784 20 5 EFBDHN CCN1CCC[C@@H]1CNC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000044997515 472362467 /nfs/dbraw/zinc/36/24/67/472362467.db2.gz MGTYIZIEZMHUEH-TZMCWYRMSA-N 0 3 337.445 2.676 20 5 EFBDHN CC(C)CN1CCCC[C@H]1CNC(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000154170356 472397100 /nfs/dbraw/zinc/39/71/00/472397100.db2.gz KERONHBJUYLQCD-AWEZNQCLSA-N 0 3 337.395 2.974 20 5 EFBDHN COc1cc(CN[C@@H](CO)[C@H](C)c2ccccc2)c([N+](=O)[O-])cc1F ZINC000613390001 479985806 /nfs/dbraw/zinc/98/58/06/479985806.db2.gz PNAFICCZFIYTSS-WBMJQRKESA-N 0 3 348.374 2.997 20 5 EFBDHN O=[N+]([O-])c1ccc(CNC2CCN(Cc3cccnc3)CC2)cc1 ZINC000089513244 472452557 /nfs/dbraw/zinc/45/25/57/472452557.db2.gz KRJGVGCNEZZXPN-UHFFFAOYSA-N 0 3 326.400 2.744 20 5 EFBDHN COc1ccc(C(=O)NC[C@H](C)N2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000032732210 472458762 /nfs/dbraw/zinc/45/87/62/472458762.db2.gz VQQFTMFHGKAGNI-STQMWFEESA-N 0 3 335.404 2.596 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)ccc1NC1CCN([C@H]2CCOC2)CC1 ZINC000089602714 472467892 /nfs/dbraw/zinc/46/78/92/472467892.db2.gz PIVYTIYOIKCGLE-ZDUSSCGKSA-N 0 3 325.796 2.913 20 5 EFBDHN CCOc1cc(NC2CCN([C@@H]3CCOC3)CC2)ccc1[N+](=O)[O-] ZINC000089602845 472468068 /nfs/dbraw/zinc/46/80/68/472468068.db2.gz WEAVWWYWYHIMRD-OAHLLOKOSA-N 0 3 335.404 2.659 20 5 EFBDHN COc1ccc(C(=O)N[C@H](CN(C)C)c2ccccc2)cc1[N+](=O)[O-] ZINC000032781231 472468333 /nfs/dbraw/zinc/46/83/33/472468333.db2.gz REOUHLOVLCMXKR-OAHLLOKOSA-N 0 3 343.383 2.636 20 5 EFBDHN CN(C)[C@@H](CNc1nc2ccccn2c1[N+](=O)[O-])Cc1ccccc1 ZINC000032806315 472469013 /nfs/dbraw/zinc/46/90/13/472469013.db2.gz XKCWJWPQWFMWDZ-OAHLLOKOSA-N 0 3 339.399 2.827 20 5 EFBDHN O=[N+]([O-])c1ccccc1NC[C@H]1C[C@H](O)CN1Cc1ccccc1 ZINC000089644898 472477950 /nfs/dbraw/zinc/47/79/50/472477950.db2.gz PRHDQUYDMNGAPB-CVEARBPZSA-N 0 3 327.384 2.642 20 5 EFBDHN O=[N+]([O-])c1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)c(F)c1 ZINC000032923423 472481597 /nfs/dbraw/zinc/48/15/97/472481597.db2.gz RPFBSKKWMUOBNC-MRXNPFEDSA-N 0 3 345.374 2.565 20 5 EFBDHN Cc1cc(C(=O)NCc2cccc(CN(C)C)c2)ccc1[N+](=O)[O-] ZINC000033083738 472495290 /nfs/dbraw/zinc/49/52/90/472495290.db2.gz XDATXHDVSWBLAI-UHFFFAOYSA-N 0 3 327.384 2.895 20 5 EFBDHN CN(C)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000077303535 472497140 /nfs/dbraw/zinc/49/71/40/472497140.db2.gz LHFCTXGOCBNYRD-INIZCTEOSA-N 0 3 331.347 2.767 20 5 EFBDHN Cc1c([C@H](C)NCc2cccc(OCC(N)=O)c2)cccc1[N+](=O)[O-] ZINC000128855875 472505022 /nfs/dbraw/zinc/50/50/22/472505022.db2.gz OHBOWIXAWIAGJB-ZDUSSCGKSA-N 0 3 343.383 2.618 20 5 EFBDHN CCc1ccc(C(=O)N2CCC[C@@H]3CN(C)CC[C@@H]32)cc1[N+](=O)[O-] ZINC000118987794 472517607 /nfs/dbraw/zinc/51/76/07/472517607.db2.gz DAOMDSNHTOCMJG-CVEARBPZSA-N 0 3 331.416 2.714 20 5 EFBDHN O=[N+]([O-])c1cc(F)ccc1NC[C@H](O)CN1CCc2ccccc2C1 ZINC000046479056 472562598 /nfs/dbraw/zinc/56/25/98/472562598.db2.gz URPLGGWHQDMGCU-INIZCTEOSA-N 0 3 345.374 2.565 20 5 EFBDHN CN(C)CCOc1ccc(NC(=O)c2ccccc2[N+](=O)[O-])cc1 ZINC000046722081 472589720 /nfs/dbraw/zinc/58/97/20/472589720.db2.gz ZVFAYSKIOGDRRR-UHFFFAOYSA-N 0 3 329.356 2.788 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CN1C1CC1 ZINC000119856273 472592785 /nfs/dbraw/zinc/59/27/85/472592785.db2.gz FUTXCVBDHOCOSE-UWVGGRQHSA-N 0 3 338.795 2.995 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CN1C1CC1 ZINC000119856597 472592816 /nfs/dbraw/zinc/59/28/16/472592816.db2.gz FUTXCVBDHOCOSE-VHSXEESVSA-N 0 3 338.795 2.995 20 5 EFBDHN Cc1nn(C)c(N[C@@H]2CCCN(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000071952821 472625079 /nfs/dbraw/zinc/62/50/79/472625079.db2.gz RXBLOMLMDKERRJ-OAHLLOKOSA-N 0 3 329.404 2.713 20 5 EFBDHN COc1ccccc1[C@H]1CCCN1CCn1cc([N+](=O)[O-])ccc1=O ZINC000090525519 472629979 /nfs/dbraw/zinc/62/99/79/472629979.db2.gz JYEMQPJYRDAAKX-MRXNPFEDSA-N 0 3 343.383 2.602 20 5 EFBDHN CCOc1ccc([C@H](C)NCCn2cc([N+](=O)[O-])cn2)cc1OCC ZINC000090538975 472631892 /nfs/dbraw/zinc/63/18/92/472631892.db2.gz GGUOEXBQUJUFKB-ZDUSSCGKSA-N 0 3 348.403 2.940 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN[C@H](C[C@H]2CCOC2)c2ccccc2)c1 ZINC000090539660 472632059 /nfs/dbraw/zinc/63/20/59/472632059.db2.gz DMTCSQFKLMQQOD-RHSMWYFYSA-N 0 3 330.388 2.549 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN[C@@H](C[C@@H]2CCOC2)c2ccccc2)c1 ZINC000090539657 472632633 /nfs/dbraw/zinc/63/26/33/472632633.db2.gz DMTCSQFKLMQQOD-YOEHRIQHSA-N 0 3 330.388 2.549 20 5 EFBDHN CC[C@H]1c2ccccc2CCN1CCn1cc([N+](=O)[O-])ccc1=O ZINC000090549329 472633066 /nfs/dbraw/zinc/63/30/66/472633066.db2.gz NKIUKKUDCOTLRE-KRWDZBQOSA-N 0 3 327.384 2.766 20 5 EFBDHN Cc1ccc(C(C)(C)CN(C)CCn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC000090550852 472634026 /nfs/dbraw/zinc/63/40/26/472634026.db2.gz WGSIKBLMYIPBGR-UHFFFAOYSA-N 0 3 343.427 2.975 20 5 EFBDHN CN(CC1CCN(C)CC1)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000103454011 472635852 /nfs/dbraw/zinc/63/58/52/472635852.db2.gz YDISHTVTOYBRTG-UHFFFAOYSA-N 0 3 346.431 2.583 20 5 EFBDHN CC[C@H](NC(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000090610778 472642163 /nfs/dbraw/zinc/64/21/63/472642163.db2.gz KPGWMQQSOZCRFE-MRRJBJDNSA-N 0 3 346.431 2.970 20 5 EFBDHN C[C@H](SCCN(C)C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000120227219 472652966 /nfs/dbraw/zinc/65/29/66/472652966.db2.gz LWBIIIIVVLCWFK-VIFPVBQESA-N 0 3 331.825 2.870 20 5 EFBDHN CCO[C@@H]1CCCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000156058043 472660735 /nfs/dbraw/zinc/66/07/35/472660735.db2.gz NPFMCGIPKUWKDN-OAHLLOKOSA-N 0 3 335.404 2.733 20 5 EFBDHN C[C@@H]1CCCN(CCNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000047148523 472661830 /nfs/dbraw/zinc/66/18/30/472661830.db2.gz IGHJJQJXDUKFJH-CYBMUJFWSA-N 0 3 346.431 2.631 20 5 EFBDHN CCOC1CCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000060485109 472662074 /nfs/dbraw/zinc/66/20/74/472662074.db2.gz RKHOGZWFGHREBQ-UHFFFAOYSA-N 0 3 335.404 2.733 20 5 EFBDHN CCOc1ccc(C(=O)NCC(C)(C)N2CCCCC2)cc1[N+](=O)[O-] ZINC000060500091 472662447 /nfs/dbraw/zinc/66/24/47/472662447.db2.gz NGKUVBXMHMXNHP-UHFFFAOYSA-N 0 3 349.431 2.988 20 5 EFBDHN C[C@H](NCCc1cccc([N+](=O)[O-])c1)c1ccc(S(C)(=O)=O)cc1 ZINC000090909972 472664278 /nfs/dbraw/zinc/66/42/78/472664278.db2.gz IBENAPWLBUKRMA-ZDUSSCGKSA-N 0 3 348.424 2.892 20 5 EFBDHN CN(C)Cc1ccccc1CNC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000061231903 472694752 /nfs/dbraw/zinc/69/47/52/472694752.db2.gz VAKCCXKJWRIKGE-FMIVXFBMSA-N 0 3 339.395 2.986 20 5 EFBDHN CN(C)CCN(Cc1ccco1)C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000156351752 472696148 /nfs/dbraw/zinc/69/61/48/472696148.db2.gz FUAFOHJASKDIMZ-UHFFFAOYSA-N 0 3 345.399 2.711 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@H]2CCN(CCCCCn3cccn3)C2)nc1 ZINC000072665220 472696853 /nfs/dbraw/zinc/69/68/53/472696853.db2.gz ZRJNQMXOKFLOEF-HNNXBMFYSA-N 0 3 344.419 2.543 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(CN(C)C)c1 ZINC000047453604 472715562 /nfs/dbraw/zinc/71/55/62/472715562.db2.gz TUQGPUVLARZQCY-UHFFFAOYSA-N 0 3 329.356 2.917 20 5 EFBDHN C[C@H](CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)N(C)C1CC1 ZINC000120589395 472716097 /nfs/dbraw/zinc/71/60/97/472716097.db2.gz OFGZFKTWURLVKR-CYBMUJFWSA-N 0 3 346.431 2.752 20 5 EFBDHN C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000120615535 472717456 /nfs/dbraw/zinc/71/74/56/472717456.db2.gz WKSJSZZNUJTDPV-WBMJQRKESA-N 0 3 346.431 2.581 20 5 EFBDHN COc1cc(CNC[C@H](C)Cn2ccnc2C)c([N+](=O)[O-])cc1OC ZINC000105442944 472752775 /nfs/dbraw/zinc/75/27/75/472752775.db2.gz AZRKSHFSLNFBMA-LBPRGKRZSA-N 0 3 348.403 2.543 20 5 EFBDHN CCN1CCC(N(C)C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)CC1 ZINC000105599379 472761142 /nfs/dbraw/zinc/76/11/42/472761142.db2.gz BOLMUJNTIMNJDS-UHFFFAOYSA-N 0 3 330.388 2.632 20 5 EFBDHN NC(=O)[C@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000157071112 472782166 /nfs/dbraw/zinc/78/21/66/472782166.db2.gz ZYEHYRMPXAFGKV-JTQLQIEISA-N 0 3 349.774 2.815 20 5 EFBDHN CCc1nn(C)c(N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000091739539 472800174 /nfs/dbraw/zinc/80/01/74/472800174.db2.gz BDDLKVLPXRTQRG-HIFRSBDPSA-N 0 3 343.431 2.966 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN(C)CCc1nccs1 ZINC000157428335 472820052 /nfs/dbraw/zinc/82/00/52/472820052.db2.gz VUUNJZJYEFCUHE-UHFFFAOYSA-N 0 3 348.428 2.863 20 5 EFBDHN CN(Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C[C@H]1CCC[C@@H]1O ZINC000091898706 472823980 /nfs/dbraw/zinc/82/39/80/472823980.db2.gz CTWKFLUGALDYDI-PBHICJAKSA-N 0 3 344.415 2.588 20 5 EFBDHN CN(C)C[C@H]1CN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)CCO1 ZINC000133673097 472829876 /nfs/dbraw/zinc/82/98/76/472829876.db2.gz FZERDYVOVZROMD-AWEZNQCLSA-N 0 3 337.420 2.539 20 5 EFBDHN CC(C)C(=O)NC1CCN(CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000079198379 472830916 /nfs/dbraw/zinc/83/09/16/472830916.db2.gz LTVGTXQHFPGQHI-UHFFFAOYSA-N 0 3 349.431 2.600 20 5 EFBDHN O=[N+]([O-])c1ccc(CN2CCC(CCN3CCOCC3)CC2)cc1 ZINC000064344360 472844848 /nfs/dbraw/zinc/84/48/48/472844848.db2.gz ZHJBGWYSATUXLJ-UHFFFAOYSA-N 0 3 333.432 2.529 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C/CN1CCC(CN2CCOCC2)CC1 ZINC000134078479 472871502 /nfs/dbraw/zinc/87/15/02/472871502.db2.gz FIUCOIORIZAYQW-HWKANZROSA-N 0 3 345.443 2.652 20 5 EFBDHN COc1cc(CSCCN(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000157914768 472873405 /nfs/dbraw/zinc/87/34/05/472873405.db2.gz XQNBNURCOYQAPM-UHFFFAOYSA-N 0 3 336.360 3.000 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCN(c3ccncc3)CC2)c2ncccc12 ZINC000073861657 472889330 /nfs/dbraw/zinc/88/93/30/472889330.db2.gz QMLZJDQVUGVTHS-UHFFFAOYSA-N 0 3 335.367 2.865 20 5 EFBDHN Cc1nn(C)c(NC[C@@H]2CCCN(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000065202067 472907782 /nfs/dbraw/zinc/90/77/82/472907782.db2.gz LOZFJPDYJHUWQD-INIZCTEOSA-N 0 3 343.431 2.961 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN(C)C[C@@H]1CCCCO1 ZINC000121841626 472927290 /nfs/dbraw/zinc/92/72/90/472927290.db2.gz JRSHFBOOXLERCK-HNNXBMFYSA-N 0 3 335.404 2.733 20 5 EFBDHN C[C@H]1CCCN(CCNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000134607606 472937139 /nfs/dbraw/zinc/93/71/39/472937139.db2.gz WLEJHZIWJQLZFP-NSHDSACASA-N 0 3 325.796 2.710 20 5 EFBDHN C[C@@H](CNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)N(C)C1CC1 ZINC000080117168 472978981 /nfs/dbraw/zinc/97/89/81/472978981.db2.gz JJMAVSSNBLTIKM-LBPRGKRZSA-N 0 3 334.420 2.612 20 5 EFBDHN O=C(N[C@H]1CCN(C2CCCC2)C1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000134865838 472979123 /nfs/dbraw/zinc/97/91/23/472979123.db2.gz MNNUZQGVTNNEJN-ZDUSSCGKSA-N 0 3 337.807 2.995 20 5 EFBDHN C[C@H](CNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)N(C)C1CC1 ZINC000080117174 472979039 /nfs/dbraw/zinc/97/90/39/472979039.db2.gz JJMAVSSNBLTIKM-GFCCVEGCSA-N 0 3 334.420 2.612 20 5 EFBDHN CC(C)C[C@@H](CN[C@@H](C)c1cccc([N+](=O)[O-])c1)N1CCOCC1 ZINC000122253645 472993048 /nfs/dbraw/zinc/99/30/48/472993048.db2.gz ZNUVCQUDOXDFRU-YJBOKZPZSA-N 0 3 335.448 2.992 20 5 EFBDHN CN(C)[C@H](CNC(=O)c1ccc(F)cc1[N+](=O)[O-])c1ccccc1 ZINC000159148336 473001279 /nfs/dbraw/zinc/00/12/79/473001279.db2.gz WZTAMFVLPDBZKL-MRXNPFEDSA-N 0 3 331.347 2.767 20 5 EFBDHN CN(Cc1ccccc1)C[C@@H](O)CSc1ccc([N+](=O)[O-])cn1 ZINC000159192779 473006733 /nfs/dbraw/zinc/00/67/33/473006733.db2.gz NDGSOFDBWYRWRD-OAHLLOKOSA-N 0 3 333.413 2.575 20 5 EFBDHN Cc1cc(C(=O)NC[C@H](Cc2ccccc2)N(C)C)cc([N+](=O)[O-])c1 ZINC000122409809 473011667 /nfs/dbraw/zinc/01/16/67/473011667.db2.gz GEGCXFVEIZNMRX-SFHVURJKSA-N 0 3 341.411 2.806 20 5 EFBDHN CCCCNC(=O)[C@@H]1CCCN(CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000051058437 473021590 /nfs/dbraw/zinc/02/15/90/473021590.db2.gz KRQBENMOTFFGNY-MRXNPFEDSA-N 0 3 333.432 2.766 20 5 EFBDHN CCCCNC(=O)[C@H]1CCCN(CCOc2ccccc2[N+](=O)[O-])C1 ZINC000051057535 473022242 /nfs/dbraw/zinc/02/22/42/473022242.db2.gz WDHGRBCSXRKZGH-HNNXBMFYSA-N 0 3 349.431 2.602 20 5 EFBDHN CC(C)N(Cc1ccccn1)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000051430204 473047959 /nfs/dbraw/zinc/04/79/59/473047959.db2.gz IFFGFNYGNSHVPV-KRWDZBQOSA-N 0 3 345.399 2.640 20 5 EFBDHN Cc1cc(N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)ncc1[N+](=O)[O-] ZINC000074746547 473056239 /nfs/dbraw/zinc/05/62/39/473056239.db2.gz MBHAJJZHKIMBEK-HUUCEWRRSA-N 0 3 348.447 2.624 20 5 EFBDHN C[C@H]1C[C@@H](c2ccc(F)cc2)CN1CCn1cc([N+](=O)[O-])ccc1=O ZINC000159837482 473064387 /nfs/dbraw/zinc/06/43/87/473064387.db2.gz BKOBIUHGALEKPX-DZGCQCFKSA-N 0 3 345.374 2.774 20 5 EFBDHN CN1CCN(Cc2ccc(CNc3ccccc3[N+](=O)[O-])cc2)CC1 ZINC000052211380 473094917 /nfs/dbraw/zinc/09/49/17/473094917.db2.gz VPLQLOZSJGGYSX-UHFFFAOYSA-N 0 3 340.427 2.954 20 5 EFBDHN Cn1cc(CN(CCCCO)C2CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000093382999 473098882 /nfs/dbraw/zinc/09/88/82/473098882.db2.gz OCFZDNBTFKEWTI-UHFFFAOYSA-N 0 3 344.415 2.732 20 5 EFBDHN C[C@@H]1C[C@@H](N(C)C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CCN1C ZINC000135655160 473104830 /nfs/dbraw/zinc/10/48/30/473104830.db2.gz IVGAUQYVYJMNMA-OCCSQVGLSA-N 0 3 344.415 2.560 20 5 EFBDHN O=C(CCN1CCC[C@@H](c2ncc[nH]2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000080959060 473111055 /nfs/dbraw/zinc/11/10/55/473111055.db2.gz UABKFQRPKJLOCX-CYBMUJFWSA-N 0 3 343.387 2.526 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H](C)N1CCCC1 ZINC000052641296 473136136 /nfs/dbraw/zinc/13/61/36/473136136.db2.gz GXQWYJTVVVLVHV-QWHCGFSZSA-N 0 3 337.445 2.676 20 5 EFBDHN Cc1ccc(CN(C)CC(C)(C)CN2CCOCC2)cc1[N+](=O)[O-] ZINC000093769591 473143112 /nfs/dbraw/zinc/14/31/12/473143112.db2.gz PYEUBOKCMWKHON-UHFFFAOYSA-N 0 3 335.448 2.693 20 5 EFBDHN CCN(Cc1ccc2c(c1)OCO2)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136821741 473178346 /nfs/dbraw/zinc/17/83/46/473178346.db2.gz PCDKYKUFTCCADW-MRXNPFEDSA-N 0 3 344.367 2.879 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CN2CCN(C3CCCCC3)CC2)c1 ZINC000137076107 473193318 /nfs/dbraw/zinc/19/33/18/473193318.db2.gz AAEXZEJSZXGGKX-SFHVURJKSA-N 0 3 333.432 2.579 20 5 EFBDHN CC(C)N(Cc1cccnc1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000125673926 473444548 /nfs/dbraw/zinc/44/45/48/473444548.db2.gz JKEJHTSYJVFKNH-QGZVFWFLSA-N 0 3 345.399 2.640 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCCN2CCN(c3ccncc3)CC2)cc1 ZINC000151335370 473445311 /nfs/dbraw/zinc/44/53/11/473445311.db2.gz UBPYEXYNGFVKAI-UHFFFAOYSA-N 0 3 342.399 2.581 20 5 EFBDHN COC(=O)COc1ccc([C@@H](C)NCc2cccc([N+](=O)[O-])c2)cc1 ZINC000185650508 473478401 /nfs/dbraw/zinc/47/84/01/473478401.db2.gz XLECTSQNPUIZSB-CYBMUJFWSA-N 0 3 344.367 2.997 20 5 EFBDHN CCc1[nH]nc(C(=O)Nc2ccc(C)cc2CN(C)C)c1[N+](=O)[O-] ZINC000185655732 473481048 /nfs/dbraw/zinc/48/10/48/473481048.db2.gz CXOPCNDCKDSRRM-UHFFFAOYSA-N 0 3 331.376 2.503 20 5 EFBDHN Cc1c([C@@H](C)NC[C@@H]2CN(CC(C)C)CCO2)cccc1[N+](=O)[O-] ZINC000178330570 473492328 /nfs/dbraw/zinc/49/23/28/473492328.db2.gz MCVWTFANVXWQQF-HZPDHXFCSA-N 0 3 335.448 2.911 20 5 EFBDHN Cc1ccc([C@H](C)NC[C@@H]2CN(CC(C)C)CCO2)cc1[N+](=O)[O-] ZINC000178329803 473492645 /nfs/dbraw/zinc/49/26/45/473492645.db2.gz LRDXTICJSQMVLE-DOTOQJQBSA-N 0 3 335.448 2.911 20 5 EFBDHN CC[C@@H](NC[C@@H]1CN(CC(C)C)CCO1)c1cccc([N+](=O)[O-])c1 ZINC000178331147 473492826 /nfs/dbraw/zinc/49/28/26/473492826.db2.gz PCUDECDIVNUQEI-QZTJIDSGSA-N 0 3 335.448 2.992 20 5 EFBDHN O=[N+]([O-])c1cccc(CNC2CCC(O)(c3cccnc3)CC2)c1 ZINC000185708769 473493758 /nfs/dbraw/zinc/49/37/58/473493758.db2.gz YPQCMDGQZLZQFL-UHFFFAOYSA-N 0 3 327.384 2.910 20 5 EFBDHN C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000126200157 473497987 /nfs/dbraw/zinc/49/79/87/473497987.db2.gz YXSOEODJVIRDTO-GWCFXTLKSA-N 0 3 325.796 2.660 20 5 EFBDHN CC[C@H]1Cc2ccccc2CN1CCn1cc([N+](=O)[O-])ccc1=O ZINC000185803466 473518967 /nfs/dbraw/zinc/51/89/67/473518967.db2.gz DDBITBYMBSLTAZ-INIZCTEOSA-N 0 3 327.384 2.593 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)N[C@@H]2C[C@H](C)N(C3CC3)C2)cc1[N+](=O)[O-] ZINC000126504007 473521509 /nfs/dbraw/zinc/52/15/09/473521509.db2.gz ULZUEVFEXWPSMS-GZBFAFLISA-N 0 3 346.431 2.889 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)N[C@H]2C[C@H](C)N(C3CC3)C2)cc1[N+](=O)[O-] ZINC000126504537 473522050 /nfs/dbraw/zinc/52/20/50/473522050.db2.gz ULZUEVFEXWPSMS-GUTXKFCHSA-N 0 3 346.431 2.889 20 5 EFBDHN CCC1(CC)[C@H](OC)C[C@@H]1NCC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000191367971 473531772 /nfs/dbraw/zinc/53/17/72/473531772.db2.gz FQGPIRACYQOHAT-JKSUJKDBSA-N 0 3 349.431 2.741 20 5 EFBDHN O=[N+]([O-])c1cccc(CN2CCC[C@@H](c3nnc(C4CC4)[nH]3)C2)c1 ZINC000152207799 473536890 /nfs/dbraw/zinc/53/68/90/473536890.db2.gz LPIHCFVMVUTYDQ-CQSZACIVSA-N 0 3 327.388 2.970 20 5 EFBDHN O=[N+]([O-])c1cccc(CN2CCC[C@@H](c3nc(C4CC4)n[nH]3)C2)c1 ZINC000152207799 473536896 /nfs/dbraw/zinc/53/68/96/473536896.db2.gz LPIHCFVMVUTYDQ-CQSZACIVSA-N 0 3 327.388 2.970 20 5 EFBDHN CC[C@H]1CCCCN1CCNC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000172252090 473561664 /nfs/dbraw/zinc/56/16/64/473561664.db2.gz QESGHNVXDQFVTK-HNNXBMFYSA-N 0 3 334.420 2.659 20 5 EFBDHN CN(C[C@H]1CCCN(C)C1)C(=O)/C=C/c1ccc(F)cc1[N+](=O)[O-] ZINC000115439909 473570166 /nfs/dbraw/zinc/57/01/66/473570166.db2.gz WQRMXQNVQIRNRO-CFNZNRNTSA-N 0 3 335.379 2.547 20 5 EFBDHN Cc1c(C(=O)N2CCCN(C3CCCC3)CC2)cccc1[N+](=O)[O-] ZINC000172422596 473606333 /nfs/dbraw/zinc/60/63/33/473606333.db2.gz XDGQVKJOTFQEFO-UHFFFAOYSA-N 0 3 331.416 2.994 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)N2CCCN(C3CCCC3)CC2)c1 ZINC000172422985 473607025 /nfs/dbraw/zinc/60/70/25/473607025.db2.gz CKCVJKGWXRTRAR-UHFFFAOYSA-N 0 3 347.415 2.694 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN[C@@H]2CCO[C@@H]2c2ccc(Cl)cc2)n1 ZINC000192029284 473610762 /nfs/dbraw/zinc/61/07/62/473610762.db2.gz RVXYLZGHKQEOHL-UKRRQHHQSA-N 0 3 336.779 2.565 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN[C@H]2CCO[C@H]2c2ccc(Cl)cc2)n1 ZINC000192029302 473610851 /nfs/dbraw/zinc/61/08/51/473610851.db2.gz RVXYLZGHKQEOHL-ZFWWWQNUSA-N 0 3 336.779 2.565 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)CN1CCCCCC1 ZINC000186268860 473634162 /nfs/dbraw/zinc/63/41/62/473634162.db2.gz FKYFSNMUKWMZFT-ZDUSSCGKSA-N 0 3 335.404 2.598 20 5 EFBDHN Cc1cccc(OC[C@H](O)CN(C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000153798148 473642688 /nfs/dbraw/zinc/64/26/88/473642688.db2.gz YDYWKCRPPQRIBU-MRXNPFEDSA-N 0 3 330.384 2.775 20 5 EFBDHN CN(C)Cc1cccc(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000172615039 473658267 /nfs/dbraw/zinc/65/82/67/473658267.db2.gz FBGSRXISGUUCTR-UHFFFAOYSA-N 0 3 327.384 2.929 20 5 EFBDHN C[C@H]1CN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CCCO1 ZINC000179393879 473683889 /nfs/dbraw/zinc/68/38/89/473683889.db2.gz JWPOCMJYIGFEFF-ZDUSSCGKSA-N 0 3 330.388 2.606 20 5 EFBDHN CCOC(C)(C)CNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000186541497 473687876 /nfs/dbraw/zinc/68/78/76/473687876.db2.gz VKADQTORYHRSFN-UHFFFAOYSA-N 0 3 332.404 2.900 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N(C)C[C@H]1CCCN(C)C1 ZINC000179576345 473696200 /nfs/dbraw/zinc/69/62/00/473696200.db2.gz SRKZPRNNQNZHJR-HNNXBMFYSA-N 0 3 333.432 2.934 20 5 EFBDHN CN1CC[C@H]2[C@H](CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000269120875 473699553 /nfs/dbraw/zinc/69/95/53/473699553.db2.gz SROKVPIQTJFCMU-DOMZBBRYSA-N 0 3 343.383 2.897 20 5 EFBDHN C[C@@H]1Cc2ccccc2CN1C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000172908499 473700861 /nfs/dbraw/zinc/70/08/61/473700861.db2.gz MNWLVIFHRQXYIN-KDOFPFPSSA-N 0 3 342.395 2.781 20 5 EFBDHN CC(C)(NC(=O)C1CCN(C2CC2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000192686761 473706054 /nfs/dbraw/zinc/70/60/54/473706054.db2.gz BTBLXAMIRFUBTN-UHFFFAOYSA-N 0 3 331.416 2.821 20 5 EFBDHN CN(C)Cc1ccccc1CNC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000172968907 473716019 /nfs/dbraw/zinc/71/60/19/473716019.db2.gz PQTNIGXMWDNVMC-UHFFFAOYSA-N 0 3 327.384 2.515 20 5 EFBDHN C[C@H]1CCCC[C@H]1N(C)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000192799230 473727787 /nfs/dbraw/zinc/72/77/87/473727787.db2.gz SWDYRKRKWBGNDM-WCQYABFASA-N 0 3 349.387 2.773 20 5 EFBDHN COc1ccc([C@@H](CNc2ncccc2[N+](=O)[O-])N(C)C)cc1OC ZINC000192905996 473745609 /nfs/dbraw/zinc/74/56/09/473745609.db2.gz UOLHKAUPYPMGJI-CQSZACIVSA-N 0 3 346.387 2.722 20 5 EFBDHN CC(C)(C)N1C[C@H](N[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1=O ZINC000193012653 473759855 /nfs/dbraw/zinc/75/98/55/473759855.db2.gz PPKPTWKIXUBFIW-CZUORRHYSA-N 0 3 331.416 2.961 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN(Cc2ccc(F)cc2)C2CCOCC2)n1 ZINC000287796742 473763130 /nfs/dbraw/zinc/76/31/30/473763130.db2.gz OGNKIOSUQQZMFC-UHFFFAOYSA-N 0 3 348.378 2.612 20 5 EFBDHN Cc1c(CC(=O)NC[C@H](C)N2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000245972953 473768784 /nfs/dbraw/zinc/76/87/84/473768784.db2.gz WGNGESZVXYDEAA-KGLIPLIRSA-N 0 3 333.432 2.682 20 5 EFBDHN CC[C@H](NC[C@@H]1COC2(CCOCC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000179998452 473773321 /nfs/dbraw/zinc/77/33/21/473773321.db2.gz HLCZKWNSORJGJI-CVEARBPZSA-N 0 3 336.388 2.558 20 5 EFBDHN CSc1cccc(C(=O)N(CCN(C)C)C(C)C)c1[N+](=O)[O-] ZINC000186877736 473773309 /nfs/dbraw/zinc/77/33/09/473773309.db2.gz YPXQPVPFUGIKBZ-UHFFFAOYSA-N 0 3 325.434 2.729 20 5 EFBDHN Cc1ccc([C@@H](CNC(=O)Cc2cccc([N+](=O)[O-])c2)N(C)C)cc1 ZINC000173284638 473793472 /nfs/dbraw/zinc/79/34/72/473793472.db2.gz HIPLKJLTDYAYMS-GOSISDBHSA-N 0 3 341.411 2.865 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCN2CC[C@H](OCc3ccncc3)C2)cc1 ZINC000287950607 473807338 /nfs/dbraw/zinc/80/73/38/473807338.db2.gz YCDXZYDJYMYDSV-SFHVURJKSA-N 0 3 343.383 2.660 20 5 EFBDHN C[C@@H](NC[C@@H](O)COCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000173383005 473820885 /nfs/dbraw/zinc/82/08/85/473820885.db2.gz XNEIQMOCCVGWML-RDTXWAMCSA-N 0 3 330.384 2.823 20 5 EFBDHN CN(C)c1ccccc1CN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173466988 473846421 /nfs/dbraw/zinc/84/64/21/473846421.db2.gz BSCFABQEGYVXDQ-OAHLLOKOSA-N 0 3 341.415 2.742 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@@H]1CCCN1C1CCCC1 ZINC000269630570 473847813 /nfs/dbraw/zinc/84/78/13/473847813.db2.gz FKHJILDTPJVJMD-KRWDZBQOSA-N 0 3 331.416 2.960 20 5 EFBDHN CCn1c(C)nc([N+](=O)[O-])c1NC[C@@H](c1ccc(F)cc1)N(C)C ZINC000288185204 473869137 /nfs/dbraw/zinc/86/91/37/473869137.db2.gz RKRIXFRGJRZDEP-AWEZNQCLSA-N 0 3 335.383 2.974 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H]1CCCN1C1CCCC1 ZINC000269722162 473870548 /nfs/dbraw/zinc/87/05/48/473870548.db2.gz SWWXYZQAQOHJRK-INIZCTEOSA-N 0 3 347.415 2.627 20 5 EFBDHN C[C@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)c1cccc([N+](=O)[O-])c1 ZINC000180426044 473875481 /nfs/dbraw/zinc/87/54/81/473875481.db2.gz KJUQWLHOMLAVRD-MEDUHNTESA-N 0 3 331.328 2.887 20 5 EFBDHN C[C@@H](NC[C@@H](O)COCc1cccs1)c1cccc([N+](=O)[O-])c1 ZINC000180436026 473876582 /nfs/dbraw/zinc/87/65/82/473876582.db2.gz DHZXIQHSQZDTDR-IUODEOHRSA-N 0 3 336.413 2.885 20 5 EFBDHN CN(C)C(=O)[C@H](NCCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000194408032 473893199 /nfs/dbraw/zinc/89/31/99/473893199.db2.gz WNSRRVOXNFIVLB-QGZVFWFLSA-N 0 3 327.384 2.556 20 5 EFBDHN CS[C@@H]1CN(c2ncc(Cl)cc2[N+](=O)[O-])C[C@@H]1N1CCCC1 ZINC000274634964 473904645 /nfs/dbraw/zinc/90/46/45/473904645.db2.gz CXIGUIKKXAKKFQ-QWHCGFSZSA-N 0 3 342.852 2.659 20 5 EFBDHN CS[C@H]1CN(c2ncc([N+](=O)[O-])cc2Cl)C[C@H]1N1CCCC1 ZINC000274681737 473918702 /nfs/dbraw/zinc/91/87/02/473918702.db2.gz OAMKQTYDAAENCB-OLZOCXBDSA-N 0 3 342.852 2.659 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CNC2(c3ccccc3)CC2)c1 ZINC000264006834 473936350 /nfs/dbraw/zinc/93/63/50/473936350.db2.gz QJNUTEBKESKRNP-INIZCTEOSA-N 0 3 328.368 2.613 20 5 EFBDHN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCC[C@@H]1C[C@H](C)O ZINC000246736670 473947239 /nfs/dbraw/zinc/94/72/39/473947239.db2.gz PCOSQFACMHWONQ-YWPYICTPSA-N 0 3 346.387 2.941 20 5 EFBDHN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NCCN1CCCC1 ZINC000180721634 473950917 /nfs/dbraw/zinc/95/09/17/473950917.db2.gz NPBUIJDCHQUFLB-UHFFFAOYSA-N 0 3 337.445 2.921 20 5 EFBDHN COCCN1CC[C@@H](NC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000264436748 473991462 /nfs/dbraw/zinc/99/14/62/473991462.db2.gz BITNYULBYOPZTM-MRXNPFEDSA-N 0 3 349.434 2.839 20 5 EFBDHN CN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000246885271 473992607 /nfs/dbraw/zinc/99/26/07/473992607.db2.gz IIWSUUNSSNDXOD-NHYWBVRUSA-N 0 3 337.807 2.805 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H](N2CCCCC2)C1 ZINC000264442435 473994221 /nfs/dbraw/zinc/99/42/21/473994221.db2.gz FCIXOVMRFBEZPA-AWEZNQCLSA-N 0 3 348.403 2.696 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@H](N2CCCCC2)C1 ZINC000264517076 474021207 /nfs/dbraw/zinc/02/12/07/474021207.db2.gz VAGURBAFWJURMY-OAHLLOKOSA-N 0 3 332.404 2.995 20 5 EFBDHN CN(C)c1ccccc1CN(C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000288764089 474044583 /nfs/dbraw/zinc/04/45/83/474044583.db2.gz HSMTWGIVJCURAK-GOSISDBHSA-N 0 3 329.400 2.826 20 5 EFBDHN COc1cc(C(=O)N(CCN(C)C)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000195328554 474058599 /nfs/dbraw/zinc/05/85/99/474058599.db2.gz CNBYREPMIOLKQL-UHFFFAOYSA-N 0 3 349.431 2.940 20 5 EFBDHN O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)C1CCN(C2CC2)CC1 ZINC000195324342 474059232 /nfs/dbraw/zinc/05/92/32/474059232.db2.gz QISLMIVLPHULNI-UHFFFAOYSA-N 0 3 325.315 2.686 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CN[C@H](CC(N)=O)C1CCCCC1 ZINC000181997107 474076922 /nfs/dbraw/zinc/07/69/22/474076922.db2.gz KDTZELKLEUEYFQ-OAHLLOKOSA-N 0 3 335.404 2.517 20 5 EFBDHN C[C@@H](CN(C)Cc1ccccc1)NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000182066288 474091876 /nfs/dbraw/zinc/09/18/76/474091876.db2.gz QVYBEXIIZWVTKM-LBPRGKRZSA-N 0 3 333.413 2.907 20 5 EFBDHN C[C@@H](CN(C)Cc1ccccc1)NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000182090229 474097401 /nfs/dbraw/zinc/09/74/01/474097401.db2.gz VLOSSLVKIQMNIM-HNNXBMFYSA-N 0 3 341.411 2.774 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CCC(Cc3cccc(F)c3)CC2)c1 ZINC000174822587 474103062 /nfs/dbraw/zinc/10/30/62/474103062.db2.gz XEUPZWRCGDVQHK-UHFFFAOYSA-N 0 3 332.379 2.885 20 5 EFBDHN CS[C@H]1CN(c2ccc([N+](=O)[O-])c3cnccc32)C[C@@H]1N(C)C ZINC000270399458 474104768 /nfs/dbraw/zinc/10/47/68/474104768.db2.gz UZVQLSFOQYKCME-HOTGVXAUSA-N 0 3 332.429 2.625 20 5 EFBDHN CS[C@H]1CCCCN(C[C@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000182222987 474126174 /nfs/dbraw/zinc/12/61/74/474126174.db2.gz URRMXYFKQQLPKR-KBPBESRZSA-N 0 3 340.445 2.552 20 5 EFBDHN Cc1nn(C)c(C)c1[C@H]1OCC[C@@H]1NCc1ccc([N+](=O)[O-])cc1 ZINC000275276958 474127992 /nfs/dbraw/zinc/12/79/92/474127992.db2.gz JWFLSAGETONWNP-RDJZCZTQSA-N 0 3 330.388 2.565 20 5 EFBDHN CC(C)N1CCN(C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC000270471136 474131534 /nfs/dbraw/zinc/13/15/34/474131534.db2.gz NIFQOCLZHSOKQT-UHFFFAOYSA-N 0 3 332.448 2.590 20 5 EFBDHN CO[C@H]1CCCC[C@@H]1NCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000275299833 474134809 /nfs/dbraw/zinc/13/48/09/474134809.db2.gz ZIBQVCUJCQBPHX-JSGCOSHPSA-N 0 3 341.795 2.734 20 5 EFBDHN Cc1ccc(N2CCC(N3CCN(C(C)C)CC3)CC2)c([N+](=O)[O-])c1 ZINC000270514689 474149739 /nfs/dbraw/zinc/14/97/39/474149739.db2.gz XZXSAEYDMHQIIJ-UHFFFAOYSA-N 0 3 346.475 2.898 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@H]2CCCN2C[C@@H]1C ZINC000247474381 474157417 /nfs/dbraw/zinc/15/74/17/474157417.db2.gz RZZCWYXMSBROOI-KCQAQPDRSA-N 0 3 349.456 2.771 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000247486855 474159925 /nfs/dbraw/zinc/15/99/25/474159925.db2.gz KXEQWXUAMMLVAM-CZUORRHYSA-N 0 3 334.420 2.829 20 5 EFBDHN C[C@@H](NC(=O)N1CCC[C@H]2CN(C)CC[C@@H]21)c1cccc([N+](=O)[O-])c1 ZINC000182406026 474168495 /nfs/dbraw/zinc/16/84/95/474168495.db2.gz NYALQTLXRURIMD-KMFMINBZSA-N 0 3 346.431 2.782 20 5 EFBDHN C[C@@H]1CN(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)[C@H]2CCCC[C@H]12 ZINC000182492495 474189446 /nfs/dbraw/zinc/18/94/46/474189446.db2.gz JHPIIKDHHKWCBP-XYPHTWIQSA-N 0 3 343.427 2.994 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(NCc2ccnc(OCCN(C)C)c2)c1 ZINC000270618376 474191771 /nfs/dbraw/zinc/19/17/71/474191771.db2.gz BREFJJHQPZSSCF-UHFFFAOYSA-N 0 3 346.387 2.551 20 5 EFBDHN CN(CCOCCO)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000282792563 474197384 /nfs/dbraw/zinc/19/73/84/474197384.db2.gz RIONXLPKCJALTP-UHFFFAOYSA-N 0 3 336.413 2.764 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c1 ZINC000282793385 474198069 /nfs/dbraw/zinc/19/80/69/474198069.db2.gz HMGWFIYVHWAMJP-CHWSQXEVSA-N 0 3 335.404 2.548 20 5 EFBDHN O=[N+]([O-])c1ccc(Cl)c(CN2CCN(C3CCOCC3)CC2)c1 ZINC000175469440 474228120 /nfs/dbraw/zinc/22/81/20/474228120.db2.gz ULTPIVOGWANIDJ-UHFFFAOYSA-N 0 3 339.823 2.545 20 5 EFBDHN CCCCO[C@H]1C[C@H](NCc2ccc(C(N)=O)cc2[N+](=O)[O-])C1(C)C ZINC000289352274 474233278 /nfs/dbraw/zinc/23/32/78/474233278.db2.gz NDFMCODRHCVWTQ-HOTGVXAUSA-N 0 3 349.431 2.767 20 5 EFBDHN CN(C)CCOc1cc(CNc2ccc(F)cc2[N+](=O)[O-])ccn1 ZINC000270716310 474233910 /nfs/dbraw/zinc/23/39/10/474233910.db2.gz MQGUFYPUKHWLJL-UHFFFAOYSA-N 0 3 334.351 2.681 20 5 EFBDHN COCCCN(CCO)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000188933623 474239555 /nfs/dbraw/zinc/23/95/55/474239555.db2.gz PACWDILHLIOOLO-UHFFFAOYSA-N 0 3 334.372 2.686 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H]3CCCN3C[C@H]2CC)c1 ZINC000282925516 474244462 /nfs/dbraw/zinc/24/44/62/474244462.db2.gz WUENZQIBYPHQLY-ZIAGYGMSSA-N 0 3 347.415 2.692 20 5 EFBDHN CN(C)C[C@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)c1ccc(Cl)cc1 ZINC000282942494 474248756 /nfs/dbraw/zinc/24/87/56/474248756.db2.gz MRQVGFYPCKVZBY-ZDUSSCGKSA-N 0 3 336.779 2.609 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)c1 ZINC000282947038 474250937 /nfs/dbraw/zinc/25/09/37/474250937.db2.gz YWJLHNIZTJAAEL-CZUORRHYSA-N 0 3 347.415 2.550 20 5 EFBDHN CCn1ccnc1[C@H]1OCC[C@@H]1NCc1ccc(C)c([N+](=O)[O-])c1 ZINC000275644252 474263471 /nfs/dbraw/zinc/26/34/71/474263471.db2.gz TXVYXLJIPMXHJX-HOCLYGCPSA-N 0 3 330.388 2.739 20 5 EFBDHN C[C@H]1C[C@H](N(C)c2c([N+](=O)[O-])ncn2C)CCN1Cc1ccccc1 ZINC000265624414 474272372 /nfs/dbraw/zinc/27/23/72/474272372.db2.gz YMESTFKSJKOAKB-GOEBONIOSA-N 0 3 343.431 2.818 20 5 EFBDHN COc1ccc(CNCCC(=O)Nc2ccccc2F)cc1[N+](=O)[O-] ZINC000608781928 480092689 /nfs/dbraw/zinc/09/26/89/480092689.db2.gz NKVQMFHAPKOGAO-UHFFFAOYSA-N 0 3 347.346 2.861 20 5 EFBDHN COC1(C)CCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC1 ZINC000275678229 474278625 /nfs/dbraw/zinc/27/86/25/474278625.db2.gz YIMUKBWOFADXBX-UHFFFAOYSA-N 0 3 339.367 2.563 20 5 EFBDHN CN(C)C1(CN(C)C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000275702510 474288326 /nfs/dbraw/zinc/28/83/26/474288326.db2.gz XXUCDCPVQUCQMA-UHFFFAOYSA-N 0 3 333.432 2.815 20 5 EFBDHN CN(C)C(=O)CCNCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000237149727 474347223 /nfs/dbraw/zinc/34/72/23/474347223.db2.gz PKZKHXPMHHLKGN-UHFFFAOYSA-N 0 3 333.413 2.891 20 5 EFBDHN O=[N+]([O-])c1cc(CN[C@H](CO)C2CCCC2)ccc1Br ZINC000289624432 474350620 /nfs/dbraw/zinc/35/06/20/474350620.db2.gz SZXYRKLOVWXAEJ-CYBMUJFWSA-N 0 3 343.221 2.998 20 5 EFBDHN C[C@H](C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21)c1ccc([N+](=O)[O-])cc1F ZINC000248550998 474354327 /nfs/dbraw/zinc/35/43/27/474354327.db2.gz GOIRZPLRVAKOSR-OGHNNQOOSA-N 0 3 349.406 2.780 20 5 EFBDHN CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000289676278 474374025 /nfs/dbraw/zinc/37/40/25/474374025.db2.gz FRTWXQAJYOAHIR-LBPRGKRZSA-N 0 3 332.404 2.929 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CNCCCn3cncn3)o2)cc1 ZINC000608835817 480099597 /nfs/dbraw/zinc/09/95/97/480099597.db2.gz WOKLADGOBALZSP-UHFFFAOYSA-N 0 3 327.344 2.626 20 5 EFBDHN CCN(CCNC(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)C1CC1 ZINC000176082881 474378598 /nfs/dbraw/zinc/37/85/98/474378598.db2.gz YXNKGQLOHGXGBD-ZDUSSCGKSA-N 0 3 334.420 2.748 20 5 EFBDHN C[C@H](C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)[C@@H](N)c1ccccc1 ZINC000237421549 474400428 /nfs/dbraw/zinc/40/04/28/474400428.db2.gz YMIJBUNWKKVDEP-SCLBCKFNSA-N 0 3 339.395 2.816 20 5 EFBDHN COc1ccc(-c2ccc(CN[C@@H]3CCC[C@H]3O)o2)c([N+](=O)[O-])c1 ZINC000237439102 474403540 /nfs/dbraw/zinc/40/35/40/474403540.db2.gz DIVJNMOIECMUFD-GDBMZVCRSA-N 0 3 332.356 2.866 20 5 EFBDHN CCOc1ccc([C@H](C)NCCCOCCOC)cc1[N+](=O)[O-] ZINC000271147117 474403957 /nfs/dbraw/zinc/40/39/57/474403957.db2.gz PMJFXLWMMCGYIN-ZDUSSCGKSA-N 0 3 326.393 2.697 20 5 EFBDHN CN(CCn1ccc([N+](=O)[O-])n1)Cc1cccc(C(F)(F)F)c1 ZINC000176211647 474411167 /nfs/dbraw/zinc/41/11/67/474411167.db2.gz AYSUSUBNHPDLJC-UHFFFAOYSA-N 0 3 328.294 2.942 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CCC(c3nc4ccccc4[nH]3)CC2)n1 ZINC000176236964 474417138 /nfs/dbraw/zinc/41/71/38/474417138.db2.gz SENBEWSODPSQCD-UHFFFAOYSA-N 0 3 340.387 2.547 20 5 EFBDHN CCC1(O)CCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000271181608 474426552 /nfs/dbraw/zinc/42/65/52/474426552.db2.gz HRBUESVZNKWFTA-UHFFFAOYSA-N 0 3 344.415 2.732 20 5 EFBDHN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccccc1[N+](=O)[O-] ZINC000248760234 474429687 /nfs/dbraw/zinc/42/96/87/474429687.db2.gz GMRJOBWJJPHRHL-WMLDXEAASA-N 0 3 339.395 2.845 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](C)N2CCC[C@H](C)C2)c1 ZINC000283578874 474441629 /nfs/dbraw/zinc/44/16/29/474441629.db2.gz WHUAWSSTYZMCOG-UONOGXRCSA-N 0 3 349.431 2.844 20 5 EFBDHN COC[C@@]1(CNCc2ccccc2[N+](=O)[O-])OCCc2ccccc21 ZINC000289862515 474460778 /nfs/dbraw/zinc/46/07/78/474460778.db2.gz ONPWFVMHCHWIQR-LJQANCHMSA-N 0 3 342.395 2.799 20 5 EFBDHN C[C@@H](C(=O)NCCc1ccccc1[N+](=O)[O-])[C@H](N)c1ccccc1 ZINC000237709724 474461803 /nfs/dbraw/zinc/46/18/03/474461803.db2.gz SBAZXBUPAUTNPC-DYVFJYSZSA-N 0 3 327.384 2.590 20 5 EFBDHN CCN(Cc1ccc(CN(C)C)cc1)C(=O)c1cc([N+](=O)[O-])cn1C ZINC000608966013 480106374 /nfs/dbraw/zinc/10/63/74/480106374.db2.gz MYRBCGJQMGVBAZ-UHFFFAOYSA-N 0 3 344.415 2.657 20 5 EFBDHN C[C@H]1CN(Cc2ccc(Cl)cc2[N+](=O)[O-])CCN1CC(C)(C)O ZINC000189918002 474505888 /nfs/dbraw/zinc/50/58/88/474505888.db2.gz PZULMNIPKGLCHX-LBPRGKRZSA-N 0 3 341.839 2.525 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCN(CC(C)(C)O)[C@H](C)C1 ZINC000189948225 474516379 /nfs/dbraw/zinc/51/63/79/474516379.db2.gz LRVSCAJQRGLQRT-CABCVRRESA-N 0 3 335.448 2.741 20 5 EFBDHN CCc1ccc(C(=O)N2CCC[C@@H]2CN2CCCC2)cc1[N+](=O)[O-] ZINC000266958761 474546937 /nfs/dbraw/zinc/54/69/37/474546937.db2.gz VRKGOWDTGURDDC-MRXNPFEDSA-N 0 3 331.416 2.858 20 5 EFBDHN C[C@H](N[C@@H](CO)C[C@@H](O)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000271447665 474550340 /nfs/dbraw/zinc/55/03/40/474550340.db2.gz DAKHQXSWECLWGM-FDQGKXFDSA-N 0 3 330.384 2.730 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@@H](C)CC[S@@](C)=O)cc1[N+](=O)[O-] ZINC000271449120 474551600 /nfs/dbraw/zinc/55/16/00/474551600.db2.gz FLGBRRXBZQDYEG-YEZLUTFDSA-N 0 3 328.434 2.801 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN1CCC2(C[C@H]2C(=O)OC)CC1 ZINC000267001214 474561280 /nfs/dbraw/zinc/56/12/80/474561280.db2.gz CZTOHZVYNTYKPC-HNNXBMFYSA-N 0 3 348.399 2.769 20 5 EFBDHN CN(C)[C@@]1(CNc2ccc3ncccc3c2[N+](=O)[O-])CCSC1 ZINC000267026774 474568248 /nfs/dbraw/zinc/56/82/48/474568248.db2.gz AGNLTAFUCZUECW-MRXNPFEDSA-N 0 3 332.429 2.992 20 5 EFBDHN C[C@H](NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC000184649949 474574315 /nfs/dbraw/zinc/57/43/15/474574315.db2.gz NPEZXFXUBMUPCU-LBPRGKRZSA-N 0 3 326.418 2.537 20 5 EFBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CN[C@@H]2C[C@@H]3OCCC[C@@H]23)c1 ZINC000249452203 474574606 /nfs/dbraw/zinc/57/46/06/474574606.db2.gz CPKZRERIYMXTLU-SCRDCRAPSA-N 0 3 328.315 2.853 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CCCN1CC ZINC000184653921 474576081 /nfs/dbraw/zinc/57/60/81/474576081.db2.gz SLBGTQHAOHJDMF-WBVHZDCISA-N 0 3 333.432 2.764 20 5 EFBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CN[C@@H]2C[C@@H]3OCCC[C@H]23)c1 ZINC000190349465 474583877 /nfs/dbraw/zinc/58/38/77/474583877.db2.gz CPKZRERIYMXTLU-BZPMIXESSA-N 0 3 328.315 2.853 20 5 EFBDHN COc1cc(NC2CCN(CCOC(C)C)CC2)ccc1[N+](=O)[O-] ZINC000267087719 474586841 /nfs/dbraw/zinc/58/68/41/474586841.db2.gz UDCDHFUTWQNFNZ-UHFFFAOYSA-N 0 3 337.420 2.905 20 5 EFBDHN CN(C)[C@@]1(CNc2ccc3cc([N+](=O)[O-])ccc3n2)CCSC1 ZINC000267120754 474595474 /nfs/dbraw/zinc/59/54/74/474595474.db2.gz TYOQBFYGVDHYQY-MRXNPFEDSA-N 0 3 332.429 2.992 20 5 EFBDHN CN(C)[C@]1(CNc2ccc3cc([N+](=O)[O-])ccc3n2)CCSC1 ZINC000267120752 474595523 /nfs/dbraw/zinc/59/55/23/474595523.db2.gz TYOQBFYGVDHYQY-INIZCTEOSA-N 0 3 332.429 2.992 20 5 EFBDHN Cc1cc([N+](=O)[O-])cc(C(=O)N(C)[C@@H](C)C2CCN(C)CC2)c1F ZINC000284241959 474601955 /nfs/dbraw/zinc/60/19/55/474601955.db2.gz PENPFTCMYVLEFR-LBPRGKRZSA-N 0 3 337.395 2.845 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCN2CCc3ccc(O)cc3CC2)cc1 ZINC000609133345 480114966 /nfs/dbraw/zinc/11/49/66/480114966.db2.gz OQOCFASCSRVXJX-UHFFFAOYSA-N 0 3 328.368 2.780 20 5 EFBDHN C[C@H](CNC(=O)NCCc1ccc([N+](=O)[O-])cc1)N1CCC[C@H](C)C1 ZINC000249760311 474613566 /nfs/dbraw/zinc/61/35/66/474613566.db2.gz XGGVQKWGJFDJTA-LSDHHAIUSA-N 0 3 348.447 2.557 20 5 EFBDHN Cc1nn(C)c(N[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000267232571 474624376 /nfs/dbraw/zinc/62/43/76/474624376.db2.gz QHBOIZIKDHBAMY-BBRMVZONSA-N 0 3 343.431 2.959 20 5 EFBDHN Cc1nn(C)c(N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000267232593 474624574 /nfs/dbraw/zinc/62/45/74/474624574.db2.gz QHBOIZIKDHBAMY-XJKSGUPXSA-N 0 3 343.431 2.959 20 5 EFBDHN C[C@H](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)C1=CCN(C)CC1 ZINC000272858362 474627238 /nfs/dbraw/zinc/62/72/38/474627238.db2.gz HYYDPKDKBHIRLP-LBPRGKRZSA-N 0 3 344.415 2.549 20 5 EFBDHN Cc1cc(NC[C@H](O)C2CCOCC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000272890516 474635202 /nfs/dbraw/zinc/63/52/02/474635202.db2.gz XPIUOBZKYJOONH-KRWDZBQOSA-N 0 3 331.372 2.651 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2ccc(CNCCCn3cncn3)o2)c1 ZINC000609140486 480117348 /nfs/dbraw/zinc/11/73/48/480117348.db2.gz LBWDHYWIESWPIF-UHFFFAOYSA-N 0 3 327.344 2.626 20 5 EFBDHN C[C@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])[C@@H](c1ccccc1)N(C)C ZINC000291666409 474644815 /nfs/dbraw/zinc/64/48/15/474644815.db2.gz LHUBZFOXBPYJPB-SJCJKPOMSA-N 0 3 342.399 2.598 20 5 EFBDHN C[C@@H]1CCC[C@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000272954355 474649764 /nfs/dbraw/zinc/64/97/64/474649764.db2.gz QSGHIEMVUXKSAZ-OLZOCXBDSA-N 0 3 326.418 2.537 20 5 EFBDHN C[C@H]1CCC[C@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000272954357 474649816 /nfs/dbraw/zinc/64/98/16/474649816.db2.gz QSGHIEMVUXKSAZ-STQMWFEESA-N 0 3 326.418 2.537 20 5 EFBDHN C[C@H]1CCC[C@@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000272954356 474650144 /nfs/dbraw/zinc/65/01/44/474650144.db2.gz QSGHIEMVUXKSAZ-QWHCGFSZSA-N 0 3 326.418 2.537 20 5 EFBDHN C[C@@H]1OCC[C@@]1(O)CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291702589 474653191 /nfs/dbraw/zinc/65/31/91/474653191.db2.gz ZDSHABRSZYKDAY-ISVAXAHUSA-N 0 3 335.187 2.531 20 5 EFBDHN C[C@@H](CCc1ccccc1[N+](=O)[O-])NCc1ccnc(N(C)C)n1 ZINC000344339631 474663830 /nfs/dbraw/zinc/66/38/30/474663830.db2.gz XDIVUVZMHAJJSF-ZDUSSCGKSA-N 0 3 329.404 2.562 20 5 EFBDHN C[C@@H](Nc1ncc([N+](=O)[O-])cc1Br)C1=CCN(C)CC1 ZINC000273029703 474680896 /nfs/dbraw/zinc/68/08/96/474680896.db2.gz UUVOAIKLMABBGH-SECBINFHSA-N 0 3 341.209 2.815 20 5 EFBDHN COc1cc(CNCC[C@H]2CCO[C@@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000273034632 474682877 /nfs/dbraw/zinc/68/28/77/474682877.db2.gz GXIYWWULUWGZNL-STQMWFEESA-N 0 3 338.404 2.907 20 5 EFBDHN C[C@@H]1CN(C2CCOCC2)CCN1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000278538669 474690303 /nfs/dbraw/zinc/69/03/03/474690303.db2.gz CJCSELGIFHVJIX-MQDFFIGUSA-N 0 3 345.443 2.793 20 5 EFBDHN C[C@@]1(NCc2cc([N+](=O)[O-])cc3c2OCOC3)CCO[C@H]1C1CC1 ZINC000273052900 474692237 /nfs/dbraw/zinc/69/22/37/474692237.db2.gz KTVGKAWZWZGSHQ-DLBZAZTESA-N 0 3 334.372 2.509 20 5 EFBDHN CO[C@]1(C)C[C@@H](N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1(C)C ZINC000340830551 474697668 /nfs/dbraw/zinc/69/76/68/474697668.db2.gz ZKSNUBGOHUIWSK-FABXCBLPSA-N 0 3 335.404 2.715 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CC[C@H](Oc3ccc(Cl)cc3)C2)c1 ZINC000292900239 474705403 /nfs/dbraw/zinc/70/54/03/474705403.db2.gz AKNCRINGLIWVNE-HNNXBMFYSA-N 0 3 336.779 2.598 20 5 EFBDHN COc1cc(C(=O)N[C@@H](C)CN2CCC[C@@H](C)C2)cc([N+](=O)[O-])c1C ZINC000253271718 474719091 /nfs/dbraw/zinc/71/90/91/474719091.db2.gz AQKIQGVULGVBQQ-OLZOCXBDSA-N 0 3 349.431 2.762 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H](C)CN2CCCCC2)c1 ZINC000344419035 474738498 /nfs/dbraw/zinc/73/84/98/474738498.db2.gz LILLNTWZOZNZJM-HNNXBMFYSA-N 0 3 349.431 2.663 20 5 EFBDHN CCNC(=O)C1(CN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CCC1 ZINC000278677824 474771978 /nfs/dbraw/zinc/77/19/78/474771978.db2.gz JOVKRMDGJXTDKO-MRXNPFEDSA-N 0 3 331.416 2.868 20 5 EFBDHN COc1ccc([C@@H](C)NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1 ZINC000273225396 474787584 /nfs/dbraw/zinc/78/75/84/474787584.db2.gz VNVYMFLHXBKHEN-UKRRQHHQSA-N 0 3 346.383 2.694 20 5 EFBDHN Cc1nn(C)c(N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000268102770 474797557 /nfs/dbraw/zinc/79/75/57/474797557.db2.gz APAWNEUBJZHCKF-IUODEOHRSA-N 0 3 329.404 2.712 20 5 EFBDHN Cc1nn(C)c(N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000268102772 474798513 /nfs/dbraw/zinc/79/85/13/474798513.db2.gz APAWNEUBJZHCKF-SWLSCSKDSA-N 0 3 329.404 2.712 20 5 EFBDHN CC(C)[C@H]1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CCCO1 ZINC000293096578 474810986 /nfs/dbraw/zinc/81/09/86/474810986.db2.gz KSRDOKXKCJVHTJ-MRXNPFEDSA-N 0 3 335.404 2.670 20 5 EFBDHN CCN1CCC[C@H]1CNC(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000268144978 474824596 /nfs/dbraw/zinc/82/45/96/474824596.db2.gz GDOPPGYFRUKRHY-ZDUSSCGKSA-N 0 3 340.811 2.532 20 5 EFBDHN CCc1nn(C)c(N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)c1[N+](=O)[O-] ZINC000310687732 474828638 /nfs/dbraw/zinc/82/86/38/474828638.db2.gz MVFQJQCDEIOZAR-CZUORRHYSA-N 0 3 343.431 2.966 20 5 EFBDHN CCc1nn(C)c(N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)c1[N+](=O)[O-] ZINC000310687734 474829500 /nfs/dbraw/zinc/82/95/00/474829500.db2.gz MVFQJQCDEIOZAR-XJKSGUPXSA-N 0 3 343.431 2.966 20 5 EFBDHN CC(C)C[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1F)N(C)C ZINC000273352509 474854512 /nfs/dbraw/zinc/85/45/12/474854512.db2.gz CTAYQBXCSIPEHQ-LBPRGKRZSA-N 0 3 326.372 2.832 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@]2(CCN(C)C2)C1 ZINC000292146346 474873253 /nfs/dbraw/zinc/87/32/53/474873253.db2.gz JRJNCJFZWKHJCV-CXAGYDPISA-N 0 3 349.456 2.630 20 5 EFBDHN CCCC[C@@H](CC)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000273388076 474875619 /nfs/dbraw/zinc/87/56/19/474875619.db2.gz DCRRUPRVZQSSCG-CYBMUJFWSA-N 0 3 328.434 2.927 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)/C=C\c1cccc([N+](=O)[O-])c1 ZINC000255582773 474877443 /nfs/dbraw/zinc/87/74/43/474877443.db2.gz JJQINMTYSZWZAP-BDUWGWSJSA-N 0 3 329.400 2.693 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CN(C2CC2)C[C@@H]1C ZINC000268241759 474883377 /nfs/dbraw/zinc/88/33/77/474883377.db2.gz VELVVWIBTZHOCX-MQIPJXDCSA-N 0 3 349.456 2.674 20 5 EFBDHN C[C@H](CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-])N1CCCC[C@H]1C ZINC000337336235 474908156 /nfs/dbraw/zinc/90/81/56/474908156.db2.gz LXHUOMQVEMSJDS-HUUCEWRRSA-N 0 3 348.447 2.999 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C\CN1CCC[C@@H](Cn2ccnn2)C1 ZINC000255908785 474918130 /nfs/dbraw/zinc/91/81/30/474918130.db2.gz KYYHAVVYMPWDRU-IJVDHGTGSA-N 0 3 327.388 2.612 20 5 EFBDHN CN(C)Cc1ccccc1CNC(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000255918564 474919613 /nfs/dbraw/zinc/91/96/13/474919613.db2.gz VAKCCXKJWRIKGE-XFXZXTDPSA-N 0 3 339.395 2.986 20 5 EFBDHN CNC(=O)c1ccc(CN(C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000285204962 474928206 /nfs/dbraw/zinc/92/82/06/474928206.db2.gz DFKGRTXGECXBOS-UHFFFAOYSA-N 0 3 327.384 2.629 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CCCCC[C@H]2C[C@@H](O)c2ccco2)c1 ZINC000268348704 474935114 /nfs/dbraw/zinc/93/51/14/474935114.db2.gz CRTMXCXJPAGUNL-GOEBONIOSA-N 0 3 348.403 2.753 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CCCCC[C@@H]2C[C@@H](O)c2ccco2)c1 ZINC000268348702 474935528 /nfs/dbraw/zinc/93/55/28/474935528.db2.gz CRTMXCXJPAGUNL-GDBMZVCRSA-N 0 3 348.403 2.753 20 5 EFBDHN CN(CCc1ccccc1[N+](=O)[O-])C[C@H](O)COc1ccccc1 ZINC000285229387 474937121 /nfs/dbraw/zinc/93/71/21/474937121.db2.gz FWETZYFMBQDOPR-INIZCTEOSA-N 0 3 330.384 2.509 20 5 EFBDHN CSc1ccccc1[C@H](C)NCCn1cc([N+](=O)[O-])ccc1=O ZINC000337369224 474946302 /nfs/dbraw/zinc/94/63/02/474946302.db2.gz OGFSAJRJLMDBAX-LBPRGKRZSA-N 0 3 333.413 2.829 20 5 EFBDHN C[C@H](CN(C)Cc1ccccc1)Nc1cccc(C(N)=O)c1[N+](=O)[O-] ZINC000341076164 474947490 /nfs/dbraw/zinc/94/74/90/474947490.db2.gz WPIWEYIRBWXKGG-CYBMUJFWSA-N 0 3 342.399 2.626 20 5 EFBDHN Cc1nc(NCc2ccccc2OCCN(C)C)ccc1[N+](=O)[O-] ZINC000268433742 474976676 /nfs/dbraw/zinc/97/66/76/474976676.db2.gz BPNJDMBQZBMUDJ-UHFFFAOYSA-N 0 3 330.388 2.851 20 5 EFBDHN C[C@H]1C[C@@H](N(C)c2ncc([N+](=O)[O-])cn2)CCN1Cc1ccccc1 ZINC000273590470 474979299 /nfs/dbraw/zinc/97/92/99/474979299.db2.gz HFOIUFPBBMVILM-HOCLYGCPSA-N 0 3 341.415 2.874 20 5 EFBDHN O=C(CN[C@@H]1CCCC[C@H]1OC(F)F)Nc1ccccc1[N+](=O)[O-] ZINC000337414670 474990931 /nfs/dbraw/zinc/99/09/31/474990931.db2.gz OXHJPPIFFMXPKG-DGCLKSJQSA-N 0 3 343.330 2.673 20 5 EFBDHN O=C(CN[C@H]1CCCC[C@H]1OC(F)F)Nc1ccccc1[N+](=O)[O-] ZINC000337414671 474991055 /nfs/dbraw/zinc/99/10/55/474991055.db2.gz OXHJPPIFFMXPKG-WCQYABFASA-N 0 3 343.330 2.673 20 5 EFBDHN CCC[C@@]1(NCC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CCOC1 ZINC000285365997 474991836 /nfs/dbraw/zinc/99/18/36/474991836.db2.gz AQTLLUCOFFVLTE-OAHLLOKOSA-N 0 3 341.795 2.736 20 5 EFBDHN CCC[C@H](NC[C@@H]1CN2CCC[C@@H]2CO1)c1cccc([N+](=O)[O-])c1 ZINC000325810944 474995771 /nfs/dbraw/zinc/99/57/71/474995771.db2.gz KDIYOUJVTFONGM-KURKYZTESA-N 0 3 333.432 2.889 20 5 EFBDHN C[C@H]1CN(c2nc3sccn3c2[N+](=O)[O-])CCN(C2CCC2)C1 ZINC000292427569 475020285 /nfs/dbraw/zinc/02/02/85/475020285.db2.gz WYNUBMSBHODWIH-LLVKDONJSA-N 0 3 335.433 2.615 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1NCCc2ccccc21 ZINC000261678077 475022795 /nfs/dbraw/zinc/02/27/95/475022795.db2.gz MNNKIVYNPWFJFD-QGZVFWFLSA-N 0 3 325.368 2.520 20 5 EFBDHN C[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CCN1C ZINC000341286061 475039436 /nfs/dbraw/zinc/03/94/36/475039436.db2.gz PYIDGYURCKGHFT-DZGCQCFKSA-N 0 3 326.400 2.973 20 5 EFBDHN C[C@@H]1CN(C(=O)CCc2cccc([N+](=O)[O-])c2)CCN(C2CCC2)C1 ZINC000292483320 475049984 /nfs/dbraw/zinc/04/99/84/475049984.db2.gz WAWNQSMPPXPPAI-HNNXBMFYSA-N 0 3 345.443 2.860 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CN1CCNC[C@H]1c1cccc(F)c1 ZINC000261761820 475052519 /nfs/dbraw/zinc/05/25/19/475052519.db2.gz OAJFMVLVBZQGCW-KRWDZBQOSA-N 0 3 345.374 2.889 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCN2CC[C@H](OCc3ccncc3)C2)c1 ZINC000281108722 475074976 /nfs/dbraw/zinc/07/49/76/475074976.db2.gz WPRRTVBCIWLQQW-SFHVURJKSA-N 0 3 343.383 2.660 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CN2CCCc3sccc3C2)c1 ZINC000609323365 480144205 /nfs/dbraw/zinc/14/42/05/480144205.db2.gz CWCOHIGJXAELFX-HNNXBMFYSA-N 0 3 348.424 2.844 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CN2CCCc3sccc3C2)c1 ZINC000609323366 480145135 /nfs/dbraw/zinc/14/51/35/480145135.db2.gz CWCOHIGJXAELFX-OAHLLOKOSA-N 0 3 348.424 2.844 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)CN1C1CC1 ZINC000273889496 475103021 /nfs/dbraw/zinc/10/30/21/475103021.db2.gz VDDNCWGDTLQAOY-RYUDHWBXSA-N 0 3 349.406 2.753 20 5 EFBDHN CCCN(CCN1CCCCCC1)C(=O)c1ccc([N+](=O)[O-])n1C ZINC000345337800 475106672 /nfs/dbraw/zinc/10/66/72/475106672.db2.gz IWTHHWUSHOQKRB-UHFFFAOYSA-N 0 3 336.436 2.662 20 5 EFBDHN CC[C@H]1CN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)CCCO1 ZINC000281217295 475119747 /nfs/dbraw/zinc/11/97/47/475119747.db2.gz BLTWFGIHZJZEFF-HNNXBMFYSA-N 0 3 335.404 2.733 20 5 EFBDHN CC[C@@H](C)N(CCO)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000287452915 475153556 /nfs/dbraw/zinc/15/35/56/475153556.db2.gz QSXPZRWDIZDEGL-SNVBAGLBSA-N 0 3 331.210 2.950 20 5 EFBDHN CCCN(CCN1CCCC1)C(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000287459944 475156821 /nfs/dbraw/zinc/15/68/21/475156821.db2.gz RYNFHHLFNRVPMS-UHFFFAOYSA-N 0 3 335.404 2.551 20 5 EFBDHN CCN1CC[C@@H]2OCCN(Cc3c(Cl)cccc3[N+](=O)[O-])[C@@H]2C1 ZINC000339378163 475174305 /nfs/dbraw/zinc/17/43/05/475174305.db2.gz CNTJRMGJNONXRP-CVEARBPZSA-N 0 3 339.823 2.543 20 5 EFBDHN CC[C@@H]1CN(CCC(=O)Nc2cccc([N+](=O)[O-])c2C)CCCO1 ZINC000281369629 475187699 /nfs/dbraw/zinc/18/76/99/475187699.db2.gz LRMLFZWYKPXHJI-CQSZACIVSA-N 0 3 335.404 2.733 20 5 EFBDHN CC[C@H]1CN(CCC(=O)Nc2cccc([N+](=O)[O-])c2C)CCCO1 ZINC000281369627 475188238 /nfs/dbraw/zinc/18/82/38/475188238.db2.gz LRMLFZWYKPXHJI-AWEZNQCLSA-N 0 3 335.404 2.733 20 5 EFBDHN COc1cc(CN([C@H](C)CO)C2CCCC2)c([N+](=O)[O-])cc1F ZINC000287561461 475196005 /nfs/dbraw/zinc/19/60/05/475196005.db2.gz BFCGUKNLYBDCLY-LLVKDONJSA-N 0 3 326.368 2.868 20 5 EFBDHN CCCOc1ccc([C@H](C)NCCn2cc([N+](=O)[O-])cn2)cc1OC ZINC000341649181 475205660 /nfs/dbraw/zinc/20/56/60/475205660.db2.gz XKILIBRCGODJIY-ZDUSSCGKSA-N 0 3 348.403 2.940 20 5 EFBDHN CNc1c(C(=O)N[C@H](C)CN2C[C@@H](C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000361180711 475249654 /nfs/dbraw/zinc/24/96/54/475249654.db2.gz UETWBTDCTSYILC-MELADBBJSA-N 0 3 348.447 2.733 20 5 EFBDHN COc1c(C(=O)NC[C@H](C)N2CCCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000354566220 475257999 /nfs/dbraw/zinc/25/79/99/475257999.db2.gz LLQCALJGIUYRPB-STQMWFEESA-N 0 3 335.404 2.596 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC(n2cncn2)CC1 ZINC000347353749 475259271 /nfs/dbraw/zinc/25/92/71/475259271.db2.gz HBKFNEOOPLMBHW-ZROIWOOFSA-N 0 3 327.388 2.927 20 5 EFBDHN COc1c(C(=O)NC[C@H](C)N2CCCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000354566217 475259369 /nfs/dbraw/zinc/25/93/69/475259369.db2.gz LLQCALJGIUYRPB-OLZOCXBDSA-N 0 3 335.404 2.596 20 5 EFBDHN C[C@H](NC(=O)c1ccc([N+](=O)[O-])c2cccnc12)C1=CCN(C)CC1 ZINC000357922723 475264246 /nfs/dbraw/zinc/26/42/46/475264246.db2.gz TWCUVKCIXUQYPP-LBPRGKRZSA-N 0 3 340.383 2.523 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)CCN1CCCC1 ZINC000361211918 475272178 /nfs/dbraw/zinc/27/21/78/475272178.db2.gz RPMLCZASIRJDIK-INIZCTEOSA-N 0 3 333.432 2.718 20 5 EFBDHN C[C@H]1CN(C)C[C@@H]1c1nc(Cc2c[nH]c3ccc([N+](=O)[O-])cc23)no1 ZINC000361262774 475312456 /nfs/dbraw/zinc/31/24/56/475312456.db2.gz PKCIJNIAJPELTD-HZMBPMFUSA-N 0 3 341.371 2.715 20 5 EFBDHN Cc1cnc(NCCc2ccc(OCCN(C)C)cc2)c([N+](=O)[O-])c1 ZINC000361266403 475315098 /nfs/dbraw/zinc/31/50/98/475315098.db2.gz SNFJDODZYNGLRY-UHFFFAOYSA-N 0 3 344.415 2.893 20 5 EFBDHN Cc1c(CNC(=O)[C@@H]2CCCN2C2CCCC2)cccc1[N+](=O)[O-] ZINC000331634503 475358530 /nfs/dbraw/zinc/35/85/30/475358530.db2.gz QTLKWOYVCSBUSF-KRWDZBQOSA-N 0 3 331.416 2.926 20 5 EFBDHN Cc1nc(NCCCN2CCc3ccccc3C2)ncc1[N+](=O)[O-] ZINC000296540309 475361751 /nfs/dbraw/zinc/36/17/51/475361751.db2.gz NWWUOQUGAMKMGV-UHFFFAOYSA-N 0 3 327.388 2.554 20 5 EFBDHN C[C@H](NC(=O)N[C@H]1C[C@@H](C)N(C2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000296590051 475385849 /nfs/dbraw/zinc/38/58/49/475385849.db2.gz WZBMFWCTCNKYEH-DYEKYZERSA-N 0 3 332.404 2.580 20 5 EFBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@@H](C(=O)N2CCCC2)C1 ZINC000331732655 475396842 /nfs/dbraw/zinc/39/68/42/475396842.db2.gz QTSYPTGBFPJYQV-GOEBONIOSA-N 0 3 331.416 2.990 20 5 EFBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@@H](C(=O)N2CCCC2)C1 ZINC000331732654 475397107 /nfs/dbraw/zinc/39/71/07/475397107.db2.gz QTSYPTGBFPJYQV-GDBMZVCRSA-N 0 3 331.416 2.990 20 5 EFBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H](C(=O)N2CCCC2)C1 ZINC000331737977 475399489 /nfs/dbraw/zinc/39/94/89/475399489.db2.gz USPGGZRYWCIJFG-GJZGRUSLSA-N 0 3 331.416 2.990 20 5 EFBDHN Cc1cc(N2CCN(C)CC[C@@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000339684314 475407864 /nfs/dbraw/zinc/40/78/64/475407864.db2.gz USYSAGUPTPXPNX-AWEZNQCLSA-N 0 3 341.415 2.891 20 5 EFBDHN CN1CCC(NC(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000331768406 475409231 /nfs/dbraw/zinc/40/92/31/475409231.db2.gz BLMFTQWKDYPNAJ-HNNXBMFYSA-N 0 3 346.431 2.578 20 5 EFBDHN CC(C)N1CCN(c2cccc(Nc3c([N+](=O)[O-])ncn3C)c2)CC1 ZINC000348128442 475413154 /nfs/dbraw/zinc/41/31/54/475413154.db2.gz ZMKIGXXFEDIDJV-UHFFFAOYSA-N 0 3 344.419 2.602 20 5 EFBDHN C[C@@H](NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CCCOC1 ZINC000348146034 475425518 /nfs/dbraw/zinc/42/55/18/475425518.db2.gz MOKGWKFFAUAKCJ-MNOVXSKESA-N 0 3 341.795 2.591 20 5 EFBDHN Cc1cc(F)c(NC(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000296685658 475428627 /nfs/dbraw/zinc/42/86/27/475428627.db2.gz IZJRCEOSYUVQKX-RYUDHWBXSA-N 0 3 338.383 2.989 20 5 EFBDHN CNC(=O)[C@@H]1CCC[C@@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000345834979 475492212 /nfs/dbraw/zinc/49/22/12/475492212.db2.gz BZCDSUAGZMJYTF-CVEARBPZSA-N 0 3 343.383 2.859 20 5 EFBDHN C[C@H](NC[C@H](O)COCc1cccs1)c1ccc([N+](=O)[O-])cc1 ZINC000296842420 475500539 /nfs/dbraw/zinc/50/05/39/475500539.db2.gz XHTZMMQSEZGVOL-WFASDCNBSA-N 0 3 336.413 2.885 20 5 EFBDHN Cc1nc(NC[C@H]2CCCN2Cc2ccccc2)ncc1[N+](=O)[O-] ZINC000296963289 475554962 /nfs/dbraw/zinc/55/49/62/475554962.db2.gz CRNDHACQDSDRCU-OAHLLOKOSA-N 0 3 327.388 2.770 20 5 EFBDHN COc1ccccc1C[C@H](NCc1c([N+](=O)[O-])ncn1C)C(C)C ZINC000348283058 475560146 /nfs/dbraw/zinc/56/01/46/475560146.db2.gz UWBVDCKDHFTUKG-AWEZNQCLSA-N 0 3 332.404 2.694 20 5 EFBDHN CC(C)N1CCCN(C(=O)C(C)(C)c2ccccc2[N+](=O)[O-])CC1 ZINC000339857062 475564591 /nfs/dbraw/zinc/56/45/91/475564591.db2.gz LKVMVEQXFPLINP-UHFFFAOYSA-N 0 3 333.432 2.815 20 5 EFBDHN COC(=O)[C@]12CN(Cc3cc([N+](=O)[O-])ccc3OC)C[C@@H]1CCCC2 ZINC000342158892 475566072 /nfs/dbraw/zinc/56/60/72/475566072.db2.gz RXMJTFYLODAGPJ-KBXCAEBGSA-N 0 3 348.399 2.769 20 5 EFBDHN C[C@@H]1C[C@H](N(C)C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)CCN1C ZINC000332240999 475570859 /nfs/dbraw/zinc/57/08/59/475570859.db2.gz IZQJQBZVUDEXEJ-VXGBXAGGSA-N 0 3 330.388 2.631 20 5 EFBDHN CCOc1ccc([C@@H](C)N[C@@H](CO)CCSC)cc1[N+](=O)[O-] ZINC000358315903 475585945 /nfs/dbraw/zinc/58/59/45/475585945.db2.gz HRLKMCXILWDAEH-DGCLKSJQSA-N 0 3 328.434 2.758 20 5 EFBDHN CN(CCN1CCCC1)C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000361616717 475599884 /nfs/dbraw/zinc/59/98/84/475599884.db2.gz OVLFUXVCEDGQIS-UHFFFAOYSA-N 0 3 345.321 2.781 20 5 EFBDHN CN(CCN1CCCC1)C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339916172 475610690 /nfs/dbraw/zinc/61/06/90/475610690.db2.gz FRMKVWOPHVJAOA-UHFFFAOYSA-N 0 3 345.321 2.781 20 5 EFBDHN COC(=O)COc1ccc(CN2CC[C@H]3CCC[C@H]32)cc1[N+](=O)[O-] ZINC000355034384 475613710 /nfs/dbraw/zinc/61/37/10/475613710.db2.gz HCWBDZARJMMTDD-ZIAGYGMSSA-N 0 3 334.372 2.521 20 5 EFBDHN COc1cc(CN2CCC[C@@H](Cc3nccn3C)C2)ccc1[N+](=O)[O-] ZINC000352777905 475614374 /nfs/dbraw/zinc/61/43/74/475614374.db2.gz IHKKTWUTSCFIGO-AWEZNQCLSA-N 0 3 344.415 2.792 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@H](N2CCN(C)CC2)[C@H](C)C1 ZINC000332398324 475625162 /nfs/dbraw/zinc/62/51/62/475625162.db2.gz QRTJQZQGXAGOQZ-NUJGCVRESA-N 0 3 346.475 2.614 20 5 EFBDHN C[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)C1=CCN(C)CC1 ZINC000358370482 475626006 /nfs/dbraw/zinc/62/60/06/475626006.db2.gz CPVFAPQBCNEJGU-LLVKDONJSA-N 0 3 337.807 2.557 20 5 EFBDHN COc1ccc(OCCN2C[C@@H]3CCCCN3C[C@@H]2C)c([N+](=O)[O-])c1 ZINC000332423289 475632745 /nfs/dbraw/zinc/63/27/45/475632745.db2.gz AQWQHRKPSXTMDG-GJZGRUSLSA-N 0 3 349.431 2.541 20 5 EFBDHN CN(CC1CCN(C)CC1)C(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000339948211 475633298 /nfs/dbraw/zinc/63/32/98/475633298.db2.gz OFHAQZXGDJWHOX-UHFFFAOYSA-N 0 3 333.432 2.673 20 5 EFBDHN COc1ccc(-c2ccc(CN3C[C@H](C)[C@@H](CO)C3)o2)c([N+](=O)[O-])c1 ZINC000361659686 475639721 /nfs/dbraw/zinc/63/97/21/475639721.db2.gz IQAVMGBAYMGFEF-QWHCGFSZSA-N 0 3 346.383 2.924 20 5 EFBDHN CC1(C)C[C@H](N[C@@H]2CCC(=O)N[C@@H]2C2CC2)c2cc([N+](=O)[O-])ccc21 ZINC000342808261 475642425 /nfs/dbraw/zinc/64/24/25/475642425.db2.gz AVGQXJCLJGYNJF-SOLBZPMBSA-N 0 3 343.427 2.964 20 5 EFBDHN C[C@H](CNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12)N1CCC[C@H](C)C1 ZINC000342923723 475655859 /nfs/dbraw/zinc/65/58/59/475655859.db2.gz FYWRPMAKWNTMGR-QWHCGFSZSA-N 0 3 344.415 2.926 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[C@]2(CCN(C)C2)C1 ZINC000297250985 475675686 /nfs/dbraw/zinc/67/56/86/475675686.db2.gz RVRYEXIFTTWUAT-KRWDZBQOSA-N 0 3 332.404 2.771 20 5 EFBDHN Cc1ccc(CCCNCc2nc3cc([N+](=O)[O-])ccc3[nH]2)cn1 ZINC000355120212 475680657 /nfs/dbraw/zinc/68/06/57/475680657.db2.gz GHYGBVDNDQJHCY-UHFFFAOYSA-N 0 3 325.372 2.897 20 5 EFBDHN CN1CCC[C@@H]1CNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000355168114 475714489 /nfs/dbraw/zinc/71/44/89/475714489.db2.gz SGIZMDYILWQUAI-SNVBAGLBSA-N 0 3 346.309 2.829 20 5 EFBDHN CCCN(CCN1CCCCC1)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000353150644 475722848 /nfs/dbraw/zinc/72/28/48/475722848.db2.gz SIVNKEXCYJSFID-UHFFFAOYSA-N 0 3 348.447 2.731 20 5 EFBDHN C[C@H](N[C@@H]1CCC[C@@H]1OC(F)F)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000348531968 475731049 /nfs/dbraw/zinc/73/10/49/475731049.db2.gz MXJUWPRMHLQHGA-BIMULSAOSA-N 0 3 343.330 2.672 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@H]1CCC[C@@H]1OC(F)F ZINC000348538669 475738693 /nfs/dbraw/zinc/73/86/93/475738693.db2.gz UPSFNBNPILZABE-STQMWFEESA-N 0 3 343.330 2.592 20 5 EFBDHN NC(=O)[C@H](CNCc1cccc([N+](=O)[O-])c1)Cc1ccccc1Cl ZINC000346674135 475754396 /nfs/dbraw/zinc/75/43/96/475754396.db2.gz TYDIQNOEIXYSIY-AWEZNQCLSA-N 0 3 347.802 2.682 20 5 EFBDHN Cc1cnc(CCNCc2cc([N+](=O)[O-])ccc2OC(F)F)nc1 ZINC000340109572 475766019 /nfs/dbraw/zinc/76/60/19/475766019.db2.gz RZFPWASKBGRLRU-UHFFFAOYSA-N 0 3 338.314 2.627 20 5 EFBDHN C[C@@H](NC(=O)N1CCN(C2CC2)C[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000297472580 475771351 /nfs/dbraw/zinc/77/13/51/475771351.db2.gz UVXKMGNOFIOTAK-ZIAGYGMSSA-N 0 3 346.431 2.782 20 5 EFBDHN C[C@H](CNC(=O)NCCc1cccc([N+](=O)[O-])c1)N1CCCC[C@H]1C ZINC000340118732 475772049 /nfs/dbraw/zinc/77/20/49/475772049.db2.gz VGSTYGBTJNPGKH-HUUCEWRRSA-N 0 3 348.447 2.699 20 5 EFBDHN C[C@@H](CNC(=O)NCCc1cccc([N+](=O)[O-])c1)N1CCCC[C@@H]1C ZINC000340118731 475772799 /nfs/dbraw/zinc/77/27/99/475772799.db2.gz VGSTYGBTJNPGKH-GJZGRUSLSA-N 0 3 348.447 2.699 20 5 EFBDHN Cc1c(CNC(=O)N[C@H](C)CN2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000358584025 475785862 /nfs/dbraw/zinc/78/58/62/475785862.db2.gz PTLWRXLVPCQYIP-UONOGXRCSA-N 0 3 348.447 2.823 20 5 EFBDHN Cc1c(CNC(=O)N[C@@H](C)CN2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000358584017 475786634 /nfs/dbraw/zinc/78/66/34/475786634.db2.gz PTLWRXLVPCQYIP-KBPBESRZSA-N 0 3 348.447 2.823 20 5 EFBDHN Cc1c(CNC(=O)NC[C@H](C)N2CCC(C)CC2)cccc1[N+](=O)[O-] ZINC000358586863 475789591 /nfs/dbraw/zinc/78/95/91/475789591.db2.gz HJNKSJAYHYVOTC-AWEZNQCLSA-N 0 3 348.447 2.823 20 5 EFBDHN C[C@H](NC(=O)N(C)[C@H]1CCN(C)C[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000297544085 475801443 /nfs/dbraw/zinc/80/14/43/475801443.db2.gz JCZOLLYUXZDMGR-XEZPLFJOSA-N 0 3 334.420 2.637 20 5 EFBDHN CS[C@@H]1CN(c2nccc3cc([N+](=O)[O-])ccc32)C[C@H]1N(C)C ZINC000297557683 475806991 /nfs/dbraw/zinc/80/69/91/475806991.db2.gz RIYJGWXXJIPCBC-HUUCEWRRSA-N 0 3 332.429 2.625 20 5 EFBDHN COCC[C@@H](NCC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C(C)(C)C ZINC000338347880 475811014 /nfs/dbraw/zinc/81/10/14/475811014.db2.gz DFKPVGQJOAPXGC-MRXNPFEDSA-N 0 3 349.431 2.525 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000340167354 475817854 /nfs/dbraw/zinc/81/78/54/475817854.db2.gz WSVSTBWCBNPGCT-AWEZNQCLSA-N 0 3 333.432 2.863 20 5 EFBDHN CN(Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)[C@@H]1CCCOC1 ZINC000348706948 475827721 /nfs/dbraw/zinc/82/77/21/475827721.db2.gz IICDVADVYQZYJC-MRXNPFEDSA-N 0 3 330.388 2.606 20 5 EFBDHN CNC(=O)c1cccc(CN(C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000338366330 475831409 /nfs/dbraw/zinc/83/14/09/475831409.db2.gz XAAUYRWDRYPYKZ-UHFFFAOYSA-N 0 3 327.384 2.629 20 5 EFBDHN CN(CCc1cccc([N+](=O)[O-])c1)Cc1ccc2c(c1)nnn2C ZINC000338380474 475843878 /nfs/dbraw/zinc/84/38/78/475843878.db2.gz JRLXJKOTZXAKKA-UHFFFAOYSA-N 0 3 325.372 2.551 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](C)N2CCCC[C@H]2C)c1 ZINC000338408863 475876268 /nfs/dbraw/zinc/87/62/68/475876268.db2.gz KPDBSNVIPVVBPK-KGLIPLIRSA-N 0 3 349.431 2.986 20 5 EFBDHN C[C@H](CNC(=O)CCOc1ccccc1[N+](=O)[O-])N1CCCC[C@@H]1C ZINC000340266594 475901175 /nfs/dbraw/zinc/90/11/75/475901175.db2.gz FEJSPPHWCZIMLV-LSDHHAIUSA-N 0 3 349.431 2.743 20 5 EFBDHN CC[C@@H]1CCCCN1CCNC(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000358768335 475919203 /nfs/dbraw/zinc/91/92/03/475919203.db2.gz UPFQCMAJGMAXGN-OAHLLOKOSA-N 0 3 349.431 2.906 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)[C@@H](CN)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000358813943 475959871 /nfs/dbraw/zinc/95/98/71/475959871.db2.gz OFLCNRTYNVPQMA-WBMJQRKESA-N 0 3 345.374 2.962 20 5 EFBDHN CC(C)n1nccc1[C@@H]1OCC[C@H]1NCc1cccc([N+](=O)[O-])c1 ZINC000343391325 476014663 /nfs/dbraw/zinc/01/46/63/476014663.db2.gz CLKWYXSMVXSWGH-NVXWUHKLSA-N 0 3 330.388 2.992 20 5 EFBDHN CN(CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](CO)c1ccccc1 ZINC000298245246 476033285 /nfs/dbraw/zinc/03/32/85/476033285.db2.gz SRKQGDVXVJKDPX-KRWDZBQOSA-N 0 3 343.383 2.589 20 5 EFBDHN CC[C@H]1CCCCN1CCNC(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000358913513 476035261 /nfs/dbraw/zinc/03/52/61/476035261.db2.gz DXDSHRVMHHTTMD-INIZCTEOSA-N 0 3 348.447 2.967 20 5 EFBDHN CCn1ccnc1[C@H]1OCC[C@H]1NCc1ccc([N+](=O)[O-])cc1C ZINC000343408090 476037075 /nfs/dbraw/zinc/03/70/75/476037075.db2.gz WZTPICBIQLBOBF-CVEARBPZSA-N 0 3 330.388 2.739 20 5 EFBDHN C[C@H]1[C@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCCN1C ZINC000343425357 476053014 /nfs/dbraw/zinc/05/30/14/476053014.db2.gz YQCZJEDZQSTKNN-TVQRCGJNSA-N 0 3 345.321 2.826 20 5 EFBDHN C[C@@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)c1csc([N+](=O)[O-])c1 ZINC000334005943 476086299 /nfs/dbraw/zinc/08/62/99/476086299.db2.gz YQTWPASNQVPKAI-UTUOFQBUSA-N 0 3 325.434 2.753 20 5 EFBDHN CN1CCC[C@]2(CCN(C(=O)c3c[nH]c4cccc([N+](=O)[O-])c34)C2)C1 ZINC000356307798 476096215 /nfs/dbraw/zinc/09/62/15/476096215.db2.gz CNTOLTSQXODCKV-SFHVURJKSA-N 0 3 342.399 2.634 20 5 EFBDHN CN1CCC[C@@]2(CCN(C(=O)c3c[nH]c4cccc([N+](=O)[O-])c34)C2)C1 ZINC000356307793 476097300 /nfs/dbraw/zinc/09/73/00/476097300.db2.gz CNTOLTSQXODCKV-GOSISDBHSA-N 0 3 342.399 2.634 20 5 EFBDHN COc1ccc(-c2ccc(CNC[C@H]3CCOC3)o2)c([N+](=O)[O-])c1 ZINC000338716001 476129786 /nfs/dbraw/zinc/12/97/86/476129786.db2.gz JXUYGNATFJNMHZ-GFCCVEGCSA-N 0 3 332.356 2.990 20 5 EFBDHN CCC(CC)(CC(=O)OC)NCc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000362324362 476171350 /nfs/dbraw/zinc/17/13/50/476171350.db2.gz QQLVFNLSGYYAEB-UHFFFAOYSA-N 0 3 342.367 2.954 20 5 EFBDHN CN(C)[C@@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000344240848 476173702 /nfs/dbraw/zinc/17/37/02/476173702.db2.gz NZFMKFZLISWCFQ-QGZVFWFLSA-N 0 3 345.374 2.637 20 5 EFBDHN CN(C)[C@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000344240847 476174196 /nfs/dbraw/zinc/17/41/96/476174196.db2.gz NZFMKFZLISWCFQ-KRWDZBQOSA-N 0 3 345.374 2.637 20 5 EFBDHN CN(CCNc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)C1CC1 ZINC000362359944 476194194 /nfs/dbraw/zinc/19/41/94/476194194.db2.gz QXXCADZFIAFKDO-UHFFFAOYSA-N 0 3 330.363 2.724 20 5 EFBDHN CN(C)CCN(CC1CCCCC1)C(=O)c1ccc([N+](=O)[O-])n1C ZINC000347243214 476198433 /nfs/dbraw/zinc/19/84/33/476198433.db2.gz UQTRMXDIUDCEPI-UHFFFAOYSA-N 0 3 336.436 2.517 20 5 EFBDHN CN1CCCC(C)(C)[C@@H]1CNC(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000347257587 476210203 /nfs/dbraw/zinc/21/02/03/476210203.db2.gz JOZOZZUQGLQLRB-AWEZNQCLSA-N 0 3 338.383 2.976 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CNC[C@@H]2CC[C@@H](CO)O2)s1 ZINC000353718752 476215672 /nfs/dbraw/zinc/21/56/72/476215672.db2.gz ZNTGIGYHHQFBBE-STQMWFEESA-N 0 3 348.424 2.953 20 5 EFBDHN CC[C@H](NC(=O)N[C@H]1CCCN(C)[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000344285394 476216223 /nfs/dbraw/zinc/21/62/23/476216223.db2.gz KKYDUDWDQBFGCO-KCXAZCMYSA-N 0 3 334.420 2.828 20 5 EFBDHN CCOc1cc(N2CCN(C3CCOCC3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000362667902 476345929 /nfs/dbraw/zinc/34/59/29/476345929.db2.gz SHFTWMOJFPETSA-AWEZNQCLSA-N 0 3 349.431 2.683 20 5 EFBDHN O=C(CCN1CCCc2occc2C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000377516930 476430718 /nfs/dbraw/zinc/43/07/18/476430718.db2.gz BBPJAKRQDIUFLQ-UHFFFAOYSA-N 0 3 329.356 2.965 20 5 EFBDHN CN1CCC2(CCN(C/C=C/c3ccccc3[N+](=O)[O-])CC2)C1=O ZINC000369650248 476459077 /nfs/dbraw/zinc/45/90/77/476459077.db2.gz UIWBUYKPDNUQHV-GQCTYLIASA-N 0 3 329.400 2.552 20 5 EFBDHN O=[N+]([O-])c1ccn(C2CCN(CC[C@H](O)c3ccccc3)CC2)n1 ZINC000377608940 476472854 /nfs/dbraw/zinc/47/28/54/476472854.db2.gz VCQJACHAZMLGDL-INIZCTEOSA-N 0 3 330.388 2.552 20 5 EFBDHN O=C(CCN1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccccc1 ZINC000369693563 476479804 /nfs/dbraw/zinc/47/98/04/476479804.db2.gz UCFVHDPUSUWESH-UHFFFAOYSA-N 0 3 328.372 2.701 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000360940528 476490696 /nfs/dbraw/zinc/49/06/96/476490696.db2.gz ZWMSDMLNMZELFJ-GOEBONIOSA-N 0 3 345.443 2.930 20 5 EFBDHN Cc1cc(NCc2ccc(N(C)C)nc2)c2cc([N+](=O)[O-])ccc2n1 ZINC000360949384 476495971 /nfs/dbraw/zinc/49/59/71/476495971.db2.gz KANDHZWZEMADIA-UHFFFAOYSA-N 0 3 337.383 2.946 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCN(CCCO)Cc2ccccc2)c1 ZINC000362963096 476505576 /nfs/dbraw/zinc/50/55/76/476505576.db2.gz ICKJTPVHJDILTD-UHFFFAOYSA-N 0 3 330.384 2.858 20 5 EFBDHN CN1CCC2(CCCN2C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)CC1 ZINC000351986767 476513769 /nfs/dbraw/zinc/51/37/69/476513769.db2.gz METKYCMVGLFXFA-UHFFFAOYSA-N 0 3 342.399 2.777 20 5 EFBDHN O=C1CC[C@@H](N[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C2(CCC2)N1 ZINC000374808884 476538417 /nfs/dbraw/zinc/53/84/17/476538417.db2.gz OJJVLKBOUMERQX-HZPDHXFCSA-N 0 3 329.400 2.763 20 5 EFBDHN O=C1CCCN1C[C@H]1CCCCN1CCc1ccc([N+](=O)[O-])cc1 ZINC000363081272 476551880 /nfs/dbraw/zinc/55/18/80/476551880.db2.gz HPOFRPQJTSNTSI-QGZVFWFLSA-N 0 3 331.416 2.614 20 5 EFBDHN C[C@@H]1CCC[C@@H](C)N(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000357735609 476567698 /nfs/dbraw/zinc/56/76/98/476567698.db2.gz YLXOMFAKZVJPOU-ZIAGYGMSSA-N 0 3 331.416 2.994 20 5 EFBDHN CN(CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H]1CCCOC1 ZINC000352230140 476568977 /nfs/dbraw/zinc/56/89/77/476568977.db2.gz IFLFCWHYXZHFLF-OAHLLOKOSA-N 0 3 331.372 2.903 20 5 EFBDHN C[C@H](NCCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1cncc(F)c1 ZINC000361134394 476626618 /nfs/dbraw/zinc/62/66/18/476626618.db2.gz FNBMJZRNOWYZHZ-NSHDSACASA-N 0 3 332.335 2.808 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@H](C)C(=O)N(C)C ZINC000357835491 476638905 /nfs/dbraw/zinc/63/89/05/476638905.db2.gz PBLNMMYPCXIFKN-VXGBXAGGSA-N 0 3 325.434 2.532 20 5 EFBDHN C[C@@H]1[C@H](NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)CCCN1C ZINC000357853602 476650303 /nfs/dbraw/zinc/65/03/03/476650303.db2.gz ZNDBFTKGZPXOSM-IAQYHMDHSA-N 0 3 337.395 2.610 20 5 EFBDHN Cc1cccc(OCCN2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1 ZINC000365823069 476716811 /nfs/dbraw/zinc/71/68/11/476716811.db2.gz UFEXGRINTCLTFI-UHFFFAOYSA-N 0 3 330.388 2.816 20 5 EFBDHN Cc1cc(N2CC[C@@H]3CCN(C)C[C@H]32)c2cccc([N+](=O)[O-])c2n1 ZINC000378508162 476718077 /nfs/dbraw/zinc/71/80/77/476718077.db2.gz OWDSASWMSUMHJU-SUMWQHHRSA-N 0 3 326.400 2.982 20 5 EFBDHN C[C@H]1CN(CC(C)(C)O)CCN1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000444671276 476726135 /nfs/dbraw/zinc/72/61/35/476726135.db2.gz FXOAHROWTZXQCQ-LBPRGKRZSA-N 0 3 341.839 2.525 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CN[C@H](C)c1ccc(CN)nc1C ZINC000422720391 476742966 /nfs/dbraw/zinc/74/29/66/476742966.db2.gz SKCVOQFXWFOYJQ-LLVKDONJSA-N 0 3 330.388 2.616 20 5 EFBDHN CCO[C@@H]1CCCC[C@H]1N[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000452032371 476783059 /nfs/dbraw/zinc/78/30/59/476783059.db2.gz CWLRTTVVDBFXRB-IXDOHACOSA-N 0 3 347.415 2.637 20 5 EFBDHN Cc1n[nH]cc1C1CCN(CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000375333050 476783915 /nfs/dbraw/zinc/78/39/15/476783915.db2.gz FABVNENOCIDILU-UHFFFAOYSA-N 0 3 330.388 2.885 20 5 EFBDHN CC(C)[C@@H](CC(F)(F)F)NCc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000445886506 476788467 /nfs/dbraw/zinc/78/84/67/476788467.db2.gz NZLIUBFUGIEWKA-LLVKDONJSA-N 0 3 333.310 2.760 20 5 EFBDHN CC(C)N1CC[C@H](N(C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000452121327 476840097 /nfs/dbraw/zinc/84/00/97/476840097.db2.gz SOPZSINPMZCOPI-HNNXBMFYSA-N 0 3 345.403 2.559 20 5 EFBDHN C[C@@H](C(=O)NCCN1CCCC1(C)C)c1ccc([N+](=O)[O-])cc1F ZINC000457051352 476847024 /nfs/dbraw/zinc/84/70/24/476847024.db2.gz HZNCBJTXQHBZKU-GFCCVEGCSA-N 0 3 337.395 2.828 20 5 EFBDHN CC1(C)CCCN1CCNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000457059752 476852686 /nfs/dbraw/zinc/85/26/86/476852686.db2.gz QQZYUVCYFVHKTC-UHFFFAOYSA-N 0 3 347.415 2.548 20 5 EFBDHN CC(C)N1CC[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000457078029 476861089 /nfs/dbraw/zinc/86/10/89/476861089.db2.gz AIHBICXQDWIVGI-CYBMUJFWSA-N 0 3 342.399 2.698 20 5 EFBDHN CC(C)N1CC[C@H](N(C)C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C1 ZINC000457102433 476875523 /nfs/dbraw/zinc/87/55/23/476875523.db2.gz ZXHDUEOMNHQWKW-LBPRGKRZSA-N 0 3 330.388 2.631 20 5 EFBDHN CC(C)N1CC[C@@H](N(C)C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000457105379 476876938 /nfs/dbraw/zinc/87/69/38/476876938.db2.gz CFGFRMMFVQUDAU-MRXNPFEDSA-N 0 3 333.432 2.814 20 5 EFBDHN CN(C)C1(CNC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)CCC1 ZINC000446619002 476896333 /nfs/dbraw/zinc/89/63/33/476896333.db2.gz ZBCINVSTSSIFAX-UHFFFAOYSA-N 0 3 346.431 2.753 20 5 EFBDHN CCOc1cc(CN2CC[C@@H](Cc3cnn(C)c3)C2)ccc1[N+](=O)[O-] ZINC000370623190 476900308 /nfs/dbraw/zinc/90/03/08/476900308.db2.gz WFBFMCPEDRLBPP-HNNXBMFYSA-N 0 3 344.415 2.792 20 5 EFBDHN CC(C)(C(=O)NCCc1ccc([N+](=O)[O-])cc1)[C@H](N)c1ccccc1 ZINC000423059841 476910638 /nfs/dbraw/zinc/91/06/38/476910638.db2.gz MWYIHSZIYMFGEW-QGZVFWFLSA-N 0 3 341.411 2.980 20 5 EFBDHN Cc1cc(OCC(=O)N(CCN(C)C)C2CCCC2)ccc1[N+](=O)[O-] ZINC000430808099 476920108 /nfs/dbraw/zinc/92/01/08/476920108.db2.gz XTILOWRBFUAKQA-UHFFFAOYSA-N 0 3 349.431 2.615 20 5 EFBDHN CC(C)C[C@@H](CN1CCCC1)NC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000452343558 476924451 /nfs/dbraw/zinc/92/44/51/476924451.db2.gz LLGZJKLKSCGXTI-ZDUSSCGKSA-N 0 3 337.395 2.974 20 5 EFBDHN C[C@@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)[C@H](C)CN1 ZINC000415429216 476924912 /nfs/dbraw/zinc/92/49/12/476924912.db2.gz AXLSQKPKLJHGCA-RKDXNWHRSA-N 0 3 346.309 2.828 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](CC(C)C)CN1CCCC1 ZINC000452343092 476925259 /nfs/dbraw/zinc/92/52/59/476925259.db2.gz VEQGVSVBYYVTRC-AWEZNQCLSA-N 0 3 349.431 2.844 20 5 EFBDHN O=[N+]([O-])c1ccn(C2CCN(CC[C@@H](O)c3ccccc3)CC2)n1 ZINC000375643155 476931763 /nfs/dbraw/zinc/93/17/63/476931763.db2.gz VCQJACHAZMLGDL-MRXNPFEDSA-N 0 3 330.388 2.552 20 5 EFBDHN N[C@@H](CC1CCCCC1)C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000423188199 476959849 /nfs/dbraw/zinc/95/98/49/476959849.db2.gz PUJINQVNHNFEII-KRWDZBQOSA-N 0 3 331.416 2.777 20 5 EFBDHN O=C(C1CN(C2CCCCC2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000457417705 477012526 /nfs/dbraw/zinc/01/25/26/477012526.db2.gz LISIBAYXDUBTCP-UHFFFAOYSA-N 0 3 329.400 2.748 20 5 EFBDHN COc1ccc(C(=O)N(C)C(C)(C)CN2CCCC2)cc1[N+](=O)[O-] ZINC000416090506 477014300 /nfs/dbraw/zinc/01/43/00/477014300.db2.gz DPTNYTLJJLHBRM-UHFFFAOYSA-N 0 3 335.404 2.550 20 5 EFBDHN CN(C)c1cccc(CN[C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)n1 ZINC000447589643 477018711 /nfs/dbraw/zinc/01/87/11/477018711.db2.gz YTHOYUSLKGSGBH-GJZGRUSLSA-N 0 3 344.419 2.526 20 5 EFBDHN CC(C)c1ccc(CN[C@H]2CCN(c3cnn(C)c3)C2)cc1[N+](=O)[O-] ZINC000370906333 477032354 /nfs/dbraw/zinc/03/23/54/477032354.db2.gz VGNBOWRIYINCFR-HNNXBMFYSA-N 0 3 343.431 2.820 20 5 EFBDHN CN(C)[C@H](CC(=O)NCCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000416158245 477045854 /nfs/dbraw/zinc/04/58/54/477045854.db2.gz SGYMPGMIGDTHQX-GOSISDBHSA-N 0 3 341.411 2.947 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1NCCN(C)C1CC1 ZINC000447814438 477065851 /nfs/dbraw/zinc/06/58/51/477065851.db2.gz YBUZUCXKYWKLFW-UHFFFAOYSA-N 0 3 327.768 2.541 20 5 EFBDHN CC(C)N1CCN([C@H]2CCN([C@H](C)c3cccc([N+](=O)[O-])c3)C2)CC1 ZINC000375892988 477066070 /nfs/dbraw/zinc/06/60/70/477066070.db2.gz WSPWVNSMMUYCFA-APWZRJJASA-N 0 3 346.475 2.756 20 5 EFBDHN C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000375903507 477072659 /nfs/dbraw/zinc/07/26/59/477072659.db2.gz SFAOZMTZHICJBD-ABAIWWIYSA-N 0 3 337.807 2.947 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)NCc1ccc2c(c1)CNC2 ZINC000423584326 477076148 /nfs/dbraw/zinc/07/61/48/477076148.db2.gz DGZGTYWIVCIMGI-UHFFFAOYSA-N 0 3 341.367 2.527 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1C[C@@H](c2ccccc2)[C@H](N)C1 ZINC000423606526 477082892 /nfs/dbraw/zinc/08/28/92/477082892.db2.gz INBVZKXBZFOOKC-DLBZAZTESA-N 0 3 339.395 2.779 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[C@@]2(CCN(C)C2)C1 ZINC000366599923 477088910 /nfs/dbraw/zinc/08/89/10/477088910.db2.gz XABOTDIGIJJKGC-QGZVFWFLSA-N 0 3 332.404 2.771 20 5 EFBDHN Cc1c(CC(=O)Nc2ccc3c(c2)CNCCO3)cccc1[N+](=O)[O-] ZINC000423647260 477098394 /nfs/dbraw/zinc/09/83/94/477098394.db2.gz AVVZULHNUMDHNW-UHFFFAOYSA-N 0 3 341.367 2.566 20 5 EFBDHN CN1CCCC(C)(C)[C@@H]1CNC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000447982657 477109301 /nfs/dbraw/zinc/10/93/01/477109301.db2.gz MHABJLJHYWNQOG-INIZCTEOSA-N 0 3 348.447 2.557 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NC[C@@H]1N(C)CCCC1(C)C ZINC000448028090 477119590 /nfs/dbraw/zinc/11/95/90/477119590.db2.gz BHITWPMJEUZRGW-INIZCTEOSA-N 0 3 348.447 2.857 20 5 EFBDHN O=[N+]([O-])c1ccn(C2CCN(CCc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000366743598 477163563 /nfs/dbraw/zinc/16/35/63/477163563.db2.gz GQOBJVOWGJKRDB-UHFFFAOYSA-N 0 3 345.359 2.579 20 5 EFBDHN CCO[C@@H]1COC[C@H]1N[C@H](CC)CSc1ccccc1[N+](=O)[O-] ZINC000453376489 477218369 /nfs/dbraw/zinc/21/83/69/477218369.db2.gz XHVFSMWGBKOAOV-UMVBOHGHSA-N 0 3 340.445 2.859 20 5 EFBDHN CC(C)Oc1cc(C(=O)NCCN2CCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000411416430 477227347 /nfs/dbraw/zinc/22/73/47/477227347.db2.gz OJDOXPANPVIOKH-CQSZACIVSA-N 0 3 349.431 2.844 20 5 EFBDHN CCOc1ccc([C@H](C)NC[C@H]2CN3CCC[C@@H]3CO2)cc1[N+](=O)[O-] ZINC000371316310 477237267 /nfs/dbraw/zinc/23/72/67/477237267.db2.gz CRHFGLANERJBGN-IMJJTQAJSA-N 0 3 349.431 2.507 20 5 EFBDHN O=C(CCN[C@@H](CCO)c1ccccc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411446937 477237893 /nfs/dbraw/zinc/23/78/93/477237893.db2.gz OWAUJAFDXDUREG-KRWDZBQOSA-N 0 3 343.383 2.637 20 5 EFBDHN C[C@@]1(CNCc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCC(=O)N1 ZINC000453585908 477242908 /nfs/dbraw/zinc/24/29/08/477242908.db2.gz HUFLYEIDDYKGGM-KRWDZBQOSA-N 0 3 329.356 2.613 20 5 EFBDHN COc1cc(NCCCN2CCCO[C@@H](C)C2)c(F)cc1[N+](=O)[O-] ZINC000432863417 477280262 /nfs/dbraw/zinc/28/02/62/477280262.db2.gz DGVLNYMMCBPSSW-LBPRGKRZSA-N 0 3 341.383 2.655 20 5 EFBDHN CN(CCNC(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)C1CC1 ZINC000454644153 477308016 /nfs/dbraw/zinc/30/80/16/477308016.db2.gz OBTULCWJHPCKGL-OAHLLOKOSA-N 0 3 346.431 2.578 20 5 EFBDHN O=C(CCCc1ccccc1)NCCNCc1ccc([N+](=O)[O-])cc1 ZINC000424191040 477323595 /nfs/dbraw/zinc/32/35/95/477323595.db2.gz QMYQMSPUSDGHSU-UHFFFAOYSA-N 0 3 341.411 2.824 20 5 EFBDHN Nc1ccc(NCC2CCN(c3ccncc3)CC2)c([N+](=O)[O-])c1 ZINC000376445418 477337304 /nfs/dbraw/zinc/33/73/04/477337304.db2.gz BFZNNZUETDYXLL-UHFFFAOYSA-N 0 3 327.388 2.901 20 5 EFBDHN C[C@@H]1[C@@H](N2CCCC2)CCN1C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000376446134 477339291 /nfs/dbraw/zinc/33/92/91/477339291.db2.gz FJBUQZRCDIVYKY-ABAIWWIYSA-N 0 3 337.807 2.947 20 5 EFBDHN CC(C)(O)CN1CCc2c(cccc2Nc2ncc([N+](=O)[O-])s2)C1 ZINC000367141355 477361694 /nfs/dbraw/zinc/36/16/94/477361694.db2.gz RUIFWIOYZUQEFX-UHFFFAOYSA-N 0 3 348.428 2.924 20 5 EFBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[C@@](C(N)=O)(c2ccccc2)C1 ZINC000411971584 477401247 /nfs/dbraw/zinc/40/12/47/477401247.db2.gz UERVPZCZIXDMGY-LIRRHRJNSA-N 0 3 339.395 2.785 20 5 EFBDHN C[C@@H](N[C@@H](C)Cc1ccccc1[N+](=O)[O-])C(=O)NCc1ccccc1 ZINC000449088925 477432628 /nfs/dbraw/zinc/43/26/28/477432628.db2.gz CCNAWZOASCJRME-LSDHHAIUSA-N 0 3 341.411 2.820 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N[C@H](C)C(=O)NCc1ccccc1 ZINC000449088762 477433471 /nfs/dbraw/zinc/43/34/71/477433471.db2.gz CCNAWZOASCJRME-HUUCEWRRSA-N 0 3 341.411 2.820 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])NCc1ccc(S(C)(=O)=O)cc1 ZINC000449103353 477440347 /nfs/dbraw/zinc/44/03/47/477440347.db2.gz PSWBTAYKBJZYJZ-ZDUSSCGKSA-N 0 3 348.424 2.719 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N[C@@H](C)C(=O)N1CCCC[C@@H]1C ZINC000449112428 477444054 /nfs/dbraw/zinc/44/40/54/477444054.db2.gz CIIJBTVFOGSZAX-ILXRZTDVSA-N 0 3 333.432 2.905 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N[C@@H]1CCN(c2ccccc2)C1=O ZINC000449121863 477448995 /nfs/dbraw/zinc/44/89/95/477448995.db2.gz IXHWNFSYPZSJPK-WMLDXEAASA-N 0 3 339.395 2.921 20 5 EFBDHN CC(C)N1CCCC[C@@H]1Cn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O ZINC000413001378 477468415 /nfs/dbraw/zinc/46/84/15/477468415.db2.gz PJTLWNZZLNXJKB-OAHLLOKOSA-N 0 3 346.387 2.674 20 5 EFBDHN COCCN1CCC(Nc2ccc([N+](=O)[O-])c3ncccc23)CC1 ZINC000413080096 477505466 /nfs/dbraw/zinc/50/54/66/477505466.db2.gz FFIPTVJXPHNVPL-UHFFFAOYSA-N 0 3 330.388 2.666 20 5 EFBDHN CCN(C[C@@H]1CCN(Cc2ccccc2)C1)c1ncc([N+](=O)[O-])cn1 ZINC000371857476 477528953 /nfs/dbraw/zinc/52/89/53/477528953.db2.gz FXFAALUAROOMCM-MRXNPFEDSA-N 0 3 341.415 2.733 20 5 EFBDHN Nc1ccc(N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000367517858 477554382 /nfs/dbraw/zinc/55/43/82/477554382.db2.gz DQUAWZDWSMHYQQ-HNAYVOBHSA-N 0 3 338.411 2.888 20 5 EFBDHN CCO[C@@H]1C[C@H](N[C@@H](C)Cc2ccccc2[N+](=O)[O-])[C@H]1n1cccn1 ZINC000449343752 477556885 /nfs/dbraw/zinc/55/68/85/477556885.db2.gz MUFFYKGOJOQTRP-OXXUSNJHSA-N 0 3 344.415 2.731 20 5 EFBDHN CS[C@H]1CN(c2nccc3ccc([N+](=O)[O-])cc32)C[C@H]1N(C)C ZINC000413204812 477568478 /nfs/dbraw/zinc/56/84/78/477568478.db2.gz JMSWARIGVRQNKP-CABCVRRESA-N 0 3 332.429 2.625 20 5 EFBDHN CCc1cc(N2CCNC(C)(C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000420278083 477660266 /nfs/dbraw/zinc/66/02/66/477660266.db2.gz NTDVTGJLLQVOLQ-UHFFFAOYSA-N 0 3 341.415 2.802 20 5 EFBDHN Cc1nc(N2CCN(Cc3ccccc3)C[C@H](C)C2)ncc1[N+](=O)[O-] ZINC000450806664 477724023 /nfs/dbraw/zinc/72/40/23/477724023.db2.gz FIPBLELWSALRLR-AWEZNQCLSA-N 0 3 341.415 2.652 20 5 EFBDHN Cc1ccc(CN[C@H]([C@H]2CCCO2)C2(CO)CCC2)cc1[N+](=O)[O-] ZINC000367956278 477770200 /nfs/dbraw/zinc/77/02/00/477770200.db2.gz MGRUYSNVZRHEHT-IAGOWNOFSA-N 0 3 334.416 2.703 20 5 EFBDHN C[C@@H]1C[C@H](NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)CCN1C ZINC000437984752 477783825 /nfs/dbraw/zinc/78/38/25/477783825.db2.gz KCPWOWHGLLFHAD-UKRRQHHQSA-N 0 3 346.431 2.752 20 5 EFBDHN CN(C)CC(C)(C)NC(=O)/C=C/c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000493821849 477843598 /nfs/dbraw/zinc/84/35/98/477843598.db2.gz MGRIYTCNNIIXTK-SOFGYWHQSA-N 0 3 325.796 2.718 20 5 EFBDHN O=C(CCNCCOc1ccc(F)cc1)Nc1ccccc1[N+](=O)[O-] ZINC000558573371 477889379 /nfs/dbraw/zinc/88/93/79/477889379.db2.gz CUJZKXHEMOPQCW-UHFFFAOYSA-N 0 3 347.346 2.731 20 5 EFBDHN CC(C)N(C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H](C)c1ccsc1 ZINC000421009654 477895444 /nfs/dbraw/zinc/89/54/44/477895444.db2.gz NHXRRDFMIGZNHE-DOMZBBRYSA-N 0 3 338.433 2.685 20 5 EFBDHN COC(=O)[C@@]1(c2ccccc2)CCN(Cc2ccccc2[N+](=O)[O-])C1 ZINC000428793534 477984479 /nfs/dbraw/zinc/98/44/79/477984479.db2.gz ZDBFNJXSJFVWPO-IBGZPJMESA-N 0 3 340.379 2.912 20 5 EFBDHN CC(C)CN(CCOc1ccccc1[N+](=O)[O-])Cc1cnn(C)c1 ZINC000459588358 477994185 /nfs/dbraw/zinc/99/41/85/477994185.db2.gz GNQIBUKHFLMNBZ-UHFFFAOYSA-N 0 3 332.404 2.865 20 5 EFBDHN O=[N+]([O-])c1ccc2oc(CN3CCC[C@@H]3[C@@H]3CCC[C@H]3O)nc2c1 ZINC000451415776 478001536 /nfs/dbraw/zinc/00/15/36/478001536.db2.gz JUCMIFVLHFOJMY-NWANDNLSSA-N 0 3 331.372 2.861 20 5 EFBDHN C[C@@H]1C[C@H](NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)CCN1C ZINC000494543262 478006518 /nfs/dbraw/zinc/00/65/18/478006518.db2.gz AUMRIONKHJMOBE-UKRRQHHQSA-N 0 3 346.431 2.752 20 5 EFBDHN C[C@H](N[C@@H]1[C@@H]2CCCO[C@H]2C1(C)C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000439615278 478007461 /nfs/dbraw/zinc/00/74/61/478007461.db2.gz FOZQPVVRHAIWIT-DANNLKNASA-N 0 3 347.415 2.715 20 5 EFBDHN CCO[C@@H]1C[C@H](N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C12CCC2 ZINC000451480016 478040320 /nfs/dbraw/zinc/04/03/20/478040320.db2.gz NZFXERLCAIUDPG-UHOFOFEASA-N 0 3 347.415 2.859 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000487517536 478040883 /nfs/dbraw/zinc/04/08/83/478040883.db2.gz OOEHUBYMGFLYJZ-CJNGLKHVSA-N 0 3 342.399 2.563 20 5 EFBDHN CO[C@@]1(C)C[C@H](NCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1(C)C ZINC000451483478 478043809 /nfs/dbraw/zinc/04/38/09/478043809.db2.gz FGXDDPWQKZVRAU-YOEHRIQHSA-N 0 3 335.404 2.635 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CCN(CC2CCCC2)C1 ZINC000494703861 478050429 /nfs/dbraw/zinc/05/04/29/478050429.db2.gz QYJDZFNJQJQDAU-AWEZNQCLSA-N 0 3 347.415 2.598 20 5 EFBDHN COc1cccc2c1C[C@H]([NH2+]Cc1cc(OC)c([O-])cc1[N+](=O)[O-])C2 ZINC000459712983 478052827 /nfs/dbraw/zinc/05/28/27/478052827.db2.gz WVPNJXHZKMDMQK-CYBMUJFWSA-N 0 3 344.367 2.575 20 5 EFBDHN CCOC[C@@H]1CCCCN1CCOc1ccc(OC)cc1[N+](=O)[O-] ZINC000459726591 478062197 /nfs/dbraw/zinc/06/21/97/478062197.db2.gz XYPOGYUARDLAQH-AWEZNQCLSA-N 0 3 338.404 2.873 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000494801906 478067061 /nfs/dbraw/zinc/06/70/61/478067061.db2.gz WRNJEYCIIWHQAG-INIZCTEOSA-N 0 3 343.383 2.636 20 5 EFBDHN O=[N+]([O-])c1ccc([C@@H]2CCCN(CCN3C[C@H]4CC[C@@H](C3)O4)C2)cc1 ZINC000451545208 478079943 /nfs/dbraw/zinc/07/99/43/478079943.db2.gz HCOUEMSYLGUXJD-QRQLOZEOSA-N 0 3 345.443 2.637 20 5 EFBDHN Cc1c(CNC2(C(N)=O)C3CC4CC(C3)CC2C4)cccc1[N+](=O)[O-] ZINC000459767783 478080907 /nfs/dbraw/zinc/08/09/07/478080907.db2.gz FILDEKIFDRKGOG-UHFFFAOYSA-N 0 3 343.427 2.673 20 5 EFBDHN CO[C@@H]1C[C@@H](N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C12CCC2 ZINC000459777441 478087438 /nfs/dbraw/zinc/08/74/38/478087438.db2.gz VWTQVCNEXVPCTO-DAXOMENPSA-N 0 3 347.415 2.777 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCN(C)[C@@H](C(C)C)C1 ZINC000488073962 478114604 /nfs/dbraw/zinc/11/46/04/478114604.db2.gz MPMIISQCPQSQQU-QGZVFWFLSA-N 0 3 348.447 2.504 20 5 EFBDHN Cc1ccccc1[C@@H](CO)NCCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000518334068 478159269 /nfs/dbraw/zinc/15/92/69/478159269.db2.gz XREFTOJBZPSFJP-QGZVFWFLSA-N 0 3 343.383 2.555 20 5 EFBDHN CC(=O)NCC[C@@H]1CCCN(C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000561982504 478211268 /nfs/dbraw/zinc/21/12/68/478211268.db2.gz HMYSWGNCMQRPBW-SBSDFTTDSA-N 0 3 331.416 2.846 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCN(C[C@H]3C[C@H]3c3ccccc3)CC2)cn1 ZINC000535785709 478231252 /nfs/dbraw/zinc/23/12/52/478231252.db2.gz BOOTXQAUDMGIJU-AEFFLSMTSA-N 0 3 338.411 2.916 20 5 EFBDHN CN(CCn1cc([N+](=O)[O-])ccc1=O)[C@H]1CCCc2ccccc21 ZINC000536376749 478249391 /nfs/dbraw/zinc/24/93/91/478249391.db2.gz CWNBEMQCYDNWLP-KRWDZBQOSA-N 0 3 327.384 2.766 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)N[C@H]2CCN(C3CC3)C2)cc1[N+](=O)[O-] ZINC000489540611 478255572 /nfs/dbraw/zinc/25/55/72/478255572.db2.gz IUUKYEJTRSRTQU-OCCSQVGLSA-N 0 3 332.404 2.500 20 5 EFBDHN CCCCN(C)CCNC(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000489578587 478257775 /nfs/dbraw/zinc/25/77/75/478257775.db2.gz AZFUGFMMKFRYSL-AWEZNQCLSA-N 0 3 336.436 2.995 20 5 EFBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CN[C@H]2CC[C@@H](CO)CC2)c1 ZINC000590646798 478275673 /nfs/dbraw/zinc/27/56/73/478275673.db2.gz TYJFTGQUXDSZNF-KLPPZKSPSA-N 0 3 330.331 2.837 20 5 EFBDHN Cc1cccnc1CCCNCc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000590658762 478279770 /nfs/dbraw/zinc/27/97/70/478279770.db2.gz BTQXKHMRPGOJFX-UHFFFAOYSA-N 0 3 343.383 2.792 20 5 EFBDHN CCC(C)(C)N1CCN(C(=O)NCCc2ccccc2[N+](=O)[O-])CC1 ZINC000594231198 478289103 /nfs/dbraw/zinc/28/91/03/478289103.db2.gz OISVTNCOSJVQGJ-UHFFFAOYSA-N 0 3 348.447 2.653 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCC(C)(C)S(C)(=O)=O ZINC000579448379 478299012 /nfs/dbraw/zinc/29/90/12/478299012.db2.gz WCDVPOOTMHCJOW-GFCCVEGCSA-N 0 3 328.434 2.767 20 5 EFBDHN O=[N+]([O-])c1cnc(N2CCN(c3ccnc4ccccc43)CC2)s1 ZINC000570337453 478338829 /nfs/dbraw/zinc/33/88/29/478338829.db2.gz XQKGLJGSPWWWNA-UHFFFAOYSA-N 0 3 341.396 2.926 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CCCC[C@@H]2CN(C)C)c1 ZINC000538413140 478358891 /nfs/dbraw/zinc/35/88/91/478358891.db2.gz XAEOTXROMMWSGH-OAHLLOKOSA-N 0 3 349.431 2.615 20 5 EFBDHN O=C(N[C@H]1CCCN2CCCC[C@@H]12)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000594418183 478374552 /nfs/dbraw/zinc/37/45/52/478374552.db2.gz GYTGNPZFPRRPMX-KBPBESRZSA-N 0 3 337.807 2.995 20 5 EFBDHN CCc1ccccc1[C@@H](N)CNC(=O)c1ccc(NC)c([N+](=O)[O-])c1 ZINC000562965278 478396146 /nfs/dbraw/zinc/39/61/46/478396146.db2.gz DYMYMQMDSBDWDU-HNNXBMFYSA-N 0 3 342.399 2.629 20 5 EFBDHN COc1cc(C(=O)NC[C@H]2CCCCN2C2CC2)cc([N+](=O)[O-])c1C ZINC000570655444 478410853 /nfs/dbraw/zinc/41/08/53/478410853.db2.gz FWFKOGDJVIHXOR-OAHLLOKOSA-N 0 3 347.415 2.659 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2NC[C@H](O)Cc1cccc(F)c1 ZINC000594505939 478415253 /nfs/dbraw/zinc/41/52/53/478415253.db2.gz FZLAAMXIQVVKTJ-PBHICJAKSA-N 0 3 330.359 2.914 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2NC[C@H](O)Cc1cccc(F)c1 ZINC000594505940 478416104 /nfs/dbraw/zinc/41/61/04/478416104.db2.gz FZLAAMXIQVVKTJ-RHSMWYFYSA-N 0 3 330.359 2.914 20 5 EFBDHN O=C(Nc1ccc([N+](=O)[O-])cc1F)N[C@H]1CCCN2CCCC[C@@H]12 ZINC000594524855 478426061 /nfs/dbraw/zinc/42/60/61/478426061.db2.gz MCWHJAIWOFKHIK-GJZGRUSLSA-N 0 3 336.367 2.872 20 5 EFBDHN C[C@H](N[C@@H]1CCCN2CCCC[C@H]12)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000594554160 478435508 /nfs/dbraw/zinc/43/55/08/478435508.db2.gz OPIXAJONSAGRPU-IAOVAPTHSA-N 0 3 346.431 2.528 20 5 EFBDHN C[C@H](N[C@H]1CCCN2CCCC[C@@H]12)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000594554161 478435537 /nfs/dbraw/zinc/43/55/37/478435537.db2.gz OPIXAJONSAGRPU-JQFCIGGWSA-N 0 3 346.431 2.528 20 5 EFBDHN C[C@H](N[C@H]1CCCN2CCCC[C@H]12)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000594554156 478435577 /nfs/dbraw/zinc/43/55/77/478435577.db2.gz OFIGWQQKDJUMSN-RRQGHBQHSA-N 0 3 346.431 2.528 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@@H]1[C@H]1CCCOC1 ZINC000581882196 478457523 /nfs/dbraw/zinc/45/75/23/478457523.db2.gz IOAVCTNMZUBNRK-WMLDXEAASA-N 0 3 347.415 2.733 20 5 EFBDHN O=c1[nH]cnc2cc(N[C@H]3CCCN4CCCC[C@@H]34)c([N+](=O)[O-])cc21 ZINC000594603275 478461890 /nfs/dbraw/zinc/46/18/90/478461890.db2.gz SUCRYNNMQAZHEJ-WFASDCNBSA-N 0 3 343.387 2.672 20 5 EFBDHN COC(=O)c1cc(C)nc(N[C@H]2CCCN3CCCC[C@@H]23)c1[N+](=O)[O-] ZINC000594603774 478462296 /nfs/dbraw/zinc/46/22/96/478462296.db2.gz VTRMBSLUVKXXTK-KBPBESRZSA-N 0 3 348.403 2.514 20 5 EFBDHN CCOC(=O)c1ccnc(N[C@H]2CCCN3CCCC[C@@H]23)c1[N+](=O)[O-] ZINC000594604040 478462816 /nfs/dbraw/zinc/46/28/16/478462816.db2.gz XCTKGUUZLAYVDH-KBPBESRZSA-N 0 3 348.403 2.595 20 5 EFBDHN CN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(Cl)cc1[N+](=O)[O-])C2 ZINC000597714268 478476039 /nfs/dbraw/zinc/47/60/39/478476039.db2.gz HPECERTXUIMYJX-MRXNPFEDSA-N 0 3 337.807 2.806 20 5 EFBDHN CN1CC[C@]2(C1)CCCN(C(=O)c1cc(Cl)cc([N+](=O)[O-])c1)C2 ZINC000597713601 478476416 /nfs/dbraw/zinc/47/64/16/478476416.db2.gz DJKNWMZMFSBXJS-INIZCTEOSA-N 0 3 337.807 2.806 20 5 EFBDHN C[C@H](NC[C@H]1COCCN1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000600712239 478479673 /nfs/dbraw/zinc/47/96/73/478479673.db2.gz VEYNSEQQGHBNPB-STQMWFEESA-N 0 3 347.440 2.962 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC[C@@H](CN2CCOC2=O)C1 ZINC000496017676 478482145 /nfs/dbraw/zinc/48/21/45/478482145.db2.gz YLBFPKCUPPPQBN-IHWMJMDHSA-N 0 3 345.399 2.772 20 5 EFBDHN Cc1cc(C)cc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000594716272 478510919 /nfs/dbraw/zinc/51/09/19/478510919.db2.gz NVWAROSLYYGUCV-KRWDZBQOSA-N 0 3 330.384 2.741 20 5 EFBDHN COC(=O)c1cc(-c2cccc([C@@H]3CNCCO3)c2)cc([N+](=O)[O-])c1 ZINC000600790116 478522635 /nfs/dbraw/zinc/52/26/35/478522635.db2.gz ZDRPVNPUCSMZRW-KRWDZBQOSA-N 0 3 342.351 2.709 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCN(C2CC2)C[C@H](C)C1 ZINC000591533927 478575589 /nfs/dbraw/zinc/57/55/89/478575589.db2.gz KEVCLRANJLMQJF-LBPRGKRZSA-N 0 3 331.416 2.768 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CCCN(C)C2 ZINC000591533950 478576305 /nfs/dbraw/zinc/57/63/05/478576305.db2.gz ZSPWHTRXPAUDIQ-GOSISDBHSA-N 0 3 331.416 2.770 20 5 EFBDHN CC(C)(C)N1CC[C@@H](NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])C1 ZINC000597923707 478577500 /nfs/dbraw/zinc/57/75/00/478577500.db2.gz OPTAHCDTRXRGKT-CYBMUJFWSA-N 0 3 333.432 2.861 20 5 EFBDHN COc1ccc2c(c1)OC[C@H](NCCOc1ccc([N+](=O)[O-])cc1)C2 ZINC000571394413 478587015 /nfs/dbraw/zinc/58/70/15/478587015.db2.gz ROCRYZZABRBSIO-CQSZACIVSA-N 0 3 344.367 2.576 20 5 EFBDHN O=C(/C=C\c1ccc(F)cc1[N+](=O)[O-])N1CC[C@@H](N2CCCCC2)C1 ZINC000491559889 478587721 /nfs/dbraw/zinc/58/77/21/478587721.db2.gz CAQSPLSOSKSSJB-GMNBZTITSA-N 0 3 347.390 2.834 20 5 EFBDHN O=C(/C=C/c1cccc([N+](=O)[O-])c1)N1CC[C@H](N2CCCCC2)C1 ZINC000491564990 478591103 /nfs/dbraw/zinc/59/11/03/478591103.db2.gz ZWAMFCKSSSLEGN-OZSKJFCKSA-N 0 3 329.400 2.695 20 5 EFBDHN COc1cc(CN[C@@H]2CCN(C(C)(C)C)C2)c([N+](=O)[O-])cc1OC ZINC000594956584 478604823 /nfs/dbraw/zinc/60/48/23/478604823.db2.gz LPJHAHRINBLINZ-CYBMUJFWSA-N 0 3 337.420 2.574 20 5 EFBDHN COc1cc(C[NH2+]CCC2(CSC)CC2)c([N+](=O)[O-])cc1[O-] ZINC000594962216 478605764 /nfs/dbraw/zinc/60/57/64/478605764.db2.gz CVQWAMOWXHQAAS-UHFFFAOYSA-N 0 3 326.418 2.932 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@@H]1CCC[C@H]([S@](C)=O)C1 ZINC000594960643 478605996 /nfs/dbraw/zinc/60/59/96/478605996.db2.gz JPRVOYYUACJTFA-CYULLINESA-N 0 3 340.445 2.773 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@@H]1CCC[C@H]([S@@](C)=O)C1 ZINC000594960645 478606183 /nfs/dbraw/zinc/60/61/83/478606183.db2.gz JPRVOYYUACJTFA-PUYAPDRXSA-N 0 3 340.445 2.773 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CN[C@H]1CCc2ccc(F)cc21 ZINC000571516014 478614467 /nfs/dbraw/zinc/61/44/67/478614467.db2.gz GVHUGURDMKAXIP-ZBFHGGJFSA-N 0 3 346.358 2.751 20 5 EFBDHN CCC[C@H](NC[C@@H](O)COc1ccccc1[N+](=O)[O-])c1ccccn1 ZINC000591734562 478616082 /nfs/dbraw/zinc/61/60/82/478616082.db2.gz PDNHRSFMZGVAKU-CABCVRRESA-N 0 3 345.399 2.861 20 5 EFBDHN C[C@]1(c2ccccc2)C[C@H]1NC[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000591744294 478618435 /nfs/dbraw/zinc/61/84/35/478618435.db2.gz PEKQPWDWWJYOGS-KFKAGJAMSA-N 0 3 342.395 2.654 20 5 EFBDHN CNC(=O)CC1(CNCc2csc([N+](=O)[O-])c2)CCCCC1 ZINC000594994661 478621748 /nfs/dbraw/zinc/62/17/48/478621748.db2.gz DMXQXKDTTHAYMS-UHFFFAOYSA-N 0 3 325.434 2.833 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H]1CCc2nc(C)ncc2C1 ZINC000595006030 478627365 /nfs/dbraw/zinc/62/73/65/478627365.db2.gz DZUBARBHQYUEHI-SMDDNHRTSA-N 0 3 342.399 2.910 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)N[C@H](CO)Cc1ccccc1 ZINC000595008661 478628008 /nfs/dbraw/zinc/62/80/08/478628008.db2.gz POUKSMWUCTXGEV-HIFRSBDPSA-N 0 3 330.384 2.858 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H](CO)Cc1ccccc1 ZINC000595008659 478628180 /nfs/dbraw/zinc/62/81/80/478628180.db2.gz POUKSMWUCTXGEV-DZGCQCFKSA-N 0 3 330.384 2.858 20 5 EFBDHN CCNC(=O)C1(CN[C@@H](C)c2ccc([N+](=O)[O-])cc2OC)CCC1 ZINC000595040091 478636987 /nfs/dbraw/zinc/63/69/87/478636987.db2.gz GTKXCYOMQQUXNH-LBPRGKRZSA-N 0 3 335.404 2.560 20 5 EFBDHN COCC1(CN[C@H](C)c2ccc([N+](=O)[O-])cc2OC)CCOCC1 ZINC000595040703 478638632 /nfs/dbraw/zinc/63/86/32/478638632.db2.gz ZPIJBHFMFAJNSI-CYBMUJFWSA-N 0 3 338.404 2.697 20 5 EFBDHN O=[N+]([O-])c1ccc(OC[C@]2(O)CCN(Cc3ccccc3)C2)cc1 ZINC000601069475 478639445 /nfs/dbraw/zinc/63/94/45/478639445.db2.gz MAWCFLLROYMSOF-SFHVURJKSA-N 0 3 328.368 2.611 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H]1CCC[C@@H]([S@@](C)=O)C1 ZINC000595059724 478645514 /nfs/dbraw/zinc/64/55/14/478645514.db2.gz JRRJQLBKEALCGM-NCUIZXKGSA-N 0 3 340.445 2.944 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC1CCN([C@H]2CCOC2)CC1 ZINC000595100803 478660983 /nfs/dbraw/zinc/66/09/83/478660983.db2.gz JAOFEKWVYUNTRG-CJNGLKHVSA-N 0 3 349.431 2.507 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C/CNC[C@H](n1cncn1)C(F)(F)F ZINC000601144179 478684240 /nfs/dbraw/zinc/68/42/40/478684240.db2.gz FYTKTCOBJQMFOE-LQPUYASZSA-N 0 3 341.293 2.593 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc([C@H]2CNCCO2)cc1 ZINC000595258183 478703856 /nfs/dbraw/zinc/70/38/56/478703856.db2.gz RTAZGIZNHYQVSD-QGZVFWFLSA-N 0 3 341.367 2.816 20 5 EFBDHN C[C@H](CN1CCC(C)CC1)NC(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000598261900 478731129 /nfs/dbraw/zinc/73/11/29/478731129.db2.gz IAUCVXNMRQRXJJ-CYBMUJFWSA-N 0 3 337.395 2.513 20 5 EFBDHN C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)/C=C/c1ccc(F)cc1[N+](=O)[O-] ZINC000491909785 478733816 /nfs/dbraw/zinc/73/38/16/478733816.db2.gz XHNFGXWGDXDDJF-QKOWSDGPSA-N 0 3 335.379 2.546 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCOc2ccc3c(c2)OCCNC3)cc1 ZINC000583019883 478743925 /nfs/dbraw/zinc/74/39/25/478743925.db2.gz QBNHLNLGWUMYEO-UHFFFAOYSA-N 0 3 330.340 2.535 20 5 EFBDHN C[C@@H](N[C@@H]1COC[C@@H]1O)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000601291038 478768359 /nfs/dbraw/zinc/76/83/59/478768359.db2.gz FCQISLUFLYJETD-QKCSRTOESA-N 0 3 334.397 2.734 20 5 EFBDHN CCCN1CC[C@H](NC(=O)[C@@H](CC)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000598341447 478774519 /nfs/dbraw/zinc/77/45/19/478774519.db2.gz BODFIBRNBZRHIT-HOTGVXAUSA-N 0 3 333.432 2.764 20 5 EFBDHN CCCN1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2SCC)C1 ZINC000598341411 478775021 /nfs/dbraw/zinc/77/50/21/478775021.db2.gz AZAGTRGGWKZRLT-LBPRGKRZSA-N 0 3 337.445 2.921 20 5 EFBDHN CCCN1CC[C@@H](NC(=O)[C@H](CC)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000598341448 478775663 /nfs/dbraw/zinc/77/56/63/478775663.db2.gz BODFIBRNBZRHIT-HZPDHXFCSA-N 0 3 333.432 2.764 20 5 EFBDHN C[C@@H](CN1CCC(C)CC1)NC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000595467549 478802196 /nfs/dbraw/zinc/80/21/96/478802196.db2.gz HSRSQSNMXOUSIU-HNNXBMFYSA-N 0 3 348.447 2.557 20 5 EFBDHN C[C@H](CN1CCC(C)CC1)NC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000595467552 478802213 /nfs/dbraw/zinc/80/22/13/478802213.db2.gz HSRSQSNMXOUSIU-OAHLLOKOSA-N 0 3 348.447 2.557 20 5 EFBDHN C[C@H](CN1CCC(C)CC1)NC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000595478141 478809108 /nfs/dbraw/zinc/80/91/08/478809108.db2.gz XYIIGROMZZXAOI-CQSZACIVSA-N 0 3 334.420 2.514 20 5 EFBDHN C[C@@H]1C[C@@]1(NCCn1cc([N+](=O)[O-])ccc1=O)c1ccc(Cl)cc1 ZINC000503389877 478840154 /nfs/dbraw/zinc/84/01/54/478840154.db2.gz IEEUEIOYNYEFMI-PXAZEXFGSA-N 0 3 347.802 2.935 20 5 EFBDHN Cc1noc(CN2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)c1[N+](=O)[O-] ZINC000595551919 478850736 /nfs/dbraw/zinc/85/07/36/478850736.db2.gz ZTMGNKLXNPVRDL-JKSUJKDBSA-N 0 3 342.399 2.598 20 5 EFBDHN COCCN(Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000507170195 478906874 /nfs/dbraw/zinc/90/68/74/478906874.db2.gz MADVRIMKVUKMIO-UHFFFAOYSA-N 0 3 330.388 2.606 20 5 EFBDHN CN1CCC2(CCCN2C(=O)/C=C\c2cccc([N+](=O)[O-])c2)CC1 ZINC000492297453 478915579 /nfs/dbraw/zinc/91/55/79/478915579.db2.gz SEXURMZMNLAJLF-SREVYHEPSA-N 0 3 329.400 2.695 20 5 EFBDHN C[C@H](C1CCN(C)CC1)N(C)C(=O)/C=C/c1cccc([N+](=O)[O-])c1 ZINC000492320395 478928291 /nfs/dbraw/zinc/92/82/91/478928291.db2.gz OUBGDKALKLLBRD-HSBSLETESA-N 0 3 331.416 2.797 20 5 EFBDHN C[C@@H](CNC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCCC1 ZINC000583792774 478941438 /nfs/dbraw/zinc/94/14/38/478941438.db2.gz QORAMEDAYYYZNE-JTQLQIEISA-N 0 3 345.321 2.828 20 5 EFBDHN CN(CCc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1CCN(C(C)(C)C)C1 ZINC000595701848 478944239 /nfs/dbraw/zinc/94/42/39/478944239.db2.gz GRSZKQHWTKPVJW-OAHLLOKOSA-N 0 3 348.447 2.652 20 5 EFBDHN CCCCN(C)CCNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000511585747 478980637 /nfs/dbraw/zinc/98/06/37/478980637.db2.gz LMEFFRJIWLUQOB-UHFFFAOYSA-N 0 3 336.436 2.511 20 5 EFBDHN CN1CC[C@@]2(CCN(c3ncc([N+](=O)[O-])cc3C(F)(F)F)C2)C1 ZINC000584159656 479033679 /nfs/dbraw/zinc/03/36/79/479033679.db2.gz QAZJGBHNGAFRDE-CYBMUJFWSA-N 0 3 330.310 2.541 20 5 EFBDHN CC[C@@H](C)C[C@@H](C)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000565593773 479042607 /nfs/dbraw/zinc/04/26/07/479042607.db2.gz DOUMOHHLUCDTNJ-CHWSQXEVSA-N 0 3 328.434 2.783 20 5 EFBDHN Cc1c(NC(=O)CCN(C)CC2=CCSC2)cccc1[N+](=O)[O-] ZINC000595888771 479054232 /nfs/dbraw/zinc/05/42/32/479054232.db2.gz OHDSBIQWSAHKDV-UHFFFAOYSA-N 0 3 335.429 2.837 20 5 EFBDHN CO[C@@H]1COC[C@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000565656918 479055997 /nfs/dbraw/zinc/05/59/97/479055997.db2.gz NHQVCHQEXMVGQP-HUUCEWRRSA-N 0 3 334.397 2.827 20 5 EFBDHN CCCN(C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[C@@H]1CCN(C)C1 ZINC000592828356 479062429 /nfs/dbraw/zinc/06/24/29/479062429.db2.gz HOJLNHDGBOYWQU-OAHLLOKOSA-N 0 3 344.415 2.561 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N(C)C[C@H]1CC1(C)C ZINC000595908723 479065039 /nfs/dbraw/zinc/06/50/39/479065039.db2.gz KBBYQFZPMLTJKL-VXGBXAGGSA-N 0 3 335.404 2.908 20 5 EFBDHN CC1(C)C[C@]1(NCCn1cc([N+](=O)[O-])ccc1=O)c1ccccc1 ZINC000595909426 479065069 /nfs/dbraw/zinc/06/50/69/479065069.db2.gz NINQILOAWZNHPK-SFHVURJKSA-N 0 3 327.384 2.672 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H]1CCCN(c2ccnn2C)C1 ZINC000584271634 479072599 /nfs/dbraw/zinc/07/25/99/479072599.db2.gz COPZDWYQMGTPJL-GJZGRUSLSA-N 0 3 343.431 2.956 20 5 EFBDHN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)c1cccc2c1CNC2 ZINC000595925844 479075434 /nfs/dbraw/zinc/07/54/34/479075434.db2.gz URNITAGNCYVITB-UHFFFAOYSA-N 0 3 339.395 2.951 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)c2cccc3c2CNC3)cc1[N+](=O)[O-] ZINC000595928715 479077244 /nfs/dbraw/zinc/07/72/44/479077244.db2.gz FJVUHFHAQXCNAF-GFCCVEGCSA-N 0 3 325.368 2.997 20 5 EFBDHN O=C(/C=C\c1cccc([N+](=O)[O-])c1)NC[C@@H]1CCCCN1C1CC1 ZINC000493615059 479082812 /nfs/dbraw/zinc/08/28/12/479082812.db2.gz FMQDNRDNWRBYMW-JEZWAEDTSA-N 0 3 329.400 2.741 20 5 EFBDHN CNc1c(C(=O)N2CCCN(C(C)(C)C)CC2)cccc1[N+](=O)[O-] ZINC000547321175 479108491 /nfs/dbraw/zinc/10/84/91/479108491.db2.gz ZPXQMTFGRCTYEZ-UHFFFAOYSA-N 0 3 334.420 2.583 20 5 EFBDHN Cc1ccccc1C[N@@H+]1CCCN(c2cc[n-]c(=O)c2[N+](=O)[O-])CC1 ZINC000596076639 479123585 /nfs/dbraw/zinc/12/35/85/479123585.db2.gz NIHWSVMUEVMYJU-UHFFFAOYSA-N 0 3 342.399 2.716 20 5 EFBDHN Cc1ccccc1C[N@H+]1CCCN(c2cc[n-]c(=O)c2[N+](=O)[O-])CC1 ZINC000596076639 479123587 /nfs/dbraw/zinc/12/35/87/479123587.db2.gz NIHWSVMUEVMYJU-UHFFFAOYSA-N 0 3 342.399 2.716 20 5 EFBDHN O=[N+]([O-])c1ccccc1CNCC[C@@H](O)COCc1ccccc1 ZINC000599023222 479129616 /nfs/dbraw/zinc/12/96/16/479129616.db2.gz RDDQKFVOKVGSLK-QGZVFWFLSA-N 0 3 330.384 2.652 20 5 EFBDHN C[C@H](c1ccccc1)[N@@H+]1CC[C@@H](Nc2cc[n-]c(=O)c2[N+](=O)[O-])C1 ZINC000596090006 479131969 /nfs/dbraw/zinc/13/19/69/479131969.db2.gz SUBITTJVPUUZQF-TZMCWYRMSA-N 0 3 328.372 2.943 20 5 EFBDHN C[C@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2cc[n-]c(=O)c2[N+](=O)[O-])C1 ZINC000596090006 479131973 /nfs/dbraw/zinc/13/19/73/479131973.db2.gz SUBITTJVPUUZQF-TZMCWYRMSA-N 0 3 328.372 2.943 20 5 EFBDHN Cc1ccc([C@@H](CNc2ccc([N+](=O)[O-])c(C(N)=O)c2)N(C)C)cc1 ZINC000596093567 479135102 /nfs/dbraw/zinc/13/51/02/479135102.db2.gz VYRARXPEHRYFSU-QGZVFWFLSA-N 0 3 342.399 2.717 20 5 EFBDHN CN(CCNC(=O)Cc1ccc(F)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000593036392 479135892 /nfs/dbraw/zinc/13/58/92/479135892.db2.gz DTZJVUVJDIVRPQ-UHFFFAOYSA-N 0 3 345.374 2.525 20 5 EFBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])NCc1cnnn1CC ZINC000599062441 479144297 /nfs/dbraw/zinc/14/42/97/479144297.db2.gz QCTYNIKMYMSZTK-LBPRGKRZSA-N 0 3 335.433 2.867 20 5 EFBDHN CC[C@H]1COC(C)(C)CN1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000593057309 479149281 /nfs/dbraw/zinc/14/92/81/479149281.db2.gz SLWGNKYIUUKWIG-ZDUSSCGKSA-N 0 3 335.404 2.813 20 5 EFBDHN C[C@H](N[C@@H]1CCO[C@H]1c1ccc(=O)[nH]c1)c1ccccc1[N+](=O)[O-] ZINC000599074697 479151092 /nfs/dbraw/zinc/15/10/92/479151092.db2.gz VGZOZJYRJIXJRC-KHIZAZIESA-N 0 3 329.356 2.876 20 5 EFBDHN C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(c2cc[n-]c(=O)c2[N+](=O)[O-])C1 ZINC000596127286 479153091 /nfs/dbraw/zinc/15/30/91/479153091.db2.gz WKVKLVPWQGQYRU-UONOGXRCSA-N 0 3 334.420 2.786 20 5 EFBDHN C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(c2cc[n-]c(=O)c2[N+](=O)[O-])C1 ZINC000596127286 479153098 /nfs/dbraw/zinc/15/30/98/479153098.db2.gz WKVKLVPWQGQYRU-UONOGXRCSA-N 0 3 334.420 2.786 20 5 EFBDHN C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(c2cc[n-]c(=O)c2[N+](=O)[O-])C1 ZINC000596127284 479153629 /nfs/dbraw/zinc/15/36/29/479153629.db2.gz WKVKLVPWQGQYRU-KGLIPLIRSA-N 0 3 334.420 2.786 20 5 EFBDHN C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2cc[n-]c(=O)c2[N+](=O)[O-])C1 ZINC000596127284 479153632 /nfs/dbraw/zinc/15/36/32/479153632.db2.gz WKVKLVPWQGQYRU-KGLIPLIRSA-N 0 3 334.420 2.786 20 5 EFBDHN C[C@H](c1ccccc1)N1CCC(Nc2ccc(N)c([N+](=O)[O-])n2)CC1 ZINC000596132857 479155892 /nfs/dbraw/zinc/15/58/92/479155892.db2.gz RUPQKNAOARAOOC-CYBMUJFWSA-N 0 3 341.415 2.631 20 5 EFBDHN Cc1cc(N2C[C@@H](C)N[C@@H](C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000599106594 479162570 /nfs/dbraw/zinc/16/25/70/479162570.db2.gz WLXMVHXUKNEDEH-BETUJISGSA-N 0 3 327.388 2.547 20 5 EFBDHN CN1CCC[C@@H](CNc2ccc(N)c([N+](=O)[O-])n2)[C@@H]1c1cccs1 ZINC000596146072 479163242 /nfs/dbraw/zinc/16/32/42/479163242.db2.gz KWYKLXKQXUUEFL-XHDPSFHLSA-N 0 3 347.444 2.550 20 5 EFBDHN C[C@@H]1CN(c2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)C[C@H](C)N1 ZINC000599110045 479164067 /nfs/dbraw/zinc/16/40/67/479164067.db2.gz CYUUYNFSEQVPRV-TXEJJXNPSA-N 0 3 330.363 2.983 20 5 EFBDHN Cc1cc(NCc2ccnc(OCCN(C)C)c2)c([N+](=O)[O-])s1 ZINC000596179674 479183241 /nfs/dbraw/zinc/18/32/41/479183241.db2.gz OFXJPIBJIBABAC-UHFFFAOYSA-N 0 3 336.417 2.912 20 5 EFBDHN O=c1[n-]ccc(NC[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000596222037 479208222 /nfs/dbraw/zinc/20/82/22/479208222.db2.gz IRLPUAIEQYNYEA-AWEZNQCLSA-N 0 3 328.372 2.629 20 5 EFBDHN O=c1[n-]ccc(NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000596222037 479208231 /nfs/dbraw/zinc/20/82/31/479208231.db2.gz IRLPUAIEQYNYEA-AWEZNQCLSA-N 0 3 328.372 2.629 20 5 EFBDHN CN1CCN(c2nc3sccn3c2[N+](=O)[O-])CC12CCCCC2 ZINC000596251426 479223701 /nfs/dbraw/zinc/22/37/01/479223701.db2.gz STEGMJBTJNNNQF-UHFFFAOYSA-N 0 3 335.433 2.759 20 5 EFBDHN C[C@@H]1CN(c2cc[n-]c(=O)c2[N+](=O)[O-])CC[N@H+](Cc2ccccc2)C1 ZINC000596257071 479227396 /nfs/dbraw/zinc/22/73/96/479227396.db2.gz KLWBNEGDIJJMNB-AWEZNQCLSA-N 0 3 342.399 2.654 20 5 EFBDHN C[C@@H]1CN(c2cc[n-]c(=O)c2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1 ZINC000596257071 479227403 /nfs/dbraw/zinc/22/74/03/479227403.db2.gz KLWBNEGDIJJMNB-AWEZNQCLSA-N 0 3 342.399 2.654 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCC1(S(C)(=O)=O)CCCC1 ZINC000556921598 479237530 /nfs/dbraw/zinc/23/75/30/479237530.db2.gz QBQJWHJUGNFEPH-CYBMUJFWSA-N 0 3 340.445 2.911 20 5 EFBDHN Cc1cc(C(=O)N2CCCN(c3ccncc3)CC2)cc([N+](=O)[O-])c1 ZINC000603082411 479237635 /nfs/dbraw/zinc/23/76/35/479237635.db2.gz FMODROQGOWBWRA-UHFFFAOYSA-N 0 3 340.383 2.651 20 5 EFBDHN Cc1ccnc(N(C)CCCN(C)Cc2ccncc2)c1[N+](=O)[O-] ZINC000585092004 479278859 /nfs/dbraw/zinc/27/88/59/479278859.db2.gz AFUJZVKEDXKOJJ-UHFFFAOYSA-N 0 3 329.404 2.652 20 5 EFBDHN O=C(NCCc1cccc([N+](=O)[O-])c1)[C@H]1CCCN1C1CCCC1 ZINC000611162591 479298603 /nfs/dbraw/zinc/29/86/03/479298603.db2.gz ATRNLYATZLOMLK-QGZVFWFLSA-N 0 3 331.416 2.661 20 5 EFBDHN O=c1oc2ccc([N+](=O)[O-])cc2n1CCCN1CCC2(CC2)CC1 ZINC000611177375 479302363 /nfs/dbraw/zinc/30/23/63/479302363.db2.gz IOBDLWFIYONGEA-UHFFFAOYSA-N 0 3 331.372 2.769 20 5 EFBDHN C[C@@H](CN1CCC(C)CC1)NC(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000596477384 479310428 /nfs/dbraw/zinc/31/04/28/479310428.db2.gz YSRZFEJMLWRLLZ-LBPRGKRZSA-N 0 3 338.383 2.976 20 5 EFBDHN CCN(C[C@H]1CCOC1)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000611205223 479310858 /nfs/dbraw/zinc/31/08/58/479310858.db2.gz OECLQSIQGJJXSO-ZIAGYGMSSA-N 0 3 335.404 2.589 20 5 EFBDHN CC[C@H](N)c1cn(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)nn1 ZINC000603231504 479313576 /nfs/dbraw/zinc/31/35/76/479313576.db2.gz QJTRMVOJFUCHGK-NSHDSACASA-N 0 3 329.282 2.663 20 5 EFBDHN C[C@@H](CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-])N1CCC[C@@H](C)C1 ZINC000593408527 479328795 /nfs/dbraw/zinc/32/87/95/479328795.db2.gz PFDIIZXSFRFTJC-OLZOCXBDSA-N 0 3 337.395 2.513 20 5 EFBDHN CC(C)c1ccc(CN2CCN([C@@H]3CCC[C@H]3O)CC2)cc1[N+](=O)[O-] ZINC000611268467 479330419 /nfs/dbraw/zinc/33/04/19/479330419.db2.gz SWMNTISLJRXIMX-IEBWSBKVSA-N 0 3 347.459 2.749 20 5 EFBDHN CCN1CCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000611271198 479331698 /nfs/dbraw/zinc/33/16/98/479331698.db2.gz WGMOYQNKRYBYQG-CQSZACIVSA-N 0 3 343.431 2.521 20 5 EFBDHN C[C@H](CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-])N1CCC(C)CC1 ZINC000593422993 479334564 /nfs/dbraw/zinc/33/45/64/479334564.db2.gz RIHUUAALBTULBV-CYBMUJFWSA-N 0 3 337.395 2.513 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNCCCn1ccnc1 ZINC000602502929 479370936 /nfs/dbraw/zinc/37/09/36/479370936.db2.gz IYIHGGMMCKXTOU-UHFFFAOYSA-N 0 3 328.294 2.990 20 5 EFBDHN CN(C)CCNC(=O)c1cccc(CNc2sccc2[N+](=O)[O-])c1 ZINC000611411996 479371934 /nfs/dbraw/zinc/37/19/34/479371934.db2.gz CEBOKWBFXDMGCV-UHFFFAOYSA-N 0 3 348.428 2.560 20 5 EFBDHN CC(C)[C@@H](CNCc1nc2cc([N+](=O)[O-])ccc2o1)N1CCCC1 ZINC000602510723 479374715 /nfs/dbraw/zinc/37/47/15/479374715.db2.gz MLKQICIQPHVDGM-OAHLLOKOSA-N 0 3 332.404 2.946 20 5 EFBDHN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2CCN(C)[C@@H]2C1 ZINC000574958742 479379050 /nfs/dbraw/zinc/37/90/50/479379050.db2.gz YQDJEEARCWHSAN-SWLSCSKDSA-N 0 3 349.456 2.873 20 5 EFBDHN Cn1cc(CCNCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cn1 ZINC000602522241 479380509 /nfs/dbraw/zinc/38/05/09/479380509.db2.gz SGQQJCGPYVEGFF-UHFFFAOYSA-N 0 3 328.294 2.679 20 5 EFBDHN COc1ccc([C@H]2CCCN2CCn2c(C)ncc2[N+](=O)[O-])cc1 ZINC000611442806 479381690 /nfs/dbraw/zinc/38/16/90/479381690.db2.gz DHVUHSLYUURYFJ-MRXNPFEDSA-N 0 3 330.388 2.945 20 5 EFBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CN[C@H](CO)CC2CCC2)c1 ZINC000603426030 479383192 /nfs/dbraw/zinc/38/31/92/479383192.db2.gz BYYUGVJUXRKWTC-LBPRGKRZSA-N 0 3 330.331 2.837 20 5 EFBDHN Cc1nccn1CCNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602534379 479385533 /nfs/dbraw/zinc/38/55/33/479385533.db2.gz RIAIFLLRLSMALS-UHFFFAOYSA-N 0 3 345.222 2.714 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN[C@@H]1CCc2n[nH]cc2C1 ZINC000602550873 479393046 /nfs/dbraw/zinc/39/30/46/479393046.db2.gz DUORSQCHTBGTPW-GFCCVEGCSA-N 0 3 340.305 2.984 20 5 EFBDHN C[C@@H](NCc1cc(Br)c([N+](=O)[O-])s1)[C@@H]1CCOC1 ZINC000602558988 479396370 /nfs/dbraw/zinc/39/63/70/479396370.db2.gz RQZDBAZRVGUVSI-HTQZYQBOSA-N 0 3 335.223 2.933 20 5 EFBDHN O=[N+]([O-])c1ccc2oc(CN[C@@H]3CCO[C@@]4(CCSC4)C3)nc2c1 ZINC000602566667 479401234 /nfs/dbraw/zinc/40/12/34/479401234.db2.gz AKWRLOGXOWLHOP-BZNIZROVSA-N 0 3 349.412 2.880 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNC[C@@]1(O)CCSC1 ZINC000602573570 479402981 /nfs/dbraw/zinc/40/29/81/479402981.db2.gz RYDNERRHKPBPNO-LBPRGKRZSA-N 0 3 336.335 2.571 20 5 EFBDHN CCN(CCn1c(C)ncc1[N+](=O)[O-])Cc1ccc(OC)c(OC)c1 ZINC000611536542 479408271 /nfs/dbraw/zinc/40/82/71/479408271.db2.gz HISFVNLJWZGCKA-UHFFFAOYSA-N 0 3 348.403 2.639 20 5 EFBDHN CCN1C[C@H](CNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1=O ZINC000593687288 479424481 /nfs/dbraw/zinc/42/44/81/479424481.db2.gz LDJCITPLEORRMV-ZDUSSCGKSA-N 0 3 343.383 2.813 20 5 EFBDHN CN(C[C@]1(O)CCN(Cc2ccccc2)C1)c1sccc1[N+](=O)[O-] ZINC000614533717 479438310 /nfs/dbraw/zinc/43/83/10/479438310.db2.gz KQCQBAIFISJTGX-QGZVFWFLSA-N 0 3 347.440 2.730 20 5 EFBDHN Cc1c(CN[C@H]([C@@H]2CCCO2)C2(CO)CCC2)cccc1[N+](=O)[O-] ZINC000602668364 479462051 /nfs/dbraw/zinc/46/20/51/479462051.db2.gz WOXKTJDKAUWICO-DLBZAZTESA-N 0 3 334.416 2.703 20 5 EFBDHN Cc1c(CN[C@@H]([C@H]2CCCO2)C2(CO)CCC2)cccc1[N+](=O)[O-] ZINC000602668771 479462747 /nfs/dbraw/zinc/46/27/47/479462747.db2.gz WOXKTJDKAUWICO-SJORKVTESA-N 0 3 334.416 2.703 20 5 EFBDHN CCCN1CC[C@H](NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)C1 ZINC000596882365 479470778 /nfs/dbraw/zinc/47/07/78/479470778.db2.gz QKZXUFOGMYVJNV-HNNXBMFYSA-N 0 3 346.431 2.753 20 5 EFBDHN O=[N+]([O-])c1ccc(CN2CCN(c3ccncc3)CC2)c(Cl)c1 ZINC000611788019 479480602 /nfs/dbraw/zinc/48/06/02/479480602.db2.gz ZZTJMOXFTSPJGO-UHFFFAOYSA-N 0 3 332.791 2.965 20 5 EFBDHN COC(=O)C[C@@](C)(NCCc1ccc([N+](=O)[O-])cc1)c1ccncc1 ZINC000589165093 479489667 /nfs/dbraw/zinc/48/96/67/479489667.db2.gz SYQQUPKAWASUEY-GOSISDBHSA-N 0 3 343.383 2.600 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNCC[C@@]1(O)CCCOC1 ZINC000602707984 479492448 /nfs/dbraw/zinc/49/24/48/479492448.db2.gz VOVJYEJCRJCBLY-AWEZNQCLSA-N 0 3 348.321 2.635 20 5 EFBDHN CN(CCc1ccccc1[N+](=O)[O-])Cc1ccccc1-n1cncn1 ZINC000589185051 479492657 /nfs/dbraw/zinc/49/26/57/479492657.db2.gz VHPSLSKHOJLSRR-UHFFFAOYSA-N 0 3 337.383 2.850 20 5 EFBDHN C[C@@H](CN1CCC(C)CC1)NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602717632 479501395 /nfs/dbraw/zinc/50/13/95/479501395.db2.gz LXFNYURGKAREPX-ZDUSSCGKSA-N 0 3 332.404 2.946 20 5 EFBDHN CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCN(CC2CC2)C1 ZINC000589374885 479519303 /nfs/dbraw/zinc/51/93/03/479519303.db2.gz NRHVTAZRHZNVJD-AWEZNQCLSA-N 0 3 332.404 2.763 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@@H]2CCN(Cc3cccc4n[nH]cc43)C2)nc1 ZINC000600117552 479526042 /nfs/dbraw/zinc/52/60/42/479526042.db2.gz WVMQTDWDWHBGMX-CYBMUJFWSA-N 0 3 338.371 2.553 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN1CCC(OCc2ccccc2)CC1 ZINC000602756991 479531807 /nfs/dbraw/zinc/53/18/07/479531807.db2.gz CBMOXUQBVLTVPE-UHFFFAOYSA-N 0 3 344.415 2.781 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN(C)CCOc1ccccc1Cl ZINC000602760604 479534149 /nfs/dbraw/zinc/53/41/49/479534149.db2.gz YIPGLXADABZZRW-UHFFFAOYSA-N 0 3 338.795 2.764 20 5 EFBDHN COc1cccc(C2CCN(CCn3c(C)ncc3[N+](=O)[O-])CC2)c1 ZINC000602766354 479536484 /nfs/dbraw/zinc/53/64/84/479536484.db2.gz QXLXWIYTSYZCQE-UHFFFAOYSA-N 0 3 344.415 2.988 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CN1CCCc2sccc2C1 ZINC000612074501 479572550 /nfs/dbraw/zinc/57/25/50/479572550.db2.gz ZZLMHJSGQSEPFE-CQSZACIVSA-N 0 3 348.424 2.844 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H]1CCCN2CCCC[C@H]12 ZINC000594094440 479586395 /nfs/dbraw/zinc/58/63/95/479586395.db2.gz JYGLEVMELYPWLM-DZGCQCFKSA-N 0 3 348.403 2.742 20 5 EFBDHN COC1CCN(CCNc2ccnc3c2cccc3[N+](=O)[O-])CC1 ZINC000590083461 479601314 /nfs/dbraw/zinc/60/13/14/479601314.db2.gz YPSUKCUMRGQTSU-UHFFFAOYSA-N 0 3 330.388 2.666 20 5 EFBDHN C[C@H]1C[C@H](CCNCc2cc3c(cc2[N+](=O)[O-])OCCO3)CCO1 ZINC000612201777 479609855 /nfs/dbraw/zinc/60/98/55/479609855.db2.gz XUSPMJNWHLFQQL-QWHCGFSZSA-N 0 3 336.388 2.661 20 5 EFBDHN O=C(N[C@@H]1CCCN2CCCC[C@H]12)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000594195111 479625312 /nfs/dbraw/zinc/62/53/12/479625312.db2.gz CCGQMLURLYMMEX-BSDSXHPESA-N 0 3 343.427 2.831 20 5 EFBDHN C[C@H](C(=O)N[C@H]1CCCN2CCCC[C@@H]12)c1ccc([N+](=O)[O-])cc1F ZINC000594196060 479626448 /nfs/dbraw/zinc/62/64/48/479626448.db2.gz KMYKXGFMCBRJPV-ZLIFDBKOSA-N 0 3 349.406 2.971 20 5 EFBDHN CCNc1ccc(C(=O)N[C@@H]2CCCN3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000594200260 479629171 /nfs/dbraw/zinc/62/91/71/479629171.db2.gz KHQRSRYOEQBXGE-CVEARBPZSA-N 0 3 346.431 2.773 20 5 EFBDHN COc1ccc(-c2ccc(CNC3([C@H](C)O)CC3)o2)c([N+](=O)[O-])c1 ZINC000597234416 479635047 /nfs/dbraw/zinc/63/50/47/479635047.db2.gz KXKLPSUNCKMQIV-NSHDSACASA-N 0 3 332.356 2.866 20 5 EFBDHN C[C@H](N[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)[C@H]1CN(C)CCO1 ZINC000618986661 479659928 /nfs/dbraw/zinc/65/99/28/479659928.db2.gz BCHIKYMPBHVCBK-AFAVFJNCSA-N 0 3 333.432 2.626 20 5 EFBDHN C[C@H](N[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)[C@H]1CN(C)CCO1 ZINC000618986662 479660506 /nfs/dbraw/zinc/66/05/06/479660506.db2.gz BCHIKYMPBHVCBK-JCURWCKSSA-N 0 3 333.432 2.626 20 5 EFBDHN CCn1cnnc1CCN[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000618987585 479660920 /nfs/dbraw/zinc/66/09/20/479660920.db2.gz LHTKBSQNGSRBIS-HNNXBMFYSA-N 0 3 329.404 2.761 20 5 EFBDHN CCn1cnnc1CCN[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000618987586 479661106 /nfs/dbraw/zinc/66/11/06/479661106.db2.gz LHTKBSQNGSRBIS-OAHLLOKOSA-N 0 3 329.404 2.761 20 5 EFBDHN CC[C@@H](CN1CCCC1)NC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000612544095 479689765 /nfs/dbraw/zinc/68/97/65/479689765.db2.gz LQYOCIIIRHKRNT-OLZOCXBDSA-N 0 3 337.395 2.828 20 5 EFBDHN COC1CCN(CCNc2ccc([N+](=O)[O-])cc2OC(F)F)CC1 ZINC000612788735 479762018 /nfs/dbraw/zinc/76/20/18/479762018.db2.gz BKKSNZIOXBKEPE-UHFFFAOYSA-N 0 3 345.346 2.719 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCN([C@@H]2CCC[C@@H]2O)CC1 ZINC000615835572 479766104 /nfs/dbraw/zinc/76/61/04/479766104.db2.gz RRLQGHDRIDFZAR-WIGMZFAJSA-N 0 3 345.443 2.529 20 5 EFBDHN CC[C@H]1CN(C)CCCN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000619567138 479831089 /nfs/dbraw/zinc/83/10/89/479831089.db2.gz UPFGUTQNVOSLIO-ZDUSSCGKSA-N 0 3 330.388 2.632 20 5 EFBDHN CC[C@@H]1CN(C)CCCN1C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000619579019 479834198 /nfs/dbraw/zinc/83/41/98/479834198.db2.gz ZEEWZBQVTNSBQD-CYBMUJFWSA-N 0 3 339.823 2.733 20 5 EFBDHN CC[C@H]1CN(C)CCCN1C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000619578775 479834269 /nfs/dbraw/zinc/83/42/69/479834269.db2.gz PEJPGXOAVYYMHA-INIZCTEOSA-N 0 3 348.447 2.730 20 5 EFBDHN CC[C@H](CN1CCCC1)NC(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000616254654 479862718 /nfs/dbraw/zinc/86/27/18/479862718.db2.gz FCEZPYMTVXYWDT-OAHLLOKOSA-N 0 3 334.420 2.577 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccccc1CN(C)C ZINC000617401411 480203109 /nfs/dbraw/zinc/20/31/09/480203109.db2.gz OBYUAOPXZWVLNK-UHFFFAOYSA-N 0 3 329.356 2.917 20 5 EFBDHN CCn1cnnc1CCNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000609851463 480213668 /nfs/dbraw/zinc/21/36/68/480213668.db2.gz MUCAUQOMPVDNDS-UHFFFAOYSA-N 0 3 341.371 2.799 20 5 EFBDHN Cc1cc(N2CC[C@H](C)[S@@](=O)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000617483677 480237499 /nfs/dbraw/zinc/23/74/99/480237499.db2.gz JEWCWPXMJPJEEV-MYODQAERSA-N 0 3 333.413 2.799 20 5 EFBDHN Cc1cc(N2CC[C@H](C)[S@](=O)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000617483676 480237553 /nfs/dbraw/zinc/23/75/53/480237553.db2.gz JEWCWPXMJPJEEV-DAOPMYJZSA-N 0 3 333.413 2.799 20 5 EFBDHN C[C@@H](O)CN(CCOc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000610161275 480245625 /nfs/dbraw/zinc/24/56/25/480245625.db2.gz CGPHKZZVEURFJE-OAHLLOKOSA-N 0 3 330.384 2.857 20 5 EFBDHN C[C@H](O)CN(CCOc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000610161274 480245761 /nfs/dbraw/zinc/24/57/61/480245761.db2.gz CGPHKZZVEURFJE-HNNXBMFYSA-N 0 3 330.384 2.857 20 5 EFBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCCN(C[C@H]2CCCO2)CC1 ZINC000610391581 480296392 /nfs/dbraw/zinc/29/63/92/480296392.db2.gz DGPPAXSXEHOGAP-JKSUJKDBSA-N 0 3 333.432 2.843 20 5 EFBDHN CSc1cccc(C(=O)N[C@@H]2CCN(CC3CC3)C2)c1[N+](=O)[O-] ZINC000614445235 480309362 /nfs/dbraw/zinc/30/93/62/480309362.db2.gz PRHYSHRBFWRDQS-GFCCVEGCSA-N 0 3 335.429 2.531 20 5 EFBDHN COc1cccc(CN(CCn2ccc([N+](=O)[O-])n2)CC(C)C)c1 ZINC000610485027 480318638 /nfs/dbraw/zinc/31/86/38/480318638.db2.gz YZNSRGKIUNCLMH-UHFFFAOYSA-N 0 3 332.404 2.958 20 5 EFBDHN C[C@H](CCNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)N(C)C ZINC000617758128 480354297 /nfs/dbraw/zinc/35/42/97/480354297.db2.gz IKHNDMHRBOUQBI-CYBMUJFWSA-N 0 3 337.423 2.751 20 5 EFBDHN C[C@@H](O)C[C@H]1CCCN1[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000152926196 533769257 /nfs/dbraw/zinc/76/92/57/533769257.db2.gz PCOSQFACMHWONQ-TYNCELHUSA-N 0 3 346.387 2.941 20 5 EFBDHN COc1cc(CN(C)CCCn2ccnc2C)c([N+](=O)[O-])cc1F ZINC000184268097 533780915 /nfs/dbraw/zinc/78/09/15/533780915.db2.gz ZRKNGRHJOVFIGR-UHFFFAOYSA-N 0 3 336.367 2.770 20 5 EFBDHN COc1cc(CN(C)C2CCC(CO)CC2)c([N+](=O)[O-])cc1F ZINC000184266809 533781936 /nfs/dbraw/zinc/78/19/36/533781936.db2.gz NJMJHILMVPNHAP-UHFFFAOYSA-N 0 3 326.368 2.725 20 5 EFBDHN COc1cc(CNC2(CO)CCCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000175996551 533868065 /nfs/dbraw/zinc/86/80/65/533868065.db2.gz CTCYMDCOZRLPGI-UHFFFAOYSA-N 0 3 346.330 2.600 20 5 EFBDHN C[C@@H](CNC(=O)Cc1cccc([N+](=O)[O-])c1)N(C)Cc1ccccc1 ZINC000173012971 533907310 /nfs/dbraw/zinc/90/73/10/533907310.db2.gz VJZWJEOFWZDRAB-HNNXBMFYSA-N 0 3 341.411 2.774 20 5 EFBDHN C[C@@H](CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N(C)C1CC1 ZINC000129458679 534034838 /nfs/dbraw/zinc/03/48/38/534034838.db2.gz YHYKZEFRMMNKRX-VIFPVBQESA-N 0 3 345.321 2.826 20 5 EFBDHN NC(=O)[C@@H]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000155039178 534426750 /nfs/dbraw/zinc/42/67/50/534426750.db2.gz SPLSXGKIBNPZPM-CYBMUJFWSA-N 0 3 329.356 2.552 20 5 EFBDHN Cc1ccoc1C(=O)NCCCN[C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000178657751 534440168 /nfs/dbraw/zinc/44/01/68/534440168.db2.gz WHDAQTCNXVHCDS-CYBMUJFWSA-N 0 3 331.372 2.967 20 5 EFBDHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1ccc([N+](=O)[O-])o1 ZINC000072013460 521749438 /nfs/dbraw/zinc/74/94/38/521749438.db2.gz WJHPHWOQDFHIRT-UHFFFAOYSA-N 0 3 335.335 2.531 20 5 EFBDHN CN(C)Cc1ccc(CNC(=O)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000077309077 521906165 /nfs/dbraw/zinc/90/61/65/521906165.db2.gz HTRUNSPWPXPQBH-UHFFFAOYSA-N 0 3 331.347 2.726 20 5 EFBDHN CN(C)Cc1cccc(NC(=O)CNc2ccccc2[N+](=O)[O-])c1 ZINC000065866477 521928805 /nfs/dbraw/zinc/92/88/05/521928805.db2.gz HSRUUBSCVNCTEV-UHFFFAOYSA-N 0 3 328.372 2.707 20 5 EFBDHN COc1cc(OC)c(OC)cc1CNCCc1ccc([N+](=O)[O-])cc1 ZINC000058092740 522825289 /nfs/dbraw/zinc/82/52/89/522825289.db2.gz XQJREOWDOLXQEE-UHFFFAOYSA-N 0 3 346.383 2.953 20 5 EFBDHN C[C@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1F)N1CCC(C)CC1 ZINC000150978592 524388317 /nfs/dbraw/zinc/38/83/17/524388317.db2.gz UEFOOYKYXYAEAH-CYBMUJFWSA-N 0 3 337.395 2.513 20 5 EFBDHN C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000120916635 524556355 /nfs/dbraw/zinc/55/63/55/524556355.db2.gz UZQMPAZZJYTFGO-HZMBPMFUSA-N 0 3 325.796 2.660 20 5 EFBDHN C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000120743484 524893941 /nfs/dbraw/zinc/89/39/41/524893941.db2.gz ABJRHMVHGSZDGH-YGRLFVJLSA-N 0 3 325.796 2.660 20 5 EFBDHN C[S@](=O)C[C@@H](NCCOc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000183131042 525386087 /nfs/dbraw/zinc/38/60/87/525386087.db2.gz HNJSKUFDXQXAKN-OSPHWJPCSA-N 0 3 348.424 2.683 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)N2CC[C@H](N3CCCC3)C2)cc1[N+](=O)[O-] ZINC000176746774 525703670 /nfs/dbraw/zinc/70/36/70/525703670.db2.gz XUGKALQVFKTYCR-ZBFHGGJFSA-N 0 3 346.431 2.844 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN[C@@H](C)c1cccnc1 ZINC000182883403 526078363 /nfs/dbraw/zinc/07/83/63/526078363.db2.gz PYESDUGSKSYHNQ-ZDUSSCGKSA-N 0 3 328.372 2.978 20 5 EFBDHN O=C(CCN1CCC([C@H]2CCCO2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000189137525 526482235 /nfs/dbraw/zinc/48/22/35/526482235.db2.gz MRCGSVNKTFKSCS-QGZVFWFLSA-N 0 3 347.415 2.814 20 5 EFBDHN O=C(CCN1CCC[C@H](c2cc[nH]n2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000193860481 526486115 /nfs/dbraw/zinc/48/61/15/526486115.db2.gz YFBOJOQBZGMOBM-ZDUSSCGKSA-N 0 3 343.387 2.526 20 5 EFBDHN O=C(NC[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000193771799 526614596 /nfs/dbraw/zinc/61/45/96/526614596.db2.gz YGCPWQKOOJEVCH-MRXNPFEDSA-N 0 3 339.395 2.847 20 5 EFBDHN Cc1sc(C(=O)N[C@@H]2CCN(CC3CCCC3)C2)cc1[N+](=O)[O-] ZINC000081293073 526874172 /nfs/dbraw/zinc/87/41/72/526874172.db2.gz GTJBOVVVRZVSHH-CYBMUJFWSA-N 0 3 337.445 2.959 20 5 EFBDHN O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CCC[C@H]1CN1CCCCC1 ZINC000152020374 527247552 /nfs/dbraw/zinc/24/75/52/527247552.db2.gz GYOFQCBWDMDUMR-INIZCTEOSA-N 0 3 349.406 2.753 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCN2CCN([C@@H]3C[C@H]4CC[C@@H]3C4)CC2)cc1 ZINC000177961819 527371156 /nfs/dbraw/zinc/37/11/56/527371156.db2.gz UVRLROIBNTVIRL-FRQCXROJSA-N 0 3 345.443 2.780 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCN2CCN([C@H]3C[C@H]4CC[C@@H]3C4)CC2)cc1 ZINC000177961834 527371500 /nfs/dbraw/zinc/37/15/00/527371500.db2.gz UVRLROIBNTVIRL-FCEWJHQRSA-N 0 3 345.443 2.780 20 5 EFBDHN O=C(NCCCNCc1cccnc1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000237687750 527677413 /nfs/dbraw/zinc/67/74/13/527677413.db2.gz XKTCYGYNBALXIF-UHFFFAOYSA-N 0 3 348.790 2.553 20 5 EFBDHN Cc1nn(C)c(NC[C@@H]2CCN(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000192958254 527678880 /nfs/dbraw/zinc/67/88/80/527678880.db2.gz GNJDVHGTSMLYQY-HNNXBMFYSA-N 0 3 329.404 2.571 20 5 EFBDHN CC(C)(C)CNC(=O)C(C)(C)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000155481177 527686067 /nfs/dbraw/zinc/68/60/67/527686067.db2.gz FRJDVTKOLKRULN-UHFFFAOYSA-N 0 3 337.420 2.504 20 5 EFBDHN CCN1CCN(c2cccc(NC(=O)c3ccc([N+](=O)[O-])o3)c2)CC1 ZINC000184280245 527711021 /nfs/dbraw/zinc/71/10/21/527711021.db2.gz AZPOHLCCIUNNEX-UHFFFAOYSA-N 0 3 344.371 2.582 20 5 EFBDHN CCO[C@@H]1C[C@@H](N(C)C[C@H](O)c2cccc([N+](=O)[O-])c2)C12CCC2 ZINC000154461097 527800984 /nfs/dbraw/zinc/80/09/84/527800984.db2.gz PMLNESPOTYQMPL-GVDBMIGSSA-N 0 3 334.416 2.908 20 5 EFBDHN CCO[C@H]1C[C@@H](NCc2ccc(C(N)=O)cc2[N+](=O)[O-])C1(CC)CC ZINC000187042263 528098288 /nfs/dbraw/zinc/09/82/88/528098288.db2.gz XGSANIMJTKYWJF-CVEARBPZSA-N 0 3 349.431 2.767 20 5 EFBDHN CCO[C@H]1C[C@H](N(C)C[C@H](O)c2cccc([N+](=O)[O-])c2)C12CCC2 ZINC000154460999 528130311 /nfs/dbraw/zinc/13/03/11/528130311.db2.gz PMLNESPOTYQMPL-ULQDDVLXSA-N 0 3 334.416 2.908 20 5 EFBDHN CCOc1ccc([C@@H](C)NCCn2ccc([N+](=O)[O-])n2)cc1OCC ZINC000181385236 528595010 /nfs/dbraw/zinc/59/50/10/528595010.db2.gz FCJTYIUSJVUEMV-CYBMUJFWSA-N 0 3 348.403 2.940 20 5 EFBDHN CC1(C)CN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CCN1 ZINC000183438911 529077560 /nfs/dbraw/zinc/07/75/60/529077560.db2.gz QWIBHDILJIIJLU-UHFFFAOYSA-N 0 3 343.836 2.551 20 5 EFBDHN CC[C@@H](NCCn1cc([N+](=O)[O-])ccc1=O)c1ccc(OC)cc1 ZINC000181807525 529172028 /nfs/dbraw/zinc/17/20/28/529172028.db2.gz WIWPARORZCJQSW-MRXNPFEDSA-N 0 3 331.372 2.506 20 5 EFBDHN CC(C)Oc1cc(C(=O)N(CCN(C)C)C2CC2)ccc1[N+](=O)[O-] ZINC000412258320 534943488 /nfs/dbraw/zinc/94/34/88/534943488.db2.gz OOENWSKKTDTTHC-UHFFFAOYSA-N 0 3 335.404 2.548 20 5 EFBDHN CC(C)Oc1cc(C(=O)N[C@H]2CCCN(C)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000412252833 534952166 /nfs/dbraw/zinc/95/21/66/534952166.db2.gz XDLHPOLAYQSPOP-OCCSQVGLSA-N 0 3 335.404 2.595 20 5 EFBDHN CC(C)[C@@H](CCO)NCc1ccc(Br)c([N+](=O)[O-])c1 ZINC000230689297 535181170 /nfs/dbraw/zinc/18/11/70/535181170.db2.gz DNNYOXCUHXLCOT-GFCCVEGCSA-N 0 3 331.210 2.854 20 5 EFBDHN CCO[C@@H]1C[C@@H](NCc2cc([N+](=O)[O-])cc3c2OCOC3)C12CCC2 ZINC000266121936 535410562 /nfs/dbraw/zinc/41/05/62/535410562.db2.gz AFXOHIBYAPQZJR-HZPDHXFCSA-N 0 3 348.399 2.899 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000342919500 535485923 /nfs/dbraw/zinc/48/59/23/535485923.db2.gz HUKOVUWWFMOXTH-GFCCVEGCSA-N 0 3 330.388 2.680 20 5 EFBDHN C[NH+](C)CCOc1ccccc1-c1noc(-c2cc([N+](=O)[O-])c[n-]2)n1 ZINC000356586892 535913469 /nfs/dbraw/zinc/91/34/69/535913469.db2.gz FBOGNAQDFVNDKX-UHFFFAOYSA-N 0 3 343.343 2.580 20 5 EFBDHN CN(C)CCOc1ccccc1-c1noc(-c2cc([N+](=O)[O-])c[nH]2)n1 ZINC000356586892 535913473 /nfs/dbraw/zinc/91/34/73/535913473.db2.gz FBOGNAQDFVNDKX-UHFFFAOYSA-N 0 3 343.343 2.580 20 5 EFBDHN CN(C)C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000360206516 535953379 /nfs/dbraw/zinc/95/33/79/535953379.db2.gz AMSWDOWLVZYANA-INIZCTEOSA-N 0 3 331.347 2.767 20 5 EFBDHN CCc1ccc(C(=O)NC[C@@H]2NCCc3ccccc32)cc1[N+](=O)[O-] ZINC000357243829 536165541 /nfs/dbraw/zinc/16/55/41/536165541.db2.gz RGWQBZOIQNPJBL-KRWDZBQOSA-N 0 3 339.395 2.774 20 5 EFBDHN COc1cc(C(=O)NC[C@H]2N(C)CCCC2(C)C)cc([N+](=O)[O-])c1C ZINC000344612929 536492743 /nfs/dbraw/zinc/49/27/43/536492743.db2.gz KELQFEKDFYCTNK-MRXNPFEDSA-N 0 3 349.431 2.762 20 5 EFBDHN COc1cc(CN2CCC[C@H](c3ccnn3C)C2)ccc1[N+](=O)[O-] ZINC000351970595 536757787 /nfs/dbraw/zinc/75/77/87/536757787.db2.gz FTKNLELUFHKESO-AWEZNQCLSA-N 0 3 330.388 2.717 20 5 EFBDHN O=C(N[C@@H](CO)CN1CCCC1)c1cc2ccccc2c2cccnc12 ZINC000673529834 547911027 /nfs/dbraw/zinc/91/10/27/547911027.db2.gz DHPBRNDDKQAMEZ-MRXNPFEDSA-N 0 3 349.434 2.575 20 5 EFBDHN Cc1cccc(C)c1OCCNC[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000754251502 575410718 /nfs/dbraw/zinc/41/07/18/575410718.db2.gz URJRXMYTNHZHJM-QGZVFWFLSA-N 0 3 330.384 2.914 20 5 EFBDHN Cc1cc(C)cc(OCCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000754250703 575410782 /nfs/dbraw/zinc/41/07/82/575410782.db2.gz MPKGXXSGQKTQIW-GOSISDBHSA-N 0 3 330.384 2.914 20 5 EFBDHN CC(C)[C@H](CN(C)C)NC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000754361533 575424714 /nfs/dbraw/zinc/42/47/14/575424714.db2.gz IIARBAJHFDRCQG-ABAIWWIYSA-N 0 3 325.384 2.540 20 5 EFBDHN COCC[C@@H](NC[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(C)o1 ZINC000754547523 575450434 /nfs/dbraw/zinc/45/04/34/575450434.db2.gz WGPFKAHBNULHCG-HZPDHXFCSA-N 0 3 334.372 2.897 20 5 EFBDHN C[C@@H](NCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CCCOC1 ZINC000754568703 575453998 /nfs/dbraw/zinc/45/39/98/575453998.db2.gz ODHPGRCGXUJHQR-GHMZBOCLSA-N 0 3 341.795 2.591 20 5 EFBDHN C[C@@H]1CN(CCCCNc2nc3ccccn3c2[N+](=O)[O-])C[C@H](C)O1 ZINC000754614913 575461714 /nfs/dbraw/zinc/46/17/14/575461714.db2.gz RHKXRVPZSWJFDD-OKILXGFUSA-N 0 3 347.419 2.544 20 5 EFBDHN Cc1nn(CN2CC[C@@H](C3CCOCC3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000754782042 575489022 /nfs/dbraw/zinc/48/90/22/575489022.db2.gz HTHJSSWMKZDIIY-OAHLLOKOSA-N 0 3 344.415 2.959 20 5 EFBDHN O=[N+]([O-])c1ccc2cnn(CN3CC[C@@H](C4CCOCC4)C3)c2c1 ZINC000754795981 575492588 /nfs/dbraw/zinc/49/25/88/575492588.db2.gz KPJREGYZEXPPNJ-OAHLLOKOSA-N 0 3 330.388 2.651 20 5 EFBDHN C[C@@H]1C[C@@H](NC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)CCN1C ZINC000756950060 575804384 /nfs/dbraw/zinc/80/43/84/575804384.db2.gz ASWNUONJCRJWID-PWSUYJOCSA-N 0 3 340.811 2.530 20 5 EFBDHN CS[C@H]1CN(c2ccc([N+](=O)[O-])cc2OC(F)F)C[C@@H]1N(C)C ZINC000760576867 576049069 /nfs/dbraw/zinc/04/90/69/576049069.db2.gz MXSVBVULXIPAGJ-AAEUAGOBSA-N 0 3 347.387 2.678 20 5 EFBDHN O=[N+]([O-])c1ccc(Cl)c(CN2CCN(c3ccncc3)CC2)c1 ZINC000760892875 576085941 /nfs/dbraw/zinc/08/59/41/576085941.db2.gz OLTQTTQBGJTVFY-UHFFFAOYSA-N 0 3 332.791 2.965 20 5 EFBDHN O=C(CCN1CC[C@H](C(F)(F)F)C1)Nc1ccccc1[N+](=O)[O-] ZINC000761050502 576104927 /nfs/dbraw/zinc/10/49/27/576104927.db2.gz KNTJLQOGEWKPKN-JTQLQIEISA-N 0 3 331.294 2.808 20 5 EFBDHN CS(=O)(=O)[C@@H]1CCC[C@H](NCc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000761525433 576174404 /nfs/dbraw/zinc/17/44/04/576174404.db2.gz JZZPKGXIFCFKDW-NWDGAFQWSA-N 0 3 346.836 2.694 20 5 EFBDHN C[C@H](NC[C@@H](O)COc1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000765289190 577027792 /nfs/dbraw/zinc/02/77/92/577027792.db2.gz MVKIVDOEWIVNJT-BLLLJJGKSA-N 0 3 334.347 2.824 20 5 EFBDHN O=[N+]([O-])c1c(N2CCN(C3CCCCC3)CC2)nc2ccccn21 ZINC000765576803 577055727 /nfs/dbraw/zinc/05/57/27/577055727.db2.gz RZGURCXGBAZHJY-UHFFFAOYSA-N 0 3 329.404 2.697 20 5 EFBDHN O=C(NC[C@H]1CCCCN1C1CC1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000765802049 577078738 /nfs/dbraw/zinc/07/87/38/577078738.db2.gz YAIOEQQVDLBAAD-GFCCVEGCSA-N 0 3 337.807 2.995 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H]1C[C@H](O)c1cnn(C)c1 ZINC000766946882 577189283 /nfs/dbraw/zinc/18/92/83/577189283.db2.gz PQWDHPHWZJNKBU-SIIHOXLZSA-N 0 3 344.415 2.977 20 5 EFBDHN C[C@@H](N(C)CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O)C(C)(C)C ZINC000726584211 577374212 /nfs/dbraw/zinc/37/42/12/577374212.db2.gz CABCYGFMEMTKRD-GFCCVEGCSA-N 0 3 348.403 2.687 20 5 EFBDHN Cc1cc([N+](=O)[O-])cc(Cl)c1NC[C@@H]1CN2CCC[C@@H]2CO1 ZINC000770099893 577402018 /nfs/dbraw/zinc/40/20/18/577402018.db2.gz LLVSWYFAYAQYGL-DGCLKSJQSA-N 0 3 325.796 2.832 20 5 EFBDHN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)OCCN1CCCCC1 ZINC000770361959 577412897 /nfs/dbraw/zinc/41/28/97/577412897.db2.gz MKNJCGZNZJZXSD-UHFFFAOYSA-N 0 3 331.372 2.579 20 5 EFBDHN O=[N+]([O-])c1ccc(Cl)cc1CN[C@@H]1CCO[C@@]2(CCOC2)C1 ZINC000770752890 581133632 /nfs/dbraw/zinc/13/36/32/581133632.db2.gz WKODOXSZASYMCP-HIFRSBDPSA-N 0 3 326.780 2.676 20 5 EFBDHN COc1cccc(NC2CCN(C[C@H]3CCCO3)CC2)c1[N+](=O)[O-] ZINC000771969591 581265842 /nfs/dbraw/zinc/26/58/42/581265842.db2.gz HPCSJKVUDVFYSF-CQSZACIVSA-N 0 3 335.404 2.659 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCC(N[C@@H]3CCCc4c[nH]nc43)CC2)cc1 ZINC000773064854 581392677 /nfs/dbraw/zinc/39/26/77/581392677.db2.gz IQFLWUZKARRUJK-QGZVFWFLSA-N 0 3 341.415 2.954 20 5 EFBDHN O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2NC[C@@H](O)c2ccccc2F)n1 ZINC000774136088 581485063 /nfs/dbraw/zinc/48/50/63/581485063.db2.gz XMYUJJVELUDKJU-ARFHVFGLSA-N 0 3 348.378 2.737 20 5 EFBDHN COC(=O)N1CCC[C@H](N[C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000774167428 581486301 /nfs/dbraw/zinc/48/63/01/581486301.db2.gz CZZSTJGTEVFNBY-BBRMVZONSA-N 0 3 333.388 2.793 20 5 EFBDHN O=[N+]([O-])c1cc2cnn(CN3CC[C@@H](N4CC=CC4)C3)c2c(Cl)c1 ZINC000774636116 581495987 /nfs/dbraw/zinc/49/59/87/581495987.db2.gz LJHTVQZKNJTOEI-CYBMUJFWSA-N 0 3 347.806 2.502 20 5 EFBDHN C[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccc(-c2nnn[n-]2)cc1 ZINC000820427229 599381864 /nfs/dbraw/zinc/38/18/64/599381864.db2.gz QLUPQAAUFNQXLN-LBPRGKRZSA-N 0 3 338.371 2.668 20 5 EFBDHN C[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccc(-c2nn[n-]n2)cc1 ZINC000820427229 599381866 /nfs/dbraw/zinc/38/18/66/599381866.db2.gz QLUPQAAUFNQXLN-LBPRGKRZSA-N 0 3 338.371 2.668 20 5 EFBDHN COC(=O)N(C)CCNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000850390339 1250461437 /nfs/dbraw/zinc/46/14/37/1250461437.db2.gz VUVVSCRRWBBNIC-UHFFFAOYSA-N 0 3 333.344 2.643 20 5 EFBDHN CC(C)(CNCc1cc([N+](=O)[O-])ccc1Cl)[C@]1(O)CCCOC1 ZINC000850400920 1250466576 /nfs/dbraw/zinc/46/65/76/1250466576.db2.gz QLTRDJPEZMZKOU-INIZCTEOSA-N 0 3 342.823 2.906 20 5 EFBDHN CC([C@H](OC(=O)c1c(Cl)cnn1C)c1ccccc1F)[N+](=O)[O-] ZINC000851107931 1250800171 /nfs/dbraw/zinc/80/01/71/1250800171.db2.gz FQJZUVJLZPNRAG-SDBXPKJASA-N 0 3 341.726 2.776 20 5 EFBDHN Cc1oc(C(C)C)nc1C(=O)NCCNCc1cccc([N+](=O)[O-])c1 ZINC001127168553 1251942800 /nfs/dbraw/zinc/94/28/00/1251942800.db2.gz PWIQJJKCCQPLKY-UHFFFAOYSA-N 0 3 346.387 2.534 20 5 EFBDHN CN(CC(=O)NC/C=C/CNc1ccccc1[N+](=O)[O-])CC(C)(C)C ZINC001107513939 1256021348 /nfs/dbraw/zinc/02/13/48/1256021348.db2.gz QIFALSXZOBIUJN-BQYQJAHWSA-N 0 3 348.447 2.657 20 5 EFBDHN CC1(C(=O)N2CCC(NCc3csc([N+](=O)[O-])c3)CC2)CCC1 ZINC000996876461 1256302186 /nfs/dbraw/zinc/30/21/86/1256302186.db2.gz AHJBDYOBXFEXOV-UHFFFAOYSA-N 0 3 337.445 2.927 20 5 EFBDHN CC(F)(F)CC(=O)N1CCC(NCc2csc([N+](=O)[O-])c2)CC1 ZINC000996978067 1256598991 /nfs/dbraw/zinc/59/89/91/1256598991.db2.gz KAHYCIOKZZOBOV-UHFFFAOYSA-N 0 3 347.387 2.782 20 5 EFBDHN O=C(NCCNCc1ccc([N+](=O)[O-])cc1)c1ccc2occc2c1 ZINC001127887125 1256955086 /nfs/dbraw/zinc/95/50/86/1256955086.db2.gz RSTSHRLDQYSYFB-UHFFFAOYSA-N 0 3 339.351 2.861 20 5 EFBDHN O=C(Cc1ccco1)N1CCC(NCc2csc([N+](=O)[O-])c2)CC1 ZINC000997115688 1256955242 /nfs/dbraw/zinc/95/52/42/1256955242.db2.gz GPYAGXPGEMONDM-UHFFFAOYSA-N 0 3 349.412 2.573 20 5 EFBDHN C/C=C(\C)C(=O)N1CCC(CNCc2csc([N+](=O)[O-])c2)CC1 ZINC000997665126 1258194355 /nfs/dbraw/zinc/19/43/55/1258194355.db2.gz YKJZCLISSRMFAW-KGVSQERTSA-N 0 3 337.445 2.951 20 5 EFBDHN CCCN(C)CC(=O)NCCC1(CNc2ccc([N+](=O)[O-])cc2)CC1 ZINC001089950846 1261134753 /nfs/dbraw/zinc/13/47/53/1261134753.db2.gz QZMBNLFKEOWGIB-UHFFFAOYSA-N 0 3 348.447 2.635 20 5 EFBDHN COc1ccc(-c2ccc(CN[C@H]3COC[C@@H]3C)o2)c([N+](=O)[O-])c1 ZINC000922642914 1266504648 /nfs/dbraw/zinc/50/46/48/1266504648.db2.gz IVTWYUUPLFIYNF-NHYWBVRUSA-N 0 3 332.356 2.988 20 5 EFBDHN COc1ccc(-c2ccc(CN[C@@H]3COC[C@@H]3C)o2)c([N+](=O)[O-])c1 ZINC000922642915 1266505106 /nfs/dbraw/zinc/50/51/06/1266505106.db2.gz IVTWYUUPLFIYNF-XHDPSFHLSA-N 0 3 332.356 2.988 20 5 EFBDHN O=C(NCCCNCc1csc([N+](=O)[O-])c1)C1(F)CCCCC1 ZINC001170155945 1278150515 /nfs/dbraw/zinc/15/05/15/1278150515.db2.gz QMAOTRUVCOSALX-UHFFFAOYSA-N 0 3 343.424 2.925 20 5 EFBDHN COc1cc(CNC[C@@]2(C)CC2(Cl)Cl)c([N+](=O)[O-])cc1O ZINC000824765671 1278270375 /nfs/dbraw/zinc/27/03/75/1278270375.db2.gz OMVNBBMWCAWFID-GFCCVEGCSA-N 0 3 335.187 2.983 20 5 EFBDHN CN(c1ccccc1)c1ccc(CNCC[S@@](C)=O)cc1[N+](=O)[O-] ZINC000735084634 1267199937 /nfs/dbraw/zinc/19/99/37/1267199937.db2.gz MQIGODNVHLXNKL-XMMPIXPASA-N 0 3 347.440 2.831 20 5 EFBDHN O=C(CN[C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(C(F)(F)F)cc1 ZINC001168976266 1272545508 /nfs/dbraw/zinc/54/55/08/1272545508.db2.gz CDYPMNVSXKOWPX-MFKMUULPSA-N 0 3 330.306 2.923 20 5 EFBDHN O=[N+]([O-])C[C@@H]1CC[C@H](N2CCN(c3ccc(F)c(F)c3)CC2)C1 ZINC001169007426 1272581282 /nfs/dbraw/zinc/58/12/82/1272581282.db2.gz NQPWCQVTRIREFS-OLZOCXBDSA-N 0 3 325.359 2.532 20 5 EFBDHN O=[N+]([O-])C[C@@H]1CC[C@H](N2CCN(C/C=C/c3ccccc3)CC2)C1 ZINC001169009338 1272583366 /nfs/dbraw/zinc/58/33/66/1272583366.db2.gz VTNXXTQXYUIQEC-AXHCFYFUSA-N 0 3 329.444 2.763 20 5 EFBDHN C[C@@H]1CN(C(=O)OC(C)(C)C)[C@@H](C)CN1[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169017539 1272615817 /nfs/dbraw/zinc/61/58/17/1272615817.db2.gz AKSLWYWRZGGDBS-CBBWQLFWSA-N 0 3 341.452 2.762 20 5 EFBDHN C[C@H]1CN([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C[C@H](C)N1C(=O)OC(C)(C)C ZINC001169047880 1272627043 /nfs/dbraw/zinc/62/70/43/1272627043.db2.gz SEDOFOLAONWQEW-ZQDZILKHSA-N 0 3 341.452 2.762 20 5 EFBDHN COc1cc([N+](=O)[O-])c(N2CCCc3ccc(CN)nc32)cc1F ZINC001169592504 1273025728 /nfs/dbraw/zinc/02/57/28/1273025728.db2.gz WKTRNGFLRWELLI-UHFFFAOYSA-N 0 3 332.335 2.681 20 5 EFBDHN CCN(C)C(C)(C)C(=O)N(C)CCCNc1ccccc1[N+](=O)[O-] ZINC001109547811 1274408529 /nfs/dbraw/zinc/40/85/29/1274408529.db2.gz WQUNPIPHCLXVAD-UHFFFAOYSA-N 0 3 336.436 2.586 20 5 EFBDHN CC(C)(NCc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CCOCC1 ZINC000786148544 1275313088 /nfs/dbraw/zinc/31/30/88/1275313088.db2.gz JOHWLTUHWWHQOR-UHFFFAOYSA-N 0 3 346.387 2.940 20 5 EFBDHN COc1ccc(CN[C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])nc1 ZINC001170312983 1279008323 /nfs/dbraw/zinc/00/83/23/1279008323.db2.gz HODFPMVFTORRLQ-GFCCVEGCSA-N 0 3 331.372 2.728 20 5 EFBDHN COc1ccc(C[C@@H](C)N2CC(N3CCCCC3)C2)c([N+](=O)[O-])c1 ZINC001170352872 1279031712 /nfs/dbraw/zinc/03/17/12/1279031712.db2.gz SIRDWDGHRGHJAX-CQSZACIVSA-N 0 3 333.432 2.705 20 5 EFBDHN COc1ccc(C[C@H](C)N2CCC[C@@]3(CCC(=O)O3)C2)c([N+](=O)[O-])c1 ZINC001170355235 1279034184 /nfs/dbraw/zinc/03/41/84/1279034184.db2.gz YAPCUNZFQYOTAL-SCLBCKFNSA-N 0 3 348.399 2.706 20 5 EFBDHN CCCOc1ccc(CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000819040041 1276577305 /nfs/dbraw/zinc/57/73/05/1276577305.db2.gz TXWHRMFHNVBLRH-INIZCTEOSA-N 0 3 331.372 2.602 20 5 EFBDHN Cc1cccc(F)c1CNC[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000819114208 1276637870 /nfs/dbraw/zinc/63/78/70/1276637870.db2.gz ZDUMGJNWNXEGJM-ZDUSSCGKSA-N 0 3 334.347 2.572 20 5 EFBDHN CC(C)Oc1cc(CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)ccn1 ZINC000819186104 1276664584 /nfs/dbraw/zinc/66/45/84/1276664584.db2.gz PCSPSBGXLUPVLK-INIZCTEOSA-N 0 3 331.372 2.600 20 5 EFBDHN CC[C@@H](C)Oc1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)ccn1 ZINC000819216507 1276691866 /nfs/dbraw/zinc/69/18/66/1276691866.db2.gz VFYAOOXOQLPXRU-CXAGYDPISA-N 0 3 345.399 2.990 20 5 EFBDHN CC[C@@H](C)Oc1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)ccn1 ZINC000819216508 1276694469 /nfs/dbraw/zinc/69/44/69/1276694469.db2.gz VFYAOOXOQLPXRU-DYVFJYSZSA-N 0 3 345.399 2.990 20 5 EFBDHN O=C(NCCNCc1cccc([N+](=O)[O-])c1)c1ccsc1Cl ZINC001134813049 1287256534 /nfs/dbraw/zinc/25/65/34/1287256534.db2.gz YEFQUKSCGKPUOL-UHFFFAOYSA-N 0 3 339.804 2.829 20 5 EFBDHN COc1ccc(C[C@@H](C)NC2(c3cccnn3)CC2)c([N+](=O)[O-])c1 ZINC001170306574 1279027880 /nfs/dbraw/zinc/02/78/80/1279027880.db2.gz XSNCWIWNZPBRFZ-GFCCVEGCSA-N 0 3 328.372 2.603 20 5 EFBDHN CCCCN1CCN([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC001170346616 1279051399 /nfs/dbraw/zinc/05/13/99/1279051399.db2.gz OSWOSKWNJBKZAS-OAHLLOKOSA-N 0 3 335.448 2.952 20 5 EFBDHN Cn1ncc(CNCCc2ccc(Cl)cc2[N+](=O)[O-])c1Cl ZINC000815135910 1287340022 /nfs/dbraw/zinc/34/00/22/1287340022.db2.gz WQYMJALXUYQPSH-UHFFFAOYSA-N 0 3 329.187 2.967 20 5 EFBDHN CC(C)(CCC(=O)N[C@@]1(C)CCN(Cc2ccccc2)C1)[N+](=O)[O-] ZINC000844964879 1279364687 /nfs/dbraw/zinc/36/46/87/1279364687.db2.gz PSPGTVSVPYQZTK-SFHVURJKSA-N 0 3 333.432 2.603 20 5 EFBDHN CC(=O)c1cc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])n(C)c1 ZINC000845872905 1279900705 /nfs/dbraw/zinc/90/07/05/1279900705.db2.gz QQSPMPQCWPLFDH-QLJPJBMISA-N 0 3 348.330 2.930 20 5 EFBDHN CC([C@@H](OC(=O)c1ccnc(N(C)C)c1)c1ccccc1F)[N+](=O)[O-] ZINC000845874609 1279901676 /nfs/dbraw/zinc/90/16/76/1279901676.db2.gz ICJIVEPKCMYXDM-BDJLRTHQSA-N 0 3 347.346 2.850 20 5 EFBDHN Cc1ncc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])c(C)n1 ZINC000845875957 1279901997 /nfs/dbraw/zinc/90/19/97/1279901997.db2.gz MFVHAXVGVRKYQZ-ZUZCIYMTSA-N 0 3 333.319 2.796 20 5 EFBDHN COc1ccc(CC(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])nc1 ZINC000845877135 1279903188 /nfs/dbraw/zinc/90/31/88/1279903188.db2.gz FBCQOGATXIVKJJ-GTNSWQLSSA-N 0 3 348.330 2.722 20 5 EFBDHN CC([C@H](OC(=O)c1ccn(C(F)F)n1)c1ccccc1F)[N+](=O)[O-] ZINC000845876748 1279903264 /nfs/dbraw/zinc/90/32/64/1279903264.db2.gz OFSSJBBMLFKAAA-UFBFGSQYSA-N 0 3 343.261 2.981 20 5 EFBDHN CC([C@H](OC(=O)[C@H]1CSCCS1)c1ccccc1F)[N+](=O)[O-] ZINC000845876724 1279903553 /nfs/dbraw/zinc/90/35/53/1279903553.db2.gz OATUOBHVYZNOEW-WQAKAFBOSA-N 0 3 345.417 2.924 20 5 EFBDHN CC([C@@H](OC(=O)[C@@H]1C[C@H]1c1cnn(C)c1)c1ccccc1F)[N+](=O)[O-] ZINC000845877678 1279903597 /nfs/dbraw/zinc/90/35/97/1279903597.db2.gz FZOMMSSPJYOMMM-FDKDBAQKSA-N 0 3 347.346 2.612 20 5 EFBDHN CC([C@H](OC(=O)[C@@H]1CCO[C@H](C)C1)c1ccccc1F)[N+](=O)[O-] ZINC000845876729 1279903724 /nfs/dbraw/zinc/90/37/24/1279903724.db2.gz ODCDZTNAIKOYBL-BLTAXRJOSA-N 0 3 325.336 2.890 20 5 EFBDHN CC([C@H](OC(=O)c1cc2n(n1)CCCC2)c1ccccc1F)[N+](=O)[O-] ZINC000845882325 1279904580 /nfs/dbraw/zinc/90/45/80/1279904580.db2.gz OMEXSYATBZLXTC-ZBEGNZNMSA-N 0 3 347.346 2.922 20 5 EFBDHN CC([C@@H](OC(=O)[C@H]1CCc2n[nH]cc2C1)c1ccccc1F)[N+](=O)[O-] ZINC000845882033 1279905640 /nfs/dbraw/zinc/90/56/40/1279905640.db2.gz NMUJXVBPKQRZOH-OHUAYANFSA-N 0 3 347.346 2.603 20 5 EFBDHN CC([C@@H](OC(=O)c1cnc2n1CCCC2)c1ccccc1F)[N+](=O)[O-] ZINC000845883273 1279906104 /nfs/dbraw/zinc/90/61/04/1279906104.db2.gz RJDQLBYMLRGIMZ-BDJLRTHQSA-N 0 3 347.346 2.922 20 5 EFBDHN COc1ccnc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])c1 ZINC000845882411 1279906550 /nfs/dbraw/zinc/90/65/50/1279906550.db2.gz UJYOHZWNDROKNX-BONVTDFDSA-N 0 3 334.303 2.793 20 5 EFBDHN CC([C@H](OC(=O)c1cnn(CCF)c1)c1ccccc1F)[N+](=O)[O-] ZINC000845881930 1279906634 /nfs/dbraw/zinc/90/66/34/1279906634.db2.gz MUMOTRCRIBWLFW-HZMBPMFUSA-N 0 3 339.298 2.555 20 5 EFBDHN CCN1C[C@@H](CNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1=O ZINC000846097704 1280031237 /nfs/dbraw/zinc/03/12/37/1280031237.db2.gz UIQJWHWZEBGSEI-SECBINFHSA-N 0 3 346.214 2.860 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H](C)CN1CCCC1=O ZINC000872024324 1287404175 /nfs/dbraw/zinc/40/41/75/1287404175.db2.gz QGGHDZGVHLUTNA-NWDGAFQWSA-N 0 3 337.445 2.978 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCCN1CCO[C@@H](C)C1 ZINC000872033983 1287406330 /nfs/dbraw/zinc/40/63/30/1287406330.db2.gz KUOFGJVFCHNJRJ-STQMWFEESA-N 0 3 339.461 2.688 20 5 EFBDHN CCC(=O)N1CC[C@H](N[C@@H](C)c2cc([N+](=O)[O-])ccc2SC)C1 ZINC000872044389 1287409358 /nfs/dbraw/zinc/40/93/58/1287409358.db2.gz UPFRYGORJZJQTN-RYUDHWBXSA-N 0 3 337.445 2.978 20 5 EFBDHN Cc1noc(C(C)C)c1C(=O)NCCNCc1cccc([N+](=O)[O-])c1 ZINC001129920595 1280375616 /nfs/dbraw/zinc/37/56/16/1280375616.db2.gz NPJRYYQFIYGAPX-UHFFFAOYSA-N 0 3 346.387 2.534 20 5 EFBDHN Cc1cc(N[C@H]2C[C@@H](CNC(=O)CN(C)C(C)C)C2)ccc1[N+](=O)[O-] ZINC001091350320 1280384228 /nfs/dbraw/zinc/38/42/28/1280384228.db2.gz LSBNFDMOLIDBQD-FZNQNYSPSA-N 0 3 348.447 2.550 20 5 EFBDHN CCN(C)C(C)(C)C(=O)NC[C@H]1C[C@H](Nc2ccccc2[N+](=O)[O-])C1 ZINC001091489824 1280772331 /nfs/dbraw/zinc/77/23/31/1280772331.db2.gz AAFVGJOXEDIAMS-HDJSIYSDSA-N 0 3 348.447 2.632 20 5 EFBDHN CCOC(=O)C1=C(Nc2c(C)cc(C)c([N+](=O)[O-])c2C)CCNC1 ZINC001170515329 1281194886 /nfs/dbraw/zinc/19/48/86/1281194886.db2.gz ISIDWXJMVGRAKP-UHFFFAOYSA-N 0 3 333.388 2.742 20 5 EFBDHN CCOC(=O)C1=C(Nc2c(Cl)cc(C)cc2[N+](=O)[O-])CCNC1 ZINC001170521687 1281283715 /nfs/dbraw/zinc/28/37/15/1281283715.db2.gz LFYYMWRTTRJJMX-UHFFFAOYSA-N 0 3 339.779 2.779 20 5 EFBDHN O=C(CCc1ccc(F)cc1)NCCNCc1ccc([N+](=O)[O-])cc1 ZINC001130918085 1281293921 /nfs/dbraw/zinc/29/39/21/1281293921.db2.gz LXVQXJNSRZQKHY-UHFFFAOYSA-N 0 3 345.374 2.573 20 5 EFBDHN Cc1cc(C(=O)NCCNCc2ccc([N+](=O)[O-])cc2)c(C)s1 ZINC001130953770 1281331766 /nfs/dbraw/zinc/33/17/66/1281331766.db2.gz IFILLYHTWSKCSU-UHFFFAOYSA-N 0 3 333.413 2.793 20 5 EFBDHN COCCCN1CCC(Nc2cc([N+](=O)[O-])ccc2C(C)=O)CC1 ZINC000807958763 1281478547 /nfs/dbraw/zinc/47/85/47/1281478547.db2.gz FOKOUIPGDLSVEB-UHFFFAOYSA-N 0 3 335.404 2.710 20 5 EFBDHN CN(C)C[C@H](CO)Nc1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000809341575 1282159205 /nfs/dbraw/zinc/15/92/05/1282159205.db2.gz TZDWYGMFNZNOJI-SSDOTTSWSA-N 0 3 341.717 2.601 20 5 EFBDHN O=C(NC1CC1)OC[C@H]1CCCCN1CCc1ccc([N+](=O)[O-])cc1 ZINC000810039063 1282802445 /nfs/dbraw/zinc/80/24/45/1282802445.db2.gz PIYKMADUWTZZOH-QGZVFWFLSA-N 0 3 347.415 2.880 20 5 EFBDHN C[C@@H](NCc1ccc(C[S@](C)=O)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815625936 1287645175 /nfs/dbraw/zinc/64/51/75/1287645175.db2.gz QIDGXRIEKQGPJS-YYUOZPCZSA-N 0 3 347.440 2.906 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(NCCNC(=O)C(C)(C)N2CCCCC2)c1 ZINC001093889214 1284600028 /nfs/dbraw/zinc/60/00/28/1284600028.db2.gz SXSQWSPLHQTWPF-UHFFFAOYSA-N 0 3 348.447 2.696 20 5 EFBDHN O=C(Cc1cccc(Cl)c1)NCCNCc1ccc([N+](=O)[O-])cc1 ZINC001133211823 1284998655 /nfs/dbraw/zinc/99/86/55/1284998655.db2.gz WNWLANHWDHKRFW-UHFFFAOYSA-N 0 3 347.802 2.697 20 5 EFBDHN Cc1ccc(F)c(C(=O)NCCNCc2ccc([N+](=O)[O-])cc2)c1F ZINC001133305406 1285158225 /nfs/dbraw/zinc/15/82/25/1285158225.db2.gz WGNZICCEIIPIEG-UHFFFAOYSA-N 0 3 349.337 2.701 20 5 EFBDHN COc1ncc([N+](=O)[O-])cc1-n1c(-c2ccccc2)cnc1[C@H](C)N ZINC001170682736 1285319533 /nfs/dbraw/zinc/31/95/33/1285319533.db2.gz SDKQTZZKLBHEPF-NSHDSACASA-N 0 3 339.355 2.871 20 5 EFBDHN CC(C)(C(=O)NCCCNc1ccc([N+](=O)[O-])cc1)N1CCCCC1 ZINC001094596345 1285410450 /nfs/dbraw/zinc/41/04/50/1285410450.db2.gz SNNJHWQSCLALPN-UHFFFAOYSA-N 0 3 348.447 2.778 20 5 EFBDHN C[C@H](N)c1ncc(-c2ccccc2)n1-c1cc([N+](=O)[O-])c2nncn2c1 ZINC001170686454 1285420024 /nfs/dbraw/zinc/42/00/24/1285420024.db2.gz RQQPBOJWFKAJPA-NSHDSACASA-N 0 3 349.354 2.510 20 5 EFBDHN Cc1ccc(NCCCNC(=O)CN2CCC(C)(C)C2)c([N+](=O)[O-])c1 ZINC001094784071 1285549008 /nfs/dbraw/zinc/54/90/08/1285549008.db2.gz GLVHACJREQQKHS-UHFFFAOYSA-N 0 3 348.447 2.553 20 5 EFBDHN Cc1noc(C)c1COc1ccccc1C(=O)OCC(C)[N+](=O)[O-] ZINC000813104705 1285653370 /nfs/dbraw/zinc/65/33/70/1285653370.db2.gz FZGBDBQQNKRBRE-SNVBAGLBSA-N 0 3 334.328 2.692 20 5 EFBDHN CC(COC(=O)c1ccccc1-c1nc(C(C)(C)C)no1)[N+](=O)[O-] ZINC000813101491 1285653767 /nfs/dbraw/zinc/65/37/67/1285653767.db2.gz BLSSUPJURFUBMB-SNVBAGLBSA-N 0 3 333.344 2.856 20 5 EFBDHN Cc1ccc(-n2nc(C(=O)OCC(C)[N+](=O)[O-])c3c2CCC3)c(F)c1 ZINC000813104549 1285654067 /nfs/dbraw/zinc/65/40/67/1285654067.db2.gz DRJFCLWNDPWKLM-LLVKDONJSA-N 0 3 347.346 2.631 20 5 EFBDHN Cc1sc2ncnc(SCC(=O)OCC(C)[N+](=O)[O-])c2c1C ZINC000813104900 1285654230 /nfs/dbraw/zinc/65/42/30/1285654230.db2.gz SSXZWEWLJFOTQH-ZETCQYMHSA-N 0 3 341.414 2.609 20 5 EFBDHN CC(COC(=O)c1cnc(-c2ccc(F)c(F)c2)s1)[N+](=O)[O-] ZINC000813105090 1285654982 /nfs/dbraw/zinc/65/49/82/1285654982.db2.gz VLHOSRXIXPZIQF-SSDOTTSWSA-N 0 3 328.296 2.910 20 5 EFBDHN CC(COC(=O)c1cccc(CNC(=O)OC(C)(C)C)c1)[N+](=O)[O-] ZINC000813107216 1285679879 /nfs/dbraw/zinc/67/98/79/1285679879.db2.gz LVTJQDBFHIQLHY-LLVKDONJSA-N 0 3 338.360 2.533 20 5 EFBDHN CCc1c(C(=O)OCC(C)[N+](=O)[O-])cnn1-c1ccc(Cl)cc1 ZINC000813108723 1285680765 /nfs/dbraw/zinc/68/07/65/1285680765.db2.gz AASLIIIMJMXZMI-JTQLQIEISA-N 0 3 337.763 2.910 20 5 EFBDHN Cc1nn(-c2ccccc2)c2nc(C(=O)OCC(C)[N+](=O)[O-])ccc12 ZINC000813109685 1285682425 /nfs/dbraw/zinc/68/24/25/1285682425.db2.gz NOUSTIWJWHCOIP-LLVKDONJSA-N 0 3 340.339 2.551 20 5 EFBDHN CC(COC(=O)c1nccnc1-c1nc2ccccc2s1)[N+](=O)[O-] ZINC000813111335 1285684224 /nfs/dbraw/zinc/68/42/24/1285684224.db2.gz GQOYUQPKARWEPH-SECBINFHSA-N 0 3 344.352 2.575 20 5 EFBDHN Cc1nn(Cc2ccccc2)c(Cl)c1C(=O)OCC(C)[N+](=O)[O-] ZINC000813112611 1285684322 /nfs/dbraw/zinc/68/43/22/1285684322.db2.gz JPYXNXYJXZNFQK-JTQLQIEISA-N 0 3 337.763 2.715 20 5 EFBDHN CC(COC(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1)[N+](=O)[O-] ZINC000813111346 1285684538 /nfs/dbraw/zinc/68/45/38/1285684538.db2.gz GRERCCIDZLHLAG-SNVBAGLBSA-N 0 3 333.344 2.679 20 5 EFBDHN CCc1c(C(=O)OCC(C)[N+](=O)[O-])cnn1-c1cccc(Cl)c1 ZINC000813115332 1285686741 /nfs/dbraw/zinc/68/67/41/1285686741.db2.gz PEFLRPBEWINEFF-JTQLQIEISA-N 0 3 337.763 2.910 20 5 EFBDHN CC(C)(C(=O)NCCCNCc1ccccc1[N+](=O)[O-])C(F)(F)F ZINC001171694257 1285756012 /nfs/dbraw/zinc/75/60/12/1285756012.db2.gz FQNVCDQPXKIVGQ-UHFFFAOYSA-N 0 3 347.337 2.779 20 5 EFBDHN CC(C)CN(C(=O)c1cc([N+](=O)[O-])ccc1F)C1CCN(C)CC1 ZINC000813252028 1285762835 /nfs/dbraw/zinc/76/28/35/1285762835.db2.gz SUXFZPXJCAZUFR-UHFFFAOYSA-N 0 3 337.395 2.926 20 5 EFBDHN O=[N+]([O-])c1cc(F)c(N2CCC(NCc3cnco3)CC2)c(F)c1 ZINC001173011649 1286382738 /nfs/dbraw/zinc/38/27/38/1286382738.db2.gz IENDKJCWCLABAR-UHFFFAOYSA-N 0 3 338.314 2.620 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CCC[C@@H](CO)CC2)c1F ZINC001173180049 1286454571 /nfs/dbraw/zinc/45/45/71/1286454571.db2.gz ICRXHIQWTZNJMR-QWHCGFSZSA-N 0 3 340.395 2.768 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)N2CCCC[C@@](C)(O)C2)c1F ZINC001173179788 1286454913 /nfs/dbraw/zinc/45/49/13/1286454913.db2.gz GTKNPWXTRJIMNC-SJKOYZFVSA-N 0 3 340.395 2.910 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)NCc2cccc(F)n2)c1F ZINC001173183640 1286456756 /nfs/dbraw/zinc/45/67/56/1286456756.db2.gz COSZUZCEUHTERX-JTQLQIEISA-N 0 3 337.326 2.997 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)NCc2cnc(C)nc2)c1F ZINC001173189405 1286458062 /nfs/dbraw/zinc/45/80/62/1286458062.db2.gz PBAFYJSIMAAGLP-SNVBAGLBSA-N 0 3 334.351 2.562 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)NCc2ccc(F)cn2)c1F ZINC001173191542 1286458245 /nfs/dbraw/zinc/45/82/45/1286458245.db2.gz MMQAJBCLJPHTKP-SNVBAGLBSA-N 0 3 337.326 2.997 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)N[C@@H](C)c2cnccn2)c1F ZINC001173191443 1286458268 /nfs/dbraw/zinc/45/82/68/1286458268.db2.gz LGXWPRKDPXEDDJ-MNOVXSKESA-N 0 3 334.351 2.814 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N(C)[C@H]2CCCOC2)c1F ZINC001173193811 1286458867 /nfs/dbraw/zinc/45/88/67/1286458867.db2.gz QYBDJBKYDGAPOL-RYUDHWBXSA-N 0 3 326.368 2.784 20 5 EFBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CCC(Oc2cnccn2)CC1 ZINC001173231840 1286483508 /nfs/dbraw/zinc/48/35/08/1286483508.db2.gz NPGDPYYYPKBCPR-CQSZACIVSA-N 0 3 342.399 2.859 20 5 EFBDHN Cc1cnc(O[C@H]2CCN([C@@H](C)Cc3ccc([N+](=O)[O-])cc3)C2)nc1 ZINC001173238588 1286496110 /nfs/dbraw/zinc/49/61/10/1286496110.db2.gz VVGLUOOQBSEUDY-YOEHRIQHSA-N 0 3 342.399 2.778 20 5 EFBDHN O=C(NCCNCc1cccc([N+](=O)[O-])c1)C1CCC(F)(F)CC1 ZINC001134335060 1286582216 /nfs/dbraw/zinc/58/22/16/1286582216.db2.gz YQAGDUDZOFAPNZ-UHFFFAOYSA-N 0 3 341.358 2.626 20 5 EFBDHN CCOc1cccc(C(=O)NCCNCc2ccc([N+](=O)[O-])cc2)c1 ZINC001134384591 1286630602 /nfs/dbraw/zinc/63/06/02/1286630602.db2.gz DWATXHOJDOBSML-UHFFFAOYSA-N 0 3 343.383 2.513 20 5 EFBDHN CCN(CC)CC(=O)N1CCC(Nc2ccc(C)cc2[N+](=O)[O-])CC1 ZINC001095228484 1286712112 /nfs/dbraw/zinc/71/21/12/1286712112.db2.gz JMTYDPFVEITVEK-UHFFFAOYSA-N 0 3 348.447 2.648 20 5 EFBDHN CCCN(C)CC(=O)N1CCC(Nc2cc(C)ccc2[N+](=O)[O-])CC1 ZINC001095233524 1286721124 /nfs/dbraw/zinc/72/11/24/1286721124.db2.gz AXZJRNQBKURKCM-UHFFFAOYSA-N 0 3 348.447 2.648 20 5 EFBDHN Cc1cc(Cl)c(C(=O)N(C)C[C@H]2CCCN2C)cc1[N+](=O)[O-] ZINC000817494121 1288618370 /nfs/dbraw/zinc/61/83/70/1288618370.db2.gz IJHNVPQQQOPEHP-LLVKDONJSA-N 0 3 325.796 2.723 20 5 EFBDHN CC[C@@H](CNC(=O)CCC(C)(C)[N+](=O)[O-])N1CCc2ccccc2C1 ZINC000822457367 1288997126 /nfs/dbraw/zinc/99/71/26/1288997126.db2.gz JCSHKPUOGILRRP-KRWDZBQOSA-N 0 3 347.459 2.775 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N1CCN(C2CC2)C[C@@H](C)C1 ZINC000823219111 1289246724 /nfs/dbraw/zinc/24/67/24/1289246724.db2.gz VUEBSSRLDMUBOB-GFCCVEGCSA-N 0 3 331.416 2.768 20 5 EFBDHN CCCN(C(=O)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1)[C@H]1CCN(C)C1 ZINC000823500293 1289323543 /nfs/dbraw/zinc/32/35/43/1289323543.db2.gz WHNMZCNDUDVKBG-YESZJQIVSA-N 0 3 331.416 2.641 20 5 EFBDHN CN(CCN1CCCCC1)C(=O)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC000824115259 1289547508 /nfs/dbraw/zinc/54/75/08/1289547508.db2.gz PKEXBIWRAWEQDK-SJORKVTESA-N 0 3 331.416 2.643 20 5 EFBDHN CN(CCN1CCCCC1)C(=O)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC000824115258 1289547534 /nfs/dbraw/zinc/54/75/34/1289547534.db2.gz PKEXBIWRAWEQDK-IRXDYDNUSA-N 0 3 331.416 2.643 20 5 EFBDHN Cc1cc(Cl)c(C(=O)N2CC[C@H](N3CCCC3)C2)cc1[N+](=O)[O-] ZINC000825699910 1290072417 /nfs/dbraw/zinc/07/24/17/1290072417.db2.gz KWMUBLHTQPWJMO-LBPRGKRZSA-N 0 3 337.807 2.867 20 5 EFBDHN CC1CCC(N2CCN(C(=O)CCC(C)(C)[N+](=O)[O-])CC2)CC1 ZINC000825869368 1290893889 /nfs/dbraw/zinc/89/38/89/1290893889.db2.gz ZBSPSXRFTISLOL-UHFFFAOYSA-N 0 3 325.453 2.545 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1CCC(Cn2ccnn2)CC1 ZINC000876814521 1291031563 /nfs/dbraw/zinc/03/15/63/1291031563.db2.gz OFICFQGHSSHLLD-UHFFFAOYSA-N 0 3 329.404 2.715 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NC[C@@H]1NCCc2ccccc21 ZINC000876846037 1291045566 /nfs/dbraw/zinc/04/55/66/1291045566.db2.gz LTKITNZTXDGRAE-INIZCTEOSA-N 0 3 339.395 2.828 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NC[C@H]1Cc2ccccc2CN1 ZINC000877339406 1291198768 /nfs/dbraw/zinc/19/87/68/1291198768.db2.gz ZKVPPSCQXGDRDB-MRXNPFEDSA-N 0 3 339.395 2.656 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@H]([C@@H]2CCCO2)C2(CO)CCC2)cc1F ZINC000878870355 1291836755 /nfs/dbraw/zinc/83/67/55/1291836755.db2.gz ZHFAGRILLLOMKS-JKSUJKDBSA-N 0 3 338.379 2.534 20 5 EFBDHN COc1ccc([C@@H]2CN(Cc3cccc([N+](=O)[O-])c3)CCN2)cc1 ZINC000879519424 1292167511 /nfs/dbraw/zinc/16/75/11/1292167511.db2.gz SYEMWEBTUHTMPC-SFHVURJKSA-N 0 3 327.384 2.750 20 5 EFBDHN CN(CCCNC(=O)c1ccsc1)Cc1ccc([N+](=O)[O-])cc1 ZINC001233733927 1312981348 /nfs/dbraw/zinc/98/13/48/1312981348.db2.gz UPKRPDOHMUKQPV-UHFFFAOYSA-N 0 3 333.413 2.908 20 5 EFBDHN COCCN1CCC(Oc2ccc3cccc([N+](=O)[O-])c3n2)CC1 ZINC001233836071 1313002053 /nfs/dbraw/zinc/00/20/53/1313002053.db2.gz GXORLCJJPNMRCY-UHFFFAOYSA-N 0 3 331.372 2.633 20 5 EFBDHN CN(CCCNC(=O)CCc1ccco1)Cc1cccc([N+](=O)[O-])c1 ZINC001233844525 1313003836 /nfs/dbraw/zinc/00/38/36/1313003836.db2.gz WERCKZTZVYZUPV-UHFFFAOYSA-N 0 3 345.399 2.759 20 5 EFBDHN CCN1CC[C@H](Oc2c([N+](=O)[O-])cc([N+](=O)[O-])c3cccnc32)C1 ZINC001233901944 1313014508 /nfs/dbraw/zinc/01/45/08/1313014508.db2.gz PKUSCXFGWSWNLG-JTQLQIEISA-N 0 3 332.316 2.524 20 5 EFBDHN Cc1cccc(C(=O)NCCCN(C)Cc2ccc([N+](=O)[O-])cc2)n1 ZINC001234061579 1313049538 /nfs/dbraw/zinc/04/95/38/1313049538.db2.gz MYPAGHPWHHDZDD-UHFFFAOYSA-N 0 3 342.399 2.550 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2NCCc3ccccc32)c1C ZINC000884284316 1294081605 /nfs/dbraw/zinc/08/16/05/1294081605.db2.gz ILSCZMDAUMRZBB-MRXNPFEDSA-N 0 3 339.395 2.828 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2ccc(CN[C@@H](CO)C[C@H]3CCCO3)o2)c1 ZINC000886229561 1294776153 /nfs/dbraw/zinc/77/61/53/1294776153.db2.gz RSQBJOHWBVHEJZ-GDBMZVCRSA-N 0 3 346.383 2.874 20 5 EFBDHN Cc1ccccc1[C@H](CO)N(C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000886435870 1294967040 /nfs/dbraw/zinc/96/70/40/1294967040.db2.gz KVEWZCHSTZZWRP-ROUUACIJSA-N 0 3 330.384 2.602 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1C[C@@H](C)Oc1cccc2c1CCN(C)C2 ZINC001234425645 1313126145 /nfs/dbraw/zinc/12/61/45/1313126145.db2.gz XQNNSMWRFOBEHG-GFCCVEGCSA-N 0 3 330.388 2.555 20 5 EFBDHN COCCN1[C@H](C)CN(c2nccc3ccc([N+](=O)[O-])cc32)C[C@@H]1C ZINC000826634054 1295731863 /nfs/dbraw/zinc/73/18/63/1295731863.db2.gz XBMQKHQICAXFGN-OKILXGFUSA-N 0 3 344.415 2.688 20 5 EFBDHN CC(=O)Nc1ccc(C(C)=O)c(O[C@@H]2CCCN(C)CC2)c1[N+](=O)[O-] ZINC001234680229 1313182199 /nfs/dbraw/zinc/18/21/99/1313182199.db2.gz BZRZPAKCAVGQTF-CYBMUJFWSA-N 0 3 349.387 2.619 20 5 EFBDHN CN1CCC[C@H](Oc2cc(O)cc3oc4ccc(O)cc4c(=O)c23)C1 ZINC001234743983 1313187737 /nfs/dbraw/zinc/18/77/37/1313187737.db2.gz IGDAUEDRYFJICI-ZDUSSCGKSA-N 0 3 341.363 2.830 20 5 EFBDHN CCC[C@@H]1CN(Cn2nccc2[N+](=O)[O-])CCN1Cc1ccccc1 ZINC000776206765 1297015297 /nfs/dbraw/zinc/01/52/97/1297015297.db2.gz AJXIOUSQEIZEJH-QGZVFWFLSA-N 0 3 343.431 2.735 20 5 EFBDHN CCC[C@H]1CN(Cn2cc([N+](=O)[O-])cn2)CCN1Cc1ccccc1 ZINC000776207623 1297052347 /nfs/dbraw/zinc/05/23/47/1297052347.db2.gz RSGBLKASOYNRDC-KRWDZBQOSA-N 0 3 343.431 2.735 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN[C@@H]2CC3(CCC3)Oc3ccccc32)n1 ZINC000932215026 1297411078 /nfs/dbraw/zinc/41/10/78/1297411078.db2.gz BTPNTKWUZCYBTD-CQSZACIVSA-N 0 3 328.372 2.827 20 5 EFBDHN CC(C)N1CCC[C@H]1C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000935006611 1297597925 /nfs/dbraw/zinc/59/79/25/1297597925.db2.gz ORNQRUIYHKAVLV-KRWDZBQOSA-N 0 3 331.416 2.959 20 5 EFBDHN C[C@H]1CSC[C@@H]1NCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000796401073 1299165673 /nfs/dbraw/zinc/16/56/73/1299165673.db2.gz CJBOBRDUUOEBQE-KWQFWETISA-N 0 3 329.809 2.528 20 5 EFBDHN CC1(C)OC[C@H](CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)O1 ZINC000851790777 1299396252 /nfs/dbraw/zinc/39/62/52/1299396252.db2.gz OSUXFSGWDTZPJN-INIZCTEOSA-N 0 3 336.388 2.590 20 5 EFBDHN Nc1ccc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000854496334 1300592596 /nfs/dbraw/zinc/59/25/96/1300592596.db2.gz JTYYQEIMEYQDGD-ZJUUUORDSA-N 0 3 347.293 2.863 20 5 EFBDHN Cc1cc([N+](=O)[O-])c(F)c(C(=O)N[C@@H]2CCN(C(C)(C)C)C2)c1F ZINC000855286565 1300890217 /nfs/dbraw/zinc/89/02/17/1300890217.db2.gz TVOLBBKUBGQLFJ-SNVBAGLBSA-N 0 3 341.358 2.784 20 5 EFBDHN C[C@H]1CN(C)c2ccccc2CN1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000246331740 1301158328 /nfs/dbraw/zinc/15/83/28/1301158328.db2.gz SSCJCWVLMGSAOC-IFXJQAMLSA-N 0 3 341.411 2.969 20 5 EFBDHN CCCN1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)C1 ZINC000856072499 1301223442 /nfs/dbraw/zinc/22/34/42/1301223442.db2.gz BANBQLRLNXMFGT-LLVKDONJSA-N 0 3 325.796 2.771 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCN2CCC[C@](O)(c3ccccc3)C2)c1 ZINC000859583156 1301497439 /nfs/dbraw/zinc/49/74/39/1301497439.db2.gz BNUBWVXHGJUDOC-LJQANCHMSA-N 0 3 342.395 2.957 20 5 EFBDHN CC([C@H](OC(=O)c1nn(C)cc1Cl)c1ccccc1F)[N+](=O)[O-] ZINC000860855399 1301942292 /nfs/dbraw/zinc/94/22/92/1301942292.db2.gz ZDJCCORRJZMTKN-SDBXPKJASA-N 0 3 341.726 2.776 20 5 EFBDHN CC([C@@H](OC(=O)c1nn(C)cc1Cl)c1ccccc1F)[N+](=O)[O-] ZINC000860855397 1301942976 /nfs/dbraw/zinc/94/29/76/1301942976.db2.gz ZDJCCORRJZMTKN-ISVAXAHUSA-N 0 3 341.726 2.776 20 5 EFBDHN CCn1cc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])c(C)n1 ZINC000860854773 1301943097 /nfs/dbraw/zinc/94/30/97/1301943097.db2.gz IPQCLRWBNBRBGP-XHDPSFHLSA-N 0 3 335.335 2.914 20 5 EFBDHN CN(C)CCN(C(=O)Cc1cccc(F)c1[N+](=O)[O-])C1CCCC1 ZINC000865787986 1303400955 /nfs/dbraw/zinc/40/09/55/1303400955.db2.gz CJBPUXVXVOPASV-UHFFFAOYSA-N 0 3 337.395 2.609 20 5 EFBDHN CN1CCN(c2cc(F)c([N+](=O)[O-])cc2CO)CC12CCCCC2 ZINC000865847420 1303426954 /nfs/dbraw/zinc/42/69/54/1303426954.db2.gz DQLZFSXUWUQDGV-UHFFFAOYSA-N 0 3 337.395 2.681 20 5 EFBDHN CC([C@@H](OC(=O)c1cnn(C(F)F)c1)c1ccccc1F)[N+](=O)[O-] ZINC000870454928 1305329740 /nfs/dbraw/zinc/32/97/40/1305329740.db2.gz ROQUKHCAWNFNHX-PRHODGIISA-N 0 3 343.261 2.981 20 5 EFBDHN CCn1ncc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])c1C ZINC000870453630 1305329884 /nfs/dbraw/zinc/32/98/84/1305329884.db2.gz BLEPUAVZHWUIPF-XHDPSFHLSA-N 0 3 335.335 2.914 20 5 EFBDHN COc1ccc(NC(=O)CCN2CCC(F)(F)CC2)c([N+](=O)[O-])c1 ZINC000796537505 1306171405 /nfs/dbraw/zinc/17/14/05/1306171405.db2.gz JTRBYCHBWZLZCU-UHFFFAOYSA-N 0 3 343.330 2.663 20 5 EFBDHN CCc1c(Cl)cc([N+](=O)[O-])c(OC[C@H]2CNCCO2)c1Cl ZINC001218178991 1315160087 /nfs/dbraw/zinc/16/00/87/1315160087.db2.gz IWRMNPGWNZUIJY-MRVPVSSYSA-N 0 3 335.187 2.831 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1COC(=O)C1CCN(C2CC2)CC1 ZINC000801874007 1311042351 /nfs/dbraw/zinc/04/23/51/1311042351.db2.gz FAMQJSFYJDZKRJ-UHFFFAOYSA-N 0 3 334.372 2.521 20 5 EFBDHN O=C(CC1CC1)NCC1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001222236531 1311103503 /nfs/dbraw/zinc/10/35/03/1311103503.db2.gz HGCFFPNTQMUQEC-UHFFFAOYSA-N 0 3 331.416 2.723 20 5 EFBDHN C/C=C(\C)C(=O)NCC1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001222756937 1311180542 /nfs/dbraw/zinc/18/05/42/1311180542.db2.gz VLXLWRUSDAQDFD-LZWSPWQCSA-N 0 3 331.416 2.889 20 5 EFBDHN CC(=O)O[C@H]1C[C@@H]2C[C@H](O[C@@H](C)c3cccc([N+](=O)[O-])c3)C[C@H]1N2C ZINC001223427771 1311259037 /nfs/dbraw/zinc/25/90/37/1311259037.db2.gz UTLCLAPNNNOUAM-QUJYTELESA-N 0 3 348.399 2.839 20 5 EFBDHN CC(=O)O[C@@H]1C[C@@H]2C[C@H](O[C@@H](C)c3ccc([N+](=O)[O-])cc3)C[C@H]1N2C ZINC001224027127 1311333663 /nfs/dbraw/zinc/33/36/63/1311333663.db2.gz UPNDIMWPXFHSEF-PXALQNAGSA-N 0 3 348.399 2.839 20 5 EFBDHN CCc1ncsc1C(=O)NCCCNCc1ccccc1[N+](=O)[O-] ZINC001159446309 1311517352 /nfs/dbraw/zinc/51/73/52/1311517352.db2.gz HFSUXDOLVDXPQN-UHFFFAOYSA-N 0 3 348.428 2.523 20 5 EFBDHN O=[N+]([O-])c1c([O-])ccnc1O[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001225661798 1311561454 /nfs/dbraw/zinc/56/14/54/1311561454.db2.gz PJGYZHOBXACYEB-CQSZACIVSA-N 0 3 329.356 2.739 20 5 EFBDHN O=[N+]([O-])c1c([O-])ccnc1O[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001225661798 1311561456 /nfs/dbraw/zinc/56/14/56/1311561456.db2.gz PJGYZHOBXACYEB-CQSZACIVSA-N 0 3 329.356 2.739 20 5 EFBDHN CC(C)c1nocc1C(=O)NCCCNCc1ccccc1[N+](=O)[O-] ZINC001159792842 1311585130 /nfs/dbraw/zinc/58/51/30/1311585130.db2.gz JGMRHLZMFHKKTD-UHFFFAOYSA-N 0 3 346.387 2.616 20 5 EFBDHN O=[N+]([O-])c1cnc(OC2CCN(C3CC3)CC2)c(Br)c1 ZINC001226339758 1311651817 /nfs/dbraw/zinc/65/18/17/1311651817.db2.gz PVQGUIBDNCQZEM-UHFFFAOYSA-N 0 3 342.193 2.758 20 5 EFBDHN O=C(NCCCNCc1ccccc1[N+](=O)[O-])C12CCC(CC1)C2 ZINC001161025831 1311840857 /nfs/dbraw/zinc/84/08/57/1311840857.db2.gz ONURMKCUGWHKCR-UHFFFAOYSA-N 0 3 331.416 2.771 20 5 EFBDHN CCc1cnccc1C(=O)NCCCNCc1csc([N+](=O)[O-])c1 ZINC001161502186 1311902358 /nfs/dbraw/zinc/90/23/58/1311902358.db2.gz VXMWQULTSUCAFX-UHFFFAOYSA-N 0 3 348.428 2.523 20 5 EFBDHN Cc1cc(C)nc(C(=O)NCCCNCc2ccccc2[N+](=O)[O-])c1 ZINC001161583761 1311922648 /nfs/dbraw/zinc/92/26/48/1311922648.db2.gz VWAXLZCPYRTCPH-UHFFFAOYSA-N 0 3 342.399 2.516 20 5 EFBDHN Cc1ncc([N+](=O)[O-])c(NC[C@@H]2CCCN2Cc2ccccc2)n1 ZINC001161885460 1311995244 /nfs/dbraw/zinc/99/52/44/1311995244.db2.gz QRWZZRMNGMMSBM-HNNXBMFYSA-N 0 3 327.388 2.770 20 5 EFBDHN CC(C)CC(=O)N1C[C@H]2CN(Cc3cccc([N+](=O)[O-])c3)C[C@H]2C1 ZINC001048649341 1312005043 /nfs/dbraw/zinc/00/50/43/1312005043.db2.gz NJBQVWZZLXKESQ-IYBDPMFKSA-N 0 3 331.416 2.531 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1C[C@H](C)Oc1ccc2c(c1)CCN(C)C2 ZINC001228936478 1312023465 /nfs/dbraw/zinc/02/34/65/1312023465.db2.gz IPXRDXZBOOWZIE-LBPRGKRZSA-N 0 3 330.388 2.555 20 5 EFBDHN CC(C)(C)CC(=O)N1C[C@H]2CN(Cc3cccc([N+](=O)[O-])c3)C[C@H]2C1 ZINC001048679777 1312039012 /nfs/dbraw/zinc/03/90/12/1312039012.db2.gz DFWDMFLQDPJRSF-IYBDPMFKSA-N 0 3 345.443 2.921 20 5 EFBDHN O=[N+]([O-])c1cc(Br)cc(O[C@@H]2CN3CCC2CC3)c1 ZINC001229146016 1312052933 /nfs/dbraw/zinc/05/29/33/1312052933.db2.gz OHZRISUJTDTLDZ-CYBMUJFWSA-N 0 3 327.178 2.830 20 5 EFBDHN O=[N+]([O-])c1ccc([O-])c(O[C@H]2COCCN(Cc3ccccc3)C2)c1 ZINC001229394753 1312088071 /nfs/dbraw/zinc/08/80/71/1312088071.db2.gz BSIHIDXSDAOUHN-MRXNPFEDSA-N 0 3 344.367 2.580 20 5 EFBDHN O=[N+]([O-])c1ccc(O)c(O[C@H]2COCCN(Cc3ccccc3)C2)c1 ZINC001229394753 1312088075 /nfs/dbraw/zinc/08/80/75/1312088075.db2.gz BSIHIDXSDAOUHN-MRXNPFEDSA-N 0 3 344.367 2.580 20 5 EFBDHN O=C(CC1CCC1)N1C[C@H]2CN(Cc3ccc([N+](=O)[O-])cc3)C[C@H]2C1 ZINC001048742192 1312093456 /nfs/dbraw/zinc/09/34/56/1312093456.db2.gz SBRGERAEVCZDJT-CALCHBBNSA-N 0 3 343.427 2.675 20 5 EFBDHN CC(C)N1CC[C@@H](Oc2cc(Br)cnc2[N+](=O)[O-])C1 ZINC001229561219 1312113941 /nfs/dbraw/zinc/11/39/41/1312113941.db2.gz UWEMTMCRWQNHNM-SNVBAGLBSA-N 0 3 330.182 2.614 20 5 EFBDHN CCN1CCC(Oc2cc(Br)cnc2[N+](=O)[O-])CC1 ZINC001229562246 1312114255 /nfs/dbraw/zinc/11/42/55/1312114255.db2.gz DOJKYEVPAKBFEB-UHFFFAOYSA-N 0 3 330.182 2.615 20 5 EFBDHN CN(C)Cc1ccccc1O[C@@H](C[N+](=O)[O-])c1ccc2c(c1)OCO2 ZINC001229700922 1312125084 /nfs/dbraw/zinc/12/50/84/1312125084.db2.gz DVXWDXHTXPQQFX-SFHVURJKSA-N 0 3 344.367 2.874 20 5 EFBDHN C[C@@H](N)c1nc2ccccc2n1-c1ncc2cccc([N+](=O)[O-])c2n1 ZINC001162763172 1312169913 /nfs/dbraw/zinc/16/99/13/1312169913.db2.gz NPKVMZDWHIBTSC-SNVBAGLBSA-N 0 3 334.339 2.897 20 5 EFBDHN COc1nc(C)c(-n2c3ccccc3nc2[C@@H](C)N)cc1[N+](=O)[O-] ZINC001162766869 1312171794 /nfs/dbraw/zinc/17/17/94/1312171794.db2.gz QWBRSOQGQCUJSY-SECBINFHSA-N 0 3 327.344 2.665 20 5 EFBDHN CC(=O)Nc1ccc(-n2c3ccccc3nc2[C@@H](C)N)cc1[N+](=O)[O-] ZINC001162777802 1312174010 /nfs/dbraw/zinc/17/40/10/1312174010.db2.gz VJGCZZFGTGUHDT-SNVBAGLBSA-N 0 3 339.355 2.912 20 5 EFBDHN Cc1cc(N[C@H]2CN3CCC2CC3)nc(-c2cccc([N+](=O)[O-])c2)n1 ZINC001163387815 1312301130 /nfs/dbraw/zinc/30/11/30/1312301130.db2.gz HVFKVOJSFRYFAI-INIZCTEOSA-N 0 3 339.399 2.866 20 5 EFBDHN O=[N+]([O-])c1cc2c(nc1N[C@H]1CCCC[C@@]13CNCCO3)CCCC2 ZINC001163645577 1312353000 /nfs/dbraw/zinc/35/30/00/1312353000.db2.gz YYMKNFSLXMXONX-FUHWJXTLSA-N 0 3 346.431 2.582 20 5 EFBDHN COc1cccc(CCNc2cc3c(cc2[N+](=O)[O-])CNC3)c1OC ZINC001163689373 1312364503 /nfs/dbraw/zinc/36/45/03/1312364503.db2.gz DKMNDTLEGHFAIL-UHFFFAOYSA-N 0 3 343.383 2.870 20 5 EFBDHN CCC(C)(C)C(=O)N1C[C@H]2CN(Cc3ccccc3[N+](=O)[O-])C[C@H]2C1 ZINC001049017880 1312366428 /nfs/dbraw/zinc/36/64/28/1312366428.db2.gz WQBJRPOZMQYZPD-IYBDPMFKSA-N 0 3 345.443 2.921 20 5 EFBDHN COc1cc(CCNc2cc3c(cc2[N+](=O)[O-])CNC3)cc(OC)c1 ZINC001163720255 1312371962 /nfs/dbraw/zinc/37/19/62/1312371962.db2.gz MWMHDYXIHIFWFM-UHFFFAOYSA-N 0 3 343.383 2.870 20 5 EFBDHN O=C(/C=C/C1CC1)NCCC1(CNCc2csc([N+](=O)[O-])c2)CC1 ZINC001163960421 1312414979 /nfs/dbraw/zinc/41/49/79/1312414979.db2.gz ZQDGHZKGBSKRMH-ONEGZZNKSA-N 0 3 349.456 2.999 20 5 EFBDHN C/C=C(\C)C(=O)NCCC1(CNCc2csc([N+](=O)[O-])c2)CC1 ZINC001163992108 1312422105 /nfs/dbraw/zinc/42/21/05/1312422105.db2.gz KNXFGIQISJSTTN-KGVSQERTSA-N 0 3 337.445 2.999 20 5 EFBDHN O=C(CCCC1CC1)NCCCNCc1csc([N+](=O)[O-])c1 ZINC001164277873 1312484318 /nfs/dbraw/zinc/48/43/18/1312484318.db2.gz QCXOOFDEXBGMAT-UHFFFAOYSA-N 0 3 325.434 2.833 20 5 EFBDHN O=[N+]([O-])c1c(Cl)ccc2nc(-n3cnc4c3CNCC4)ccc21 ZINC001164313883 1312490488 /nfs/dbraw/zinc/49/04/88/1312490488.db2.gz VJHFRTYLJPRURG-UHFFFAOYSA-N 0 3 329.747 2.628 20 5 EFBDHN O=[N+]([O-])c1cc2nc(Cl)ccc2cc1-n1cnc2c1CNCC2 ZINC001164316904 1312491418 /nfs/dbraw/zinc/49/14/18/1312491418.db2.gz JUWLSEJYYBYEDU-UHFFFAOYSA-N 0 3 329.747 2.628 20 5 EFBDHN CC(C)(C)C(=O)N1C[C@H]2CN(Cc3cccc([N+](=O)[O-])c3)C[C@H]2C1 ZINC001049184113 1312551348 /nfs/dbraw/zinc/55/13/48/1312551348.db2.gz WRMOMQIVRUBMRA-GASCZTMLSA-N 0 3 331.416 2.531 20 5 EFBDHN O=[N+]([O-])c1cc(F)cnc1N1C[C@H]2CCN(Cc3ccccc3)[C@H]2C1 ZINC001165089963 1312565999 /nfs/dbraw/zinc/56/59/99/1312565999.db2.gz WLFPZEPVKUJSKY-PBHICJAKSA-N 0 3 342.374 2.840 20 5 EFBDHN CC(C)(C)N1CCN(c2ccc(-c3ccc([N+](=O)[O-])cc3)nn2)CC1 ZINC001165091175 1312567003 /nfs/dbraw/zinc/56/70/03/1312567003.db2.gz PFWYYCDLMCWRNG-UHFFFAOYSA-N 0 3 341.415 2.972 20 5 EFBDHN C[C@@H]1CN(c2ccc([N+](=O)[O-])c(N)n2)[C@@H](C)CN1Cc1ccccc1 ZINC001165202996 1312585670 /nfs/dbraw/zinc/58/56/70/1312585670.db2.gz QYAYBLILXQGLHM-KGLIPLIRSA-N 0 3 341.415 2.671 20 5 EFBDHN c1cnc2c(c1)ccc1ccc(CN3CC[C@H](N4CCOCC4)C3)nc12 ZINC001232220549 1312651992 /nfs/dbraw/zinc/65/19/92/1312651992.db2.gz AANRFZCMZWQQBO-IBGZPJMESA-N 0 3 348.450 2.690 20 5 EFBDHN N[C@H]1CN([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCC1(F)F ZINC001246603476 1314655867 /nfs/dbraw/zinc/65/58/67/1314655867.db2.gz YUJZAXMPNCWMAQ-HIFRSBDPSA-N 0 3 325.359 2.511 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C/c1nc(-c2ccc3c(n2)CCNC3)no1 ZINC001247598035 1314806083 /nfs/dbraw/zinc/80/60/83/1314806083.db2.gz SWNDQNQXPSMMAB-SOFGYWHQSA-N 0 3 349.350 2.856 20 5 EFBDHN Cc1cccc(-c2nc(-c3ccc4c(n3)CCNC4)no2)c1[N+](=O)[O-] ZINC001215372000 1314825893 /nfs/dbraw/zinc/82/58/93/1314825893.db2.gz AOSBCSYGWMNLID-UHFFFAOYSA-N 0 3 337.339 2.661 20 5 EFBDHN OC1(Cc2nc(-c3cc4ccccc4c4ccccc34)no2)CNC1 ZINC001247792389 1314841669 /nfs/dbraw/zinc/84/16/69/1314841669.db2.gz PXBLKXOYQOAALE-UHFFFAOYSA-N 0 3 331.375 2.920 20 5 EFBDHN O=[N+]([O-])c1cc(O[C@H]2CNCCC2(F)F)cc(C(F)(F)F)c1 ZINC001218454187 1315198961 /nfs/dbraw/zinc/19/89/61/1315198961.db2.gz OVYCBXLBYMZCEC-JTQLQIEISA-N 0 3 326.221 2.990 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(C)cc1O[C@H]1CNCc2ccccc21 ZINC001218489609 1315204958 /nfs/dbraw/zinc/20/49/58/1315204958.db2.gz PIWGCJHOJFHMCE-KRWDZBQOSA-N 0 3 342.351 2.913 20 5 EFBDHN N[C@@H](Cc1c2ccccc2cc2ccccc21)C(=O)NCc1c[nH]cn1 ZINC001219606246 1315329035 /nfs/dbraw/zinc/32/90/35/1315329035.db2.gz IIPZDPRQLCLMRR-FQEVSTJZSA-N 0 3 344.418 2.902 20 5 EFBDHN O=C(NC1CC1)[C@H]1CCCN(C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC001254004021 1315664566 /nfs/dbraw/zinc/66/45/66/1315664566.db2.gz FGFZDSGSADATHR-VFQAQYNWSA-N 0 3 329.400 2.599 20 5 EFBDHN O=C(NC1CC1)[C@@H]1CCCN(C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC001254004023 1315664581 /nfs/dbraw/zinc/66/45/81/1315664581.db2.gz FGFZDSGSADATHR-YFCVBGDOSA-N 0 3 329.400 2.599 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCC(NCc3cn(CCF)cn3)CC2)cc1 ZINC001254470702 1315706794 /nfs/dbraw/zinc/70/67/94/1315706794.db2.gz QMVKHBJVDJUHQX-UHFFFAOYSA-N 0 3 347.394 2.519 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCC(NCc3ccn(CCF)n3)CC2)cc1 ZINC001254470769 1315707202 /nfs/dbraw/zinc/70/72/02/1315707202.db2.gz UEOONSVXDLTPTK-UHFFFAOYSA-N 0 3 347.394 2.519 20 5 EFBDHN C[C@@H]1CCN(C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CCC1=O ZINC001254473548 1315707442 /nfs/dbraw/zinc/70/74/42/1315707442.db2.gz FDFKEGPPQADGGO-CQSZACIVSA-N 0 3 331.416 2.865 20 5 EFBDHN Cc1ncc(CN(C)C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cn1 ZINC001254480847 1315708734 /nfs/dbraw/zinc/70/87/34/1315708734.db2.gz NDLXMFAYZWBNIS-UHFFFAOYSA-N 0 3 341.415 2.794 20 5 EFBDHN CCOc1ccc([C@@H](CO)N[C@H](C)Cc2ccccc2[N+](=O)[O-])cn1 ZINC001254531337 1315720656 /nfs/dbraw/zinc/72/06/56/1315720656.db2.gz DPXAMQAGEBQZTI-CZUORRHYSA-N 0 3 345.399 2.643 20 5 EFBDHN CCOC(=O)c1cccc(CN[C@H](C)Cc2ccccc2[N+](=O)[O-])n1 ZINC001254539113 1315721200 /nfs/dbraw/zinc/72/12/00/1315721200.db2.gz FVFHBVUIEUWIBR-CYBMUJFWSA-N 0 3 343.383 2.887 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N1CCC(N2CC(F)(F)C2)CC1 ZINC001254558396 1315723627 /nfs/dbraw/zinc/72/36/27/1315723627.db2.gz FVHFSBJUGROINE-CYBMUJFWSA-N 0 3 339.386 2.941 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N1CCC(C(=O)N2CCCC2)CC1 ZINC001254563478 1315724092 /nfs/dbraw/zinc/72/40/92/1315724092.db2.gz WXULBXNBQMIJPP-HNNXBMFYSA-N 0 3 345.443 2.860 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N1C[C@@H]2COC[C@H](C1)C2(F)F ZINC001254567602 1315724612 /nfs/dbraw/zinc/72/46/12/1315724612.db2.gz XPALFZYENIQMHB-BNOWGMLFSA-N 0 3 326.343 2.739 20 5 EFBDHN COCCCCN1CCN([C@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC001254567993 1315724715 /nfs/dbraw/zinc/72/47/15/1315724715.db2.gz DWPQMYAXULOEFS-MRXNPFEDSA-N 0 3 335.448 2.570 20 5 EFBDHN Cc1cnc(O[C@@H]2CCN([C@@H](C)Cc3ccccc3[N+](=O)[O-])C2)nc1 ZINC001254569825 1315725391 /nfs/dbraw/zinc/72/53/91/1315725391.db2.gz LFQCPOIIWRHRMD-GOEBONIOSA-N 0 3 342.399 2.778 20 5 EFBDHN Cc1cnc(O[C@H]2CCN([C@@H](C)Cc3ccccc3[N+](=O)[O-])C2)nc1 ZINC001254569828 1315725679 /nfs/dbraw/zinc/72/56/79/1315725679.db2.gz LFQCPOIIWRHRMD-HOCLYGCPSA-N 0 3 342.399 2.778 20 5 EFBDHN COC(=O)c1ccccc1CN[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254573025 1315726104 /nfs/dbraw/zinc/72/61/04/1315726104.db2.gz VNRCAXDZBZRJGG-OAHLLOKOSA-N 0 3 326.352 2.638 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@H](NCc1cc(F)cc3c1OCOC3)C2 ZINC001254575328 1315726429 /nfs/dbraw/zinc/72/64/29/1315726429.db2.gz PSGVANNZZYAQHR-MRXNPFEDSA-N 0 3 344.342 2.857 20 5 EFBDHN CC(C)COc1cc(CN[C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)ncn1 ZINC001254584201 1315727485 /nfs/dbraw/zinc/72/74/85/1315727485.db2.gz FYBBNJYWHNGOTN-OAHLLOKOSA-N 0 3 342.399 2.677 20 5 EFBDHN CC(F)(F)c1ncncc1CN[C@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254587878 1315728031 /nfs/dbraw/zinc/72/80/31/1315728031.db2.gz BWOHMFXHBSTFEN-ZDUSSCGKSA-N 0 3 334.326 2.754 20 5 EFBDHN COc1cccc2c1OC[C@H]2N[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254587909 1315728048 /nfs/dbraw/zinc/72/80/48/1315728048.db2.gz CEORYQAWWZEDFF-CZUORRHYSA-N 0 3 326.352 2.794 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@H](N1CCCC[C@@](O)(C(F)(F)F)C1)C2 ZINC001254593395 1315728344 /nfs/dbraw/zinc/72/83/44/1315728344.db2.gz LZUMTBBPOQAAGJ-CABCVRRESA-N 0 3 344.333 2.841 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@@H](N1CC[C@H](Oc3ccncc3)C1)C2 ZINC001254606836 1315730496 /nfs/dbraw/zinc/73/04/96/1315730496.db2.gz IDYUNIYDELVYSO-WMZOPIPTSA-N 0 3 325.368 2.610 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@H](N1CCN3CCc4ccccc4[C@@H]3C1)C2 ZINC001254607978 1315730695 /nfs/dbraw/zinc/73/06/95/1315730695.db2.gz OAKDVANVMFYJJG-CTNGQTDRSA-N 0 3 349.434 2.977 20 5 EFBDHN CC(C)C(=O)N(C)C1CCN([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254605229 1315730717 /nfs/dbraw/zinc/73/07/17/1315730717.db2.gz AMIKZEBTUBLVCT-SFHVURJKSA-N 0 3 345.443 2.641 20 5 EFBDHN CC(=O)N(C(C)C)C1CCN([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254609269 1315730867 /nfs/dbraw/zinc/73/08/67/1315730867.db2.gz UYLBKOCIEVTOCE-LJQANCHMSA-N 0 3 345.443 2.783 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@H](N1CC[C@@H](N3CCCCC3)[C@@H](F)C1)C2 ZINC001254610558 1315731142 /nfs/dbraw/zinc/73/11/42/1315731142.db2.gz NMNBDFFDQPXVLR-CEXWTWQISA-N 0 3 347.434 2.960 20 5 EFBDHN O=C1CCCCN1C1CCN([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254608769 1315731144 /nfs/dbraw/zinc/73/11/44/1315731144.db2.gz SMRRSYIAVACIDA-GOSISDBHSA-N 0 3 343.427 2.539 20 5 EFBDHN CC(C)(C)C(=O)NC1CCN([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254612754 1315731904 /nfs/dbraw/zinc/73/19/04/1315731904.db2.gz YPOTVNZPRMDHCU-QGZVFWFLSA-N 0 3 345.443 2.689 20 5 EFBDHN COc1cc(N2CCC(n3ccnc3[C@@H](C)N)CC2)ccc1[N+](=O)[O-] ZINC001256083508 1315903382 /nfs/dbraw/zinc/90/33/82/1315903382.db2.gz QYYYMJUTXXLKQA-GFCCVEGCSA-N 0 3 345.403 2.661 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)CN(CC1CCC3(CC1)OCCO3)CC2 ZINC001256394297 1315934844 /nfs/dbraw/zinc/93/48/44/1315934844.db2.gz CVHRZLRMEDZLNI-UHFFFAOYSA-N 0 3 332.400 2.886 20 5 EFBDHN O=C(C1CC1)N1CCC2(C1)CCN(Cc1ccccc1[N+](=O)[O-])CC2 ZINC001040569215 1316325097 /nfs/dbraw/zinc/32/50/97/1316325097.db2.gz FEMUVAKTIIKJQK-UHFFFAOYSA-N 0 3 343.427 2.819 20 5 EFBDHN CN(CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)CCC(F)(F)F ZINC001320377637 1329119591 /nfs/dbraw/zinc/11/95/91/1329119591.db2.gz AXNYPGMQEQZCKF-UHFFFAOYSA-N 0 3 337.273 2.947 20 5 EFBDHN COC[C@H](O)CNCc1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001321434793 1329386660 /nfs/dbraw/zinc/38/66/60/1329386660.db2.gz GAVHRJCJUNJTFI-LLVKDONJSA-N 0 3 340.763 2.605 20 5 EFBDHN CCCN1CCCC[C@@H]1C(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC001322418699 1329457462 /nfs/dbraw/zinc/45/74/62/1329457462.db2.gz YCMBKWRBOPXOFL-QGZVFWFLSA-N 0 3 333.432 2.860 20 5 EFBDHN Cc1cncc([N+](=O)[O-])c1N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC001324270460 1329612330 /nfs/dbraw/zinc/61/23/30/1329612330.db2.gz ANQGLFZDVYJIST-HOCLYGCPSA-N 0 3 326.400 2.968 20 5 EFBDHN Cc1cncc([N+](=O)[O-])c1N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC001324270461 1329612569 /nfs/dbraw/zinc/61/25/69/1329612569.db2.gz ANQGLFZDVYJIST-ZBFHGGJFSA-N 0 3 326.400 2.968 20 5 EFBDHN C[C@@H]1CCCN(C(=O)CCN[C@@H]2CCc3c2cccc3[N+](=O)[O-])C1 ZINC001326845698 1330373663 /nfs/dbraw/zinc/37/36/63/1330373663.db2.gz WYVDMDXIXFZTRB-CZUORRHYSA-N 0 3 331.416 2.820 20 5 EFBDHN C[C@@H]1CN(c2ncnc3c(Cl)cc([N+](=O)[O-])cc32)[C@@H](C)CN1C ZINC001327662891 1330506102 /nfs/dbraw/zinc/50/61/02/1330506102.db2.gz RNNZSMGPYIRZMS-ZJUUUORDSA-N 0 3 335.795 2.720 20 5 EFBDHN C[C@@H]1[C@@H](C)N(c2ncnc3c(Cl)cc([N+](=O)[O-])cc32)CCN1C ZINC001328555916 1330602552 /nfs/dbraw/zinc/60/25/52/1330602552.db2.gz FYZGMHPCMHEJLC-NXEZZACHSA-N 0 3 335.795 2.720 20 5 EFBDHN COc1cccc([C@H]2CCCN2CCn2c(C)ncc2[N+](=O)[O-])c1 ZINC001330657696 1330764571 /nfs/dbraw/zinc/76/45/71/1330764571.db2.gz NMOHSTFVDGAMML-MRXNPFEDSA-N 0 3 330.388 2.945 20 5 EFBDHN C[C@H](NCc1c(Br)cccc1[N+](=O)[O-])[C@H]1CCOC1 ZINC001335780563 1331401880 /nfs/dbraw/zinc/40/18/80/1331401880.db2.gz KUBKNKPMEGHEBC-UWVGGRQHSA-N 0 3 329.194 2.872 20 5 EFBDHN C[C@@H](NCc1c(Br)cccc1[N+](=O)[O-])[C@H]1CCOC1 ZINC001335780565 1331401906 /nfs/dbraw/zinc/40/19/06/1331401906.db2.gz KUBKNKPMEGHEBC-ZJUUUORDSA-N 0 3 329.194 2.872 20 5 EFBDHN CC(C)NC(=O)c1ccc(N[C@@H]2CN(C3CC3)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC001339608437 1331911199 /nfs/dbraw/zinc/91/11/99/1331911199.db2.gz BEXKIHNNONVDMX-BLLLJJGKSA-N 0 3 346.431 2.628 20 5 EFBDHN COc1cccc(CN2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1C ZINC001341393999 1332256812 /nfs/dbraw/zinc/25/68/12/1332256812.db2.gz VRFUPQROHNYOGM-UHFFFAOYSA-N 0 3 330.388 2.945 20 5 EFBDHN C[C@@H](NCCN1C(=O)COc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC001341684266 1332276590 /nfs/dbraw/zinc/27/65/90/1332276590.db2.gz OUJJJSGYBHWMNV-CYBMUJFWSA-N 0 3 341.367 2.671 20 5 EFBDHN CC(COC(=O)Cc1cc(Br)ccc1Cl)[N+](=O)[O-] ZINC001344996449 1332501035 /nfs/dbraw/zinc/50/10/35/1332501035.db2.gz FUXMKYBKAWJSKA-SSDOTTSWSA-N 0 3 336.569 2.853 20 5 EFBDHN O=C(N[C@H]1CCCN2CCCC[C@H]12)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000847253404 1333448319 /nfs/dbraw/zinc/44/83/19/1333448319.db2.gz DESIUWQQWXLIHP-DZGCQCFKSA-N 0 3 337.807 2.995 20 5 EFBDHN O=C(N[C@H]1CCCN2CCCC[C@@H]12)c1cc([N+](=O)[O-])ccc1Cl ZINC000847253551 1333448342 /nfs/dbraw/zinc/44/83/42/1333448342.db2.gz HJCBEMUXSRDOSH-GJZGRUSLSA-N 0 3 337.807 2.995 20 5 EFBDHN Cc1cc(F)cc(C(=O)N[C@@H]2CCCN3CCCC[C@H]23)c1[N+](=O)[O-] ZINC000847254951 1333448929 /nfs/dbraw/zinc/44/89/29/1333448929.db2.gz HZTWLDQYMGIMHV-HUUCEWRRSA-N 0 3 335.379 2.789 20 5 EFBDHN O=C(N[C@H]1CCCN2CCCC[C@H]12)c1cccc(Cl)c1[N+](=O)[O-] ZINC000847254935 1333449305 /nfs/dbraw/zinc/44/93/05/1333449305.db2.gz HXUKAIDLRVLMMB-UONOGXRCSA-N 0 3 337.807 2.995 20 5 EFBDHN O=C(N[C@H]1CCCN2CCCC[C@H]12)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000847256726 1333451743 /nfs/dbraw/zinc/45/17/43/1333451743.db2.gz RJBWLVOCENORSP-DZGCQCFKSA-N 0 3 337.807 2.995 20 5 EFBDHN Cc1cc([N+](=O)[O-])cc(C(=O)N[C@H]2CCCN3CCCC[C@H]23)c1F ZINC000847257732 1333453196 /nfs/dbraw/zinc/45/31/96/1333453196.db2.gz YVWMGCCSGGBNGH-LSDHHAIUSA-N 0 3 335.379 2.789 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1C(=O)NCCN1CCC(C)CC1 ZINC001354496248 1334333158 /nfs/dbraw/zinc/33/31/58/1334333158.db2.gz VOYYLHVCBIJRSV-UHFFFAOYSA-N 0 3 337.445 2.778 20 5 EFBDHN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCCN2CCCC[C@H]12 ZINC000848352220 1334685700 /nfs/dbraw/zinc/68/57/00/1334685700.db2.gz NLBOFJLYZGLKGW-ZIAGYGMSSA-N 0 3 335.379 2.789 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1cnn(CN(C[C@H]2CCOC2)C2CC2)c1 ZINC000848474537 1334735499 /nfs/dbraw/zinc/73/54/99/1334735499.db2.gz FZNUSYRDCPRVNB-CQSZACIVSA-N 0 3 342.399 2.917 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1cnn(CN2CC[C@H]([C@H]3CCOC3)C2)c1 ZINC000848482913 1334739348 /nfs/dbraw/zinc/73/93/48/1334739348.db2.gz VAJAYYHOOMYPSX-GJZGRUSLSA-N 0 3 342.399 2.774 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2N[C@H](CO)C[C@H](O)c1ccccc1 ZINC000848537106 1334782180 /nfs/dbraw/zinc/78/21/80/1334782180.db2.gz ZRRCGRRGTDPNMP-FNHZYXHNSA-N 0 3 342.395 2.656 20 5 EFBDHN CCCC[C@@H](N)C(=O)Nc1ccc([N+](=O)[O-])c(Br)c1 ZINC000211396999 1417294234 /nfs/dbraw/zinc/29/42/34/1417294234.db2.gz GWQGTQLVGMYNQA-SNVBAGLBSA-N 0 3 330.182 2.813 20 5 EFBDHN CCCN1CCC[C@H]1CNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000804777805 713466820 /nfs/dbraw/zinc/46/68/20/713466820.db2.gz GEACRJDGWNEBOE-AWEZNQCLSA-N 0 3 341.358 2.677 20 5 EFBDHN Cc1occc1C(=O)N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001021814891 714513483 /nfs/dbraw/zinc/51/34/83/714513483.db2.gz BHYCSNAVGMZFHU-OKILXGFUSA-N 0 3 329.356 2.547 20 5 EFBDHN O=C(N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1)c1sccc1F ZINC001022042539 714691396 /nfs/dbraw/zinc/69/13/96/714691396.db2.gz HOPRJJATWAOICW-TXEJJXNPSA-N 0 3 349.387 2.846 20 5 EFBDHN CCC(CC)[N@H+](CCOC)Cc1ccc([O-])c(OC)c1[N+](=O)[O-] ZINC000891677971 714925657 /nfs/dbraw/zinc/92/56/57/714925657.db2.gz PDRWOTIZAXSCOF-UHFFFAOYSA-N 0 3 326.393 2.946 20 5 EFBDHN CCC(CC)[N@@H+](CCOC)Cc1ccc([O-])c(OC)c1[N+](=O)[O-] ZINC000891677971 714925661 /nfs/dbraw/zinc/92/56/61/714925661.db2.gz PDRWOTIZAXSCOF-UHFFFAOYSA-N 0 3 326.393 2.946 20 5 EFBDHN CCC(CC)N(CCOC)Cc1ccc(O)c(OC)c1[N+](=O)[O-] ZINC000891677971 714925664 /nfs/dbraw/zinc/92/56/64/714925664.db2.gz PDRWOTIZAXSCOF-UHFFFAOYSA-N 0 3 326.393 2.946 20 5 EFBDHN Cc1cc(C)c(C(=O)N[C@H]2C[C@@H](NCc3ccccc3[N+](=O)[O-])C2)[nH]1 ZINC001022294252 714979230 /nfs/dbraw/zinc/97/92/30/714979230.db2.gz YYZCZXYCZCOTJY-GASCZTMLSA-N 0 3 342.399 2.590 20 5 EFBDHN COc1c([O-])ccc(CN2CCC[C@H]2C[NH+]2CCCCC2)c1[N+](=O)[O-] ZINC000891749443 714994825 /nfs/dbraw/zinc/99/48/25/714994825.db2.gz YMTTYJRWAIZZIH-HNNXBMFYSA-N 0 3 349.431 2.759 20 5 EFBDHN O=C(N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1)C1CC2(CCC2)C1 ZINC001022568027 715218342 /nfs/dbraw/zinc/21/83/42/715218342.db2.gz IIVBXAROZWPJDB-IYBDPMFKSA-N 0 3 343.427 2.912 20 5 EFBDHN COc1c([O-])ccc(C[NH+]2CCc3ccccc3CC2)c1[N+](=O)[O-] ZINC000892041611 715230818 /nfs/dbraw/zinc/23/08/18/715230818.db2.gz JVUQEXDKOGAVJQ-UHFFFAOYSA-N 0 3 328.368 2.910 20 5 EFBDHN COc1c(O)ccc(CN2CCc3ccccc3CC2)c1[N+](=O)[O-] ZINC000892041611 715230819 /nfs/dbraw/zinc/23/08/19/715230819.db2.gz JVUQEXDKOGAVJQ-UHFFFAOYSA-N 0 3 328.368 2.910 20 5 EFBDHN C[C@H](CNC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])N1CCCC[C@H]1C ZINC000727708859 724389837 /nfs/dbraw/zinc/38/98/37/724389837.db2.gz MZVJCRRQTJNKQL-GHMZBOCLSA-N 0 3 341.358 2.866 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1C[C@@H](C)N(C2CC2)C1 ZINC000934398097 715449754 /nfs/dbraw/zinc/44/97/54/715449754.db2.gz RLSNIFNJNLDWMQ-MNOVXSKESA-N 0 3 335.429 2.672 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CN(C2CC2)C[C@@H]1C ZINC000934574376 715685569 /nfs/dbraw/zinc/68/55/69/715685569.db2.gz GIHRQOHATVUPAF-IINYFYTJSA-N 0 3 335.429 2.529 20 5 EFBDHN CC(COC(=O)C1=Cc2ccccc2O[C@@H]1C(F)(F)F)[N+](=O)[O-] ZINC000893045567 719528082 /nfs/dbraw/zinc/52/80/82/719528082.db2.gz XXRJMGVIAFVTSM-PELKAZGASA-N 0 3 331.246 2.602 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]C2(C)Cc3ccccc3C2)c1[N+](=O)[O-] ZINC000893219796 720097507 /nfs/dbraw/zinc/09/75/07/720097507.db2.gz IZLNRHSORXHZMZ-UHFFFAOYSA-N 0 3 328.368 2.956 20 5 EFBDHN CCNC(=O)C1(CNCc2ccc(Cl)cc2[N+](=O)[O-])CCC1 ZINC000894008411 720210066 /nfs/dbraw/zinc/21/00/66/720210066.db2.gz ZHTBOBQKBLZGNF-UHFFFAOYSA-N 0 3 325.796 2.644 20 5 EFBDHN COCCOC[C@H](C)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000894082491 720263847 /nfs/dbraw/zinc/26/38/47/720263847.db2.gz ZGAPGTDEFRTWJE-JTQLQIEISA-N 0 3 336.310 2.755 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CNC[C@H]3COCO3)o2)c(Cl)c1 ZINC000894872456 722930084 /nfs/dbraw/zinc/93/00/84/722930084.db2.gz JFICVOPHRJIIRI-LBPRGKRZSA-N 0 3 338.747 2.971 20 5 EFBDHN CC(C)(CNCc1ccc(Cl)cc1[N+](=O)[O-])C1(O)CCOCC1 ZINC000894955564 723034587 /nfs/dbraw/zinc/03/45/87/723034587.db2.gz RIYJXBXMJVKUER-UHFFFAOYSA-N 0 3 342.823 2.906 20 5 EFBDHN C[C@H](CNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)N1CCCCC1 ZINC000917840223 728794110 /nfs/dbraw/zinc/79/41/10/728794110.db2.gz QPQLMJHMHCTKKY-GFCCVEGCSA-N 0 3 331.372 2.945 20 5 EFBDHN O=C(N[C@H]1C[C@H](CNCc2csc([N+](=O)[O-])c2)C1)C1(C2CC2)CC1 ZINC000983951321 723272562 /nfs/dbraw/zinc/27/25/62/723272562.db2.gz LSOSDFCTQWHHSD-YEORSEQZSA-N 0 3 349.456 2.831 20 5 EFBDHN CC(C)C[C@@H]1CN(C)CCN1c1ncnc2ccc([N+](=O)[O-])cc21 ZINC000896651758 723423985 /nfs/dbraw/zinc/42/39/85/723423985.db2.gz XZHGVWVSOTWUOP-CQSZACIVSA-N 0 3 329.404 2.705 20 5 EFBDHN CC(C)(C)C(=O)N[C@H]1C[C@H](CNCc2csc([N+](=O)[O-])c2)C1 ZINC000985063589 723810882 /nfs/dbraw/zinc/81/08/82/723810882.db2.gz UQXKGOKVCAIOFD-UMSPYCQHSA-N 0 3 325.434 2.687 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C1CCN(C(=O)c2ccco2)CC1 ZINC000985216523 724001536 /nfs/dbraw/zinc/00/15/36/724001536.db2.gz CRVYFZVISVYHPT-UHFFFAOYSA-N 0 3 343.383 2.924 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN[C@@H](CO)C[C@@H]1CCCO1 ZINC000895748320 724293606 /nfs/dbraw/zinc/29/36/06/724293606.db2.gz LQCRBDFDQLLIFQ-OLZOCXBDSA-N 0 3 348.321 2.633 20 5 EFBDHN C[C@H](CN1CCCCC1)NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000152627373 726199250 /nfs/dbraw/zinc/19/92/50/726199250.db2.gz JJGAKHRYWWECFU-LLVKDONJSA-N 0 3 325.796 2.852 20 5 EFBDHN Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)NC[C@H]1CCCN1C ZINC000888279628 727066926 /nfs/dbraw/zinc/06/69/26/727066926.db2.gz LTOSVQAAAXODLD-SNVBAGLBSA-N 0 3 326.784 2.772 20 5 EFBDHN CN1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])CC12CCCCC2 ZINC000908576566 727219919 /nfs/dbraw/zinc/21/99/19/727219919.db2.gz JDSXCPREWBBIME-UHFFFAOYSA-N 0 3 331.416 2.614 20 5 EFBDHN CCN1CCCN(C(=O)C(C)(C)c2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000910274065 727426057 /nfs/dbraw/zinc/42/60/57/727426057.db2.gz MKHOLRRBAZIBLC-CQSZACIVSA-N 0 3 333.432 2.815 20 5 EFBDHN CCN1CCCN(C(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)[C@H](C)C1 ZINC000910284561 727427330 /nfs/dbraw/zinc/42/73/30/727427330.db2.gz QWHAIMNUAZEKJT-OLZOCXBDSA-N 0 3 337.395 2.780 20 5 EFBDHN CCN1CCCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)[C@H](C)C1 ZINC000910290235 727428265 /nfs/dbraw/zinc/42/82/65/727428265.db2.gz ZAGYMMGWWQTARS-GFCCVEGCSA-N 0 3 331.372 2.897 20 5 EFBDHN CC[C@@H](C)C[C@@H](N)C(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000912149987 727664573 /nfs/dbraw/zinc/66/45/73/727664573.db2.gz HMMBTQULXSWQTG-QMTHXVAHSA-N 0 3 327.812 2.970 20 5 EFBDHN Cc1c(CN2CCC(C(=O)NCC(C)C)CC2)cccc1[N+](=O)[O-] ZINC000917009627 727754337 /nfs/dbraw/zinc/75/43/37/727754337.db2.gz GZKYGZXAZVYLBT-UHFFFAOYSA-N 0 3 333.432 2.887 20 5 EFBDHN CC(C)N1CCCN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000139274388 727763322 /nfs/dbraw/zinc/76/33/22/727763322.db2.gz GYIWOHWTKSDSIS-UHFFFAOYSA-N 0 3 325.796 2.805 20 5 EFBDHN CC(=O)N1CC[C@H](CN(C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000156519364 727927487 /nfs/dbraw/zinc/92/74/87/727927487.db2.gz IVGWARKCYGPTTP-CYBMUJFWSA-N 0 3 325.796 2.548 20 5 EFBDHN CC(C)[C@H](CCO)NCc1cccc([N+](=O)[O-])c1Br ZINC000231078072 728612846 /nfs/dbraw/zinc/61/28/46/728612846.db2.gz UMHYAQRDTZBHIC-NSHDSACASA-N 0 3 331.210 2.854 20 5 EFBDHN COc1ccccc1C[C@](C)(CO)NCc1ccc([N+](=O)[O-])c(F)c1 ZINC000931604230 1126136740 /nfs/dbraw/zinc/13/67/40/1126136740.db2.gz VVAUCJFVPZOUDF-GOSISDBHSA-N 0 3 348.374 2.826 20 5 EFBDHN C[C@@H]1CN[C@@H](C)[C@@H](C)N1C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC001576881463 1089504324 /nfs/dbraw/zinc/50/43/24/1089504324.db2.gz VKSUQHOVKRBGAT-HRDYMLBCSA-N 0 3 329.759 2.598 20 5 EFBDHN NCc1cccnc1NC(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC001580347337 1090872539 /nfs/dbraw/zinc/87/25/39/1090872539.db2.gz VRLZBEPQXLRHOF-UHFFFAOYSA-N 0 3 340.261 2.720 20 5 EFBDHN O=C(Nc1ccc2c(c1)CNC2)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC001580770007 1091003618 /nfs/dbraw/zinc/00/36/18/1091003618.db2.gz JMWRNXAVFPUWJN-UHFFFAOYSA-N 0 3 333.294 2.929 20 5 EFBDHN CC(C)(C)[C@@H]1CC[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001589103773 1093032799 /nfs/dbraw/zinc/03/27/99/1093032799.db2.gz WMGFLVIPIMHQMP-LLVKDONJSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)(C)[C@@H]1CC[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001589103773 1093032805 /nfs/dbraw/zinc/03/28/05/1093032805.db2.gz WMGFLVIPIMHQMP-LLVKDONJSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)(C)[C@@H]1CC[N@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001589103773 1093032812 /nfs/dbraw/zinc/03/28/12/1093032812.db2.gz WMGFLVIPIMHQMP-LLVKDONJSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)(C)[C@@H]1CC[N@@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001589103773 1093032818 /nfs/dbraw/zinc/03/28/18/1093032818.db2.gz WMGFLVIPIMHQMP-LLVKDONJSA-N 0 3 330.392 2.643 20 5 EFBDHN CC(C)[N@H+](Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])C1CCCC1 ZINC001589695776 1093127647 /nfs/dbraw/zinc/12/76/47/1093127647.db2.gz VQJVDMVBHOQCKD-UHFFFAOYSA-N 0 3 330.392 2.928 20 5 EFBDHN CC(C)[N@@H+](Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])C1CCCC1 ZINC001589695776 1093127652 /nfs/dbraw/zinc/12/76/52/1093127652.db2.gz VQJVDMVBHOQCKD-UHFFFAOYSA-N 0 3 330.392 2.928 20 5 EFBDHN CC(C)[N@H+](Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])C1CCCC1 ZINC001589695776 1093127653 /nfs/dbraw/zinc/12/76/53/1093127653.db2.gz VQJVDMVBHOQCKD-UHFFFAOYSA-N 0 3 330.392 2.928 20 5 EFBDHN CC(C)[N@@H+](Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])C1CCCC1 ZINC001589695776 1093127659 /nfs/dbraw/zinc/12/76/59/1093127659.db2.gz VQJVDMVBHOQCKD-UHFFFAOYSA-N 0 3 330.392 2.928 20 5 EFBDHN C[C@H]1CCC[C@H](C)[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590245014 1093335465 /nfs/dbraw/zinc/33/54/65/1093335465.db2.gz XPOZKQKWBORAAL-RYUDHWBXSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@H]1CCC[C@H](C)[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590245014 1093335467 /nfs/dbraw/zinc/33/54/67/1093335467.db2.gz XPOZKQKWBORAAL-RYUDHWBXSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@H]1CCC[C@H](C)[N@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590245014 1093335468 /nfs/dbraw/zinc/33/54/68/1093335468.db2.gz XPOZKQKWBORAAL-RYUDHWBXSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@H]1CCC[C@H](C)[N@@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590245014 1093335473 /nfs/dbraw/zinc/33/54/73/1093335473.db2.gz XPOZKQKWBORAAL-RYUDHWBXSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@H]([N@H+](C)Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590245591 1093336375 /nfs/dbraw/zinc/33/63/75/1093336375.db2.gz XQPGRAFFGGDGAB-NEPJUHHUSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@H]([N@@H+](C)Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590245591 1093336382 /nfs/dbraw/zinc/33/63/82/1093336382.db2.gz XQPGRAFFGGDGAB-NEPJUHHUSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@H]([N@H+](C)Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590245591 1093336394 /nfs/dbraw/zinc/33/63/94/1093336394.db2.gz XQPGRAFFGGDGAB-NEPJUHHUSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@H]([N@@H+](C)Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590245591 1093336402 /nfs/dbraw/zinc/33/64/02/1093336402.db2.gz XQPGRAFFGGDGAB-NEPJUHHUSA-N 0 3 330.392 2.785 20 5 EFBDHN CC[NH+](CC)CCC[C@H](C)Nc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001590687986 1093550468 /nfs/dbraw/zinc/55/04/68/1093550468.db2.gz RJDZHBPOUOCBKG-LBPRGKRZSA-N 0 3 347.423 2.697 20 5 EFBDHN CC[NH+](CC)CCC[C@H](C)Nc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001590687986 1093550471 /nfs/dbraw/zinc/55/04/71/1093550471.db2.gz RJDZHBPOUOCBKG-LBPRGKRZSA-N 0 3 347.423 2.697 20 5 EFBDHN C[N@H+](Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])[C@@H]1CCC(C)(C)C1 ZINC001591137104 1093670387 /nfs/dbraw/zinc/67/03/87/1093670387.db2.gz RQOYDHNZGRIAFJ-CYBMUJFWSA-N 0 3 330.392 2.785 20 5 EFBDHN C[N@@H+](Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])[C@@H]1CCC(C)(C)C1 ZINC001591137104 1093670391 /nfs/dbraw/zinc/67/03/91/1093670391.db2.gz RQOYDHNZGRIAFJ-CYBMUJFWSA-N 0 3 330.392 2.785 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[NH+]1CCC2(CCC2)CC1 ZINC001593467243 1094308838 /nfs/dbraw/zinc/30/88/38/1094308838.db2.gz OEAVZYQGUWTXSG-UHFFFAOYSA-N 0 3 328.376 2.541 20 5 EFBDHN COc1c(O)ccc(CN[C@@H]2CCCO[C@H]2CC(C)C)c1[N+](=O)[O-] ZINC000893684295 1095874326 /nfs/dbraw/zinc/87/43/26/1095874326.db2.gz AJADBTQMSGEJEA-HIFRSBDPSA-N 0 3 338.404 2.992 20 5 EFBDHN CC[C@H]([NH2+]Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])[C@@H]1CC1(C)C ZINC001604061208 1096714787 /nfs/dbraw/zinc/71/47/87/1096714787.db2.gz KRYORILXIVPNSW-STQMWFEESA-N 0 3 330.392 2.689 20 5 EFBDHN CC[C@H]([NH2+]Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])[C@@H]1CC1(C)C ZINC001604061208 1096714792 /nfs/dbraw/zinc/71/47/92/1096714792.db2.gz KRYORILXIVPNSW-STQMWFEESA-N 0 3 330.392 2.689 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[N@H+](CCC1CC1)CC1CC1 ZINC001607077712 1097505560 /nfs/dbraw/zinc/50/55/60/1097505560.db2.gz QPILJAMZVWXKTC-UHFFFAOYSA-N 0 3 342.403 2.787 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[N@@H+](CCC1CC1)CC1CC1 ZINC001607077712 1097505564 /nfs/dbraw/zinc/50/55/64/1097505564.db2.gz QPILJAMZVWXKTC-UHFFFAOYSA-N 0 3 342.403 2.787 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1C[N@H+](CCC1CC1)CC1CC1 ZINC001607077712 1097505570 /nfs/dbraw/zinc/50/55/70/1097505570.db2.gz QPILJAMZVWXKTC-UHFFFAOYSA-N 0 3 342.403 2.787 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1C[N@@H+](CCC1CC1)CC1CC1 ZINC001607077712 1097505578 /nfs/dbraw/zinc/50/55/78/1097505578.db2.gz QPILJAMZVWXKTC-UHFFFAOYSA-N 0 3 342.403 2.787 20 5 EFBDHN CN1C[C@@H]2CCN(C(=O)c3ccnc4c3ccc3cccnc34)[C@@H]2C1 ZINC001269225039 1097965884 /nfs/dbraw/zinc/96/58/84/1097965884.db2.gz OGDDTLLZCMUHGE-WMLDXEAASA-N 0 3 332.407 2.559 20 5 EFBDHN C[C@@H]1C[C@@H](C)[C@H](C)[N@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001609153921 1098170989 /nfs/dbraw/zinc/17/09/89/1098170989.db2.gz FWBJFHFMMJIQOO-UTUOFQBUSA-N 0 3 330.392 2.641 20 5 EFBDHN C[C@@H]1C[C@@H](C)[C@H](C)[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001609153921 1098170995 /nfs/dbraw/zinc/17/09/95/1098170995.db2.gz FWBJFHFMMJIQOO-UTUOFQBUSA-N 0 3 330.392 2.641 20 5 EFBDHN C[C@@H]1C[C@@H](C)[C@H](C)[N@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001609153921 1098170999 /nfs/dbraw/zinc/17/09/99/1098170999.db2.gz FWBJFHFMMJIQOO-UTUOFQBUSA-N 0 3 330.392 2.641 20 5 EFBDHN C[C@@H]1C[C@@H](C)[C@H](C)[N@@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001609153921 1098171002 /nfs/dbraw/zinc/17/10/02/1098171002.db2.gz FWBJFHFMMJIQOO-UTUOFQBUSA-N 0 3 330.392 2.641 20 5 EFBDHN CC[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001609199812 1098196698 /nfs/dbraw/zinc/19/66/98/1098196698.db2.gz GLTYCMZJXJDEOM-FZMZJTMJSA-N 0 3 330.392 2.833 20 5 EFBDHN CC[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001609199812 1098196702 /nfs/dbraw/zinc/19/67/02/1098196702.db2.gz GLTYCMZJXJDEOM-FZMZJTMJSA-N 0 3 330.392 2.833 20 5 EFBDHN CC[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001609199811 1098196736 /nfs/dbraw/zinc/19/67/36/1098196736.db2.gz GLTYCMZJXJDEOM-BXUZGUMPSA-N 0 3 330.392 2.833 20 5 EFBDHN CC[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001609199811 1098196738 /nfs/dbraw/zinc/19/67/38/1098196738.db2.gz GLTYCMZJXJDEOM-BXUZGUMPSA-N 0 3 330.392 2.833 20 5 EFBDHN CC[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001609199814 1098196910 /nfs/dbraw/zinc/19/69/10/1098196910.db2.gz GLTYCMZJXJDEOM-SMDDNHRTSA-N 0 3 330.392 2.833 20 5 EFBDHN CC[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001609199814 1098196915 /nfs/dbraw/zinc/19/69/15/1098196915.db2.gz GLTYCMZJXJDEOM-SMDDNHRTSA-N 0 3 330.392 2.833 20 5 EFBDHN Cc1[nH]ccc1C(=O)N1CCC(NCc2csc([N+](=O)[O-])c2)CC1 ZINC000990856544 1109727674 /nfs/dbraw/zinc/72/76/74/1109727674.db2.gz CLKUHUXDWLIVET-UHFFFAOYSA-N 0 3 348.428 2.687 20 5 EFBDHN CCN(CCNc1ccccc1[N+](=O)[O-])C(=O)CN1CCC(C)CC1 ZINC001106818161 1111880098 /nfs/dbraw/zinc/88/00/98/1111880098.db2.gz VFHHKQYTPHKATR-UHFFFAOYSA-N 0 3 348.447 2.587 20 5 EFBDHN CN(C)C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc2O1 ZINC000370503803 282126528 /nfs/dbraw/zinc/12/65/28/282126528.db2.gz YUMMGAOAQNATJA-OAHLLOKOSA-N 0 3 341.367 2.564 20 5 EFBDHN CSc1cccc(C(=O)N[C@H](C)CN2CCCCC2)c1[N+](=O)[O-] ZINC000188044586 295680802 /nfs/dbraw/zinc/68/08/02/295680802.db2.gz UGAKUVLSXXXZGG-GFCCVEGCSA-N 0 3 337.445 2.921 20 5 EFBDHN CN(CCN(C)C1CC1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000183933933 529901910 /nfs/dbraw/zinc/90/19/10/529901910.db2.gz NUAUFFPBGRISLD-UHFFFAOYSA-N 0 3 326.784 2.806 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN[C@H](C)c1ccccn1 ZINC000181807992 234330075 /nfs/dbraw/zinc/33/00/75/234330075.db2.gz NLNJFKKBROMOGJ-CYBMUJFWSA-N 0 3 328.372 2.978 20 5 EFBDHN Cc1c([C@H](C)NCCC(=O)Nc2ccc([N+](=O)[O-])cc2C)cnn1C ZINC000183438335 235076845 /nfs/dbraw/zinc/07/68/45/235076845.db2.gz QXXLUGXMKNAQGC-LBPRGKRZSA-N 0 3 345.403 2.625 20 5 EFBDHN COC[C@@H](N[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)C1CC1 ZINC000183473815 235098540 /nfs/dbraw/zinc/09/85/40/235098540.db2.gz WRYBFYPZYLCKIQ-LKFCYVNXSA-N 0 3 341.795 2.590 20 5 EFBDHN COc1cc(CN2CCN(C3CCCC3)CC2)c([N+](=O)[O-])cc1F ZINC000184242230 235345212 /nfs/dbraw/zinc/34/52/12/235345212.db2.gz RPXIEGJKUFRUGM-UHFFFAOYSA-N 0 3 337.395 2.803 20 5 EFBDHN CN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000164169130 283162498 /nfs/dbraw/zinc/16/24/98/283162498.db2.gz XJDIDEVFIJGYAJ-RISCZKNCSA-N 0 3 337.807 2.805 20 5 EFBDHN CN1CC[C@H]2[C@H](CCCN2C(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000164173986 283162748 /nfs/dbraw/zinc/16/27/48/283162748.db2.gz LBUZLMRJUXIPHA-YPMHNXCESA-N 0 3 337.807 2.805 20 5 EFBDHN C[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)[C@H](c1ccccc1)N(C)C ZINC000187222248 236149973 /nfs/dbraw/zinc/14/99/73/236149973.db2.gz DZSUFKHDJRWQMB-IFXJQAMLSA-N 0 3 341.411 2.945 20 5 EFBDHN C[C@H](NC(=O)N(C)CC1(N(C)C)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000189725290 237189741 /nfs/dbraw/zinc/18/97/41/237189741.db2.gz ADWVCXHLCGSGFV-ZDUSSCGKSA-N 0 3 334.420 2.782 20 5 EFBDHN C[C@@H](CN1CCCCC1)NC(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000071970316 202365672 /nfs/dbraw/zinc/36/56/72/202365672.db2.gz JPZUMZCBIJSSJE-NSHDSACASA-N 0 3 325.796 2.852 20 5 EFBDHN CN(CC1CCN(C)CC1)C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000077563600 202392549 /nfs/dbraw/zinc/39/25/49/202392549.db2.gz XZBWNZNQOLGZIR-UHFFFAOYSA-N 0 3 325.796 2.662 20 5 EFBDHN CN(C)CCN(CC1CCCCC1)C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000190248933 238330439 /nfs/dbraw/zinc/33/04/39/238330439.db2.gz IRKNECCYCAYGPH-UHFFFAOYSA-N 0 3 348.447 2.761 20 5 EFBDHN CCOC(=O)N1CCC(NCc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000236881696 201147737 /nfs/dbraw/zinc/14/77/37/201147737.db2.gz NDZFBYADUCHENV-UHFFFAOYSA-N 0 3 341.795 2.959 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000267594774 201222484 /nfs/dbraw/zinc/22/24/84/201222484.db2.gz QYMDZLMZQUHPKC-NEPJUHHUSA-N 0 3 337.807 2.947 20 5 EFBDHN O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CC[C@@H](N2CCCCC2)C1 ZINC000274377698 201268220 /nfs/dbraw/zinc/26/82/20/201268220.db2.gz LZXGXBKKJDQXNY-CYBMUJFWSA-N 0 3 337.807 2.949 20 5 EFBDHN C[C@@H](N(C)Cc1ccc(Br)c([N+](=O)[O-])c1)C(C)(C)O ZINC000295040395 201348412 /nfs/dbraw/zinc/34/84/12/201348412.db2.gz AGMZPCOKFJHVNO-SECBINFHSA-N 0 3 331.210 2.949 20 5 EFBDHN O=[N+]([O-])c1cnc(NCc2ccccc2CN2CCC[C@@H]2CO)s1 ZINC000192526101 240051064 /nfs/dbraw/zinc/05/10/64/240051064.db2.gz AXDSWHHAOYJRKT-CQSZACIVSA-N 0 3 348.428 2.620 20 5 EFBDHN COc1cccc(C(=O)NCc2ccc(CN(C)C)cc2)c1[N+](=O)[O-] ZINC000195324654 240218626 /nfs/dbraw/zinc/21/86/26/240218626.db2.gz RSBLEPAVAHZSDL-UHFFFAOYSA-N 0 3 343.383 2.595 20 5 EFBDHN Cc1ccc([C@@H]2CCCCCN2C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)o1 ZINC000229349861 242157349 /nfs/dbraw/zinc/15/73/49/242157349.db2.gz BFHCEGFFCRHDEJ-CVEARBPZSA-N 0 3 348.403 2.671 20 5 EFBDHN CO[C@](C)([C@H](C)NCC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000411972699 243049450 /nfs/dbraw/zinc/04/94/50/243049450.db2.gz QIMQVONTLVVPHN-YVEFUNNKSA-N 0 3 335.404 2.635 20 5 EFBDHN CO[C@@](C)([C@H](C)NCC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000411972697 243050061 /nfs/dbraw/zinc/05/00/61/243050061.db2.gz QIMQVONTLVVPHN-SJCJKPOMSA-N 0 3 335.404 2.635 20 5 EFBDHN Cc1n[nH]c([C@@H]2CCN(Cc3cc([N+](=O)[O-])ccc3OC(C)C)C2)n1 ZINC000412032723 243080754 /nfs/dbraw/zinc/08/07/54/243080754.db2.gz REGDSTFKIQDPJD-CYBMUJFWSA-N 0 3 345.403 2.798 20 5 EFBDHN Cc1nc([C@@H]2CCN(Cc3cc([N+](=O)[O-])ccc3OC(C)C)C2)n[nH]1 ZINC000412032723 243080758 /nfs/dbraw/zinc/08/07/58/243080758.db2.gz REGDSTFKIQDPJD-CYBMUJFWSA-N 0 3 345.403 2.798 20 5 EFBDHN Cc1nnc([C@@H]2CCN(Cc3cc([N+](=O)[O-])ccc3OC(C)C)C2)[nH]1 ZINC000412032723 243080764 /nfs/dbraw/zinc/08/07/64/243080764.db2.gz REGDSTFKIQDPJD-CYBMUJFWSA-N 0 3 345.403 2.798 20 5 EFBDHN Cc1c(CN2CCC[C@H](N3CCCC3=O)CC2)cccc1[N+](=O)[O-] ZINC000412060420 243109323 /nfs/dbraw/zinc/10/93/23/243109323.db2.gz ZUXGCUWAWKWVGR-INIZCTEOSA-N 0 3 331.416 2.880 20 5 EFBDHN CC1(C)CCCN(CCNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000412289651 243249501 /nfs/dbraw/zinc/24/95/01/243249501.db2.gz IAOQTSXYSHXROE-DLBZAZTESA-N 0 3 345.443 2.937 20 5 EFBDHN CCn1cc([C@@H]2OCC[C@H]2CNCc2csc([N+](=O)[O-])c2)cn1 ZINC000414500068 244194623 /nfs/dbraw/zinc/19/46/23/244194623.db2.gz BKFTUSYRBCUOTJ-SWLSCSKDSA-N 0 3 336.417 2.740 20 5 EFBDHN CN(C)C(=O)[C@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000414503023 244197993 /nfs/dbraw/zinc/19/79/93/244197993.db2.gz VINWLZJZVZLLAV-AWEZNQCLSA-N 0 3 343.383 2.765 20 5 EFBDHN Cc1ccc(NC(=O)N2C[C@@H](c3ccccc3)[C@H](N)C2)cc1[N+](=O)[O-] ZINC000414661362 244280325 /nfs/dbraw/zinc/28/03/25/244280325.db2.gz PUNSQXGZELICRQ-JKSUJKDBSA-N 0 3 340.383 2.862 20 5 EFBDHN CCN1CCC(n2nccc2NC(=O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000073079974 203254998 /nfs/dbraw/zinc/25/49/98/203254998.db2.gz DWVYCOYQSLGNTB-UHFFFAOYSA-N 0 3 343.387 2.700 20 5 EFBDHN Cc1ccc([C@@H](CNCc2ccc([N+](=O)[O-])cc2)N2CCOCC2)o1 ZINC000073052226 203255278 /nfs/dbraw/zinc/25/52/78/203255278.db2.gz MSBOPLRPGFAZEA-QGZVFWFLSA-N 0 3 345.399 2.659 20 5 EFBDHN COc1cc(C(=O)N2CCC[C@H]2CN2CCCCC2)ccc1[N+](=O)[O-] ZINC000075505663 203315697 /nfs/dbraw/zinc/31/56/97/203315697.db2.gz KMBSOHRZMOTLKA-HNNXBMFYSA-N 0 3 347.415 2.694 20 5 EFBDHN CN(C)CCN(Cc1ccccc1)C(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000077509178 203392726 /nfs/dbraw/zinc/39/27/26/203392726.db2.gz SLESVVSZXCBLBW-UHFFFAOYSA-N 0 3 345.374 2.938 20 5 EFBDHN COC(=O)COc1ccc(CN2C[C@H](C)[C@H](C)[C@H]2C)cc1[N+](=O)[O-] ZINC000418121921 245112590 /nfs/dbraw/zinc/11/25/90/245112590.db2.gz JFEXONKATDNOEC-RWMBFGLXSA-N 0 3 336.388 2.623 20 5 EFBDHN C[C@H]1NCCN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)[C@H]1C ZINC000262745164 245157578 /nfs/dbraw/zinc/15/75/78/245157578.db2.gz FSOYJVUJEVOTDG-MNOVXSKESA-N 0 3 346.412 2.541 20 5 EFBDHN CN(CC1CCN(C)CC1)C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000103453492 204080830 /nfs/dbraw/zinc/08/08/30/204080830.db2.gz KSWWHXYNYKQHBO-UHFFFAOYSA-N 0 3 325.796 2.662 20 5 EFBDHN CCN(CCNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C)C1CC1 ZINC000103614799 204085214 /nfs/dbraw/zinc/08/52/14/204085214.db2.gz UELGTSTXKWXTEL-UHFFFAOYSA-N 0 3 348.447 2.999 20 5 EFBDHN C[C@@H](O)CN(CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000104684127 204114638 /nfs/dbraw/zinc/11/46/38/204114638.db2.gz ZDVHMOLZDNNINC-CQSZACIVSA-N 0 3 349.431 2.573 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@H](O)Cc1ccccc1 ZINC000105493149 204147183 /nfs/dbraw/zinc/14/71/83/204147183.db2.gz LZQNCOXDCAGBDW-QGZVFWFLSA-N 0 3 330.384 2.687 20 5 EFBDHN C[C@@H](c1cccc(O)c1)N(C)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000109782449 204291651 /nfs/dbraw/zinc/29/16/51/204291651.db2.gz VXKZQWKGLYKZDO-GUYCJALGSA-N 0 3 346.383 2.733 20 5 EFBDHN CN(C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C1CCN(C)CC1 ZINC000125790974 205026548 /nfs/dbraw/zinc/02/65/48/205026548.db2.gz SVGLUUFRLAHZHL-UHFFFAOYSA-N 0 3 345.321 2.780 20 5 EFBDHN C[C@H]1SCCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)[C@@H]1C ZINC000128672090 205156286 /nfs/dbraw/zinc/15/62/86/205156286.db2.gz SYLIHKHDKAIUQF-GHMZBOCLSA-N 0 3 341.408 2.888 20 5 EFBDHN CN(C[C@@H]1CCN(C)C1)C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000129840587 205213972 /nfs/dbraw/zinc/21/39/72/205213972.db2.gz YICDGLCBSHCINZ-SNVBAGLBSA-N 0 3 345.321 2.637 20 5 EFBDHN CC[C@@H](NC(=O)N1CCN2CCC[C@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000247031199 205254437 /nfs/dbraw/zinc/25/44/37/205254437.db2.gz MJOLBCWXQWBXRT-JKSUJKDBSA-N 0 3 332.404 2.536 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCN2CCNC[C@@H]2c2ccccc2)c1 ZINC000420410825 245675768 /nfs/dbraw/zinc/67/57/68/245675768.db2.gz RMOOPQMTNVCCRT-GOSISDBHSA-N 0 3 327.384 2.620 20 5 EFBDHN CCCN1C[C@H](CNCc2ccc([N+](=O)[O-])cc2Cl)CC1=O ZINC000421351945 245938418 /nfs/dbraw/zinc/93/84/18/245938418.db2.gz NGRCQZPXKHAOKJ-NSHDSACASA-N 0 3 325.796 2.596 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)C[C@H]1CCCN1C ZINC000421710678 246073918 /nfs/dbraw/zinc/07/39/18/246073918.db2.gz LVBALALEBUWPBN-NVXWUHKLSA-N 0 3 333.432 2.716 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N(CCN(C)C)C(C)C)c1 ZINC000156759880 206097973 /nfs/dbraw/zinc/09/79/73/206097973.db2.gz MZAQSBBAUPAWGY-UHFFFAOYSA-N 0 3 325.434 2.729 20 5 EFBDHN CN1CC[C@@H]2[C@H](CCCN2C(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000157204771 206123395 /nfs/dbraw/zinc/12/33/95/206123395.db2.gz ADOYLCFBNZVWFD-CZUORRHYSA-N 0 3 349.456 2.630 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)N(CCN(C)C)C(C)C)cc1[N+](=O)[O-] ZINC000159462033 206247521 /nfs/dbraw/zinc/24/75/21/206247521.db2.gz GJGFTIJHIBIJDU-CQSZACIVSA-N 0 3 336.436 2.946 20 5 EFBDHN CCN(CCn1cc([N+](=O)[O-])ccc1=O)Cc1cccc(Cl)c1 ZINC000159749508 206260683 /nfs/dbraw/zinc/26/06/83/206260683.db2.gz RVGDNCXBRDFKDH-UHFFFAOYSA-N 0 3 335.791 2.932 20 5 EFBDHN O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC[C@H]1CN1CCCCC1 ZINC000068132210 296226861 /nfs/dbraw/zinc/22/68/61/296226861.db2.gz OLRYCKAVKGJBST-AWEZNQCLSA-N 0 3 335.379 2.824 20 5 EFBDHN CN(Cc1ccc(Br)cc1[N+](=O)[O-])C[C@@H]1CCOC1 ZINC000425415192 247078341 /nfs/dbraw/zinc/07/83/41/247078341.db2.gz FHTOENRNPISBRE-JTQLQIEISA-N 0 3 329.194 2.826 20 5 EFBDHN C[C@@H]1[C@H](C)N(Cc2ccc(Br)cc2[N+](=O)[O-])CCN1C ZINC000425454862 247091266 /nfs/dbraw/zinc/09/12/66/247091266.db2.gz GYANVPRAJZIJHH-MNOVXSKESA-N 0 3 342.237 2.882 20 5 EFBDHN O=C(NCCN1CCCCCC1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000265139256 247239578 /nfs/dbraw/zinc/23/95/78/247239578.db2.gz BEHYGVPQWURFMA-UHFFFAOYSA-N 0 3 330.388 2.682 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@](C)(O)c1ccccc1 ZINC000265142199 247242896 /nfs/dbraw/zinc/24/28/96/247242896.db2.gz MDAAEDGMUHSVCW-SFHVURJKSA-N 0 3 330.384 2.991 20 5 EFBDHN CC(C)[C@@H](CCO)N[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000162184025 206390267 /nfs/dbraw/zinc/39/02/67/206390267.db2.gz SJFBYDNHUHFQEN-ZWNOBZJWSA-N 0 3 343.811 2.572 20 5 EFBDHN C[C@H]1CN2CCC[C@@H]2CN1C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000265993903 248006911 /nfs/dbraw/zinc/00/69/11/248006911.db2.gz MWEQJJMAXNUOIP-XJKSGUPXSA-N 0 3 331.416 2.568 20 5 EFBDHN CN(C[C@H]1CCCN(C)C1)C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000265995755 248008737 /nfs/dbraw/zinc/00/87/37/248008737.db2.gz MYCOCJMFNBZDFE-AWEZNQCLSA-N 0 3 333.432 2.673 20 5 EFBDHN CN(CCOc1ccc([N+](=O)[O-])cc1)C[C@H](O)Cc1ccccc1 ZINC000433052362 248008954 /nfs/dbraw/zinc/00/89/54/248008954.db2.gz MASYLKGXBLQDCU-QGZVFWFLSA-N 0 3 330.384 2.509 20 5 EFBDHN O=C1CCC[C@H](CNCc2ccc(-c3ccccc3[N+](=O)[O-])o2)N1 ZINC000433202766 248028546 /nfs/dbraw/zinc/02/85/46/248028546.db2.gz TZLNHYSFJYATTB-GFCCVEGCSA-N 0 3 329.356 2.613 20 5 EFBDHN COCCN(CCOc1ccc([N+](=O)[O-])cc1)[C@H]1CCCSC1 ZINC000433197236 248028602 /nfs/dbraw/zinc/02/86/02/248028602.db2.gz QRSXAWQCSQGNEN-HNNXBMFYSA-N 0 3 340.445 2.818 20 5 EFBDHN CCOc1cc(CN(CCO)[C@H]2CCCSC2)ccc1[N+](=O)[O-] ZINC000433211231 248028976 /nfs/dbraw/zinc/02/89/76/248028976.db2.gz XEUPXBZJQVHJAS-AWEZNQCLSA-N 0 3 340.445 2.683 20 5 EFBDHN CC(C)c1ccc(CN2CCN(C[C@@H]3CCOC3)CC2)cc1[N+](=O)[O-] ZINC000093817733 218252061 /nfs/dbraw/zinc/25/20/61/218252061.db2.gz BHMZBAWNGXLEHV-KRWDZBQOSA-N 0 3 347.459 2.872 20 5 EFBDHN CC1(C)CCCN(CCNC(=O)CCNc2ccccc2[N+](=O)[O-])C1 ZINC000444613876 250316583 /nfs/dbraw/zinc/31/65/83/250316583.db2.gz YHTIHZKKBQGVMH-UHFFFAOYSA-N 0 3 348.447 2.635 20 5 EFBDHN C[C@@H]1CN(CC(C)(C)O)CCN1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000444671273 250325057 /nfs/dbraw/zinc/32/50/57/250325057.db2.gz FXOAHROWTZXQCQ-GFCCVEGCSA-N 0 3 341.839 2.525 20 5 EFBDHN CCC(CC)(CC(=O)OC)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444670021 250325223 /nfs/dbraw/zinc/32/52/23/250325223.db2.gz XREIPNVJAUCJDX-UHFFFAOYSA-N 0 3 334.376 2.683 20 5 EFBDHN COC(=O)[C@@H]1CCCC[C@]1(C)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444668821 250325454 /nfs/dbraw/zinc/32/54/54/250325454.db2.gz ZREFKJHSYWDKFP-SJCJKPOMSA-N 0 3 346.387 2.683 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN[C@H](CCO)C3CCCCC3)nc2c1 ZINC000444684595 250328856 /nfs/dbraw/zinc/32/88/56/250328856.db2.gz NGFHBRJIIVTKFI-CQSZACIVSA-N 0 3 332.404 2.892 20 5 EFBDHN CN(C)C1(CNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000446612001 250515491 /nfs/dbraw/zinc/51/54/91/250515491.db2.gz BJGNKVXPDGLBAH-UHFFFAOYSA-N 0 3 334.420 2.613 20 5 EFBDHN COCC[C@@](C)(O)CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000172072214 206785546 /nfs/dbraw/zinc/78/55/46/206785546.db2.gz OLTDOHFCUQTJTB-QGZVFWFLSA-N 0 3 334.372 2.732 20 5 EFBDHN CSc1ccc(C(=O)N2CC[C@@H]3CC[C@H](C2)N3C)cc1[N+](=O)[O-] ZINC000174623141 207038709 /nfs/dbraw/zinc/03/87/09/207038709.db2.gz YJXHBHAKJLDATQ-QWHCGFSZSA-N 0 3 335.429 2.625 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H]2CC[C@@H](C1)N2C ZINC000174682539 207046129 /nfs/dbraw/zinc/04/61/29/207046129.db2.gz CVMUZAUOXOEORT-GUTXKFCHSA-N 0 3 349.456 2.771 20 5 EFBDHN CC(C)c1ccc(CNC[C@@H]2CCCN2CCCO)cc1[N+](=O)[O-] ZINC000449387643 251006713 /nfs/dbraw/zinc/00/67/13/251006713.db2.gz MJJPEVCEFVFXTR-INIZCTEOSA-N 0 3 335.448 2.655 20 5 EFBDHN CO[C@@H]1COCC[C@@H]1CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000449453184 251030763 /nfs/dbraw/zinc/03/07/63/251030763.db2.gz HMIHXJNTLJSUFS-FZKQIMNGSA-N 0 3 346.383 2.996 20 5 EFBDHN CO[C@H]1CCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000449503766 251045885 /nfs/dbraw/zinc/04/58/85/251045885.db2.gz PWYSGEURZSYZCN-DYVFJYSZSA-N 0 3 344.415 2.852 20 5 EFBDHN C[C@H](NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)C(C)(C)CN(C)C ZINC000449941215 251207813 /nfs/dbraw/zinc/20/78/13/251207813.db2.gz VBRSGUQESQMXEK-ZDUSSCGKSA-N 0 3 349.431 2.650 20 5 EFBDHN Cc1nc(N[C@H]2CCN([C@@H](C)c3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000450273276 251323826 /nfs/dbraw/zinc/32/38/26/251323826.db2.gz GEEUHHFPKUUHDI-ZFWWWQNUSA-N 0 3 327.388 2.941 20 5 EFBDHN CCN1CCCC[C@@H]1CNc1ccc(CC(=O)OC)cc1[N+](=O)[O-] ZINC000450337382 251350703 /nfs/dbraw/zinc/35/07/03/251350703.db2.gz ULPLTQRTYSQXOB-CQSZACIVSA-N 0 3 335.404 2.597 20 5 EFBDHN CN1CC=C(CNC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC1 ZINC000450417527 251378752 /nfs/dbraw/zinc/37/87/52/251378752.db2.gz JNHFEGBQOZVJQJ-UHFFFAOYSA-N 0 3 343.305 2.605 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)N(C)C[C@H]2CCCN(C)C2)cc1[N+](=O)[O-] ZINC000176720422 207253296 /nfs/dbraw/zinc/25/32/96/207253296.db2.gz YTAUULFGDGJPEX-CABCVRRESA-N 0 3 348.447 2.947 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)N2CCC[C@@H](N(C)C)C2)cc1[N+](=O)[O-] ZINC000176747151 207256610 /nfs/dbraw/zinc/25/66/10/207256610.db2.gz QMWWKMDNSQPQRU-UKRRQHHQSA-N 0 3 334.420 2.700 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@@H](C)N(C3CC3)C2)c1 ZINC000177159251 207300101 /nfs/dbraw/zinc/30/01/01/207300101.db2.gz AYZYIXVBBIJQOT-GHMZBOCLSA-N 0 3 335.429 2.672 20 5 EFBDHN CC1(C)COC[C@@H]1NCCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000451815314 251698594 /nfs/dbraw/zinc/69/85/94/251698594.db2.gz WCPWCCIONQTWLH-HNNXBMFYSA-N 0 3 331.372 2.807 20 5 EFBDHN C[C@H](CCc1ccccc1[N+](=O)[O-])N[C@H]1C[C@H]2CCCCN2C1=O ZINC000453452444 252040225 /nfs/dbraw/zinc/04/02/25/252040225.db2.gz SGXWNFHEOIVZDG-BMFZPTHFSA-N 0 3 331.416 2.659 20 5 EFBDHN Cc1cccc(OC[C@@H](O)CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000268853583 252301940 /nfs/dbraw/zinc/30/19/40/252301940.db2.gz QIBKITBDHMNJSG-YOEHRIQHSA-N 0 3 330.384 2.994 20 5 EFBDHN C[C@@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)c1cccc([N+](=O)[O-])c1 ZINC000180426064 207776382 /nfs/dbraw/zinc/77/63/82/207776382.db2.gz KJUQWLHOMLAVRD-BDJLRTHQSA-N 0 3 331.328 2.887 20 5 EFBDHN O=[N+]([O-])c1c(N2CCC[C@H]2CN2CCCCC2)nc2sccn21 ZINC000160447114 285077794 /nfs/dbraw/zinc/07/77/94/285077794.db2.gz WVPXJIANIZOPKW-LBPRGKRZSA-N 0 3 335.433 2.759 20 5 EFBDHN COc1cc(OC)cc([C@@H](O)CN[C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000131057314 533084525 /nfs/dbraw/zinc/08/45/25/533084525.db2.gz VFSAHLYBZYYSCW-XIKOKIGWSA-N 0 3 346.383 2.996 20 5 EFBDHN C[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)[C@@H](c1ccccc1)N(C)C ZINC000187222230 533094344 /nfs/dbraw/zinc/09/43/44/533094344.db2.gz DZSUFKHDJRWQMB-KUHUBIRLSA-N 0 3 341.411 2.945 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CNC[C@H]1CN(CC(C)C)CCO1 ZINC000468650442 256017949 /nfs/dbraw/zinc/01/79/49/256017949.db2.gz HFHHBGKEWBBMSE-HVRVZBDQSA-N 0 3 347.459 2.945 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN[C@H]1CC(=O)N(C(C)(C)C)C1 ZINC000468746277 256018366 /nfs/dbraw/zinc/01/83/66/256018366.db2.gz FZUTVWHCBRWHQD-NRUITVPNSA-N 0 3 331.416 2.987 20 5 EFBDHN C[C@@H]1CC[C@@H](NCC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)[C@H](C)C1 ZINC000119247286 221276219 /nfs/dbraw/zinc/27/62/19/221276219.db2.gz DBVDDQMJXQPIEP-IJLUTSLNSA-N 0 3 349.387 2.676 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000119408725 221313482 /nfs/dbraw/zinc/31/34/82/221313482.db2.gz AEZNMILWYGSKCZ-WBVHZDCISA-N 0 3 331.416 2.613 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CNC[C@H]1CCCCS1(=O)=O ZINC000344827229 533385174 /nfs/dbraw/zinc/38/51/74/533385174.db2.gz ZDYKKAFTYDVTHO-RCBBPTIPSA-N 0 3 338.429 2.555 20 5 EFBDHN COc1c(CN[C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)c(C)nn1C ZINC000162386748 141370387 /nfs/dbraw/zinc/37/03/87/141370387.db2.gz ONUJLTYKGJOJOT-MRXNPFEDSA-N 0 3 344.415 2.756 20 5 EFBDHN CN1CCCC(C)(C)[C@@H]1CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000344651232 142055816 /nfs/dbraw/zinc/05/58/16/142055816.db2.gz ZGSQIMCUXQKUHG-INIZCTEOSA-N 0 3 344.415 2.926 20 5 EFBDHN Cc1c(C(=O)N2CCN([C@@H]3C[C@H]3C)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000346136841 142153157 /nfs/dbraw/zinc/15/31/57/142153157.db2.gz LRTYMUBYZNJCBH-PBFPGSCMSA-N 0 3 331.416 2.706 20 5 EFBDHN C[C@@H]1C[C@H]1N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)C[C@@H](C)C1 ZINC000346187831 142164181 /nfs/dbraw/zinc/16/41/81/142164181.db2.gz OISSCBWYDDTKEQ-HWWQOWPSSA-N 0 3 335.379 2.536 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCN([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000346190452 142164704 /nfs/dbraw/zinc/16/47/04/142164704.db2.gz PAKZUDUFGMJTAG-DXCKQFNASA-N 0 3 331.416 2.706 20 5 EFBDHN CCN(CCN1CCCCCC1)C(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000346345220 142192636 /nfs/dbraw/zinc/19/26/36/142192636.db2.gz HLWPNQOKQSHPKX-UHFFFAOYSA-N 0 3 349.431 2.942 20 5 EFBDHN CCN(CCN1CCCCCC1)C(=O)c1cccc([N+](=O)[O-])c1OC ZINC000346354144 142193681 /nfs/dbraw/zinc/19/36/81/142193681.db2.gz QWWNNLLTCVUJJC-UHFFFAOYSA-N 0 3 349.431 2.942 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000346459589 142208146 /nfs/dbraw/zinc/20/81/46/142208146.db2.gz IBTSBFNVSBVZPH-HNNXBMFYSA-N 0 3 346.431 2.773 20 5 EFBDHN CN(C)CCN(Cc1ccccc1)c1nc2sccn2c1[N+](=O)[O-] ZINC000347758523 142267789 /nfs/dbraw/zinc/26/77/89/142267789.db2.gz VUFVUOAKUOFZTP-UHFFFAOYSA-N 0 3 345.428 2.872 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCCN(C(C)C)C2)c1 ZINC000347934070 142295457 /nfs/dbraw/zinc/29/54/57/142295457.db2.gz BUVYATGLYUGEMU-LBPRGKRZSA-N 0 3 337.445 2.919 20 5 EFBDHN CC(C)N1CCC[C@@H](NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000347952906 142298780 /nfs/dbraw/zinc/29/87/80/142298780.db2.gz NNUHUOHNWKPSEW-GFCCVEGCSA-N 0 3 325.796 2.851 20 5 EFBDHN CC[C@H]1CCC[C@@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000349660568 142344213 /nfs/dbraw/zinc/34/42/13/142344213.db2.gz CNPXUGPNXDHHLF-UONOGXRCSA-N 0 3 340.445 2.927 20 5 EFBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCN(C)[C@@H](C)C1 ZINC000341205069 145012161 /nfs/dbraw/zinc/01/21/61/145012161.db2.gz QKRJYXHMLNRHEQ-GOEBONIOSA-N 0 3 348.447 2.998 20 5 EFBDHN CCCN(CCN1CCCC1)C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000342263964 145089913 /nfs/dbraw/zinc/08/99/13/145089913.db2.gz NBKOTOWYBLAPGO-UHFFFAOYSA-N 0 3 348.447 2.731 20 5 EFBDHN Cc1ccc([C@H](C)NCC2(CS(C)(=O)=O)CCC2)cc1[N+](=O)[O-] ZINC000342321059 145100180 /nfs/dbraw/zinc/10/01/80/145100180.db2.gz GNHSXGZAFZAJIN-ZDUSSCGKSA-N 0 3 340.445 2.769 20 5 EFBDHN C[C@@H]1[C@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CCCN1C ZINC000342361292 145108585 /nfs/dbraw/zinc/10/85/85/145108585.db2.gz SQMICFZXYADXBG-BXKDBHETSA-N 0 3 326.784 2.852 20 5 EFBDHN CCC[C@@H]1CN(c2c([N+](=O)[O-])ncn2C)CCN1Cc1ccccc1 ZINC000342788653 145193922 /nfs/dbraw/zinc/19/39/22/145193922.db2.gz PFGAWAJYPPZGJD-MRXNPFEDSA-N 0 3 343.431 2.819 20 5 EFBDHN CCCN(CCN1CCCCC1)C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000342801403 145196617 /nfs/dbraw/zinc/19/66/17/145196617.db2.gz CXOGGGITOJIVTJ-UHFFFAOYSA-N 0 3 333.432 2.862 20 5 EFBDHN CCCN1CCC[C@@H]1CNC(=O)c1c(OCC)cccc1[N+](=O)[O-] ZINC000343556278 145236998 /nfs/dbraw/zinc/23/69/98/145236998.db2.gz SAZLYFOORBDZNH-CYBMUJFWSA-N 0 3 335.404 2.598 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CN1CCC2(CCCC2)CC1 ZINC000343558107 145238041 /nfs/dbraw/zinc/23/80/41/145238041.db2.gz SHYPSNOWUJLZGV-OAHLLOKOSA-N 0 3 334.416 2.991 20 5 EFBDHN CS[C@@H]1CN(Cc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1N(C)C ZINC000343567079 145239934 /nfs/dbraw/zinc/23/99/34/145239934.db2.gz VPERCANMMKJSNE-UONOGXRCSA-N 0 3 329.853 2.726 20 5 EFBDHN C[C@H]1[C@@H](Nc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)CCCN1C ZINC000343610182 145252062 /nfs/dbraw/zinc/25/20/62/145252062.db2.gz STSKYMHKJUPXOF-BBRMVZONSA-N 0 3 346.431 2.725 20 5 EFBDHN CCCN1CCC[C@@H]1CNC(=O)c1cc(OCC)ccc1[N+](=O)[O-] ZINC000343638836 145258954 /nfs/dbraw/zinc/25/89/54/145258954.db2.gz ZZQLCTZYAXWIAI-CYBMUJFWSA-N 0 3 335.404 2.598 20 5 EFBDHN CN(CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)CCC(F)(F)F ZINC000343906085 145321134 /nfs/dbraw/zinc/32/11/34/145321134.db2.gz LFVKIMQKALSZGE-UHFFFAOYSA-N 0 3 347.293 2.777 20 5 EFBDHN Cc1ccc(NC(=O)CCN[C@H](C)c2cccc([N+](=O)[O-])c2)nc1 ZINC000343972110 145336335 /nfs/dbraw/zinc/33/63/35/145336335.db2.gz FWYLTYGFQNODJX-CYBMUJFWSA-N 0 3 328.372 2.978 20 5 EFBDHN CN(C)[C@@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1)c1ccccc1 ZINC000344189380 145388406 /nfs/dbraw/zinc/38/84/06/145388406.db2.gz MPBZOLLTUJFNEX-INIZCTEOSA-N 0 3 331.347 2.767 20 5 EFBDHN CCN1CCCC[C@@H]1C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000351630706 146163859 /nfs/dbraw/zinc/16/38/59/146163859.db2.gz QNSKJSAEGJMUPB-CQSZACIVSA-N 0 3 339.823 2.781 20 5 EFBDHN C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000351744751 146193386 /nfs/dbraw/zinc/19/33/86/146193386.db2.gz XCIHQYYXDXASGC-XHDPSFHLSA-N 0 3 336.367 2.824 20 5 EFBDHN C[C@@H]1CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCC1(F)F ZINC000352028844 146269645 /nfs/dbraw/zinc/26/96/45/146269645.db2.gz RXSZADYGBKQMJU-LLVKDONJSA-N 0 3 327.331 2.901 20 5 EFBDHN Cc1cc(N2CCN(C)[C@H](C)[C@@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000356790998 147336709 /nfs/dbraw/zinc/33/67/09/147336709.db2.gz IVAKKADADCVELJ-KGLIPLIRSA-N 0 3 341.415 2.889 20 5 EFBDHN C[C@H](C(=O)N(C)CCc1ccccc1[N+](=O)[O-])N1CCCCCC1 ZINC000359145398 148007620 /nfs/dbraw/zinc/00/76/20/148007620.db2.gz UYEXPUYCGXWFDQ-OAHLLOKOSA-N 0 3 333.432 2.860 20 5 EFBDHN CCC(=O)c1ccc(NC[C@H](O)CN2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000359485087 148098108 /nfs/dbraw/zinc/09/81/08/148098108.db2.gz SDYIGMCKHOBHEZ-HNNXBMFYSA-N 0 3 349.431 2.692 20 5 EFBDHN CCC(=O)c1ccc(NC[C@@H](O)CN2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000359485090 148098246 /nfs/dbraw/zinc/09/82/46/148098246.db2.gz SDYIGMCKHOBHEZ-OAHLLOKOSA-N 0 3 349.431 2.692 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCCN[C@@H](CO)c2cccc(F)c2)cc1 ZINC000359620666 148142082 /nfs/dbraw/zinc/14/20/82/148142082.db2.gz ZFGZQYRZZSSDDC-KRWDZBQOSA-N 0 3 334.347 2.826 20 5 EFBDHN CO[C@@]1(CNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCOC1 ZINC000359654529 148152683 /nfs/dbraw/zinc/15/26/83/148152683.db2.gz SHUGZDTVHOUFDI-QGZVFWFLSA-N 0 3 332.356 2.750 20 5 EFBDHN O=C(c1ccc([N+](=O)[O-])[nH]1)N(CCN1CCCCCC1)C1CCC1 ZINC000359800508 148192597 /nfs/dbraw/zinc/19/25/97/148192597.db2.gz VSOFKBUQLZJSDJ-UHFFFAOYSA-N 0 3 334.420 2.794 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@H](CO)Cc1ccc(F)cc1 ZINC000359818372 148197216 /nfs/dbraw/zinc/19/72/16/148197216.db2.gz OGBRPDIKFJUVCH-INIZCTEOSA-N 0 3 348.374 2.826 20 5 EFBDHN C[C@@H]1[C@H](NC(=O)c2cccc([N+](=O)[O-])c2)CCN1Cc1ccccc1 ZINC000359832155 148201496 /nfs/dbraw/zinc/20/14/96/148201496.db2.gz LJGJLLKFSJBKIZ-RDTXWAMCSA-N 0 3 339.395 2.988 20 5 EFBDHN Cc1cc(N2CCC(OCCN(C)C)CC2)c(F)cc1[N+](=O)[O-] ZINC000360047094 148260488 /nfs/dbraw/zinc/26/04/88/148260488.db2.gz JOWZIQDQOWQWRY-UHFFFAOYSA-N 0 3 325.384 2.589 20 5 EFBDHN CS[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2Cl)C[C@H]1N(C)C ZINC000360200390 148297137 /nfs/dbraw/zinc/29/71/37/148297137.db2.gz RDEDECWGPAVTMM-ZIAGYGMSSA-N 0 3 329.853 2.726 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1CN1CC[C@H](N2CCN(C(C)C)CC2)C1 ZINC000363874107 149025348 /nfs/dbraw/zinc/02/53/48/149025348.db2.gz HAQPIFVNTWDZPZ-IBGZPJMESA-N 0 3 346.475 2.504 20 5 EFBDHN CCc1nn(C)c(N2CC[C@@H](N(C)Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000364901234 149270875 /nfs/dbraw/zinc/27/08/75/149270875.db2.gz RZCHTZMOSPBVPE-OAHLLOKOSA-N 0 3 343.431 2.601 20 5 EFBDHN O=[N+]([O-])c1ccn(C2CCN(Cc3ccc4c(c3)CCO4)CC2)n1 ZINC000365117567 149321521 /nfs/dbraw/zinc/32/15/21/149321521.db2.gz QICKRYPKOYHWID-UHFFFAOYSA-N 0 3 328.372 2.563 20 5 EFBDHN COC[C@@H]1CCCCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000368654801 150172737 /nfs/dbraw/zinc/17/27/37/150172737.db2.gz CPYDFHMMEQMDPG-CYBMUJFWSA-N 0 3 336.388 2.710 20 5 EFBDHN COC[C@@H]1CCCCN(Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1 ZINC000368659496 150174224 /nfs/dbraw/zinc/17/42/24/150174224.db2.gz OLJDWGSLXCTRRN-CYBMUJFWSA-N 0 3 338.404 2.861 20 5 EFBDHN CC1(C)CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H]1[C@@H]1CCCO1 ZINC000368694359 150184108 /nfs/dbraw/zinc/18/41/08/150184108.db2.gz YSYWFIPHKCMXEC-DOTOQJQBSA-N 0 3 347.415 2.813 20 5 EFBDHN Cc1c(CN2CC[C@@]3(C2)c2ccccc2NC3=O)cccc1[N+](=O)[O-] ZINC000368712560 150188402 /nfs/dbraw/zinc/18/84/02/150188402.db2.gz OSBBUBNMPXSUJB-LJQANCHMSA-N 0 3 337.379 2.999 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CC[C@@H](Oc3ccccc3)C2)c1 ZINC000372730742 151053411 /nfs/dbraw/zinc/05/34/11/151053411.db2.gz ZRKRWRHGLQTACV-QZTJIDSGSA-N 0 3 328.368 2.782 20 5 EFBDHN CC(C)(C)OC(=O)CCCN1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000373295109 151147719 /nfs/dbraw/zinc/14/77/19/151147719.db2.gz UHNFVOMIICHAGE-UHFFFAOYSA-N 0 3 338.408 2.550 20 5 EFBDHN O=C(CCN1CCC(OCC2CC2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000374090701 151282304 /nfs/dbraw/zinc/28/23/04/151282304.db2.gz AJYQAJLYGFJQQC-UHFFFAOYSA-N 0 3 347.415 2.814 20 5 EFBDHN O=C(CCN1CCC(OCC2CC2)CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000374090190 151282318 /nfs/dbraw/zinc/28/23/18/151282318.db2.gz ATMAWIDPXHUMPN-UHFFFAOYSA-N 0 3 347.415 2.814 20 5 EFBDHN Cc1ccc(CN2CCC[C@@H]2C[C@@H](O)c2cnn(C)c2)cc1[N+](=O)[O-] ZINC000374256249 151310359 /nfs/dbraw/zinc/31/03/59/151310359.db2.gz NCLBMNPVWCGGTP-SJLPKXTDSA-N 0 3 344.415 2.725 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@H]2CC(=O)N3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC000374514822 151361143 /nfs/dbraw/zinc/36/11/43/151361143.db2.gz PYPHPFOGMWOFKY-AEGPPILISA-N 0 3 347.415 2.798 20 5 EFBDHN Cc1c([C@H](C)N[C@@H]2CCN(c3cnn(C)c3)C2)cccc1[N+](=O)[O-] ZINC000374574556 151373453 /nfs/dbraw/zinc/37/34/53/151373453.db2.gz IIZNSTZCLONDCJ-UONOGXRCSA-N 0 3 329.404 2.566 20 5 EFBDHN CO[C@@H]1CCCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000378629797 152131698 /nfs/dbraw/zinc/13/16/98/152131698.db2.gz DOHSJOCXHVXXJA-QGZVFWFLSA-N 0 3 344.415 2.996 20 5 EFBDHN Cc1c(CNC(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)cccc1[N+](=O)[O-] ZINC000408331329 152177526 /nfs/dbraw/zinc/17/75/26/152177526.db2.gz QQKAQEGZPVYLQG-NVXWUHKLSA-N 0 3 346.431 2.529 20 5 EFBDHN Cc1c(CNC(=O)N2CCC[C@H]3CN(C)CC[C@H]32)cccc1[N+](=O)[O-] ZINC000408331325 152177546 /nfs/dbraw/zinc/17/75/46/152177546.db2.gz QQKAQEGZPVYLQG-DOTOQJQBSA-N 0 3 346.431 2.529 20 5 EFBDHN C[C@H](NC(=O)N[C@H]1C[C@@H](C)N(C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000122156079 222025723 /nfs/dbraw/zinc/02/57/23/222025723.db2.gz PDVNJEULZIUHHN-DYEKYZERSA-N 0 3 332.404 2.580 20 5 EFBDHN C[C@@H](NCCN1CCc2ccccc2C1=O)c1ccc([N+](=O)[O-])cc1 ZINC000188682996 265147177 /nfs/dbraw/zinc/14/71/77/265147177.db2.gz VZGMCWSGMCVPCQ-CQSZACIVSA-N 0 3 339.395 2.944 20 5 EFBDHN COc1ccc(CN[C@@H](CO)Cc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000188990005 265166986 /nfs/dbraw/zinc/16/69/86/265166986.db2.gz WHZABSHFHXGSCN-MRXNPFEDSA-N 0 3 330.384 2.605 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@H](CO)Cc1ccc(C)cc1 ZINC000188974089 265167421 /nfs/dbraw/zinc/16/74/21/265167421.db2.gz HTEJWVYDMIUXGX-KRWDZBQOSA-N 0 3 344.411 2.995 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1CNCCN1CCc2ccccc2C1=O ZINC000189035479 265168477 /nfs/dbraw/zinc/16/84/77/265168477.db2.gz SUCKQSVYYQWAHA-UHFFFAOYSA-N 0 3 339.395 2.691 20 5 EFBDHN COC(=O)[C@@](C)(CNCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000191581914 265270127 /nfs/dbraw/zinc/27/01/27/265270127.db2.gz BJEQUIQMKOIDTQ-SFHVURJKSA-N 0 3 328.368 2.815 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)Nc1ccn(CCN(C)C)n1 ZINC000191673287 265273284 /nfs/dbraw/zinc/27/32/84/265273284.db2.gz UHLZKOMPPGPBJO-UHFFFAOYSA-N 0 3 346.391 2.614 20 5 EFBDHN COc1cc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1C ZINC000193983912 265355389 /nfs/dbraw/zinc/35/53/89/265355389.db2.gz UIXDQOIDJMJQNA-OAHLLOKOSA-N 0 3 342.399 2.993 20 5 EFBDHN CCCc1[nH]nc(C(=O)Nc2cc(C)cc(CN(C)C)c2)c1[N+](=O)[O-] ZINC000270381918 265699863 /nfs/dbraw/zinc/69/98/63/265699863.db2.gz NZFIFDGJFZLDJG-UHFFFAOYSA-N 0 3 345.403 2.893 20 5 EFBDHN COc1ccc(OCCN[C@H](CCO)c2ccccc2)c([N+](=O)[O-])c1 ZINC000271695376 266044055 /nfs/dbraw/zinc/04/40/55/266044055.db2.gz RRPVEKNPCBQCOX-MRXNPFEDSA-N 0 3 346.383 2.696 20 5 EFBDHN CN(C)CCN(Cc1ccco1)C(=O)/C=C/c1ccccc1[N+](=O)[O-] ZINC000088250626 272994819 /nfs/dbraw/zinc/99/48/19/272994819.db2.gz MDZNXJFOXBDHRT-MDZDMXLPSA-N 0 3 343.383 2.791 20 5 EFBDHN CO[C@@H]1[C@H](C)[C@H](NCc2cc([N+](=O)[O-])cc3c2OCOC3)C1(C)C ZINC000271979645 266113152 /nfs/dbraw/zinc/11/31/52/266113152.db2.gz JCUVSGVBBZPDPF-HPEXNQPKSA-N 0 3 336.388 2.610 20 5 EFBDHN CN1CC[C@H]2CCN(c3ccc([N+](=O)[O-])c(OC(F)F)c3)[C@@H]2C1 ZINC000272258849 266206590 /nfs/dbraw/zinc/20/65/90/266206590.db2.gz ZUYLTJIGWKKGEQ-GXFFZTMASA-N 0 3 327.331 2.727 20 5 EFBDHN CCC[N@H+](CC)CC[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272289690 266216906 /nfs/dbraw/zinc/21/69/06/266216906.db2.gz FLQKQMLUWWJART-UHFFFAOYSA-N 0 3 329.347 2.535 20 5 EFBDHN CCC[N@@H+](CC)CC[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272289690 266216909 /nfs/dbraw/zinc/21/69/09/266216909.db2.gz FLQKQMLUWWJART-UHFFFAOYSA-N 0 3 329.347 2.535 20 5 EFBDHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)[C@H]2C1 ZINC000272372104 266244042 /nfs/dbraw/zinc/24/40/42/266244042.db2.gz GQYPJPQBYQHFRY-YGRLFVJLSA-N 0 3 338.795 2.806 20 5 EFBDHN COC1(C)CCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000272407103 266256269 /nfs/dbraw/zinc/25/62/69/266256269.db2.gz YGZFZWSJXVTEDY-UHFFFAOYSA-N 0 3 344.415 2.996 20 5 EFBDHN COc1cc(CN[C@@H]2CCSC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000272492405 266281918 /nfs/dbraw/zinc/28/19/18/266281918.db2.gz UOWRUGPBRKVBHB-SNVBAGLBSA-N 0 3 348.371 2.842 20 5 EFBDHN C[C@@H](NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)C1=CCN(C)CC1 ZINC000272724895 266365241 /nfs/dbraw/zinc/36/52/41/266365241.db2.gz JQVSEYZPDWXTLL-OLZOCXBDSA-N 0 3 332.404 2.605 20 5 EFBDHN CN(C)C[C@H]1CCCCN1C(=O)/C=C/c1ccc(F)cc1[N+](=O)[O-] ZINC000104413480 273003107 /nfs/dbraw/zinc/00/31/07/273003107.db2.gz HOVOWWZOTQQWFK-LOWQCSRCSA-N 0 3 335.379 2.690 20 5 EFBDHN CS[C@@H]1CN(c2ccc(F)cc2[N+](=O)[O-])C[C@@H]1N1CCCC1 ZINC000274677932 266689997 /nfs/dbraw/zinc/68/99/97/266689997.db2.gz MZZDNNIABVWOKX-LSDHHAIUSA-N 0 3 325.409 2.750 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CCCN(C)C1 ZINC000108329810 273009242 /nfs/dbraw/zinc/00/92/42/273009242.db2.gz XXFDMQBVUKWRDC-OLZOCXBDSA-N 0 3 337.445 2.533 20 5 EFBDHN CCOc1cc(CN2CCC[C@H](c3n[nH]c(C)n3)C2)ccc1[N+](=O)[O-] ZINC000276948772 267083544 /nfs/dbraw/zinc/08/35/44/267083544.db2.gz TYDHMNSVDJPCPU-AWEZNQCLSA-N 0 3 345.403 2.800 20 5 EFBDHN CCOc1cc(CN2CCC[C@H](c3nc(C)n[nH]3)C2)ccc1[N+](=O)[O-] ZINC000276948772 267083545 /nfs/dbraw/zinc/08/35/45/267083545.db2.gz TYDHMNSVDJPCPU-AWEZNQCLSA-N 0 3 345.403 2.800 20 5 EFBDHN CCOc1cc(CN2CCC[C@H](c3nnc(C)[nH]3)C2)ccc1[N+](=O)[O-] ZINC000276948772 267083547 /nfs/dbraw/zinc/08/35/47/267083547.db2.gz TYDHMNSVDJPCPU-AWEZNQCLSA-N 0 3 345.403 2.800 20 5 EFBDHN CCO[C@@H]1C[C@H](NCc2ccc(C(N)=O)cc2[N+](=O)[O-])C1(CC)CC ZINC000187042327 273051700 /nfs/dbraw/zinc/05/17/00/273051700.db2.gz XGSANIMJTKYWJF-JKSUJKDBSA-N 0 3 349.431 2.767 20 5 EFBDHN O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCN1C1CCCC1 ZINC000269739772 273089776 /nfs/dbraw/zinc/08/97/76/273089776.db2.gz WRJSYXXOSYPRIL-KRWDZBQOSA-N 0 3 331.416 2.661 20 5 EFBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCC1(N(C)C)CCC1 ZINC000275585718 273137565 /nfs/dbraw/zinc/13/75/65/273137565.db2.gz FHNKNNJXHFBHPV-UHFFFAOYSA-N 0 3 348.447 2.999 20 5 EFBDHN COc1cc(CNC[C@H]2CCCCN2C2CC2)c([N+](=O)[O-])cc1OC ZINC000277505862 273158864 /nfs/dbraw/zinc/15/88/64/273158864.db2.gz QDRJMBWXSPXFJS-OAHLLOKOSA-N 0 3 349.431 2.719 20 5 EFBDHN COCCN1CC[C@H](N[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000279079940 273174427 /nfs/dbraw/zinc/17/44/27/273174427.db2.gz MMMNNNDJBZFPKX-GUYCJALGSA-N 0 3 333.432 2.628 20 5 EFBDHN CC1(C)C[C@H](N[C@H]2CC(=O)N(C3CC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000279126097 273179507 /nfs/dbraw/zinc/17/95/07/273179507.db2.gz QPXKKKWPHSZZFB-ZBEGNZNMSA-N 0 3 329.400 2.670 20 5 EFBDHN CC1(C)C[C@@H](N[C@H]2CC(=O)N(C3CC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000279126096 273179598 /nfs/dbraw/zinc/17/95/98/273179598.db2.gz QPXKKKWPHSZZFB-MEDUHNTESA-N 0 3 329.400 2.670 20 5 EFBDHN CC(C)[C@@H](C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N(C)C ZINC000279357674 273206353 /nfs/dbraw/zinc/20/63/53/273206353.db2.gz UYOQEXWCIOCYBY-ZDUSSCGKSA-N 0 3 347.337 2.816 20 5 EFBDHN CC1(C)CCN(C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCS1 ZINC000279813998 273256414 /nfs/dbraw/zinc/25/64/14/273256414.db2.gz XYONOGXXTCLFQS-AWEZNQCLSA-N 0 3 340.445 2.552 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CNC[C@H](CO)[C@H]3CCOC3)o2)cc1 ZINC000280290975 273311995 /nfs/dbraw/zinc/31/19/95/273311995.db2.gz MQVBGOUOSKAQAV-LSDHHAIUSA-N 0 3 346.383 2.589 20 5 EFBDHN CCOc1ccc([C@@H](C)NCC2([S@](C)=O)CCC2)cc1[N+](=O)[O-] ZINC000280884553 273377547 /nfs/dbraw/zinc/37/75/47/273377547.db2.gz BDHTVOAEHOVVKL-SPSFWMDKSA-N 0 3 340.445 2.945 20 5 EFBDHN COC[C@H](CO)N[C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000280935533 273383100 /nfs/dbraw/zinc/38/31/00/273383100.db2.gz IMBIKNBBUHFASJ-NEPJUHHUSA-N 0 3 336.413 2.981 20 5 EFBDHN C[S@@](=O)C1(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000282336743 273547694 /nfs/dbraw/zinc/54/76/94/273547694.db2.gz LVKWZNDVBZKYTA-HSZRJFAPSA-N 0 3 334.397 2.856 20 5 EFBDHN CCC(CC)(CCO)NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000282506445 273572757 /nfs/dbraw/zinc/57/27/57/273572757.db2.gz RKNBLYCBKQJYBY-UHFFFAOYSA-N 0 3 343.811 2.718 20 5 EFBDHN CN(C)C[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)c1ccc(Cl)cc1 ZINC000282851086 273629159 /nfs/dbraw/zinc/62/91/59/273629159.db2.gz LOUSEIQWKSXHRK-LBPRGKRZSA-N 0 3 337.763 2.874 20 5 EFBDHN CN(C)C[C@@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)c1ccc(Cl)cc1 ZINC000282942492 273642897 /nfs/dbraw/zinc/64/28/97/273642897.db2.gz MRQVGFYPCKVZBY-CYBMUJFWSA-N 0 3 336.779 2.609 20 5 EFBDHN COc1ccc([C@@H](O)CN[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000284018921 273787102 /nfs/dbraw/zinc/78/71/02/273787102.db2.gz IRNDSBIDWOHZHV-DIFFPNOSSA-N 0 3 331.372 2.570 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@H]2CCCC23CCOCC3)c([N+](=O)[O-])c1 ZINC000284905248 273905036 /nfs/dbraw/zinc/90/50/36/273905036.db2.gz UYYRZRBLTVIXGP-HNNXBMFYSA-N 0 3 335.360 2.942 20 5 EFBDHN C[C@H](N[C@@H]1CCN(c2ccccn2)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000284977863 273919761 /nfs/dbraw/zinc/91/97/61/273919761.db2.gz GAHZFDGZMVKSMJ-GXTWGEPZSA-N 0 3 327.388 2.502 20 5 EFBDHN C[C@@H](NC[C@@H]1COC2(CCCCC2)O1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000285054159 273933585 /nfs/dbraw/zinc/93/35/85/273933585.db2.gz IOICPUPBQJLQJC-TZMCWYRMSA-N 0 3 335.404 2.903 20 5 EFBDHN COCCCN(C)CCN[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433241445 274019425 /nfs/dbraw/zinc/01/94/25/274019425.db2.gz OVTYCRGKWADETJ-KRWDZBQOSA-N 0 3 335.448 2.875 20 5 EFBDHN CO[C@@H]([C@@H](C)N[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C)C1CC1 ZINC000414163015 274061959 /nfs/dbraw/zinc/06/19/59/274061959.db2.gz FLCZCBWDPNOMLL-HSMVNMDESA-N 0 3 335.404 2.633 20 5 EFBDHN Cc1c([C@@H](C)NCC2(S(C)(=O)=O)CCCC2)cccc1[N+](=O)[O-] ZINC000285793130 274076106 /nfs/dbraw/zinc/07/61/06/274076106.db2.gz VIUCWKSHCZPVRX-CYBMUJFWSA-N 0 3 340.445 2.911 20 5 EFBDHN CCOC[C@H](NCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C(C)C ZINC000286088467 274130980 /nfs/dbraw/zinc/13/09/80/274130980.db2.gz KMBAYQRNMPABOA-ZDUSSCGKSA-N 0 3 343.811 2.837 20 5 EFBDHN CCN1CCN(CCCNc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000286159278 274145032 /nfs/dbraw/zinc/14/50/32/274145032.db2.gz OQISYYZSEOUABA-UHFFFAOYSA-N 0 3 326.828 2.688 20 5 EFBDHN CCS[C@H]1CCC[C@H]1NCC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000286193463 274151192 /nfs/dbraw/zinc/15/11/92/274151192.db2.gz PSUUYOGNODAYRQ-ZBFHGGJFSA-N 0 3 349.456 2.748 20 5 EFBDHN CCOC[C@@H](NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C(C)C ZINC000286286502 274169884 /nfs/dbraw/zinc/16/98/84/274169884.db2.gz UXEFUBGHVCUIOW-CYBMUJFWSA-N 0 3 343.811 2.837 20 5 EFBDHN CCS[C@H]1CCC[C@H]1NCC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000286325445 274178642 /nfs/dbraw/zinc/17/86/42/274178642.db2.gz WWJAANXRPUQNOM-ZBFHGGJFSA-N 0 3 349.456 2.748 20 5 EFBDHN CCS[C@H]1CCC[C@@H]1NCC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000286325442 274178652 /nfs/dbraw/zinc/17/86/52/274178652.db2.gz WWJAANXRPUQNOM-HOCLYGCPSA-N 0 3 349.456 2.748 20 5 EFBDHN C[C@@H]1C[C@H](N2CCCC2)CN1c1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000286333976 274180306 /nfs/dbraw/zinc/18/03/06/274180306.db2.gz LQXJXZVTRRWWLF-OCCSQVGLSA-N 0 3 344.415 2.543 20 5 EFBDHN CS[C@H]1CN(c2cc(C)nc3ccc([N+](=O)[O-])cc32)C[C@@H]1N(C)C ZINC000340783292 274186436 /nfs/dbraw/zinc/18/64/36/274186436.db2.gz QWCMRAFGXJEUFG-IRXDYDNUSA-N 0 3 346.456 2.933 20 5 EFBDHN CCN1CCN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H](C)C1 ZINC000286480843 274210385 /nfs/dbraw/zinc/21/03/85/274210385.db2.gz LHESUIPTLCQJJH-AWEZNQCLSA-N 0 3 344.415 2.818 20 5 EFBDHN CC1CCN(CCNC(=O)N(C)CCc2ccccc2[N+](=O)[O-])CC1 ZINC000286592651 274232024 /nfs/dbraw/zinc/23/20/24/274232024.db2.gz KQFZJYXVXJUBJI-UHFFFAOYSA-N 0 3 348.447 2.511 20 5 EFBDHN C[C@@H]1CCC[C@H](C)N(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000357737930 274295720 /nfs/dbraw/zinc/29/57/20/274295720.db2.gz GCJZBWIWWSUBIM-KGLIPLIRSA-N 0 3 331.416 2.994 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)N1C[C@H](N2CCCC2)C[C@H]1C ZINC000286926260 274302320 /nfs/dbraw/zinc/30/23/20/274302320.db2.gz LDSZADVGJUBYOT-TZMCWYRMSA-N 0 3 348.403 2.694 20 5 EFBDHN O=[N+]([O-])c1cccc(F)c1NCc1ccccc1CN1CC[C@H](O)C1 ZINC000287094192 274340674 /nfs/dbraw/zinc/34/06/74/274340674.db2.gz YYEKEJQPEIONBQ-HNNXBMFYSA-N 0 3 345.374 2.913 20 5 EFBDHN C[C@H]1[C@H](N2CCCC2)CCN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000287296080 274387833 /nfs/dbraw/zinc/38/78/33/274387833.db2.gz UCJDSGULMVOXIL-SWLSCSKDSA-N 0 3 342.399 2.775 20 5 EFBDHN CCN1CCCC[C@@H]1CNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000110597174 276157995 /nfs/dbraw/zinc/15/79/95/276157995.db2.gz REZXKRFXJMAQSL-CYBMUJFWSA-N 0 3 332.404 2.766 20 5 EFBDHN CCN(CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)[C@@H](C)C(C)C ZINC000120239110 276314488 /nfs/dbraw/zinc/31/44/88/276314488.db2.gz WCSKASNQMXPLFO-NSHDSACASA-N 0 3 337.376 2.628 20 5 EFBDHN CN(C)[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000003444730 276776219 /nfs/dbraw/zinc/77/62/19/276776219.db2.gz UZYWUDBJEZPKHL-KRWDZBQOSA-N 0 3 327.384 2.556 20 5 EFBDHN CN1CCC2(CCCN2C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CC1 ZINC000408071411 276890980 /nfs/dbraw/zinc/89/09/80/276890980.db2.gz KRJOIMDHUJUFMA-UHFFFAOYSA-N 0 3 342.399 2.777 20 5 EFBDHN CC(C)c1ccc(CN2[C@@H]3CC[C@H]2CN(C)C(=O)C3)cc1[N+](=O)[O-] ZINC000449651329 278037034 /nfs/dbraw/zinc/03/70/34/278037034.db2.gz VUQNCVNHCLTCIK-CABCVRRESA-N 0 3 331.416 2.913 20 5 EFBDHN CC(C)c1ccc(CN[C@H]2CC(=O)N3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC000337845146 278037303 /nfs/dbraw/zinc/03/73/03/278037303.db2.gz HLUUYQBKRZSFTE-JKSUJKDBSA-N 0 3 331.416 2.961 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1CN1CCCC1 ZINC000421754214 278665738 /nfs/dbraw/zinc/66/57/38/278665738.db2.gz AXXSUSHFNFNBJP-OAHLLOKOSA-N 0 3 331.416 2.912 20 5 EFBDHN CCN(CCNC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000338444920 279204319 /nfs/dbraw/zinc/20/43/19/279204319.db2.gz BUVXPGCQDFRFPY-LBPRGKRZSA-N 0 3 337.445 2.676 20 5 EFBDHN C[C@H](CN1CCCCC1)NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000027740269 279301427 /nfs/dbraw/zinc/30/14/27/279301427.db2.gz DZPNCURSTVSIHX-CYBMUJFWSA-N 0 3 337.445 2.678 20 5 EFBDHN CCOc1cccc([C@H](C)NCCn2cc([N+](=O)[O-])ccc2=O)c1 ZINC000180672265 279974511 /nfs/dbraw/zinc/97/45/11/279974511.db2.gz MXMPNSHXLRQFNP-ZDUSSCGKSA-N 0 3 331.372 2.506 20 5 EFBDHN Cc1ccccc1[C@H]([C@H](C)NC(=O)c1cc([N+](=O)[O-])c[nH]1)N(C)C ZINC000354379659 281388999 /nfs/dbraw/zinc/38/89/99/281388999.db2.gz BVXLRQXJTYRZHN-LRDDRELGSA-N 0 3 330.388 2.653 20 5 EFBDHN COc1cc(CN[C@H]2C[C@@](C)(OC)C2(C)C)c([N+](=O)[O-])cc1OC ZINC000072926671 292721450 /nfs/dbraw/zinc/72/14/50/292721450.db2.gz XJPFOQMZXRQHFZ-DOTOQJQBSA-N 0 3 338.404 2.905 20 5 EFBDHN CN1CCC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000367358364 289904615 /nfs/dbraw/zinc/90/46/15/289904615.db2.gz JVKAEFIWYHTTTI-UHFFFAOYSA-N 0 3 337.807 2.949 20 5 EFBDHN C[C@H](N[C@@H]1CCC[C@H]1OC(F)F)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000348521500 290012962 /nfs/dbraw/zinc/01/29/62/290012962.db2.gz QIIXKFLQXCINPG-UFGOTCBOSA-N 0 3 343.330 2.672 20 5 EFBDHN O=C(N[C@H]1CCN(CC2CCCC2)C1)c1ccc(F)cc1[N+](=O)[O-] ZINC000133561098 293261358 /nfs/dbraw/zinc/26/13/58/293261358.db2.gz IXGRPIAWMZYUCG-AWEZNQCLSA-N 0 3 335.379 2.728 20 5 EFBDHN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000289908197 293943568 /nfs/dbraw/zinc/94/35/68/293943568.db2.gz UVYCDVWHQIQWQM-OAHLLOKOSA-N 0 3 330.388 2.635 20 5 EFBDHN CN(CCN(C)C1CC1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000290372078 294069378 /nfs/dbraw/zinc/06/93/78/294069378.db2.gz HMNWEHFIUOBHGL-UHFFFAOYSA-N 0 3 329.347 2.722 20 5 EFBDHN O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])C12CCCN1CCC2 ZINC000290514123 294107737 /nfs/dbraw/zinc/10/77/37/294107737.db2.gz TYIYBXNGVZJTCD-UHFFFAOYSA-N 0 3 337.807 2.535 20 5 EFBDHN O=C([C@@H]1CCN(C/C=C/c2ccccc2[N+](=O)[O-])C1)N1CCCC1 ZINC000290557505 294119735 /nfs/dbraw/zinc/11/97/35/294119735.db2.gz SCNIJEPIRZNGCQ-BIENSFFJSA-N 0 3 329.400 2.552 20 5 EFBDHN COCC[C@](C)(O)CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000290893545 294213780 /nfs/dbraw/zinc/21/37/80/294213780.db2.gz NEDOQJYBUZKEBS-ZDUSSCGKSA-N 0 3 337.203 2.779 20 5 EFBDHN COC(=O)c1cc(CN(C)CCc2cccc([N+](=O)[O-])c2)n(C)c1C ZINC000291002708 294243375 /nfs/dbraw/zinc/24/33/75/294243375.db2.gz CIWAIGDBHSQEGV-UHFFFAOYSA-N 0 3 345.399 2.703 20 5 EFBDHN C[C@@H]1OCC[C@]1(O)CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291702593 294457913 /nfs/dbraw/zinc/45/79/13/294457913.db2.gz ZDSHABRSZYKDAY-SDBXPKJASA-N 0 3 335.187 2.531 20 5 EFBDHN Cc1cc(N2CCN(CC3CCOCC3)CC2)c(F)cc1[N+](=O)[O-] ZINC000292605377 294734474 /nfs/dbraw/zinc/73/44/74/294734474.db2.gz MQFZSXDKLMCSND-UHFFFAOYSA-N 0 3 337.395 2.591 20 5 EFBDHN COc1cc(CNC[C@]2(O)CCCC2(C)C)c([N+](=O)[O-])cc1OC ZINC000292986415 294845039 /nfs/dbraw/zinc/84/50/39/294845039.db2.gz NPCWABQMJWKAGZ-QGZVFWFLSA-N 0 3 338.404 2.643 20 5 EFBDHN CN(C)[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000293359065 294951066 /nfs/dbraw/zinc/95/10/66/294951066.db2.gz ZUDQYDWRZBPXEN-LLVKDONJSA-N 0 3 345.321 2.780 20 5 EFBDHN Cc1cc(C(=O)N2CCN(C3CCC3)C[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000293580237 295004167 /nfs/dbraw/zinc/00/41/67/295004167.db2.gz BADGBORQOQXQCL-CYBMUJFWSA-N 0 3 331.416 2.850 20 5 EFBDHN Cc1cccc(C(=O)N2CCN(C3CCC3)C[C@@H](C)C2)c1[N+](=O)[O-] ZINC000293699324 295030394 /nfs/dbraw/zinc/03/03/94/295030394.db2.gz NEPSGCCNPUNFBA-CYBMUJFWSA-N 0 3 331.416 2.850 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCN(C2CCC2)C[C@@H](C)C1 ZINC000293710047 295033358 /nfs/dbraw/zinc/03/33/58/295033358.db2.gz OFYHAUWQXYILRH-CYBMUJFWSA-N 0 3 331.416 2.850 20 5 EFBDHN C[C@@H](NCCCN(C)CC(F)(F)F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000293870520 295067909 /nfs/dbraw/zinc/06/79/09/295067909.db2.gz UXIUOROJLUBIOE-SNVBAGLBSA-N 0 3 334.342 2.712 20 5 EFBDHN CSc1ccc([C@H](CNc2c([N+](=O)[O-])ncn2C)N(C)C)cc1 ZINC000294161383 295120525 /nfs/dbraw/zinc/12/05/25/295120525.db2.gz RMSFSQZVVSKGCE-ZDUSSCGKSA-N 0 3 335.433 2.765 20 5 EFBDHN CN1CCC[C@]2(CCN(C(=O)c3cccc(Cl)c3[N+](=O)[O-])C2)C1 ZINC000294332627 295148939 /nfs/dbraw/zinc/14/89/39/295148939.db2.gz XQAFVPZZBZZTOS-INIZCTEOSA-N 0 3 337.807 2.806 20 5 EFBDHN CSc1ccc([C@H](CNC(=O)c2ccc([N+](=O)[O-])[nH]2)N(C)C)cc1 ZINC000294481613 295174194 /nfs/dbraw/zinc/17/41/94/295174194.db2.gz QHJYHAVSMQPNQL-AWEZNQCLSA-N 0 3 348.428 2.678 20 5 EFBDHN C[C@H](CN1CCCCC1)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000294599365 295192218 /nfs/dbraw/zinc/19/22/18/295192218.db2.gz UYFCFPYQSSIEGW-CQSZACIVSA-N 0 3 347.415 2.548 20 5 EFBDHN CC[S@](=O)[C@@H]1CCC[C@H](N[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)C1 ZINC000294638205 295198602 /nfs/dbraw/zinc/19/86/02/295198602.db2.gz GEUSDRFPHVRNQR-UGNUEGEHSA-N 0 3 339.461 2.907 20 5 EFBDHN Cc1cc(Cl)c(C(=O)N(C)CC2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000294764179 295223234 /nfs/dbraw/zinc/22/32/34/295223234.db2.gz BIFJGMKQAHZDPC-UHFFFAOYSA-N 0 3 339.823 2.970 20 5 EFBDHN Cc1cc(Cl)c(C(=O)NC[C@H](C)N(C)C2CC2)cc1[N+](=O)[O-] ZINC000294816228 295232407 /nfs/dbraw/zinc/23/24/07/295232407.db2.gz GJTZDJPVMIYEIP-JTQLQIEISA-N 0 3 325.796 2.769 20 5 EFBDHN C[C@H](NC[C@@]1(O)CCc2ccccc21)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294826140 295233623 /nfs/dbraw/zinc/23/36/23/295233623.db2.gz QSAJNGGCMGORJB-SGTLLEGYSA-N 0 3 327.384 2.662 20 5 EFBDHN CCn1cc([C@@H](C)N[C@H](C)CC(=O)Nc2cccc([N+](=O)[O-])c2)cn1 ZINC000294870356 295239012 /nfs/dbraw/zinc/23/90/12/295239012.db2.gz PEYWDIZMMQMMQV-CHWSQXEVSA-N 0 3 345.403 2.879 20 5 EFBDHN CCn1cc([C@@H](C)N[C@@H](C)CC(=O)Nc2cccc([N+](=O)[O-])c2)cn1 ZINC000294870365 295239087 /nfs/dbraw/zinc/23/90/87/295239087.db2.gz PEYWDIZMMQMMQV-QWHCGFSZSA-N 0 3 345.403 2.879 20 5 EFBDHN C[C@@H]1CN(c2cc(C(F)(F)F)ncc2[N+](=O)[O-])CCN(C2CC2)C1 ZINC000294987962 295254511 /nfs/dbraw/zinc/25/45/11/295254511.db2.gz QFGOMBTWJYJLBW-JTQLQIEISA-N 0 3 344.337 2.929 20 5 EFBDHN Cc1cc(Cl)c(C(=O)NC2CCN(C3CC3)CC2)cc1[N+](=O)[O-] ZINC000294999698 295255884 /nfs/dbraw/zinc/25/58/84/295255884.db2.gz HRMRQYHLTLZMBX-UHFFFAOYSA-N 0 3 337.807 2.913 20 5 EFBDHN C[C@@H]1C[C@@H](NC(=O)CCC(C)(C)[N+](=O)[O-])CCN1Cc1ccccc1 ZINC000295010738 295257366 /nfs/dbraw/zinc/25/73/66/295257366.db2.gz CRTMIEORZWNWAC-WBVHZDCISA-N 0 3 347.459 2.991 20 5 EFBDHN COC[C@]1(C)CCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000295105671 295268951 /nfs/dbraw/zinc/26/89/51/295268951.db2.gz KXXYOBBLLDYMRG-GOSISDBHSA-N 0 3 344.415 2.854 20 5 EFBDHN Cc1cc(Cl)c(C(=O)N[C@H]2CN(C3CC3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000295136985 295273163 /nfs/dbraw/zinc/27/31/63/295273163.db2.gz OCUPNOZFXMRLOO-YGRLFVJLSA-N 0 3 337.807 2.769 20 5 EFBDHN CC(C)(C[C@@H]1CCCN(CCOc2cccc([N+](=O)[O-])c2)C1)C(N)=O ZINC000295412081 295315714 /nfs/dbraw/zinc/31/57/14/295315714.db2.gz BZCMMWQNTRLQDE-AWEZNQCLSA-N 0 3 349.431 2.587 20 5 EFBDHN C[C@H]1[C@@H](NC(=O)CCC(C)(C)[N+](=O)[O-])CCN1Cc1ccccc1 ZINC000295412765 295315999 /nfs/dbraw/zinc/31/59/99/295315999.db2.gz UMFHQMSLIOQXIW-HOCLYGCPSA-N 0 3 333.432 2.601 20 5 EFBDHN CC(C)(C[C@H]1CCCN(CCc2ccc([N+](=O)[O-])cc2)C1)C(N)=O ZINC000295518527 295334179 /nfs/dbraw/zinc/33/41/79/295334179.db2.gz IHWLIPFZRNSTEN-OAHLLOKOSA-N 0 3 333.432 2.751 20 5 EFBDHN C[C@@H]1[C@@H](CC(F)(F)F)C[C@H](C)N1CCn1cc([N+](=O)[O-])ccc1=O ZINC000295598241 295346655 /nfs/dbraw/zinc/34/66/55/295346655.db2.gz CCGLTMIXWRDMQY-QJPTWQEYSA-N 0 3 347.337 2.808 20 5 EFBDHN CN1CCC[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3Cl)C2)C1 ZINC000295647253 295354576 /nfs/dbraw/zinc/35/45/76/295354576.db2.gz RDGQYCWYIQWWGZ-MRXNPFEDSA-N 0 3 337.807 2.806 20 5 EFBDHN C[C@H]1[C@H](N2CCCC2)CCN1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000295762734 295372142 /nfs/dbraw/zinc/37/21/42/295372142.db2.gz PFKSWTXONFZDOJ-SMDDNHRTSA-N 0 3 337.807 2.947 20 5 EFBDHN CO[C@]1(C)C[C@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1(C)C ZINC000295821608 295381337 /nfs/dbraw/zinc/38/13/37/295381337.db2.gz BXMCCRJYDLXSQC-WMLDXEAASA-N 0 3 335.404 2.635 20 5 EFBDHN C[C@@H]1CN2CCC[C@H]2CN1C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000265993896 297097068 /nfs/dbraw/zinc/09/70/68/297097068.db2.gz MWEQJJMAXNUOIP-CJNGLKHVSA-N 0 3 331.416 2.568 20 5 EFBDHN Cc1cc(N2CC[C@H]3CCN(C)C[C@@H]32)c2cccc([N+](=O)[O-])c2n1 ZINC000378508160 301342573 /nfs/dbraw/zinc/34/25/73/301342573.db2.gz OWDSASWMSUMHJU-DYVFJYSZSA-N 0 3 326.400 2.982 20 5 EFBDHN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NCCN1CCCCCC1 ZINC000152149162 303654021 /nfs/dbraw/zinc/65/40/21/303654021.db2.gz NEAHKUGLYHPLMR-UHFFFAOYSA-N 0 3 344.415 2.611 20 5 EFBDHN O=[N+]([O-])c1ccc(CN2CCNC[C@H]2c2ccncc2)c(Cl)c1 ZINC000261949914 304802204 /nfs/dbraw/zinc/80/22/04/304802204.db2.gz FVMWHGAGHFQCGX-INIZCTEOSA-N 0 3 332.791 2.790 20 5 EFBDHN CN(C)CCN(C(=O)NCc1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000176912270 310774083 /nfs/dbraw/zinc/77/40/83/310774083.db2.gz GGZITGATDUAPAW-UHFFFAOYSA-N 0 3 334.420 2.611 20 5 EFBDHN COc1ccc2c(c1)ncc([N+](=O)[O-])c2N1CC[C@H](N2CC=CC2)C1 ZINC000297094352 310851747 /nfs/dbraw/zinc/85/17/47/310851747.db2.gz KTLLRYXNVZEWAY-ZDUSSCGKSA-N 0 3 340.383 2.602 20 5 EFBDHN CN(C)[C@@]1(CNc2nccc3cc([N+](=O)[O-])ccc32)CCSC1 ZINC000297576534 310910304 /nfs/dbraw/zinc/91/03/04/310910304.db2.gz SIDRHGKWHQXTDA-MRXNPFEDSA-N 0 3 332.429 2.992 20 5 EFBDHN O=C(NC1CCN(C2CC2)CC1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000298694967 311014995 /nfs/dbraw/zinc/01/49/95/311014995.db2.gz DXOKEAAJQOYHQI-UHFFFAOYSA-N 0 3 329.356 2.698 20 5 EFBDHN C[C@H](CN1CCCCC1)NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000298720322 311017354 /nfs/dbraw/zinc/01/73/54/311017354.db2.gz DFBURYVOUIFQDC-GFCCVEGCSA-N 0 3 331.372 2.945 20 5 EFBDHN CCN1CCC(Nc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)CC1 ZINC000298775514 311022530 /nfs/dbraw/zinc/02/25/30/311022530.db2.gz KQZAENHQBWSADG-UHFFFAOYSA-N 0 3 346.431 2.727 20 5 EFBDHN CCN1CCC[C@@H]1CNc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000298777118 311022843 /nfs/dbraw/zinc/02/28/43/311022843.db2.gz LUTBNNMQECOVJS-OAHLLOKOSA-N 0 3 346.431 2.727 20 5 EFBDHN O=C(NC[C@@H](c1cccs1)N1CCCC1)c1ccc([N+](=O)[O-])[nH]1 ZINC000298886812 311032063 /nfs/dbraw/zinc/03/20/63/311032063.db2.gz SFZRUYLMNULGEO-LBPRGKRZSA-N 0 3 334.401 2.551 20 5 EFBDHN O=C(NC[C@@H](c1cccs1)[NH+]1CCCC1)c1ccc([N+](=O)[O-])[n-]1 ZINC000298886812 311032065 /nfs/dbraw/zinc/03/20/65/311032065.db2.gz SFZRUYLMNULGEO-LBPRGKRZSA-N 0 3 334.401 2.551 20 5 EFBDHN C[C@H](NC(=O)N1CCN(C2CCCC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000298961920 311037809 /nfs/dbraw/zinc/03/78/09/311037809.db2.gz MWICIXXCYHDLRQ-AWEZNQCLSA-N 0 3 346.431 2.926 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)CN2C[C@H](C)C[C@H](C)C2)c1 ZINC000299235018 311064145 /nfs/dbraw/zinc/06/41/45/311064145.db2.gz ULZMMYUERSUDCY-MJBXVCDLSA-N 0 3 349.431 2.700 20 5 EFBDHN C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000299244234 311065021 /nfs/dbraw/zinc/06/50/21/311065021.db2.gz MCXJMPQONAQNKZ-OLZOCXBDSA-N 0 3 344.415 2.926 20 5 EFBDHN Cc1[nH]nc(C(=O)Nc2cccc(CN3CCCCC3)c2)c1[N+](=O)[O-] ZINC000299428513 311083888 /nfs/dbraw/zinc/08/38/88/311083888.db2.gz BJCFECIJRXMZAU-UHFFFAOYSA-N 0 3 343.387 2.865 20 5 EFBDHN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1CN1CCCC1 ZINC000299497064 311090731 /nfs/dbraw/zinc/09/07/31/311090731.db2.gz HEBNJUALWCIZQW-OAHLLOKOSA-N 0 3 349.456 2.774 20 5 EFBDHN CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H](c1cccs1)N(C)C ZINC000301125595 311120334 /nfs/dbraw/zinc/12/03/34/311120334.db2.gz VPGXRPOZGKJGLU-AWEZNQCLSA-N 0 3 348.428 2.731 20 5 EFBDHN CC(C)CN1CCN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000301643309 311149389 /nfs/dbraw/zinc/14/93/89/311149389.db2.gz OHLNKMVVFQFAKI-UHFFFAOYSA-N 0 3 329.347 2.974 20 5 EFBDHN C[C@H]1CCCN(CCNc2ncc(Br)cc2[N+](=O)[O-])C1 ZINC000301714238 311154184 /nfs/dbraw/zinc/15/41/84/311154184.db2.gz ZGFVKDSMVIJOOD-JTQLQIEISA-N 0 3 343.225 2.896 20 5 EFBDHN O=[N+]([O-])c1ccc(NC2CCN([C@H]3CCOC3)CC2)c2ccncc21 ZINC000301719984 311154606 /nfs/dbraw/zinc/15/46/06/311154606.db2.gz MDQNDYUOWDIAGT-AWEZNQCLSA-N 0 3 342.399 2.808 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1NC[C@H]1C[C@H](O)CN1Cc1ccccc1 ZINC000301892065 311165300 /nfs/dbraw/zinc/16/53/00/311165300.db2.gz VMKFXABGYINILE-SJORKVTESA-N 0 3 341.411 2.951 20 5 EFBDHN O=[N+]([O-])c1cc(F)ccc1NCc1ccccc1CN1CC[C@@H](O)C1 ZINC000302059315 311175226 /nfs/dbraw/zinc/17/52/26/311175226.db2.gz SCWFSKJBXXCUOV-MRXNPFEDSA-N 0 3 345.374 2.913 20 5 EFBDHN CCN1CCN(c2cccc(Nc3ccc([N+](=O)[O-])cn3)c2)CC1 ZINC000302258016 311187457 /nfs/dbraw/zinc/18/74/57/311187457.db2.gz OWIWHFPHJDSEOD-UHFFFAOYSA-N 0 3 327.388 2.875 20 5 EFBDHN CN(C[C@]1(O)CCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000302493999 311191407 /nfs/dbraw/zinc/19/14/07/311191407.db2.gz ZZSQOMSOGIXBIQ-LJQANCHMSA-N 0 3 341.411 2.668 20 5 EFBDHN Cc1cccc(NC[C@H]2C[C@H](O)CN2Cc2ccccc2)c1[N+](=O)[O-] ZINC000302494365 311191553 /nfs/dbraw/zinc/19/15/53/311191553.db2.gz LIEJVJRHJPDBSP-SJORKVTESA-N 0 3 341.411 2.951 20 5 EFBDHN COc1ccc(-c2ccc(CN3CCC[C@H](O)C3)o2)c([N+](=O)[O-])c1 ZINC000305737824 311224884 /nfs/dbraw/zinc/22/48/84/311224884.db2.gz VKJOMEDCWTVVFR-LBPRGKRZSA-N 0 3 332.356 2.820 20 5 EFBDHN Cc1c(CNC[C@@H](O)COc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000326233321 311243800 /nfs/dbraw/zinc/24/38/00/311243800.db2.gz VIKPGMZXPJPEIZ-OAHLLOKOSA-N 0 3 334.347 2.572 20 5 EFBDHN CC(C)c1ccc(CN2CCN(C[C@@H](C)O)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000330516297 311320369 /nfs/dbraw/zinc/32/03/69/311320369.db2.gz IFRSDUOOQGZECC-LSDHHAIUSA-N 0 3 335.448 2.605 20 5 EFBDHN CC(C)c1ccc(CN2CCN(C[C@H](C)O)C[C@H]2C)cc1[N+](=O)[O-] ZINC000330516294 311320382 /nfs/dbraw/zinc/32/03/82/311320382.db2.gz IFRSDUOOQGZECC-CABCVRRESA-N 0 3 335.448 2.605 20 5 EFBDHN CCN1C[C@@H](C)N(CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C[C@@H]1C ZINC000330581129 311322898 /nfs/dbraw/zinc/32/28/98/311322898.db2.gz QMSUFPOLBGHXCC-UONOGXRCSA-N 0 3 348.447 2.646 20 5 EFBDHN CCN1C[C@H](C)N(CCC(=O)Nc2cccc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000330802506 311335587 /nfs/dbraw/zinc/33/55/87/311335587.db2.gz AUUYQBIZJUHOHC-KBPBESRZSA-N 0 3 348.447 2.646 20 5 EFBDHN CCN1C[C@@H](C)N(CCC(=O)Nc2cccc([N+](=O)[O-])c2C)[C@H](C)C1 ZINC000330802508 311335808 /nfs/dbraw/zinc/33/58/08/311335808.db2.gz AUUYQBIZJUHOHC-ZIAGYGMSSA-N 0 3 348.447 2.646 20 5 EFBDHN CCN1CCC(N(C)C(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000330862946 311339677 /nfs/dbraw/zinc/33/96/77/311339677.db2.gz QQFNAEDKLCCCNT-LBPRGKRZSA-N 0 3 337.395 2.780 20 5 EFBDHN CCN1C[C@H](C)N(Cc2cc(OC)c(F)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000331312057 311366758 /nfs/dbraw/zinc/36/67/58/311366758.db2.gz CAMLROJUZFWJHN-RYUDHWBXSA-N 0 3 325.384 2.657 20 5 EFBDHN C[C@H](C(=O)N1C[C@@H](N2CCCC2)C[C@H]1C)c1ccc([N+](=O)[O-])cc1F ZINC000331874258 311429324 /nfs/dbraw/zinc/42/93/24/311429324.db2.gz BWPFCIYXUMUBHR-IPYPFGDCSA-N 0 3 349.406 2.923 20 5 EFBDHN CCN1CCC(N(C)C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CC1 ZINC000332232469 311475315 /nfs/dbraw/zinc/47/53/15/311475315.db2.gz FCSAOOFYOWXQLI-UHFFFAOYSA-N 0 3 330.388 2.632 20 5 EFBDHN CC(C)(C)O[C@@H]1C[C@H](NCc2ccc(C(N)=O)cc2[N+](=O)[O-])C1(C)C ZINC000412083655 311983138 /nfs/dbraw/zinc/98/31/38/311983138.db2.gz UCOHYDBEBDGJGG-LSDHHAIUSA-N 0 3 349.431 2.766 20 5 EFBDHN CC(C)c1[n-]nc(C(=O)Nc2ccc(C[NH+](C)C)cc2F)c1[N+](=O)[O-] ZINC000412560225 311991604 /nfs/dbraw/zinc/99/16/04/311991604.db2.gz PQRLSBVNXIGOON-UHFFFAOYSA-N 0 3 349.366 2.894 20 5 EFBDHN CC(C)N1C[C@H](N[C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1=O ZINC000417304161 312206135 /nfs/dbraw/zinc/20/61/35/312206135.db2.gz BMNSDUYNAWMRLC-RHSMWYFYSA-N 0 3 331.416 2.961 20 5 EFBDHN CC(C)N1C[C@@H](N[C@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1=O ZINC000417304163 312206291 /nfs/dbraw/zinc/20/62/91/312206291.db2.gz BMNSDUYNAWMRLC-YOEHRIQHSA-N 0 3 331.416 2.961 20 5 EFBDHN O=C1C[C@H](N[C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)CN1C1CC1 ZINC000417308737 312206967 /nfs/dbraw/zinc/20/69/67/312206967.db2.gz IEOPXKQGVFFFDE-SUMWQHHRSA-N 0 3 329.400 2.715 20 5 EFBDHN CNC(=O)[C@@H]1CCC[C@@H]1N[C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417309771 312207079 /nfs/dbraw/zinc/20/70/79/312207079.db2.gz KAPOYHLJOYUMAV-HYVNUMGLSA-N 0 3 331.416 2.867 20 5 EFBDHN Cc1nc2n(n1)C[C@H](N[C@H]1CCCCc3ccc([N+](=O)[O-])cc31)CC2 ZINC000417311997 312207156 /nfs/dbraw/zinc/20/71/56/312207156.db2.gz MYJNQDFTEREIOJ-PBHICJAKSA-N 0 3 341.415 2.867 20 5 EFBDHN CC(C)COC[C@H](O)CN[C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417335798 312210572 /nfs/dbraw/zinc/21/05/72/312210572.db2.gz GSIJSWLCDBEXKM-AEFFLSMTSA-N 0 3 336.432 2.985 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](NC[C@@H](O)COCC1CC1)CCCC2 ZINC000417345117 312211850 /nfs/dbraw/zinc/21/18/50/312211850.db2.gz TVFFPPRLGBRDLV-AEFFLSMTSA-N 0 3 334.416 2.739 20 5 EFBDHN CCS(=O)(=O)CCCN[C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417366224 312214643 /nfs/dbraw/zinc/21/46/43/312214643.db2.gz NETMMJGFISCGNX-MRXNPFEDSA-N 0 3 340.445 2.777 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N(C)C[C@@H]2CCCN2C)cc1[N+](=O)[O-] ZINC000420811173 312395171 /nfs/dbraw/zinc/39/51/71/312395171.db2.gz SUUTYXSCZURLRX-ZFWWWQNUSA-N 0 3 334.420 2.700 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@H]1NCCc2ccccc21 ZINC000423665781 312440577 /nfs/dbraw/zinc/44/05/77/312440577.db2.gz HPTZUYFTMHUDNM-QGZVFWFLSA-N 0 3 339.395 2.828 20 5 EFBDHN O=C([N-]c1nc(C2CC[NH2+]CC2)cs1)c1ccc([N+](=O)[O-])s1 ZINC000423974527 312492853 /nfs/dbraw/zinc/49/28/53/312492853.db2.gz AHNWCTHZIFAPML-UHFFFAOYSA-N 0 3 338.414 2.832 20 5 EFBDHN Cc1cc(C(=O)N2C[C@@H](c3cccc(F)c3)[C@H](N)C2)ccc1[N+](=O)[O-] ZINC000424015298 312496667 /nfs/dbraw/zinc/49/66/67/312496667.db2.gz YTDRCIRYFPCELW-JKSUJKDBSA-N 0 3 343.358 2.609 20 5 EFBDHN Cc1ccc(C(=O)N2C[C@@H](c3ccccc3F)[C@H](N)C2)cc1[N+](=O)[O-] ZINC000424042313 312501945 /nfs/dbraw/zinc/50/19/45/312501945.db2.gz WEWWFDGYJLWGKB-GOEBONIOSA-N 0 3 343.358 2.609 20 5 EFBDHN CCc1ccc(C(=O)N2C[C@H](N)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000424070555 312507088 /nfs/dbraw/zinc/50/70/88/312507088.db2.gz CQPIXTYJJODZHG-OAHLLOKOSA-N 0 3 325.368 2.687 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)CN1C[C@H](C)C[C@@H](C)C1 ZINC000426915782 312534919 /nfs/dbraw/zinc/53/49/19/312534919.db2.gz HIDSECLTVURSMD-MGPQQGTHSA-N 0 3 349.431 2.700 20 5 EFBDHN CN(C)CCc1ccccc1NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000438570045 312620167 /nfs/dbraw/zinc/62/01/67/312620167.db2.gz PRGMLNRAKGDEEE-UHFFFAOYSA-N 0 3 328.372 2.533 20 5 EFBDHN C[C@]1(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCC(=O)N1 ZINC000453582087 312912116 /nfs/dbraw/zinc/91/21/16/312912116.db2.gz AZRYVYZJTLBKNO-QGZVFWFLSA-N 0 3 329.356 2.613 20 5 EFBDHN CN(Cc1ccccc1)C1(CNC(=O)c2ccc([N+](=O)[O-])o2)CCC1 ZINC000456127021 313033139 /nfs/dbraw/zinc/03/31/39/313033139.db2.gz YIZBFWMPOJMKNK-UHFFFAOYSA-N 0 3 343.383 2.972 20 5 EFBDHN COc1ccc(-c2ccc(CN3C[C@@H](O)C[C@H]3C)o2)c([N+](=O)[O-])c1 ZINC000471809593 313162025 /nfs/dbraw/zinc/16/20/25/313162025.db2.gz IOCKMKCPEYJDQB-NEPJUHHUSA-N 0 3 332.356 2.819 20 5 EFBDHN C[C@@H](C1CCN(C)CC1)N(C)C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000479546786 313270588 /nfs/dbraw/zinc/27/05/88/313270588.db2.gz NMHWQFDCPOFLPP-LBPRGKRZSA-N 0 3 344.415 2.878 20 5 EFBDHN CCn1ccnc1[C@H]1OCC[C@@H]1NC/C=C\c1ccccc1[N+](=O)[O-] ZINC000486830709 313344790 /nfs/dbraw/zinc/34/47/90/313344790.db2.gz ZSNHXVJGPMBQHY-WETOOIFXSA-N 0 3 342.399 2.944 20 5 EFBDHN CSc1cccc(C(=O)N[C@@H]2CCCN(C(C)C)C2)c1[N+](=O)[O-] ZINC000487133654 313369686 /nfs/dbraw/zinc/36/96/86/313369686.db2.gz GQUMTWPFSXELNS-GFCCVEGCSA-N 0 3 337.445 2.919 20 5 EFBDHN CN(C)C[C@@H]1CCCCN1C(=O)/C=C\c1ccc(F)cc1[N+](=O)[O-] ZINC000491531661 313760591 /nfs/dbraw/zinc/76/05/91/313760591.db2.gz HOVOWWZOTQQWFK-VIHMKRCTSA-N 0 3 335.379 2.690 20 5 EFBDHN O=C(/C=C/c1ccc(F)cc1[N+](=O)[O-])N1CC[C@H](N2CCCCC2)C1 ZINC000491559891 313764275 /nfs/dbraw/zinc/76/42/75/313764275.db2.gz CAQSPLSOSKSSJB-YERXGYGTSA-N 0 3 347.390 2.834 20 5 EFBDHN C[C@@H]1C[C@H]1N1CCN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000492898933 314169720 /nfs/dbraw/zinc/16/97/20/314169720.db2.gz UXYUWWSOLULGQT-WPKACVTGSA-N 0 3 343.427 2.797 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N2CCN(C)CC[C@@H]2C)cc1[N+](=O)[O-] ZINC000492964003 314193988 /nfs/dbraw/zinc/19/39/88/314193988.db2.gz UZYVKOLVECRHQU-KBPBESRZSA-N 0 3 334.420 2.700 20 5 EFBDHN C[C@H]1CN(C(=O)/C=C\c2ccccc2[N+](=O)[O-])CCN(C2CC2)C1 ZINC000493170087 314264974 /nfs/dbraw/zinc/26/49/74/314264974.db2.gz HTLGTTVXBMJUSD-DEBLGDTFSA-N 0 3 329.400 2.551 20 5 EFBDHN CN(C[C@H]1CCCN1C)C(=O)/C=C\c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000493456710 314364016 /nfs/dbraw/zinc/36/40/16/314364016.db2.gz SPUOXTIGODHKBC-FWPCIQOSSA-N 0 3 337.807 2.814 20 5 EFBDHN C[C@H](N[C@]1(C)CCO[C@@H]1C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000494276822 314568807 /nfs/dbraw/zinc/56/88/07/314568807.db2.gz LUPNKTPNBRQBIH-FEUHOPSXSA-N 0 3 341.795 2.732 20 5 EFBDHN COC(=O)N1CCC[C@H]([C@H](C)NCc2csc([N+](=O)[O-])c2)C1 ZINC000495479603 314729231 /nfs/dbraw/zinc/72/92/31/314729231.db2.gz JAASHGRJLIHBOM-JQWIXIFHSA-N 0 3 327.406 2.613 20 5 EFBDHN COC(=O)N1CCC[C@H]([C@@H](C)NCc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000495480928 314729076 /nfs/dbraw/zinc/72/90/76/314729076.db2.gz ODOIYLNIHCAUIS-NEPJUHHUSA-N 0 3 339.367 2.690 20 5 EFBDHN CC(COC(=O)c1ccc(N(C)C(=O)OC(C)(C)C)s1)[N+](=O)[O-] ZINC000496454266 315071770 /nfs/dbraw/zinc/07/17/70/315071770.db2.gz MCXTVKSAYGURDI-VIFPVBQESA-N 0 3 344.389 2.941 20 5 EFBDHN CC(COC(=O)Cc1ccccc1NC(=O)OC(C)(C)C)[N+](=O)[O-] ZINC000496976239 315264192 /nfs/dbraw/zinc/26/41/92/315264192.db2.gz UZZKJEZLQSHTEN-NSHDSACASA-N 0 3 338.360 2.785 20 5 EFBDHN C[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CCCC1 ZINC000516716294 315698900 /nfs/dbraw/zinc/69/89/00/315698900.db2.gz JXEQAEWJOOXQEB-SNVBAGLBSA-N 0 3 326.784 2.854 20 5 EFBDHN CN(C)C[C@@H]1CCCCN1C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000517802428 315783261 /nfs/dbraw/zinc/78/32/61/315783261.db2.gz XUVUMAQKSFRVHB-KRWDZBQOSA-N 0 3 348.447 2.730 20 5 EFBDHN C[C@H]1CCN(CCNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000524719390 316167893 /nfs/dbraw/zinc/16/78/93/316167893.db2.gz KJTREENSOFQXPB-JTQLQIEISA-N 0 3 345.321 2.685 20 5 EFBDHN Cc1ccccc1[C@@H]([C@H](C)NC(=O)c1cc([N+](=O)[O-])cn1C)N(C)C ZINC000525959166 316263512 /nfs/dbraw/zinc/26/35/12/316263512.db2.gz SRQIPLZVXBMYJW-SUMWQHHRSA-N 0 3 344.415 2.663 20 5 EFBDHN CN(C)Cc1ccc(-c2noc(-c3cc([N+](=O)[O-])cn3C)n2)cc1 ZINC000531348826 317254513 /nfs/dbraw/zinc/25/45/13/317254513.db2.gz GTCIGOABVOTQRE-UHFFFAOYSA-N 0 3 327.344 2.712 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(N2CC[C@@H](N3CCN(C(C)C)CC3)C2)c1 ZINC000531836326 317321398 /nfs/dbraw/zinc/32/13/98/317321398.db2.gz SGMCAQHBFFGXNJ-MRXNPFEDSA-N 0 3 332.448 2.508 20 5 EFBDHN CC(C)Oc1ccccc1[C@@H](C)NCCn1cc([N+](=O)[O-])ccc1=O ZINC000539225410 317716394 /nfs/dbraw/zinc/71/63/94/317716394.db2.gz LWYARDKZQQIDAZ-CQSZACIVSA-N 0 3 345.399 2.895 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCNC2(c3ccc4c(c3)OCO4)CC2)cc1 ZINC000539333540 317718260 /nfs/dbraw/zinc/71/82/60/317718260.db2.gz FWXXHTIIMYRUDD-UHFFFAOYSA-N 0 3 342.351 2.981 20 5 EFBDHN CCN(C[C@H]1CCCN1CC)C(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000547798154 318043137 /nfs/dbraw/zinc/04/31/37/318043137.db2.gz WYTJHBAKCSWSBP-CQSZACIVSA-N 0 3 335.404 2.550 20 5 EFBDHN C[C@H](C(=O)NC[C@@H]1N(C)CCCC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000548403920 318104125 /nfs/dbraw/zinc/10/41/25/318104125.db2.gz WVOQZKARFOQJDK-BBRMVZONSA-N 0 3 333.432 2.935 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@H]2CCN(C[C@@H]3CCC4(CCCC4)O3)C2)nc1 ZINC000548921395 318157194 /nfs/dbraw/zinc/15/71/94/318157194.db2.gz VGMQWZAXZVGVMB-HOCLYGCPSA-N 0 3 346.431 2.968 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCCN(C(C)(C)C)CC2)c1 ZINC000549417756 318173562 /nfs/dbraw/zinc/17/35/62/318173562.db2.gz DTDJJEWEUJCAEH-UHFFFAOYSA-N 0 3 349.431 2.940 20 5 EFBDHN C[C@H](CNCc1cc([N+](=O)[O-])ccc1OC(F)F)Cn1cccn1 ZINC000551241196 318203818 /nfs/dbraw/zinc/20/38/18/318203818.db2.gz IBZNSYIJECMWKK-LLVKDONJSA-N 0 3 340.330 2.819 20 5 EFBDHN C[C@@H](CNCc1cc([N+](=O)[O-])ccc1OC(F)F)Cn1cccn1 ZINC000551241200 318203830 /nfs/dbraw/zinc/20/38/30/318203830.db2.gz IBZNSYIJECMWKK-NSHDSACASA-N 0 3 340.330 2.819 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@H]2CCc3cc(F)ccc32)c1 ZINC000552030989 318238592 /nfs/dbraw/zinc/23/85/92/318238592.db2.gz ZAXAFDJHFNBOJG-YJBOKZPZSA-N 0 3 346.358 2.751 20 5 EFBDHN CSc1ccc(C(=O)N2[C@@H]3CC[C@H]2CCN(C)C3)cc1[N+](=O)[O-] ZINC000552146656 318245467 /nfs/dbraw/zinc/24/54/67/318245467.db2.gz STHNKAPPQZCGJJ-QWHCGFSZSA-N 0 3 335.429 2.625 20 5 EFBDHN CCc1ccccc1CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000565417400 318968617 /nfs/dbraw/zinc/96/86/17/318968617.db2.gz SAMWQMITXIOGGW-QGZVFWFLSA-N 0 3 330.384 2.687 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](N)Cc3ccccc32)c1 ZINC000566103718 319032795 /nfs/dbraw/zinc/03/27/95/319032795.db2.gz HTJKYQJXJCFLDV-ZDUSSCGKSA-N 0 3 341.367 2.524 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CN[C@@H]1CSc2ccccc21 ZINC000566116018 319035079 /nfs/dbraw/zinc/03/50/79/319035079.db2.gz MXBSKAXMMMVRAX-TZMCWYRMSA-N 0 3 346.408 2.771 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2NC[C@H](O)COc1ccc(F)cc1 ZINC000566476048 319081805 /nfs/dbraw/zinc/08/18/05/319081805.db2.gz SGIZUQFWXPONFO-GUYCJALGSA-N 0 3 346.358 2.751 20 5 EFBDHN CC(C)(C)[C@@H]1NC(=O)CC[C@H]1N[C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000566475083 319081965 /nfs/dbraw/zinc/08/19/65/319081965.db2.gz JTYUFAYKWZKELT-JJRVBVJISA-N 0 3 331.416 2.865 20 5 EFBDHN Cn1cc([C@H]2OCCC[C@@H]2N[C@@H]2CCc3c2cccc3[N+](=O)[O-])cn1 ZINC000566483372 319083102 /nfs/dbraw/zinc/08/31/02/319083102.db2.gz KYMWMOBTFQMKBF-SOLBZPMBSA-N 0 3 342.399 2.826 20 5 EFBDHN CC(C)N1CCCC[C@H]1Cn1nc(-c2ccccc2[N+](=O)[O-])oc1=O ZINC000567897627 319223529 /nfs/dbraw/zinc/22/35/29/319223529.db2.gz JXUWHHMXLKESBL-ZDUSSCGKSA-N 0 3 346.387 2.674 20 5 EFBDHN C[C@H](N[C@H]1CCCC[C@@H]1N1CCOCC1)c1ccccc1[N+](=O)[O-] ZINC000568462484 319284952 /nfs/dbraw/zinc/28/49/52/319284952.db2.gz AJVGBVROAIWTHX-ZVZYQTTQSA-N 0 3 333.432 2.889 20 5 EFBDHN CS(=O)(=O)[C@@H]1CCC[C@H](N[C@H]2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000568531373 319293473 /nfs/dbraw/zinc/29/34/73/319293473.db2.gz CBVVIYBCXZAPIU-ZOWXZIJZSA-N 0 3 338.429 2.528 20 5 EFBDHN CCOc1cccc(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])c1 ZINC000571039523 319536020 /nfs/dbraw/zinc/53/60/20/319536020.db2.gz BLMJUGJIQNCVPZ-HNNXBMFYSA-N 0 3 346.383 2.523 20 5 EFBDHN C[C@@H](C(=O)NC[C@@H](C)N1CCC(C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000573654082 319784965 /nfs/dbraw/zinc/78/49/65/319784965.db2.gz DKNQEVILYRMNDR-HUUCEWRRSA-N 0 3 333.432 2.935 20 5 EFBDHN Cc1cc(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])ccc1F ZINC000576665100 320036742 /nfs/dbraw/zinc/03/67/42/320036742.db2.gz MJWWUPCEEYZUTJ-AWEZNQCLSA-N 0 3 334.347 2.572 20 5 EFBDHN Cc1ccc(NC(=O)CCNCc2cccc([N+](=O)[O-])c2C)nc1 ZINC000578436171 320206035 /nfs/dbraw/zinc/20/60/35/320206035.db2.gz DNZDXUGTBILRRM-UHFFFAOYSA-N 0 3 328.372 2.725 20 5 EFBDHN COc1ccc(CNC[C@@H](O)[C@@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000578725747 320232525 /nfs/dbraw/zinc/23/25/25/320232525.db2.gz VWOLWCVFKMEGQE-SUMWQHHRSA-N 0 3 330.384 2.858 20 5 EFBDHN CCOc1cc(CNCCOc2ccc([N+](=O)[O-])cc2)ccc1O ZINC000578733855 320233741 /nfs/dbraw/zinc/23/37/41/320233741.db2.gz OSWOQWZGIFGZKB-UHFFFAOYSA-N 0 3 332.356 2.868 20 5 EFBDHN Cc1ccc([C@@H](C)NC[C@H](O)COCc2ccco2)cc1[N+](=O)[O-] ZINC000181840260 323253125 /nfs/dbraw/zinc/25/31/25/323253125.db2.gz PZRHUJJGQSGNLR-HIFRSBDPSA-N 0 3 334.372 2.725 20 5 EFBDHN CN(CCc1cccs1)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000181925316 323255775 /nfs/dbraw/zinc/25/57/75/323255775.db2.gz FXGANUNYNHSZGK-ZDUSSCGKSA-N 0 3 336.413 2.571 20 5 EFBDHN CC[C@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCCO1 ZINC000182250964 323272340 /nfs/dbraw/zinc/27/23/40/323272340.db2.gz XPKOZHXVEQHYQP-JSGCOSHPSA-N 0 3 341.795 2.734 20 5 EFBDHN CC[C@H](N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C)[C@H]1CCCO1 ZINC000182336678 323277992 /nfs/dbraw/zinc/27/79/92/323277992.db2.gz KQCHZXKOQSXQQC-HEHGZKQESA-N 0 3 335.404 2.777 20 5 EFBDHN CC[C@H](NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCCO1 ZINC000182367204 323279852 /nfs/dbraw/zinc/27/98/52/323279852.db2.gz JBXSDEGMBBMWMN-FZMZJTMJSA-N 0 3 341.795 2.734 20 5 EFBDHN C[C@H](C(=O)N(C)[C@H]1CCN(C)C[C@@H]1C)c1ccc([N+](=O)[O-])cc1F ZINC000184192168 323358568 /nfs/dbraw/zinc/35/85/68/323358568.db2.gz DGUUDFIJOFYVJY-MKBNYLNASA-N 0 3 337.395 2.636 20 5 EFBDHN O=C(NCc1ccc([N+](=O)[O-])cc1Cl)C1CCN(C2CC2)CC1 ZINC000192839491 323482481 /nfs/dbraw/zinc/48/24/81/323482481.db2.gz SFHWGOIQXZYIQK-UHFFFAOYSA-N 0 3 337.807 2.739 20 5 EFBDHN O=[N+]([O-])c1cc(Br)ccc1CN[C@H](CO)C1CCCC1 ZINC000386143255 323759249 /nfs/dbraw/zinc/75/92/49/323759249.db2.gz RHWLCUKJXXGKLI-CYBMUJFWSA-N 0 3 343.221 2.998 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2cccc(Cl)c2)c1 ZINC000579812839 324036285 /nfs/dbraw/zinc/03/62/85/324036285.db2.gz KYNUEJAXYPBXQX-OAHLLOKOSA-N 0 3 336.775 2.778 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2)CN1Cc1ccccc1 ZINC000137441529 473206051 /nfs/dbraw/zinc/20/60/51/473206051.db2.gz ADMOBDGBBURAIY-YOEHRIQHSA-N 0 3 339.395 2.988 20 5 EFBDHN C[C@@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2)CN1Cc1ccccc1 ZINC000137441578 473206545 /nfs/dbraw/zinc/20/65/45/473206545.db2.gz ADMOBDGBBURAIY-RHSMWYFYSA-N 0 3 339.395 2.988 20 5 EFBDHN CCC[C@@H](NCC1(CS(C)(=O)=O)CC1)c1cccc([N+](=O)[O-])c1 ZINC000090182680 472607186 /nfs/dbraw/zinc/60/71/86/472607186.db2.gz ORBKPBPGZFIPDD-OAHLLOKOSA-N 0 3 340.445 2.850 20 5 EFBDHN Cc1c(NC(=O)CCN[C@@H](CO)c2ccccc2)cccc1[N+](=O)[O-] ZINC000095462552 473208535 /nfs/dbraw/zinc/20/85/35/473208535.db2.gz UXIVTAKOPLWSLD-INIZCTEOSA-N 0 3 343.383 2.555 20 5 EFBDHN NC(=O)c1ccc(CN2CC[C@H](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000124101380 473211389 /nfs/dbraw/zinc/21/13/89/473211389.db2.gz PIOFEEYNWSCIKH-OAHLLOKOSA-N 0 3 339.395 2.758 20 5 EFBDHN NC(=O)c1ccc(CN2CC[C@@H](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000124101126 473211413 /nfs/dbraw/zinc/21/14/13/473211413.db2.gz PIOFEEYNWSCIKH-HNNXBMFYSA-N 0 3 339.395 2.758 20 5 EFBDHN Cc1c(NC(=O)CCN(C)CCc2ccccn2)cccc1[N+](=O)[O-] ZINC000124385232 473240326 /nfs/dbraw/zinc/24/03/26/473240326.db2.gz GFTZVFLLPDNOLQ-UHFFFAOYSA-N 0 3 342.399 2.801 20 5 EFBDHN C[C@@H]1C[C@H](Nc2ncc(Br)cc2[N+](=O)[O-])CCN1C ZINC000161673780 473252177 /nfs/dbraw/zinc/25/21/77/473252177.db2.gz OUWQLAXZSYIRBD-PSASIEDQSA-N 0 3 329.198 2.647 20 5 EFBDHN O=C(NCC1CCN(Cc2cccs2)CC1)c1cc([N+](=O)[O-])c[nH]1 ZINC000143551068 473275855 /nfs/dbraw/zinc/27/58/55/473275855.db2.gz DJPWLXMBTBRNBI-UHFFFAOYSA-N 0 3 348.428 2.626 20 5 EFBDHN CN1CCC[C@H](CNc2ncc([N+](=O)[O-])cc2Br)C1 ZINC000081941379 473276231 /nfs/dbraw/zinc/27/62/31/473276231.db2.gz CUEGLZNBRRAMIP-SECBINFHSA-N 0 3 329.198 2.506 20 5 EFBDHN O=[N+]([O-])c1cnc(N[C@H]2CCN3CCCC[C@H]23)c(Br)c1 ZINC000081941355 473276403 /nfs/dbraw/zinc/27/64/03/473276403.db2.gz GUZWNNRFQLMBRR-NWDGAFQWSA-N 0 3 341.209 2.791 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCN(CCO)CCc2ccccc2)c1 ZINC000112698443 473295945 /nfs/dbraw/zinc/29/59/45/473295945.db2.gz GYHNAMJURXPGOA-UHFFFAOYSA-N 0 3 330.384 2.511 20 5 EFBDHN C[C@H](CNC(=O)NCc1cccc([N+](=O)[O-])c1)N1CCC(C)CC1 ZINC000171201883 473319248 /nfs/dbraw/zinc/31/92/48/473319248.db2.gz INUHJTKCBHZAAV-CQSZACIVSA-N 0 3 334.420 2.514 20 5 EFBDHN CC(C)[C@H](CCO)N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000162259823 473323322 /nfs/dbraw/zinc/32/33/22/473323322.db2.gz NUWRHZSXVPYYMR-MFKMUULPSA-N 0 3 343.811 2.572 20 5 EFBDHN C[C@H](C(=O)N(C)CC1CCN(C)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000185186844 473355020 /nfs/dbraw/zinc/35/50/20/473355020.db2.gz HNJIVEYHRFAXAP-LBPRGKRZSA-N 0 3 337.395 2.638 20 5 EFBDHN CSc1ccc(C(=O)N2CC[C@@H](N3CCCC3)C2)cc1[N+](=O)[O-] ZINC000171449098 473390986 /nfs/dbraw/zinc/39/09/86/473390986.db2.gz OQBSRSLYHRVZEB-CYBMUJFWSA-N 0 3 335.429 2.627 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@H](N2CCCC2)C1 ZINC000171448067 473391096 /nfs/dbraw/zinc/39/10/96/473391096.db2.gz PVFRZGKALOVDPS-UKRRQHHQSA-N 0 3 349.456 2.772 20 5 EFBDHN COC[C@H]1C[C@@H](O)CN1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000593673216 479418451 /nfs/dbraw/zinc/41/84/51/479418451.db2.gz BYIMPOPRCSGZSX-CHWSQXEVSA-N 0 3 348.424 2.905 20 5 EFBDHN C[C@@H](CNCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000619845120 479894584 /nfs/dbraw/zinc/89/45/84/479894584.db2.gz QKUFTOCDQIAWDH-LBPRGKRZSA-N 0 3 328.434 2.640 20 5 EFBDHN CNc1ccc(C(=O)NCc2ccccc2CN(C)C)cc1[N+](=O)[O-] ZINC000006992954 471582540 /nfs/dbraw/zinc/58/25/40/471582540.db2.gz JFNVQIKTYBAQHD-UHFFFAOYSA-N 0 3 342.399 2.628 20 5 EFBDHN CC(C)N(CCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])C(C)C ZINC000015131524 471891317 /nfs/dbraw/zinc/89/13/17/471891317.db2.gz FIUUIIWVXHKIEH-UHFFFAOYSA-N 0 3 343.449 2.529 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000016599682 471942747 /nfs/dbraw/zinc/94/27/47/471942747.db2.gz NBTMSZDEFJWEBM-MRXNPFEDSA-N 0 3 343.383 2.636 20 5 EFBDHN Cc1c(C(=O)NCCN(C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000053348892 471996297 /nfs/dbraw/zinc/99/62/97/471996297.db2.gz BYPRBIRREIIKRA-UHFFFAOYSA-N 0 3 327.384 2.765 20 5 EFBDHN C[C@H](CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CCC(C)CC1 ZINC000067269787 472012563 /nfs/dbraw/zinc/01/25/63/472012563.db2.gz YQJHAYKKFMDKDV-CYBMUJFWSA-N 0 3 344.415 2.926 20 5 EFBDHN Cc1noc(C2CCN(CCCOc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000053618194 472024462 /nfs/dbraw/zinc/02/44/62/472024462.db2.gz MKRLNNATTUZQTO-UHFFFAOYSA-N 0 3 346.387 2.935 20 5 EFBDHN Cc1ccccc1[C@H](C)NC[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000039982519 472026824 /nfs/dbraw/zinc/02/68/24/472026824.db2.gz IBZPZBIFGRKQPI-HOCLYGCPSA-N 0 3 330.384 2.994 20 5 EFBDHN Cc1ccccc1[C@H](C)NC[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000039982523 472026951 /nfs/dbraw/zinc/02/69/51/472026951.db2.gz IBZPZBIFGRKQPI-GOEBONIOSA-N 0 3 330.384 2.994 20 5 EFBDHN Cc1ccc([C@@H](CNc2ccc(C(N)=O)cc2[N+](=O)[O-])N(C)C)cc1 ZINC000067383216 472027096 /nfs/dbraw/zinc/02/70/96/472027096.db2.gz VTVJGFJLUJOJIR-QGZVFWFLSA-N 0 3 342.399 2.717 20 5 EFBDHN O=[N+]([O-])c1cc(Br)cnc1NC[C@H]1CCN(C2CC2)C1 ZINC000040713405 472040187 /nfs/dbraw/zinc/04/01/87/472040187.db2.gz FYOBZAWLFMRSPG-SECBINFHSA-N 0 3 341.209 2.649 20 5 EFBDHN CN(C)[C@H](CNc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cccc(F)c1 ZINC000024107860 472048416 /nfs/dbraw/zinc/04/84/16/472048416.db2.gz YUWOQONSOZHESG-MRXNPFEDSA-N 0 3 346.362 2.548 20 5 EFBDHN CNc1ccc(C(=O)NCC(C)(C)N2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000054287070 472073890 /nfs/dbraw/zinc/07/38/90/472073890.db2.gz UKGSSLSYUKHPKP-CYBMUJFWSA-N 0 3 348.447 2.877 20 5 EFBDHN C[C@H]1CCC[C@@H](N(C)CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000026473476 472138668 /nfs/dbraw/zinc/13/86/68/472138668.db2.gz HGAOXZYRGDGITK-NWDGAFQWSA-N 0 3 349.387 2.773 20 5 EFBDHN Cc1cc(C(=O)N2CCC[C@H]2CN2CCCCC2)ccc1[N+](=O)[O-] ZINC000068133649 472140307 /nfs/dbraw/zinc/14/03/07/472140307.db2.gz XYPWEZLTRJMJTR-INIZCTEOSA-N 0 3 331.416 2.994 20 5 EFBDHN Cc1ccc(C(=O)N2CCC[C@@H]2CN2CCCCC2)cc1[N+](=O)[O-] ZINC000068135280 472140423 /nfs/dbraw/zinc/14/04/23/472140423.db2.gz AABUCPAYCUAMQY-MRXNPFEDSA-N 0 3 331.416 2.994 20 5 EFBDHN Cc1c(C(=O)N2CCC[C@H]2CN2CCCCC2)cccc1[N+](=O)[O-] ZINC000068134768 472140632 /nfs/dbraw/zinc/14/06/32/472140632.db2.gz PEYGKFOTFCAFAT-HNNXBMFYSA-N 0 3 331.416 2.994 20 5 EFBDHN Cc1ccc(CN(C)C[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC000026712584 472144889 /nfs/dbraw/zinc/14/48/89/472144889.db2.gz GAPXALWAIZOPHH-KRWDZBQOSA-N 0 3 330.384 2.775 20 5 EFBDHN Cc1ccccc1CN(C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000026712102 472145979 /nfs/dbraw/zinc/14/59/79/472145979.db2.gz BTTGMSZZRQXCOP-QGZVFWFLSA-N 0 3 330.384 2.775 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H](N(C)C)C1 ZINC000068341921 472172627 /nfs/dbraw/zinc/17/26/27/472172627.db2.gz RQRKAUGGWYPPPG-JSGCOSHPSA-N 0 3 337.445 2.628 20 5 EFBDHN O=[N+]([O-])c1cnn(C[C@H](O)CN(Cc2ccoc2)C2CCCCC2)c1 ZINC000075767230 472195104 /nfs/dbraw/zinc/19/51/04/472195104.db2.gz MYIRKUNNIQEVAQ-QGZVFWFLSA-N 0 3 348.403 2.580 20 5 EFBDHN CCOC(=O)C1CCN(CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000055897407 472252562 /nfs/dbraw/zinc/25/25/62/472252562.db2.gz RXYHJBSVOTWWGL-UHFFFAOYSA-N 0 3 336.388 2.639 20 5 EFBDHN CN(CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)C1CCCCCC1 ZINC000029166702 472256684 /nfs/dbraw/zinc/25/66/84/472256684.db2.gz ASZDWPWHMRHLBB-UHFFFAOYSA-N 0 3 349.387 2.917 20 5 EFBDHN Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@H](CN1CCCC1)c1ccccc1 ZINC000029179161 472257912 /nfs/dbraw/zinc/25/79/12/472257912.db2.gz BKRRQUBTWMMEAW-INIZCTEOSA-N 0 3 342.399 2.500 20 5 EFBDHN CC[C@@H](CN1CCCC1)NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000609878581 480216904 /nfs/dbraw/zinc/21/69/04/480216904.db2.gz XWWASVKXCDNIPM-ZDUSSCGKSA-N 0 3 325.796 2.852 20 5 EFBDHN CCN1CCC(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)CC1 ZINC000029607057 472284965 /nfs/dbraw/zinc/28/49/65/472284965.db2.gz CRIWKXOBTRTGDJ-LBPRGKRZSA-N 0 3 337.445 2.676 20 5 EFBDHN C[C@@H](C1CC1)N(CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C1CC1 ZINC000029726171 472292452 /nfs/dbraw/zinc/29/24/52/472292452.db2.gz DBNDCBLUMLXKJM-LBPRGKRZSA-N 0 3 329.400 2.747 20 5 EFBDHN CN(CCCNC(=O)c1csc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000044355634 472301723 /nfs/dbraw/zinc/30/17/23/472301723.db2.gz KNYABWBPFCATHV-UHFFFAOYSA-N 0 3 333.413 2.908 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)NCCN2CCCCCC2)c1 ZINC000076249794 472307116 /nfs/dbraw/zinc/30/71/16/472307116.db2.gz PBOLEXJXWWNOFF-UHFFFAOYSA-N 0 3 337.445 2.923 20 5 EFBDHN CN1CCC[C@H](CNc2ncc(Br)cc2[N+](=O)[O-])C1 ZINC000044537805 472315503 /nfs/dbraw/zinc/31/55/03/472315503.db2.gz RSPSDKRGARGFLM-SECBINFHSA-N 0 3 329.198 2.506 20 5 EFBDHN CCO[C@@H]1CCCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000076407322 472341118 /nfs/dbraw/zinc/34/11/18/472341118.db2.gz BIYCJXYBTBZQBH-OAHLLOKOSA-N 0 3 335.404 2.733 20 5 EFBDHN CN(C)[C@@H](CNC(=O)c1csc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000044868984 472345849 /nfs/dbraw/zinc/34/58/49/472345849.db2.gz COYJMMYGUIZTSC-CQSZACIVSA-N 0 3 333.413 2.559 20 5 EFBDHN CN(C)CCN(Cc1ccco1)C(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000088250489 472352442 /nfs/dbraw/zinc/35/24/42/472352442.db2.gz MJDPOZCQIISHSW-UHFFFAOYSA-N 0 3 335.335 2.531 20 5 EFBDHN COc1ccc(NC(=O)CN([C@@H](C)C2CC2)C2CC2)c([N+](=O)[O-])c1 ZINC000031653779 472386909 /nfs/dbraw/zinc/38/69/09/472386909.db2.gz VGQDUZPIYZCNBB-NSHDSACASA-N 0 3 333.388 2.805 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCCN1CC(C)C ZINC000154186728 472399869 /nfs/dbraw/zinc/39/98/69/472399869.db2.gz NTHINUZLJYDZLM-OAHLLOKOSA-N 0 3 349.431 2.844 20 5 EFBDHN O=C(CCc1cccc([N+](=O)[O-])c1)N1CCN(C2CCCC2)CC1 ZINC000154283101 472411235 /nfs/dbraw/zinc/41/12/35/472411235.db2.gz TZBNZSDUOUUWTJ-UHFFFAOYSA-N 0 3 331.416 2.614 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CN(CCO)[C@@H]2CCc3ccccc32)c1 ZINC000154414377 472430647 /nfs/dbraw/zinc/43/06/47/472430647.db2.gz JBNBWSFGILUZOV-MOPGFXCFSA-N 0 3 342.395 2.610 20 5 EFBDHN CN(C[C@@H]1CCCN(C)C1)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000117806927 472480386 /nfs/dbraw/zinc/48/03/86/472480386.db2.gz ZHYARKJXOYYIKR-GFCCVEGCSA-N 0 3 339.823 2.591 20 5 EFBDHN CN(C)Cc1cccc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000033083836 472495185 /nfs/dbraw/zinc/49/51/85/472495185.db2.gz DAKFCPZCGYDSKQ-UHFFFAOYSA-N 0 3 327.384 2.515 20 5 EFBDHN O=[N+]([O-])c1ccc(CCN2CCCN(c3nccs3)CC2)cc1 ZINC000058268438 472531032 /nfs/dbraw/zinc/53/10/32/472531032.db2.gz DKSMRIDYASPFAN-UHFFFAOYSA-N 0 3 332.429 2.806 20 5 EFBDHN CN(CCN1CCCC1)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089897937 472538339 /nfs/dbraw/zinc/53/83/39/472538339.db2.gz ICWWGAALHKLGGX-UHFFFAOYSA-N 0 3 330.388 2.777 20 5 EFBDHN COc1cc(C(=O)NCC(C)(C)N2CCCCC2)ccc1[N+](=O)[O-] ZINC000101626919 472545256 /nfs/dbraw/zinc/54/52/56/472545256.db2.gz QIRGBMGBDGIVEI-UHFFFAOYSA-N 0 3 335.404 2.598 20 5 EFBDHN CCOc1ccc([C@@H](C)NCCn2cnnc2C2CC2)cc1[N+](=O)[O-] ZINC000090032732 472583445 /nfs/dbraw/zinc/58/34/45/472583445.db2.gz PIIKVGRCDKFFPD-GFCCVEGCSA-N 0 3 345.403 2.813 20 5 EFBDHN CC(C)CN(CCN(C)C)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000130239710 472591587 /nfs/dbraw/zinc/59/15/87/472591587.db2.gz HMYNVRYAYFTOBW-UHFFFAOYSA-N 0 3 346.431 2.665 20 5 EFBDHN CN(C)CCN(Cc1ccccc1F)C(=O)c1cccc([N+](=O)[O-])c1 ZINC000058990995 472619157 /nfs/dbraw/zinc/61/91/57/472619157.db2.gz URSAYOJPXCBWFN-UHFFFAOYSA-N 0 3 345.374 2.938 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN[C@@H](C[C@H]2CCOC2)c2ccccc2)c1 ZINC000090539662 472632207 /nfs/dbraw/zinc/63/22/07/472632207.db2.gz DMTCSQFKLMQQOD-PBHICJAKSA-N 0 3 330.388 2.549 20 5 EFBDHN CCN1CCN(C[C@H](C)CNc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000060380208 472649934 /nfs/dbraw/zinc/64/99/34/472649934.db2.gz WQILDAQJUQAHRH-CYBMUJFWSA-N 0 3 340.855 2.934 20 5 EFBDHN CCOC1CCN(CCC(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000060485113 472661472 /nfs/dbraw/zinc/66/14/72/472661472.db2.gz NKQGZNWTHSYUET-UHFFFAOYSA-N 0 3 335.404 2.733 20 5 EFBDHN Cc1c(CN2CCC(OC[C@H]3CCOC3)CC2)cccc1[N+](=O)[O-] ZINC000131772986 472691100 /nfs/dbraw/zinc/69/11/00/472691100.db2.gz YTBRPHXTLPDTJQ-HNNXBMFYSA-N 0 3 334.416 2.921 20 5 EFBDHN Nc1nc(N[C@@H](CN2CCCCC2)c2ccccc2)ncc1[N+](=O)[O-] ZINC000078333967 472697674 /nfs/dbraw/zinc/69/76/74/472697674.db2.gz WVYNLXNODGIFLO-AWEZNQCLSA-N 0 3 342.403 2.606 20 5 EFBDHN CNc1ccc(C(=O)Nc2cccc(CN(C)C)c2)cc1[N+](=O)[O-] ZINC000047460179 472717299 /nfs/dbraw/zinc/71/72/99/472717299.db2.gz QLDAPHPYALQPGS-UHFFFAOYSA-N 0 3 328.372 2.950 20 5 EFBDHN Cc1cnc(N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)c([N+](=O)[O-])c1 ZINC000078658013 472748393 /nfs/dbraw/zinc/74/83/93/472748393.db2.gz ASTXYODSGSQLQF-GJZGRUSLSA-N 0 3 348.447 2.624 20 5 EFBDHN CN(C[C@H]1CCN(Cc2ccccc2)C1)c1ncccc1[N+](=O)[O-] ZINC000078674865 472752642 /nfs/dbraw/zinc/75/26/42/472752642.db2.gz AGAQDXXRNFEPCD-MRXNPFEDSA-N 0 3 326.400 2.948 20 5 EFBDHN CC(C)(CNC(=O)CCOc1ccccc1[N+](=O)[O-])N1CCCCC1 ZINC000063661909 472798506 /nfs/dbraw/zinc/79/85/06/472798506.db2.gz ONDRVTRMTXXRSJ-UHFFFAOYSA-N 0 3 349.431 2.744 20 5 EFBDHN CC(C)(C)N1CCCN(C(=O)CCNc2ccccc2[N+](=O)[O-])CC1 ZINC000063723962 472806590 /nfs/dbraw/zinc/80/65/90/472806590.db2.gz ZPJKNZLFKZYGOP-UHFFFAOYSA-N 0 3 348.447 2.730 20 5 EFBDHN CN(CCn1cc([N+](=O)[O-])cn1)Cc1ccc(C(F)(F)F)cc1 ZINC000157376054 472814750 /nfs/dbraw/zinc/81/47/50/472814750.db2.gz JBKFWLFDTQOMQJ-UHFFFAOYSA-N 0 3 328.294 2.942 20 5 EFBDHN CC(C)(C)CCN1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000079262523 472838889 /nfs/dbraw/zinc/83/88/89/472838889.db2.gz CLTJLNKXMCCYKN-UHFFFAOYSA-N 0 3 333.432 2.718 20 5 EFBDHN Cn1cnc([N+](=O)[O-])c1NC[C@@H]1CCCN(Cc2cccs2)C1 ZINC000064550876 472861504 /nfs/dbraw/zinc/86/15/04/472861504.db2.gz WDUWBUKLMFTCFE-LBPRGKRZSA-N 0 3 335.433 2.714 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)CCN1Cc1ccccc1 ZINC000079553987 472886126 /nfs/dbraw/zinc/88/61/26/472886126.db2.gz WVHFTCFDAAJSHB-DZGCQCFKSA-N 0 3 342.399 2.706 20 5 EFBDHN CN(CCNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C1CC1 ZINC000065124818 472901122 /nfs/dbraw/zinc/90/11/22/472901122.db2.gz ZVFFFEUHIQFBIZ-UHFFFAOYSA-N 0 3 346.412 2.542 20 5 EFBDHN CCN(CCC(=O)OC)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000092380030 472904646 /nfs/dbraw/zinc/90/46/46/472904646.db2.gz ALFHIFRDIXCFQC-UHFFFAOYSA-N 0 3 345.193 2.742 20 5 EFBDHN CN(CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C(C1CC1)C1CC1 ZINC000065243278 472912749 /nfs/dbraw/zinc/91/27/49/472912749.db2.gz ISSCVXWFNDILKV-UHFFFAOYSA-N 0 3 329.400 2.604 20 5 EFBDHN CN1CCC(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000065308487 472923687 /nfs/dbraw/zinc/92/36/87/472923687.db2.gz JKGBQRNMWYHPAM-UHFFFAOYSA-N 0 3 346.412 2.542 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN(C)C[C@H]1CCCCO1 ZINC000121841811 472928328 /nfs/dbraw/zinc/92/83/28/472928328.db2.gz JRSHFBOOXLERCK-OAHLLOKOSA-N 0 3 335.404 2.733 20 5 EFBDHN CN1CCN(CCCCNc2ccc([N+](=O)[O-])c3cccnc23)CC1 ZINC000092606992 472945278 /nfs/dbraw/zinc/94/52/78/472945278.db2.gz ANOOVVUZPRZPCS-UHFFFAOYSA-N 0 3 343.431 2.583 20 5 EFBDHN C[C@H](CN1CCCCC1)NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000079985116 472953576 /nfs/dbraw/zinc/95/35/76/472953576.db2.gz XHPIRSVEHAEHAI-KGLIPLIRSA-N 0 3 334.420 2.829 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CCC[C@H]2C[C@H](O)c2ccc(F)cc2)n1 ZINC000134788809 472967005 /nfs/dbraw/zinc/96/70/05/472967005.db2.gz VANXIFHJSBPKJM-HOTGVXAUSA-N 0 3 348.378 2.519 20 5 EFBDHN CN(C)C[C@H]1CCCCN1C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000134836059 472972951 /nfs/dbraw/zinc/97/29/51/472972951.db2.gz MPYLYAALZVJAPZ-CYBMUJFWSA-N 0 3 325.796 2.805 20 5 EFBDHN Cc1ccc(CN(CCC(N)=O)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000122094115 472973949 /nfs/dbraw/zinc/97/39/49/472973949.db2.gz POWLFIJRHMTZKS-UHFFFAOYSA-N 0 3 327.384 2.781 20 5 EFBDHN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCC[C@@H](N2CCCC2)C1 ZINC000134875312 472979458 /nfs/dbraw/zinc/97/94/58/472979458.db2.gz GZBRWXXIEXDXJN-CQSZACIVSA-N 0 3 337.807 2.949 20 5 EFBDHN CC(C)C[C@H](CN[C@H](C)c1cccc([N+](=O)[O-])c1)N1CCOCC1 ZINC000122254369 472992522 /nfs/dbraw/zinc/99/25/22/472992522.db2.gz ZNUVCQUDOXDFRU-CRAIPNDOSA-N 0 3 335.448 2.992 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)c2cccc([N+](=O)[O-])c2)CN1Cc1ccccc1 ZINC000134931153 472994871 /nfs/dbraw/zinc/99/48/71/472994871.db2.gz NOTZGVQBOPUDIA-YOEHRIQHSA-N 0 3 339.395 2.988 20 5 EFBDHN CN(C)CCN(C(=O)c1ccc([N+](=O)[O-])s1)C1CCCCC1 ZINC000065746129 473005917 /nfs/dbraw/zinc/00/59/17/473005917.db2.gz NUHBPEDIETUZJF-UHFFFAOYSA-N 0 3 325.434 2.993 20 5 EFBDHN CSc1ccc(C(=O)N[C@H]2CCN(CC3CC3)C2)cc1[N+](=O)[O-] ZINC000108306914 473012210 /nfs/dbraw/zinc/01/22/10/473012210.db2.gz DODAYNCTTMJSHP-ZDUSSCGKSA-N 0 3 335.429 2.531 20 5 EFBDHN CCCCNC(=O)[C@H]1CCCN(CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000051057584 473021319 /nfs/dbraw/zinc/02/13/19/473021319.db2.gz CTXZBQZQPOBEJD-HNNXBMFYSA-N 0 3 349.431 2.602 20 5 EFBDHN O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NCCN1CCCCCC1 ZINC000066044948 473041619 /nfs/dbraw/zinc/04/16/19/473041619.db2.gz WJZDZXUUQGCLJB-UHFFFAOYSA-N 0 3 344.415 2.542 20 5 EFBDHN CN(CCc1ccccc1)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000051404559 473046768 /nfs/dbraw/zinc/04/67/68/473046768.db2.gz ODNFYJIBVFOEPL-KRWDZBQOSA-N 0 3 330.384 2.509 20 5 EFBDHN Cc1cc(NCc2ccc(OCCN(C)C)cc2)ncc1[N+](=O)[O-] ZINC000074741446 473055408 /nfs/dbraw/zinc/05/54/08/473055408.db2.gz NECDSMIKDRCGTI-UHFFFAOYSA-N 0 3 330.388 2.851 20 5 EFBDHN CN(CCOc1ccccc1[N+](=O)[O-])Cc1ccc2c(c1)OCCO2 ZINC000051589215 473059644 /nfs/dbraw/zinc/05/96/44/473059644.db2.gz DWUIAKCMACLNKH-UHFFFAOYSA-N 0 3 344.367 2.877 20 5 EFBDHN CC(C)NC(=O)c1ccc(NCCN2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000052160311 473089271 /nfs/dbraw/zinc/08/92/71/473089271.db2.gz BPOVEPBYUGZTBO-UHFFFAOYSA-N 0 3 348.447 2.877 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCCN2CCS[C@H]3COCC[C@@H]32)cc1 ZINC000135562089 473092878 /nfs/dbraw/zinc/09/28/78/473092878.db2.gz XRUKFWUCKWIURN-HOTGVXAUSA-N 0 3 338.429 2.570 20 5 EFBDHN Cc1nn(C)c(N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000160242945 473100389 /nfs/dbraw/zinc/10/03/89/473100389.db2.gz AHOHGDKISVCTMP-SWLSCSKDSA-N 0 3 329.404 2.569 20 5 EFBDHN C[C@@H](CS(=O)(=O)c1ccccc1)NCCc1cccc([N+](=O)[O-])c1 ZINC000123203690 473109517 /nfs/dbraw/zinc/10/95/17/473109517.db2.gz CXWFIWXJEYQROQ-AWEZNQCLSA-N 0 3 348.424 2.589 20 5 EFBDHN C[C@H](CS(=O)(=O)c1ccccc1)NCCc1cccc([N+](=O)[O-])c1 ZINC000123203866 473110165 /nfs/dbraw/zinc/11/01/65/473110165.db2.gz CXWFIWXJEYQROQ-CQSZACIVSA-N 0 3 348.424 2.589 20 5 EFBDHN COc1ccc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000093534670 473115655 /nfs/dbraw/zinc/11/56/55/473115655.db2.gz QCDUPAQCKKXAIW-AWEZNQCLSA-N 0 3 328.372 2.685 20 5 EFBDHN COc1ccccc1[C@H](CNc1c([N+](=O)[O-])ncn1C)N1CCCC1 ZINC000052722491 473142393 /nfs/dbraw/zinc/14/23/93/473142393.db2.gz GQKNQSJWTLOTGH-AWEZNQCLSA-N 0 3 345.403 2.586 20 5 EFBDHN CN(C/C=C/c1ccccc1[N+](=O)[O-])CC(C)(C)CN1CCOCC1 ZINC000093769552 473142990 /nfs/dbraw/zinc/14/29/90/473142990.db2.gz SUPBVOOWRUKROV-SOFGYWHQSA-N 0 3 347.459 2.898 20 5 EFBDHN NC(=O)C[C@H]1CCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000093808796 473146877 /nfs/dbraw/zinc/14/68/77/473146877.db2.gz CXAWNTBJGXVICN-CYBMUJFWSA-N 0 3 343.383 2.942 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(NCc2ccccc2OCCN(C)C)n1 ZINC000123487137 473147131 /nfs/dbraw/zinc/14/71/31/473147131.db2.gz UDUDCJNJEOTUHM-UHFFFAOYSA-N 0 3 330.388 2.851 20 5 EFBDHN CCOC[C@H]1CCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000093838639 473149850 /nfs/dbraw/zinc/14/98/50/473149850.db2.gz BJFNISSMWOZBMT-AWEZNQCLSA-N 0 3 344.415 2.854 20 5 EFBDHN CN(Cc1ccc(Br)c([N+](=O)[O-])c1)C[C@H]1CCOC1 ZINC000093839822 473150991 /nfs/dbraw/zinc/15/09/91/473150991.db2.gz RGWLTHOOTQUYDH-LLVKDONJSA-N 0 3 329.194 2.826 20 5 EFBDHN C[C@@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cc2Br)CCN1C ZINC000094007925 473166949 /nfs/dbraw/zinc/16/69/49/473166949.db2.gz RQYRVQVSIAMTQP-BDAKNGLRSA-N 0 3 329.198 2.647 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@@H]1CCN(CC2CC2)C1 ZINC000094125258 473178947 /nfs/dbraw/zinc/17/89/47/473178947.db2.gz NJILKMVRKRJQSF-OAHLLOKOSA-N 0 3 331.416 2.734 20 5 EFBDHN Cc1cc(C(=O)NCCCCN2C[C@@H](C)O[C@H](C)C2)cc([N+](=O)[O-])c1 ZINC000123735835 473179051 /nfs/dbraw/zinc/17/90/51/473179051.db2.gz VLPZJHAMTXQFEF-HUUCEWRRSA-N 0 3 349.431 2.522 20 5 EFBDHN CCc1nn(C)c(NC[C@H](C)N(C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000094157767 473181911 /nfs/dbraw/zinc/18/19/11/473181911.db2.gz PRMRBIHGAAUZJQ-ZDUSSCGKSA-N 0 3 331.420 2.823 20 5 EFBDHN CN(CCOc1ccc(F)cc1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136867995 473182361 /nfs/dbraw/zinc/18/23/61/473182361.db2.gz KDNFTQMPDNULEB-KRWDZBQOSA-N 0 3 334.347 2.778 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)c1ccc(SC)c([N+](=O)[O-])c1 ZINC000110997550 473189158 /nfs/dbraw/zinc/18/91/58/473189158.db2.gz XRYUVLZHKITPAC-ZDUSSCGKSA-N 0 3 337.445 2.921 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H](C(C)C)N1CCCCC1 ZINC000171455556 473392146 /nfs/dbraw/zinc/39/21/46/473392146.db2.gz JNDHYEVVFZGJIK-QGZVFWFLSA-N 0 3 349.431 2.730 20 5 EFBDHN COC(=O)[C@@H](C)CN(C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000114063574 473436721 /nfs/dbraw/zinc/43/67/21/473436721.db2.gz XQGKZSWDKPNCLM-LBPRGKRZSA-N 0 3 347.371 2.533 20 5 EFBDHN C[C@H](C(=O)N[C@H]1C[C@H](C)N(C2CC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000185489482 473440437 /nfs/dbraw/zinc/44/04/37/473440437.db2.gz JSHAQSBINFWIPY-SRVKXCTJSA-N 0 3 335.379 2.579 20 5 EFBDHN C[C@H](C(=O)N[C@H]1C[C@@H](C)N(C2CC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000185489469 473440547 /nfs/dbraw/zinc/44/05/47/473440547.db2.gz JSHAQSBINFWIPY-WOPDTQHZSA-N 0 3 335.379 2.579 20 5 EFBDHN Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])o2)c(OCCN(C)C)c1 ZINC000151350395 473446912 /nfs/dbraw/zinc/44/69/12/473446912.db2.gz OTBXJYUBJLYCTA-UHFFFAOYSA-N 0 3 333.344 2.689 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(CCN(C)C)C(C)C ZINC000185532098 473450112 /nfs/dbraw/zinc/45/01/12/473450112.db2.gz WOCSIBQYWIVPRM-INIZCTEOSA-N 0 3 335.448 2.962 20 5 EFBDHN CC(C)C[C@H](CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)N(C)C ZINC000114377743 473457182 /nfs/dbraw/zinc/45/71/82/473457182.db2.gz GQHOPGUFNKDANP-OAHLLOKOSA-N 0 3 348.447 2.875 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCN(CCO)[C@@H]1CCc2ccccc21 ZINC000114466469 473469781 /nfs/dbraw/zinc/46/97/81/473469781.db2.gz XXUDHADWJCBFOE-QGZVFWFLSA-N 0 3 342.395 2.955 20 5 EFBDHN CCNc1ccc(C(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)cc1[N+](=O)[O-] ZINC000164068406 473476677 /nfs/dbraw/zinc/47/66/77/473476677.db2.gz WQXUAAOYSBKUNX-HOCLYGCPSA-N 0 3 346.431 2.583 20 5 EFBDHN C[C@@H](CNC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)N(C)C1CC1 ZINC000151861385 473501787 /nfs/dbraw/zinc/50/17/87/473501787.db2.gz SJYLKFCWHADAJJ-ZDUSSCGKSA-N 0 3 346.431 2.752 20 5 EFBDHN CC[C@@H](N[C@H](C(=O)N1CCOCC1)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000164952551 473502991 /nfs/dbraw/zinc/50/29/91/473502991.db2.gz ZIXOBQGGHGDLAX-SJORKVTESA-N 0 3 349.431 2.519 20 5 EFBDHN CCC[C@H](N[C@@H](CC)C(=O)N1CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000165116813 473506860 /nfs/dbraw/zinc/50/68/60/473506860.db2.gz IASOIOUHPFBSTR-IRXDYDNUSA-N 0 3 349.431 2.663 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](c2ccccc2)N(C)C)c1 ZINC000152042546 473518680 /nfs/dbraw/zinc/51/86/80/473518680.db2.gz HCSXREVBSDHUNP-KRWDZBQOSA-N 0 3 327.384 2.936 20 5 EFBDHN O=[N+]([O-])c1ccccc1CN1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1 ZINC000152114824 473525880 /nfs/dbraw/zinc/52/58/80/473525880.db2.gz NYGYEHXDURDZBY-CQSZACIVSA-N 0 3 327.388 2.970 20 5 EFBDHN O=[N+]([O-])c1ccccc1CN1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1 ZINC000152114824 473525885 /nfs/dbraw/zinc/52/58/85/473525885.db2.gz NYGYEHXDURDZBY-CQSZACIVSA-N 0 3 327.388 2.970 20 5 EFBDHN N[C@H](CNC(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000152144306 473529191 /nfs/dbraw/zinc/52/91/91/473529191.db2.gz KXRDFHWUPNRJNT-QGZVFWFLSA-N 0 3 342.399 2.603 20 5 EFBDHN COC(=O)c1ccc(CN(C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000178572042 473533263 /nfs/dbraw/zinc/53/32/63/473533263.db2.gz XGOJRMVDRXJCCF-QGZVFWFLSA-N 0 3 344.367 2.547 20 5 EFBDHN CC[C@H]1CCCCN1CCNC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000172154170 473536224 /nfs/dbraw/zinc/53/62/24/473536224.db2.gz AZHVYHBSNQZJCK-HNNXBMFYSA-N 0 3 334.420 2.659 20 5 EFBDHN O=C1CCc2cc([N+](=O)[O-])c(NCCN3CCCCCC3)cc2N1 ZINC000170639542 473571240 /nfs/dbraw/zinc/57/12/40/473571240.db2.gz XEQHYVGVCBFWDJ-UHFFFAOYSA-N 0 3 332.404 2.767 20 5 EFBDHN CN(C)Cc1cccc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2F)c1 ZINC000127154343 473582528 /nfs/dbraw/zinc/58/25/28/473582528.db2.gz OGBIBRSQOCSHFG-UHFFFAOYSA-N 0 3 345.374 2.654 20 5 EFBDHN C[C@H](O)CN(CC(=O)Nc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000170691611 473589918 /nfs/dbraw/zinc/58/99/18/473589918.db2.gz XPIIBIGKEXYNEC-ZDUSSCGKSA-N 0 3 335.404 2.549 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCCN(C2CCCC2)CC1 ZINC000172421555 473606367 /nfs/dbraw/zinc/60/63/67/473606367.db2.gz YEXVLRBVMAIAOZ-UHFFFAOYSA-N 0 3 331.416 2.994 20 5 EFBDHN CCOc1ccc([C@H](C)NCCC(=O)N[C@@H](C)CC)cc1[N+](=O)[O-] ZINC000153244524 473614448 /nfs/dbraw/zinc/61/44/48/473614448.db2.gz KRYOYYOYWNSIOK-STQMWFEESA-N 0 3 337.420 2.949 20 5 EFBDHN C[C@@H](C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)N1[C@H](C)CC[C@H]1C ZINC000153440318 473624292 /nfs/dbraw/zinc/62/42/92/473624292.db2.gz JNQUAFJHYAPHJC-MCIONIFRSA-N 0 3 331.416 2.741 20 5 EFBDHN CN(C(=O)/C=C/c1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CCCN(C)C1 ZINC000153593453 473631202 /nfs/dbraw/zinc/63/12/02/473631202.db2.gz PQUWCNDQQQOETP-STMXVASLSA-N 0 3 337.807 2.814 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@@H]1CCN(CC2CC2)C1 ZINC000127611339 473632968 /nfs/dbraw/zinc/63/29/68/473632968.db2.gz OSXIMYBXMJCVIZ-CQSZACIVSA-N 0 3 332.404 2.817 20 5 EFBDHN CN(C)Cc1cccc(NC(=O)COc2ccc([N+](=O)[O-])cc2)c1 ZINC000127619678 473633381 /nfs/dbraw/zinc/63/33/81/473633381.db2.gz JXHYTNANVOWFDZ-UHFFFAOYSA-N 0 3 329.356 2.674 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)[C@@H](C2CC2)N2CCCC2)cc1[N+](=O)[O-] ZINC000127648922 473637606 /nfs/dbraw/zinc/63/76/06/473637606.db2.gz ICXKSMORPQZHKF-SUMWQHHRSA-N 0 3 331.416 2.955 20 5 EFBDHN CC(C)(C)OC(=O)NC[C@@H](NCc1ccccc1[N+](=O)[O-])C1CC1 ZINC000153835270 473643739 /nfs/dbraw/zinc/64/37/39/473643739.db2.gz FQBXDEZMDYCSQO-CQSZACIVSA-N 0 3 335.404 2.988 20 5 EFBDHN COc1ccc(OCCN2CCS[C@H](C)CC2)c([N+](=O)[O-])c1 ZINC000192187874 473644869 /nfs/dbraw/zinc/64/48/69/473644869.db2.gz RBELPBCMIVIPFT-GFCCVEGCSA-N 0 3 326.418 2.810 20 5 EFBDHN CC(C)OCCN1CCC(Nc2ncc(Cl)cc2[N+](=O)[O-])CC1 ZINC000153893359 473648205 /nfs/dbraw/zinc/64/82/05/473648205.db2.gz SOOVKLMZHQLWOL-UHFFFAOYSA-N 0 3 342.827 2.945 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000153945683 473652628 /nfs/dbraw/zinc/65/26/28/473652628.db2.gz LFTUBCZWMKCTNQ-CYBMUJFWSA-N 0 3 342.399 2.747 20 5 EFBDHN CC(C)C[C@@H]1OCCC[C@@H]1NCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000186340094 473654627 /nfs/dbraw/zinc/65/46/27/473654627.db2.gz RSTAYKLOAQVTEM-HOCLYGCPSA-N 0 3 335.404 2.717 20 5 EFBDHN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1N)[C@H](c1ccccc1)N(C)C ZINC000186481816 473680391 /nfs/dbraw/zinc/68/03/91/473680391.db2.gz LPDRVFVCANJBLH-SJKOYZFVSA-N 0 3 342.399 2.598 20 5 EFBDHN CCO[C@@H]1C[C@@](CO)(NC/C=C/c2ccccc2[N+](=O)[O-])C1(C)C ZINC000186580275 473693246 /nfs/dbraw/zinc/69/32/46/473693246.db2.gz GMWCLIUQZVIRAL-MQZONAICSA-N 0 3 334.416 2.764 20 5 EFBDHN NC(=O)c1ccc(CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000192600472 473695420 /nfs/dbraw/zinc/69/54/20/473695420.db2.gz CQUFRTQAWVVINA-KRWDZBQOSA-N 0 3 325.368 2.861 20 5 EFBDHN O=C(CCNc1ccccc1[N+](=O)[O-])Nc1ccc2c(c1)CNCC2 ZINC000269186528 473724069 /nfs/dbraw/zinc/72/40/69/473724069.db2.gz FYANVWMYDNNQSK-UHFFFAOYSA-N 0 3 340.383 2.681 20 5 EFBDHN C[C@H]1CN(CC2CCN(c3cc(N)ccc3[N+](=O)[O-])CC2)C[C@H](C)O1 ZINC000192788856 473726301 /nfs/dbraw/zinc/72/63/01/473726301.db2.gz KYLFOYJGBCIWDS-KBPBESRZSA-N 0 3 348.447 2.503 20 5 EFBDHN C[C@@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CCOCC1 ZINC000179838544 473740276 /nfs/dbraw/zinc/74/02/76/473740276.db2.gz RAIULMFNXMFZPP-SNVBAGLBSA-N 0 3 341.795 2.591 20 5 EFBDHN CN(Cc1cccc(F)c1)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000193315879 473780088 /nfs/dbraw/zinc/78/00/88/473780088.db2.gz FBYFSVCDAVMPLB-HNNXBMFYSA-N 0 3 334.347 2.606 20 5 EFBDHN O=C(N[C@@H]1CCN(CC2CCCC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000173279210 473792283 /nfs/dbraw/zinc/79/22/83/473792283.db2.gz HSFOEPZDDLPFLB-CYBMUJFWSA-N 0 3 335.379 2.728 20 5 EFBDHN CC(=O)c1cc(NCCCN2CCCO[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000287932037 473801696 /nfs/dbraw/zinc/80/16/96/473801696.db2.gz XHQCHCSRAFBEPS-ZDUSSCGKSA-N 0 3 335.404 2.710 20 5 EFBDHN COc1ccc(C(=O)NCCN[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000173339419 473809835 /nfs/dbraw/zinc/80/98/35/473809835.db2.gz ASIHXSSQQLUQHD-ZDUSSCGKSA-N 0 3 343.383 2.684 20 5 EFBDHN O=C1CC[C@H]2CN(CCc3ccc([N+](=O)[O-])cc3)CC[C@@H]2N1C1CC1 ZINC000246322361 473827696 /nfs/dbraw/zinc/82/76/96/473827696.db2.gz RUHKNSIRJNKLDX-YJBOKZPZSA-N 0 3 343.427 2.613 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CN(CCCO)Cc2ccccc2)c1 ZINC000269631473 473847786 /nfs/dbraw/zinc/84/77/86/473847786.db2.gz FPPCRJYEHVGWQS-SFHVURJKSA-N 0 3 330.384 2.513 20 5 EFBDHN CN1CCN(C[C@H](O)c2cccc([N+](=O)[O-])c2)Cc2ccccc21 ZINC000269648107 473850300 /nfs/dbraw/zinc/85/03/00/473850300.db2.gz FPQPRIWNQPGWCU-SFHVURJKSA-N 0 3 327.384 2.580 20 5 EFBDHN CN(C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H](CCO)c1ccccc1 ZINC000269632492 473850488 /nfs/dbraw/zinc/85/04/88/473850488.db2.gz FZWRZSHXYHIHPN-MSOLQXFVSA-N 0 3 330.384 2.684 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC1CCN(CC)CC1 ZINC000281960777 473899882 /nfs/dbraw/zinc/89/98/82/473899882.db2.gz NDBAHHYTTRWCIG-UHFFFAOYSA-N 0 3 336.392 2.599 20 5 EFBDHN CS[C@@H]1CN(c2ncc([N+](=O)[O-])cc2Cl)C[C@@H]1N1CCCC1 ZINC000274681741 473918620 /nfs/dbraw/zinc/91/86/20/473918620.db2.gz OAMKQTYDAAENCB-QWHCGFSZSA-N 0 3 342.852 2.659 20 5 EFBDHN C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)c1cc(F)c([N+](=O)[O-])cc1F ZINC000288360229 473920256 /nfs/dbraw/zinc/92/02/56/473920256.db2.gz KOTXAZNREBNRGA-WDEREUQCSA-N 0 3 339.342 2.572 20 5 EFBDHN CCC(CC)(CNCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)OC ZINC000194593519 473922886 /nfs/dbraw/zinc/92/28/86/473922886.db2.gz OLRGMQYWBSLHBD-UHFFFAOYSA-N 0 3 339.348 2.572 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCCN(CC)CC1 ZINC000282075132 473938317 /nfs/dbraw/zinc/93/83/17/473938317.db2.gz XCSHOEDLRZTNLU-UHFFFAOYSA-N 0 3 336.392 2.553 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1C(=O)NCCCCN1C[C@H](C)O[C@@H](C)C1 ZINC000194814553 473958153 /nfs/dbraw/zinc/95/81/53/473958153.db2.gz UUYDGJPJLUWPOY-GJZGRUSLSA-N 0 3 349.431 2.522 20 5 EFBDHN CSc1cccc(C(=O)NC[C@@H]2CCN(C3CC3)C2)c1[N+](=O)[O-] ZINC000188049055 473963344 /nfs/dbraw/zinc/96/33/44/473963344.db2.gz SJTZPIXUSNDFHJ-NSHDSACASA-N 0 3 335.429 2.531 20 5 EFBDHN C[C@H](NCCn1ccc([N+](=O)[O-])n1)c1ccc(Br)cc1 ZINC000181107440 474006064 /nfs/dbraw/zinc/00/60/64/474006064.db2.gz ORMIZAVCYFBULX-JTQLQIEISA-N 0 3 339.193 2.905 20 5 EFBDHN CCCCN(C)C[C@H](C)Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000288692480 474024338 /nfs/dbraw/zinc/02/43/38/474024338.db2.gz BKKATMWZOZFBMD-LBPRGKRZSA-N 0 3 343.449 2.531 20 5 EFBDHN C[C@H](NC(=O)N1CC[C@@H](N2CCCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000264584576 474048012 /nfs/dbraw/zinc/04/80/12/474048012.db2.gz KIKZMCOPFHDRSD-WMLDXEAASA-N 0 3 346.431 2.926 20 5 EFBDHN C[C@@H](NCCC(=O)Nc1ccccc1[N+](=O)[O-])c1cccc(O)c1 ZINC000181582730 474049721 /nfs/dbraw/zinc/04/97/21/474049721.db2.gz TYDZXEXGTFLVDQ-GFCCVEGCSA-N 0 3 329.356 2.980 20 5 EFBDHN O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])NCCN1CCCC1 ZINC000181852530 474066003 /nfs/dbraw/zinc/06/60/03/474066003.db2.gz GPVHXGXYQQICNR-UHFFFAOYSA-N 0 3 343.836 2.552 20 5 EFBDHN C[C@H]1CN(C)CC[C@H]1N(C)C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000247265330 474104292 /nfs/dbraw/zinc/10/42/92/474104292.db2.gz FGEHPMZTDFKWJW-WMLDXEAASA-N 0 3 348.447 2.586 20 5 EFBDHN CN(CCc1ccccc1)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182214481 474124124 /nfs/dbraw/zinc/12/41/24/474124124.db2.gz OQIKYCBTPAOWDG-MRXNPFEDSA-N 0 3 330.384 2.509 20 5 EFBDHN C[C@@H](NCc1cc([N+](=O)[O-])ccc1Cl)C1CCS(=O)(=O)CC1 ZINC000275299712 474135731 /nfs/dbraw/zinc/13/57/31/474135731.db2.gz HSCQINBWJVBARU-SNVBAGLBSA-N 0 3 346.836 2.551 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CCN(C)C[C@H]2C)c1 ZINC000247419268 474143345 /nfs/dbraw/zinc/14/33/45/474143345.db2.gz NUQJJRVSENFZDI-BXUZGUMPSA-N 0 3 337.445 2.729 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000247486848 474160125 /nfs/dbraw/zinc/16/01/25/474160125.db2.gz KXEQWXUAMMLVAM-CJNGLKHVSA-N 0 3 334.420 2.829 20 5 EFBDHN COc1ccc([C@@H](CCO)NCCOc2ccccc2[N+](=O)[O-])cc1 ZINC000182402984 474166279 /nfs/dbraw/zinc/16/62/79/474166279.db2.gz VRFKCLPSKBEWTR-MRXNPFEDSA-N 0 3 346.383 2.696 20 5 EFBDHN C[C@H]1CN(C)CC[C@H]1N(C)C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000247501822 474166759 /nfs/dbraw/zinc/16/67/59/474166759.db2.gz UZQMPAZZJYTFGO-IINYFYTJSA-N 0 3 325.796 2.660 20 5 EFBDHN C[C@H](c1ccccc1)N(CCn1cc([N+](=O)[O-])ccc1=O)C1CC1 ZINC000270556532 474169006 /nfs/dbraw/zinc/16/90/06/474169006.db2.gz IVLBIDXHQPYYRL-CQSZACIVSA-N 0 3 327.384 2.982 20 5 EFBDHN CCOc1ccc(C(=O)NCc2ccc3c(c2)CNC3)cc1[N+](=O)[O-] ZINC000188749501 474184499 /nfs/dbraw/zinc/18/44/99/474184499.db2.gz XZOMJTGSOOCVAJ-UHFFFAOYSA-N 0 3 341.367 2.527 20 5 EFBDHN COc1cc(C[NH2+][C@H]2CCO[C@@H](C(C)(C)C)C2)c([N+](=O)[O-])cc1[O-] ZINC000270601111 474185794 /nfs/dbraw/zinc/18/57/94/474185794.db2.gz ARVNIZFQUSCLNG-BLLLJJGKSA-N 0 3 338.404 2.992 20 5 EFBDHN CN(C)C1(CNC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)CCC1 ZINC000275440809 474185731 /nfs/dbraw/zinc/18/57/31/474185731.db2.gz KHXNKNXPPGKJHW-UHFFFAOYSA-N 0 3 340.811 2.532 20 5 EFBDHN COCCCN(CCO)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000188934964 474239402 /nfs/dbraw/zinc/23/94/02/474239402.db2.gz KMICDVDPZWOJGN-UHFFFAOYSA-N 0 3 334.372 2.686 20 5 EFBDHN C[C@H](C1CCN(C)CC1)N(C)C(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000270748036 474247971 /nfs/dbraw/zinc/24/79/71/474247971.db2.gz AENHOUKUKOTDGM-VIIAAUOXSA-N 0 3 331.416 2.797 20 5 EFBDHN CCN1CCN([C@@H]2CCN([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)CC1 ZINC000182766913 474251792 /nfs/dbraw/zinc/25/17/92/474251792.db2.gz WPUMLRQKTOHLLY-FUHWJXTLSA-N 0 3 346.475 2.676 20 5 EFBDHN CC(C)N1CCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000265564585 474254689 /nfs/dbraw/zinc/25/46/89/474254689.db2.gz MPAPLPRKMLMLSN-UHFFFAOYSA-N 0 3 339.823 2.733 20 5 EFBDHN O=[N+]([O-])c1cnc(NCC2(N3CCCC3)CCOCC2)c(Cl)c1 ZINC000265581792 474260085 /nfs/dbraw/zinc/26/00/85/474260085.db2.gz WPVOJVHKCJRHJI-UHFFFAOYSA-N 0 3 340.811 2.700 20 5 EFBDHN C[C@H]1C[C@@H](Nc2c(Br)cncc2[N+](=O)[O-])CCN1C ZINC000231630162 474263685 /nfs/dbraw/zinc/26/36/85/474263685.db2.gz WFDCYOAPTHQXAZ-IUCAKERBSA-N 0 3 329.198 2.647 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1CN[C@H]1CCCO[C@@H]1c1nccn1C ZINC000275729830 474297036 /nfs/dbraw/zinc/29/70/36/474297036.db2.gz ZRGUTBXJYUBECD-HOTGVXAUSA-N 0 3 330.388 2.647 20 5 EFBDHN CN(C[C@@H](O)COc1ccccc1[N+](=O)[O-])[C@H]1CCc2ccccc21 ZINC000248375152 474299602 /nfs/dbraw/zinc/29/96/02/474299602.db2.gz VVDBITHFEITYEH-WBVHZDCISA-N 0 3 342.395 2.954 20 5 EFBDHN Cc1ccncc1CCCNCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000289516183 474304166 /nfs/dbraw/zinc/30/41/66/474304166.db2.gz DKYLGQPWYSWERU-UHFFFAOYSA-N 0 3 325.372 2.897 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@@H]1CCN(C)C[C@H]1C ZINC000248399304 474306521 /nfs/dbraw/zinc/30/65/21/474306521.db2.gz VQRHKMFNJYJUNG-QGPMSJSTSA-N 0 3 347.459 2.962 20 5 EFBDHN CN(C)C1(CN(C)C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CCC1 ZINC000275755318 474306664 /nfs/dbraw/zinc/30/66/64/474306664.db2.gz BRKYBCRQDSSENR-UHFFFAOYSA-N 0 3 330.388 2.632 20 5 EFBDHN C[S@](=O)C[C@H](NCCOc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000183120103 474332636 /nfs/dbraw/zinc/33/26/36/474332636.db2.gz KTUGMBCEDJSHMU-OWJWWREXSA-N 0 3 348.424 2.683 20 5 EFBDHN COc1ccc(NC(=O)CN[C@@H]2CC[C@@H](C)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC000248563290 474357999 /nfs/dbraw/zinc/35/79/99/474357999.db2.gz NUVMKBMJTXMUBM-MBNYWOFBSA-N 0 3 335.404 2.956 20 5 EFBDHN COc1ccc(NC(=O)CN[C@@H]2CC[C@H](C)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC000248563292 474358231 /nfs/dbraw/zinc/35/82/31/474358231.db2.gz NUVMKBMJTXMUBM-SGMGOOAPSA-N 0 3 335.404 2.956 20 5 EFBDHN CC[C@H](N[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C)[C@H]1CCCO1 ZINC000248589705 474369169 /nfs/dbraw/zinc/36/91/69/474369169.db2.gz KQCHZXKOQSXQQC-DVOMOZLQSA-N 0 3 335.404 2.777 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)[C@@H](N)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000237325040 474382905 /nfs/dbraw/zinc/38/29/05/474382905.db2.gz REZBNCIVEWLEAQ-CJNGLKHVSA-N 0 3 327.384 2.650 20 5 EFBDHN C[C@@H](C1CCN(C)CC1)N(C)C(=O)/C=C/c1ccccc1[N+](=O)[O-] ZINC000271053644 474387427 /nfs/dbraw/zinc/38/74/27/474387427.db2.gz UGRJVIMXOXOWCF-VFNNOXKTSA-N 0 3 331.416 2.797 20 5 EFBDHN CCOc1ccc([C@H](C)NCC2(C(N)=O)CCCC2)cc1[N+](=O)[O-] ZINC000271061960 474392913 /nfs/dbraw/zinc/39/29/13/474392913.db2.gz CICGIVQIIHUDTO-LBPRGKRZSA-N 0 3 335.404 2.690 20 5 EFBDHN C[C@@H]1CN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)[C@H](C)CN1 ZINC000237385848 474394308 /nfs/dbraw/zinc/39/43/08/474394308.db2.gz MFVMIMPBBNCUNG-GHMZBOCLSA-N 0 3 346.412 2.541 20 5 EFBDHN O=[N+]([O-])c1ccccc1CNCC1CCN(CC(F)(F)F)CC1 ZINC000189470042 474409963 /nfs/dbraw/zinc/40/99/63/474409963.db2.gz BXSXSXHAMPYLEM-UHFFFAOYSA-N 0 3 331.338 2.959 20 5 EFBDHN CN(CCCOc1cccc(Cl)c1)CCn1ccc([N+](=O)[O-])n1 ZINC000176213821 474412929 /nfs/dbraw/zinc/41/29/29/474412929.db2.gz VCYPABPJZFXHHC-UHFFFAOYSA-N 0 3 338.795 2.846 20 5 EFBDHN COCC1(O)CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000271163791 474413767 /nfs/dbraw/zinc/41/37/67/474413767.db2.gz FJNROODUYCLCBM-UHFFFAOYSA-N 0 3 346.383 2.828 20 5 EFBDHN COc1cc(CN[C@H]2COc3c(C)cccc3C2)c([N+](=O)[O-])cc1O ZINC000289789511 474427214 /nfs/dbraw/zinc/42/72/14/474427214.db2.gz YOURUGVKNLMOME-CQSZACIVSA-N 0 3 344.367 2.711 20 5 EFBDHN CN(Cc1ccc(Br)c([N+](=O)[O-])c1)C[C@H]1CCC[C@H]1O ZINC000271231790 474455395 /nfs/dbraw/zinc/45/53/95/474455395.db2.gz CGCLJSKNKYQSLR-BXUZGUMPSA-N 0 3 343.221 2.950 20 5 EFBDHN Cc1cccc(OC[C@H](O)CN[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000266779068 474479872 /nfs/dbraw/zinc/47/98/72/474479872.db2.gz CEZUNCKNFIRGHJ-RHSMWYFYSA-N 0 3 330.384 2.994 20 5 EFBDHN CS[C@H]1CN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)C[C@H]1N(C)C ZINC000271308064 474487017 /nfs/dbraw/zinc/48/70/17/474487017.db2.gz IAVFRLBCPZUFOA-YPMHNXCESA-N 0 3 347.387 2.678 20 5 EFBDHN C[C@@H](NC[C@@H](O)COc1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000266825322 474495371 /nfs/dbraw/zinc/49/53/71/474495371.db2.gz CTQYZJRZPIULMD-MLGOLLRUSA-N 0 3 334.347 2.824 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000176548194 474496597 /nfs/dbraw/zinc/49/65/97/474496597.db2.gz FEMCETOVUGRJIM-OLZOCXBDSA-N 0 3 337.807 2.947 20 5 EFBDHN C[C@H](C(=O)N1CC[C@H]2CC[C@@H](C1)N2C)c1ccc([N+](=O)[O-])cc1F ZINC000184354284 474504304 /nfs/dbraw/zinc/50/43/04/474504304.db2.gz MQLRSFMNPQHNBG-SCRDCRAPSA-N 0 3 335.379 2.533 20 5 EFBDHN COC[C@]1(CNCc2cccc([N+](=O)[O-])c2)OCCc2ccccc21 ZINC000289979331 474511209 /nfs/dbraw/zinc/51/12/09/474511209.db2.gz WQABCOVNOLJBAP-IBGZPJMESA-N 0 3 342.395 2.799 20 5 EFBDHN Cc1cccc(C(=O)NCCN[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000266900555 474523021 /nfs/dbraw/zinc/52/30/21/474523021.db2.gz UDGWDEGKGXOTEF-AWEZNQCLSA-N 0 3 327.384 2.984 20 5 EFBDHN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)C12CCCN1CCC2 ZINC000290016700 474527912 /nfs/dbraw/zinc/52/79/12/474527912.db2.gz JOPOTMBQVTWEGV-UHFFFAOYSA-N 0 3 331.416 2.662 20 5 EFBDHN CCc1ccc(C(=O)N2CCC[C@H]2CN2CCCC2)cc1[N+](=O)[O-] ZINC000266958758 474547327 /nfs/dbraw/zinc/54/73/27/474547327.db2.gz VRKGOWDTGURDDC-INIZCTEOSA-N 0 3 331.416 2.858 20 5 EFBDHN CC[C@H](N[C@H]1CCC[C@@H](S(C)(=O)=O)C1)c1cccc([N+](=O)[O-])c1 ZINC000271506504 474573855 /nfs/dbraw/zinc/57/38/55/474573855.db2.gz NYOJOLONMJMHMJ-IMJJTQAJSA-N 0 3 340.445 2.991 20 5 EFBDHN CC[C@H](N[C@@H]1CCC[C@H](S(C)(=O)=O)C1)c1cccc([N+](=O)[O-])c1 ZINC000271506507 474574049 /nfs/dbraw/zinc/57/40/49/474574049.db2.gz NYOJOLONMJMHMJ-KBMXLJTQSA-N 0 3 340.445 2.991 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCN1CCCCC1 ZINC000184693746 474587564 /nfs/dbraw/zinc/58/75/64/474587564.db2.gz BWPGISKUIOQUCG-MRXNPFEDSA-N 0 3 333.432 2.766 20 5 EFBDHN COc1cc(C[NH2+]CC2([C@H](C)CCO)CCC2)c([N+](=O)[O-])cc1[O-] ZINC000271795458 474591814 /nfs/dbraw/zinc/59/18/14/474591814.db2.gz HSXLDVVSFCWGKY-GFCCVEGCSA-N 0 3 338.404 2.587 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H](C)N(C)C1CC1 ZINC000184733561 474597120 /nfs/dbraw/zinc/59/71/20/474597120.db2.gz DHLPMDQDVKZJAR-HIFRSBDPSA-N 0 3 333.432 2.762 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H](C)N(C)C1CC1 ZINC000184733600 474597310 /nfs/dbraw/zinc/59/73/10/474597310.db2.gz DHLPMDQDVKZJAR-ZFWWWQNUSA-N 0 3 333.432 2.762 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H](C)N(C)C1CC1 ZINC000184733618 474597773 /nfs/dbraw/zinc/59/77/73/474597773.db2.gz DHLPMDQDVKZJAR-DZGCQCFKSA-N 0 3 333.432 2.762 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)CC1CCN(C)CC1 ZINC000184758302 474602187 /nfs/dbraw/zinc/60/21/87/474602187.db2.gz HDUCUXNNICAFKJ-KRWDZBQOSA-N 0 3 347.459 2.964 20 5 EFBDHN C[C@H]1CCCN(CCNc2ccc([N+](=O)[O-])cc2N2CCOC2=O)C1 ZINC000267185905 474611923 /nfs/dbraw/zinc/61/19/23/474611923.db2.gz GKTOMICTWCQPEH-ZDUSSCGKSA-N 0 3 348.403 2.695 20 5 EFBDHN C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000249756808 474612287 /nfs/dbraw/zinc/61/22/87/474612287.db2.gz DOGNFRHJNUSRNZ-CABCVRRESA-N 0 3 348.447 2.857 20 5 EFBDHN COc1ccc(CN2CCc3ccc(O)cc3CC2)cc1[N+](=O)[O-] ZINC000609133312 480115744 /nfs/dbraw/zinc/11/57/44/480115744.db2.gz JKJRHSVHDNHEMX-UHFFFAOYSA-N 0 3 328.368 2.910 20 5 EFBDHN C[C@@H]1CN(C[C@H]2CCCN2CCc2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1 ZINC000249835957 474619415 /nfs/dbraw/zinc/61/94/15/474619415.db2.gz WHQCLXPZWFAFCB-GPMSIDNRSA-N 0 3 347.459 2.711 20 5 EFBDHN C[C@H](CN1CCCCC1)Nc1ccc([N+](=O)[O-])cc1N1CCOC1=O ZINC000267260445 474631515 /nfs/dbraw/zinc/63/15/15/474631515.db2.gz WSESFJJMMBXRBZ-CYBMUJFWSA-N 0 3 348.403 2.838 20 5 EFBDHN Cc1cc(N[C@H](C)CN2CCOCC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000272881255 474632786 /nfs/dbraw/zinc/63/27/86/474632786.db2.gz VKUZKZHFUOMCFD-CYBMUJFWSA-N 0 3 330.388 2.584 20 5 EFBDHN CC(C)n1nccc1[C@H]1OCC[C@@H]1NCc1cccc([N+](=O)[O-])c1 ZINC000284404015 474633896 /nfs/dbraw/zinc/63/38/96/474633896.db2.gz CLKWYXSMVXSWGH-RDJZCZTQSA-N 0 3 330.388 2.992 20 5 EFBDHN CN(C[C@@H]1CCCN(C)C1)c1ncc([N+](=O)[O-])cc1Br ZINC000267280505 474636788 /nfs/dbraw/zinc/63/67/88/474636788.db2.gz VDNOLRKLIFPQBN-SNVBAGLBSA-N 0 3 343.225 2.530 20 5 EFBDHN CCN(CCNC(=O)NC(C)(C)c1ccccc1[N+](=O)[O-])C1CC1 ZINC000291681240 474647821 /nfs/dbraw/zinc/64/78/21/474647821.db2.gz FHBVTVYNLSGSHS-UHFFFAOYSA-N 0 3 334.420 2.613 20 5 EFBDHN C[C@@H]1[C@@H](NC(=O)c2ccccc2[N+](=O)[O-])CCN1Cc1ccccc1 ZINC000291730266 474658840 /nfs/dbraw/zinc/65/88/40/474658840.db2.gz IGKCRKROUQGZRZ-PBHICJAKSA-N 0 3 339.395 2.988 20 5 EFBDHN C[C@@H]1CN(CCC2CCN(c3ccc([N+](=O)[O-])cn3)CC2)C[C@@H](C)O1 ZINC000267366339 474659206 /nfs/dbraw/zinc/65/92/06/474659206.db2.gz JBGQYQSMTRRHLC-HUUCEWRRSA-N 0 3 348.447 2.706 20 5 EFBDHN CN1CC[C@]2(CCN(C(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)C2)C1 ZINC000292856084 474677601 /nfs/dbraw/zinc/67/76/01/474677601.db2.gz ROUIHPFYOCKROF-HNNXBMFYSA-N 0 3 338.795 2.808 20 5 EFBDHN Cc1cc(NCCCc2cnn(C)n2)c2cc([N+](=O)[O-])ccc2n1 ZINC000292858816 474679840 /nfs/dbraw/zinc/67/98/40/474679840.db2.gz RYCXIVAWQNETIL-UHFFFAOYSA-N 0 3 326.360 2.625 20 5 EFBDHN C[C@H](Nc1ncc([N+](=O)[O-])cc1Br)C1=CCN(C)CC1 ZINC000273029705 474681481 /nfs/dbraw/zinc/68/14/81/474681481.db2.gz UUVOAIKLMABBGH-VIFPVBQESA-N 0 3 341.209 2.815 20 5 EFBDHN Cn1ncc(CCCNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)n1 ZINC000292930677 474720268 /nfs/dbraw/zinc/72/02/68/474720268.db2.gz JABPHMKMEOSUQK-UHFFFAOYSA-N 0 3 341.371 2.706 20 5 EFBDHN Cc1ccc(OC[C@H](O)CN(C)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000305314615 474730385 /nfs/dbraw/zinc/73/03/85/474730385.db2.gz MNVIZUGQMDIXQQ-MRXNPFEDSA-N 0 3 330.384 2.775 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)CN1C1CC1 ZINC000267976841 474733854 /nfs/dbraw/zinc/73/38/54/474733854.db2.gz NRXQGBHDXNABHZ-JSGCOSHPSA-N 0 3 331.416 2.614 20 5 EFBDHN CCc1oc(CNCCc2ccc([N+](=O)[O-])cc2)cc1C(=O)OC ZINC000338944084 474760071 /nfs/dbraw/zinc/76/00/71/474760071.db2.gz OVNDSFFATHSKME-UHFFFAOYSA-N 0 3 332.356 2.869 20 5 EFBDHN O=[N+]([O-])c1cccc(CNCc2cccc(N3CCOCC3)c2)c1 ZINC000293010752 474764314 /nfs/dbraw/zinc/76/43/14/474764314.db2.gz PSJFRGJEXALYEA-UHFFFAOYSA-N 0 3 327.384 2.721 20 5 EFBDHN CC(C)(C)[C@H](CO)NCc1ccc(Br)c([N+](=O)[O-])c1 ZINC000278674394 474770216 /nfs/dbraw/zinc/77/02/16/474770216.db2.gz LTTYPDDQTQSDPR-LBPRGKRZSA-N 0 3 331.210 2.854 20 5 EFBDHN CC(C)Oc1ccc([C@H](CNc2ncc([N+](=O)[O-])cn2)N(C)C)cc1 ZINC000340923667 474783293 /nfs/dbraw/zinc/78/32/93/474783293.db2.gz WGWMSQWRFBBHIS-INIZCTEOSA-N 0 3 345.403 2.887 20 5 EFBDHN Cn1ncc(CCCNCc2ccc(-c3ccccc3[N+](=O)[O-])o2)n1 ZINC000293056616 474790454 /nfs/dbraw/zinc/79/04/54/474790454.db2.gz ULXPXSVCPDIGQT-UHFFFAOYSA-N 0 3 341.371 2.706 20 5 EFBDHN CCN1CCC(NC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000268095210 474793454 /nfs/dbraw/zinc/79/34/54/474793454.db2.gz LWFPYJLKUZIVDH-UHFFFAOYSA-N 0 3 340.811 2.532 20 5 EFBDHN COc1cc(C[NH2+]CCc2c[nH]c3ncccc23)c([N+](=O)[O-])cc1[O-] ZINC000344852826 474801143 /nfs/dbraw/zinc/80/11/43/474801143.db2.gz WZWRJSXZXVIDHV-UHFFFAOYSA-N 0 3 342.355 2.518 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@@H]2CCCC23CCOCC3)c([N+](=O)[O-])c1 ZINC000284905255 474821416 /nfs/dbraw/zinc/82/14/16/474821416.db2.gz UYYRZRBLTVIXGP-OAHLLOKOSA-N 0 3 335.360 2.942 20 5 EFBDHN Nc1ccc(NC2CCN(Cc3ccccc3)CC2)nc1[N+](=O)[O-] ZINC000310473597 474825796 /nfs/dbraw/zinc/82/57/96/474825796.db2.gz CBKLBXDJHAYLGX-UHFFFAOYSA-N 0 3 327.388 2.649 20 5 EFBDHN CN(C)CCOc1cccc(NC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000337253514 474828981 /nfs/dbraw/zinc/82/89/81/474828981.db2.gz LSZBWXOVQCAJTI-UHFFFAOYSA-N 0 3 329.356 2.788 20 5 EFBDHN C[C@@H](NCc1ccc2c(c1)OCCO2)c1ccc(N)c([N+](=O)[O-])c1 ZINC000284934102 474831166 /nfs/dbraw/zinc/83/11/66/474831166.db2.gz DNUPIHWGSABZGP-LLVKDONJSA-N 0 3 329.356 2.799 20 5 EFBDHN C[C@H](N[C@H]1CCN(c2ccccn2)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000284977869 474850377 /nfs/dbraw/zinc/85/03/77/474850377.db2.gz GAHZFDGZMVKSMJ-JSGCOSHPSA-N 0 3 327.388 2.502 20 5 EFBDHN O=C(NCC1CC1)[C@@H]1CCCN(C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000255567192 474874660 /nfs/dbraw/zinc/87/46/60/474874660.db2.gz ZDGFIQNLHCYETF-GPCFVJJQSA-N 0 3 343.427 2.846 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CN(C3CC3)C[C@@H]2C)c1 ZINC000268285171 474906150 /nfs/dbraw/zinc/90/61/50/474906150.db2.gz XYAIOKZBTPYHTO-HZMBPMFUSA-N 0 3 335.429 2.529 20 5 EFBDHN C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H]2CCN(C)C[C@H]21 ZINC000273457664 474908060 /nfs/dbraw/zinc/90/80/60/474908060.db2.gz DXRAJGZKRUOVSK-FZDCUMRKSA-N 0 3 329.400 2.551 20 5 EFBDHN CS[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2C)C[C@H]1N1CCCC1 ZINC000273475198 474917924 /nfs/dbraw/zinc/91/79/24/474917924.db2.gz HQVXVVMCWWBZGH-HZPDHXFCSA-N 0 3 349.456 2.555 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCN(C2CCC2)C[C@H](C)C1 ZINC000292243453 474920310 /nfs/dbraw/zinc/92/03/10/474920310.db2.gz DESBTSGWNLAEKG-ZDUSSCGKSA-N 0 3 347.415 2.550 20 5 EFBDHN CN1CC[C@@]2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)C2)C1 ZINC000292245070 474921683 /nfs/dbraw/zinc/92/16/83/474921683.db2.gz OMVVYCJLGMKBCU-QGZVFWFLSA-N 0 3 345.424 2.977 20 5 EFBDHN C[C@@H](C1CCN(C)CC1)N(C)C(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000273485464 474924101 /nfs/dbraw/zinc/92/41/01/474924101.db2.gz RJHUGLSTOWPMJH-NSHDSACASA-N 0 3 338.383 2.928 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)CCN(C)Cc1occc1C ZINC000292298018 474948433 /nfs/dbraw/zinc/94/84/33/474948433.db2.gz MPEJHSXZSMEMFE-UHFFFAOYSA-N 0 3 347.371 2.965 20 5 EFBDHN C[C@H](NC[C@@H](O)CCc1ccccc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000285270453 474953095 /nfs/dbraw/zinc/95/30/95/474953095.db2.gz QTBIUMNAYDGHIU-BBRMVZONSA-N 0 3 329.400 2.821 20 5 EFBDHN CN1CC[C@@]2(CCN(c3cc(Br)ccc3[N+](=O)[O-])C2)C1 ZINC000292307367 474953063 /nfs/dbraw/zinc/95/30/63/474953063.db2.gz NYRRKRCFWIRPOL-CQSZACIVSA-N 0 3 340.221 2.889 20 5 EFBDHN CS[C@H]1CN(C(=O)c2ccc(C)c([N+](=O)[O-])c2)C[C@H]1N1CCCC1 ZINC000273545215 474955192 /nfs/dbraw/zinc/95/51/92/474955192.db2.gz UNKISNZTVXEPJI-CVEARBPZSA-N 0 3 349.456 2.555 20 5 EFBDHN COc1ccc(NC(=O)CCN(C)Cc2occc2C)c([N+](=O)[O-])c1 ZINC000292312422 474956428 /nfs/dbraw/zinc/95/64/28/474956428.db2.gz NMBLQNNASBURHK-UHFFFAOYSA-N 0 3 347.371 2.965 20 5 EFBDHN Cc1ccccc1CN1CCC(Nc2ncc([N+](=O)[O-])cn2)CC1 ZINC000273593929 474980608 /nfs/dbraw/zinc/98/06/08/474980608.db2.gz HUQPJQWYOMWJFJ-UHFFFAOYSA-N 0 3 327.388 2.770 20 5 EFBDHN C[C@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1OCCc2sccc21 ZINC000292380772 474994055 /nfs/dbraw/zinc/99/40/55/474994055.db2.gz JRSDIJQUJBGNQG-CXMBCZLWSA-N 0 3 348.424 2.982 20 5 EFBDHN Cc1c(C(=O)N2CCN(C3CCC3)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000292441275 475028021 /nfs/dbraw/zinc/02/80/21/475028021.db2.gz RPXKZXDCGQFLEO-ZDUSSCGKSA-N 0 3 331.416 2.850 20 5 EFBDHN C[C@@H](NC(=O)NC(C)(C)c1ccccc1[N+](=O)[O-])C1=CCN(C)CC1 ZINC000292443022 475030035 /nfs/dbraw/zinc/03/00/35/475030035.db2.gz XEWMIVPKGSGAAR-CYBMUJFWSA-N 0 3 346.431 2.780 20 5 EFBDHN COc1cc(CNCCc2cccc(C)n2)c([N+](=O)[O-])cc1OC ZINC000280590209 475036030 /nfs/dbraw/zinc/03/60/30/475036030.db2.gz NENUWTPRGJPARR-UHFFFAOYSA-N 0 3 331.372 2.648 20 5 EFBDHN C[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CCN1C ZINC000341286071 475038266 /nfs/dbraw/zinc/03/82/66/475038266.db2.gz PYIDGYURCKGHFT-UKRRQHHQSA-N 0 3 326.400 2.973 20 5 EFBDHN C[C@H](c1ccccc1)N1CCC(Nc2c([N+](=O)[O-])ncn2C)CC1 ZINC000341492085 475088374 /nfs/dbraw/zinc/08/83/74/475088374.db2.gz WEKICYKNPWXHKN-CYBMUJFWSA-N 0 3 329.404 2.966 20 5 EFBDHN Cc1c(NC(=O)[C@@H](C)N2CCCN(C(C)C)CC2)cccc1[N+](=O)[O-] ZINC000292579226 475097505 /nfs/dbraw/zinc/09/75/05/475097505.db2.gz UEPQYZXJQRAIML-OAHLLOKOSA-N 0 3 348.447 2.646 20 5 EFBDHN CCc1ccc(C(=O)N2CC[C@@H](N3CCCC3)[C@@H]2C)cc1[N+](=O)[O-] ZINC000287356087 475110612 /nfs/dbraw/zinc/11/06/12/475110612.db2.gz WMYDJAPBPNABIR-XJKSGUPXSA-N 0 3 331.416 2.856 20 5 EFBDHN CC[C@@H]1CN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)CCCO1 ZINC000281217299 475120354 /nfs/dbraw/zinc/12/03/54/475120354.db2.gz BLTWFGIHZJZEFF-OAHLLOKOSA-N 0 3 335.404 2.733 20 5 EFBDHN O=[N+]([O-])c1ccc(Cl)cc1N1CCN(CC2CCOCC2)CC1 ZINC000287407473 475133600 /nfs/dbraw/zinc/13/36/00/475133600.db2.gz SOFUYJAXSQXKHY-UHFFFAOYSA-N 0 3 339.823 2.797 20 5 EFBDHN N[C@H](Cc1ccccc1)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000269050485 475148260 /nfs/dbraw/zinc/14/82/60/475148260.db2.gz KHSWIEPHSCJFKA-GOSISDBHSA-N 0 3 341.411 2.604 20 5 EFBDHN COc1cc(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)c([N+](=O)[O-])cc1F ZINC000296041242 475175551 /nfs/dbraw/zinc/17/55/51/475175551.db2.gz ODDSQROMRYTWQF-LYRGGWFBSA-N 0 3 336.363 2.790 20 5 EFBDHN CCCN(CCN1CCCC1)C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000287520544 475181204 /nfs/dbraw/zinc/18/12/04/475181204.db2.gz VGBQZSKSDJOIBK-UHFFFAOYSA-N 0 3 333.432 2.862 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)c([N+](=O)[O-])c1 ZINC000296146235 475208913 /nfs/dbraw/zinc/20/89/13/475208913.db2.gz XOWHAAAFCQAQQN-IMJJTQAJSA-N 0 3 347.371 2.940 20 5 EFBDHN C[C@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)CCN(C2CC2)C1 ZINC000296173778 475215401 /nfs/dbraw/zinc/21/54/01/475215401.db2.gz GBVZJTXFAVVQQG-LLVKDONJSA-N 0 3 336.367 2.682 20 5 EFBDHN CCn1cc([C@H](C)NCCC(=O)Nc2cccc([N+](=O)[O-])c2C)cn1 ZINC000296191709 475220306 /nfs/dbraw/zinc/22/03/06/475220306.db2.gz UWBIOYAXHWCEHW-ZDUSSCGKSA-N 0 3 345.403 2.799 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCN(C2CC2)C1 ZINC000361159168 475230988 /nfs/dbraw/zinc/23/09/88/475230988.db2.gz ISGMEYZDVBPDNU-HUUCEWRRSA-N 0 3 331.416 2.516 20 5 EFBDHN C[C@H](C(=O)NC[C@H]1CCCCN1C1CC1)c1ccc([N+](=O)[O-])cc1F ZINC000347328434 475234911 /nfs/dbraw/zinc/23/49/11/475234911.db2.gz AHUWBESNACVISU-SWLSCSKDSA-N 0 3 349.406 2.971 20 5 EFBDHN O=C(CCc1cccc([N+](=O)[O-])c1)NC[C@H]1NCCc2ccccc21 ZINC000262467593 475246746 /nfs/dbraw/zinc/24/67/46/475246746.db2.gz XYDQRBXDTQHZRG-GOSISDBHSA-N 0 3 339.395 2.531 20 5 EFBDHN CNc1c(C(=O)N[C@@H](C)CN2C[C@H](C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000361180713 475250638 /nfs/dbraw/zinc/25/06/38/475250638.db2.gz UETWBTDCTSYILC-MJBXVCDLSA-N 0 3 348.447 2.733 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(C)CC[C@@H]1C ZINC000361197754 475263694 /nfs/dbraw/zinc/26/36/94/475263694.db2.gz AHRLJDBZJRTNTA-GOEBONIOSA-N 0 3 333.432 2.716 20 5 EFBDHN CCOc1ccc(C(=O)N[C@@H](C)CN2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000347367070 475270449 /nfs/dbraw/zinc/27/04/49/475270449.db2.gz FEOFPUIWRHJYDZ-KGLIPLIRSA-N 0 3 349.431 2.844 20 5 EFBDHN Cc1cc(CN(C)C)cc(NC(=O)c2c(N)cccc2[N+](=O)[O-])c1 ZINC000354604435 475283181 /nfs/dbraw/zinc/28/31/81/475283181.db2.gz VNKHZEGZQBDHQC-UHFFFAOYSA-N 0 3 328.372 2.799 20 5 EFBDHN C[C@@H]1[C@@H](O)CCCN1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000296369244 475285783 /nfs/dbraw/zinc/28/57/83/475285783.db2.gz SNIBFFNKGAWAHT-DOMZBBRYSA-N 0 3 331.372 2.638 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CC3(CCOCC3)[C@@H]2C2CC2)c1 ZINC000296421822 475307141 /nfs/dbraw/zinc/30/71/41/475307141.db2.gz XZTRWWSUIXYQOL-SJORKVTESA-N 0 3 332.400 2.519 20 5 EFBDHN CN1CCCC(C)(C)[C@@H]1CNC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000347490178 475317833 /nfs/dbraw/zinc/31/78/33/475317833.db2.gz GXIOEYVDDVMBMS-INIZCTEOSA-N 0 3 348.447 2.557 20 5 EFBDHN CC[C@H](c1ccccc1OC)N(C)CCn1cc([N+](=O)[O-])ccc1=O ZINC000347556465 475325358 /nfs/dbraw/zinc/32/53/58/475325358.db2.gz IDTCHTKDRDDQJY-MRXNPFEDSA-N 0 3 345.399 2.848 20 5 EFBDHN CC(C)C[C@H]1CCCN1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000354684972 475336323 /nfs/dbraw/zinc/33/63/23/475336323.db2.gz NXPHAELGQDTUIQ-OAHLLOKOSA-N 0 3 331.416 2.994 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C\CN[C@H](C1CC1)[C@]1(CO)CCCO1 ZINC000354720721 475357995 /nfs/dbraw/zinc/35/79/95/475357995.db2.gz PATFTTHRZKYALK-GPGHGMIHSA-N 0 3 332.400 2.518 20 5 EFBDHN C[C@H]1CN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H](C)N1C ZINC000339625053 475359888 /nfs/dbraw/zinc/35/98/88/475359888.db2.gz WRMGIMZFBGPJLB-KBPBESRZSA-N 0 3 344.415 2.817 20 5 EFBDHN COCC[C@H](N[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)C(C)(C)C ZINC000337836724 475364835 /nfs/dbraw/zinc/36/48/35/475364835.db2.gz CMRLEIRAUOAGCT-HOTGVXAUSA-N 0 3 349.431 2.741 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CN[C@@H]1CCO[C@@H](C(F)(F)F)C1 ZINC000348103485 475392306 /nfs/dbraw/zinc/39/23/06/475392306.db2.gz CFZZMDRKGCUUNE-ZWNOBZJWSA-N 0 3 334.294 2.803 20 5 EFBDHN C[C@H](NC(=O)N[C@@H](C)C1=CCN(C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000296610436 475393800 /nfs/dbraw/zinc/39/38/00/475393800.db2.gz KAUBZFQQUXARTP-STQMWFEESA-N 0 3 332.404 2.605 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@H](C)N1CCCC[C@@H]1C ZINC000348116479 475403251 /nfs/dbraw/zinc/40/32/51/475403251.db2.gz JZWIFBNEQXWELS-KBPBESRZSA-N 0 3 349.431 2.986 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@H](C)N1CCCC[C@H]1C ZINC000348116480 475404051 /nfs/dbraw/zinc/40/40/51/475404051.db2.gz JZWIFBNEQXWELS-KGLIPLIRSA-N 0 3 349.431 2.986 20 5 EFBDHN CN(C)CCO[C@@H]1CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000339680204 475404173 /nfs/dbraw/zinc/40/41/73/475404173.db2.gz BJUAUUKFVXFZCW-GFCCVEGCSA-N 0 3 347.337 2.771 20 5 EFBDHN C[C@H]1[C@H](NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)CCCN1C ZINC000345750744 475420033 /nfs/dbraw/zinc/42/00/33/475420033.db2.gz OHPWTCQFYNTGEB-SUMWQHHRSA-N 0 3 346.431 2.752 20 5 EFBDHN C[C@H](NC[C@@H](O)COc1ccccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000296687145 475429826 /nfs/dbraw/zinc/42/98/26/475429826.db2.gz JGLPSUSYYHPCNW-SWLSCSKDSA-N 0 3 334.347 2.824 20 5 EFBDHN CN(CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@@H]1CCC(C)(C)C1 ZINC000361469858 475474777 /nfs/dbraw/zinc/47/47/77/475474777.db2.gz OPVLVLBJTDHCLZ-OAHLLOKOSA-N 0 3 331.416 2.994 20 5 EFBDHN C[C@@H](Cn1cccn1)NCCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000354920103 475521325 /nfs/dbraw/zinc/52/13/25/475521325.db2.gz NCWPMVUNBOFKFY-ZDUSSCGKSA-N 0 3 341.371 2.667 20 5 EFBDHN CC[C@H](NCc1cc([N+](=O)[O-])cc2c1OCOC2)C1CCOCC1 ZINC000332148877 475531477 /nfs/dbraw/zinc/53/14/77/475531477.db2.gz MNAOQEVXCWNZLW-INIZCTEOSA-N 0 3 336.388 2.756 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@]2(C1)CCCN(C)C2 ZINC000296915011 475532895 /nfs/dbraw/zinc/53/28/95/475532895.db2.gz PFKGURMSAWUWPX-QGZVFWFLSA-N 0 3 332.404 2.853 20 5 EFBDHN Cc1cc(F)c(NC(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000296926864 475538985 /nfs/dbraw/zinc/53/89/85/475538985.db2.gz ZNHDSRREFHZXSQ-BXUZGUMPSA-N 0 3 338.383 2.893 20 5 EFBDHN CCN(CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H]1CCOC1 ZINC000361597074 475584850 /nfs/dbraw/zinc/58/48/50/475584850.db2.gz WVEHCMHXCOWCBF-OAHLLOKOSA-N 0 3 331.372 2.903 20 5 EFBDHN C[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1F)N1CCCC[C@H]1C ZINC000358327286 475593257 /nfs/dbraw/zinc/59/32/57/475593257.db2.gz FYGDVLFBXQWHMT-OLZOCXBDSA-N 0 3 337.395 2.656 20 5 EFBDHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000346464289 475605929 /nfs/dbraw/zinc/60/59/29/475605929.db2.gz SZDXHBVATOCKCU-INIZCTEOSA-N 0 3 344.415 2.809 20 5 EFBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[C@H](N2CCN(C)CC2)[C@H](C)C1 ZINC000332394240 475625208 /nfs/dbraw/zinc/62/52/08/475625208.db2.gz NWMSVDZROBHDJZ-MDZRGWNJSA-N 0 3 346.475 2.614 20 5 EFBDHN COc1ccc(OCCN2C[C@H]3CCCCN3C[C@H]2C)c([N+](=O)[O-])c1 ZINC000332423291 475632783 /nfs/dbraw/zinc/63/27/83/475632783.db2.gz AQWQHRKPSXTMDG-HUUCEWRRSA-N 0 3 349.431 2.541 20 5 EFBDHN COc1ccc([C@H](CNc2ccc([N+](=O)[O-])nc2)N(C)C)cc1OC ZINC000339961095 475642223 /nfs/dbraw/zinc/64/22/23/475642223.db2.gz XNKLCFOAJMIIOS-AWEZNQCLSA-N 0 3 346.387 2.722 20 5 EFBDHN Cc1ccc([C@H](CNC(=O)c2ccc([N+](=O)[O-])[nH]2)N2CCCC2)cc1 ZINC000346552977 475653881 /nfs/dbraw/zinc/65/38/81/475653881.db2.gz DEJCUNVUVQHJQY-INIZCTEOSA-N 0 3 342.399 2.798 20 5 EFBDHN CC[C@H]1CN2CCC[C@@H]2CN1C(=O)CSc1ccccc1[N+](=O)[O-] ZINC000332577175 475674451 /nfs/dbraw/zinc/67/44/51/475674451.db2.gz GKLSCFCFYHOIFJ-UONOGXRCSA-N 0 3 349.456 2.772 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000358447831 475687085 /nfs/dbraw/zinc/68/70/85/475687085.db2.gz QZXZJEZDMVBBIO-HNNXBMFYSA-N 0 3 334.420 2.577 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nc(CNC[C@H](CO)C3CC3)cs2)c1 ZINC000353126080 475701657 /nfs/dbraw/zinc/70/16/57/475701657.db2.gz RMLLAMNNMRZSPZ-CYBMUJFWSA-N 0 3 333.413 2.826 20 5 EFBDHN CCOc1ccc(C(=O)NC[C@H](C)N2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000343070576 475741208 /nfs/dbraw/zinc/74/12/08/475741208.db2.gz FDICAPGZAGUNRV-KGLIPLIRSA-N 0 3 349.431 2.986 20 5 EFBDHN Cc1ccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000338285098 475747831 /nfs/dbraw/zinc/74/78/31/475747831.db2.gz MYNAMJVADSLZSF-LJQANCHMSA-N 0 3 341.411 2.952 20 5 EFBDHN COc1ccc(C(=O)NC[C@@H](C)N2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000343081994 475751206 /nfs/dbraw/zinc/75/12/06/475751206.db2.gz VQQFTMFHGKAGNI-CHWSQXEVSA-N 0 3 335.404 2.596 20 5 EFBDHN O=[N+]([O-])c1ccc(CNC[C@]2(CO)C[C@@H]2c2ccccc2)c(F)c1 ZINC000353191902 475758242 /nfs/dbraw/zinc/75/82/42/475758242.db2.gz LAFOVIZMUDXOIF-AEFFLSMTSA-N 0 3 330.359 2.990 20 5 EFBDHN NC(=O)[C@@H](CNCc1ccc([N+](=O)[O-])cc1)Cc1ccccc1Cl ZINC000346680898 475758674 /nfs/dbraw/zinc/75/86/74/475758674.db2.gz XZQPSBOROLMMPF-CQSZACIVSA-N 0 3 347.802 2.682 20 5 EFBDHN Cc1c(CNC(=O)N[C@@H](C)CN2CCCCC2)cccc1[N+](=O)[O-] ZINC000358545197 475760913 /nfs/dbraw/zinc/76/09/13/475760913.db2.gz MHGDKJSGRFDXET-ZDUSSCGKSA-N 0 3 334.420 2.577 20 5 EFBDHN C[C@@H](NC(=O)N1CCN(C2CC2)C[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000297472579 475770775 /nfs/dbraw/zinc/77/07/75/475770775.db2.gz UVXKMGNOFIOTAK-UONOGXRCSA-N 0 3 346.431 2.782 20 5 EFBDHN C[C@@H](NC(=O)N1CC[C@@]2(C1)CCCN(C)C2)c1ccccc1[N+](=O)[O-] ZINC000297509775 475789244 /nfs/dbraw/zinc/78/92/44/475789244.db2.gz YVVWUDBEASEGBF-KDOFPFPSSA-N 0 3 346.431 2.783 20 5 EFBDHN C[C@@H](C(=O)N(C)CCc1cccc([N+](=O)[O-])c1)N1[C@H](C)CC[C@H]1C ZINC000338334932 475797582 /nfs/dbraw/zinc/79/75/82/475797582.db2.gz UCGHKKGJRRQIOF-KFWWJZLASA-N 0 3 333.432 2.857 20 5 EFBDHN C[C@H](NC(=O)N1CC[C@]2(C1)CCCN(C)C2)c1ccc([N+](=O)[O-])cc1 ZINC000297552665 475804401 /nfs/dbraw/zinc/80/44/01/475804401.db2.gz JWXYGASRZLYBAK-KBXCAEBGSA-N 0 3 346.431 2.783 20 5 EFBDHN C[C@H](NC(=O)N(C)C[C@H]1CCCN(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000297593284 475819909 /nfs/dbraw/zinc/81/99/09/475819909.db2.gz MWDPMLXFVGMNTJ-KBPBESRZSA-N 0 3 334.420 2.639 20 5 EFBDHN Cc1ncc(C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])c(=O)[n-]1 ZINC000346812364 475879491 /nfs/dbraw/zinc/87/94/91/475879491.db2.gz WMBSXFBFBVFNNB-CZUORRHYSA-N 0 3 342.399 2.900 20 5 EFBDHN CN(C)CCOC1CCN(c2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000343261822 475901098 /nfs/dbraw/zinc/90/10/98/475901098.db2.gz CQILYISYJQNMTK-UHFFFAOYSA-N 0 3 344.415 2.690 20 5 EFBDHN CS[C@@H]1CN(Cc2c(F)cccc2[N+](=O)[O-])C[C@H]1N1CCCC1 ZINC000358814480 475961648 /nfs/dbraw/zinc/96/16/48/475961648.db2.gz UKZKCXOODKHVBL-HZPDHXFCSA-N 0 3 339.436 2.746 20 5 EFBDHN CS[C@@H]1CN(Cc2c(F)cccc2[N+](=O)[O-])C[C@@H]1N1CCCC1 ZINC000358814481 475962322 /nfs/dbraw/zinc/96/23/22/475962322.db2.gz UKZKCXOODKHVBL-JKSUJKDBSA-N 0 3 339.436 2.746 20 5 EFBDHN CN(CCc1ccccc1[N+](=O)[O-])Cc1ccc2c(c1)oc(=O)n2C ZINC000353454604 475982995 /nfs/dbraw/zinc/98/29/95/475982995.db2.gz KTXBPEMNBQYIEH-UHFFFAOYSA-N 0 3 341.367 2.714 20 5 EFBDHN C[C@@H]1CCN(C)CCN1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000353456394 475985117 /nfs/dbraw/zinc/98/51/17/475985117.db2.gz VVHDRVREDBCHQU-CQSZACIVSA-N 0 3 343.431 2.521 20 5 EFBDHN Cc1nn(C)c(N[C@H]2CCN([C@H](C)c3ccccc3)C2)c1[N+](=O)[O-] ZINC000358881190 476009632 /nfs/dbraw/zinc/00/96/32/476009632.db2.gz NJCQUGLZUCGIAV-HIFRSBDPSA-N 0 3 329.404 2.884 20 5 EFBDHN CC[C@H](NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCOCC1 ZINC000343402000 476030435 /nfs/dbraw/zinc/03/04/35/476030435.db2.gz KORFHDKNVRFBFY-HNNXBMFYSA-N 0 3 346.387 2.940 20 5 EFBDHN CCn1ccnc1[C@@H]1OCC[C@H]1NC/C=C/c1ccccc1[N+](=O)[O-] ZINC000343409024 476039047 /nfs/dbraw/zinc/03/90/47/476039047.db2.gz ZSNHXVJGPMBQHY-NDOICKTLSA-N 0 3 342.399 2.944 20 5 EFBDHN CC(=O)N1CCC(NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000340474794 476059174 /nfs/dbraw/zinc/05/91/74/476059174.db2.gz XUKBIBOCLATZFF-UHFFFAOYSA-N 0 3 343.383 2.955 20 5 EFBDHN C[C@@H]1C[C@H](N2CCCC2)CN1c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000343593036 476091766 /nfs/dbraw/zinc/09/17/66/476091766.db2.gz PBIMYMXOJCPLJT-DOMZBBRYSA-N 0 3 343.387 2.708 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@H](CO)Cc2c[nH]c3ccccc23)c(F)c1 ZINC000350285456 476119822 /nfs/dbraw/zinc/11/98/22/476119822.db2.gz GRZCCBJMINCBKJ-AWEZNQCLSA-N 0 3 343.358 2.908 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CNC[C@H]2COCCO2)s1 ZINC000338716250 476128985 /nfs/dbraw/zinc/12/89/85/476128985.db2.gz OWBAPOGDXQOGOP-LBPRGKRZSA-N 0 3 334.397 2.828 20 5 EFBDHN COc1c(C(=O)NCc2ccc(CN(C)C)cc2)cccc1[N+](=O)[O-] ZINC000353686430 476187961 /nfs/dbraw/zinc/18/79/61/476187961.db2.gz PRWLRGRKEBVSDF-UHFFFAOYSA-N 0 3 343.383 2.595 20 5 EFBDHN C[C@@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)CCN1C ZINC000340697205 476213862 /nfs/dbraw/zinc/21/38/62/476213862.db2.gz QBWREZPIOLSPDC-NXEZZACHSA-N 0 3 345.321 2.826 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)CCN1C ZINC000340697207 476214507 /nfs/dbraw/zinc/21/45/07/476214507.db2.gz QBWREZPIOLSPDC-UWVGGRQHSA-N 0 3 345.321 2.826 20 5 EFBDHN CC[C@H](NCc1cc([N+](=O)[O-])ccc1OC)C1(C(=O)OC)CCC1 ZINC000353842687 476298481 /nfs/dbraw/zinc/29/84/81/476298481.db2.gz NDRKVTVXLCFUMH-HNNXBMFYSA-N 0 3 336.388 2.815 20 5 EFBDHN CN(Cc1ccccc1)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])[nH]1)C1CC1 ZINC000357307276 476324269 /nfs/dbraw/zinc/32/42/69/476324269.db2.gz QRYFHUHDHWHWOJ-INIZCTEOSA-N 0 3 342.399 2.563 20 5 EFBDHN CN(C[C@H]1CCN(C)[C@@H]1c1cccnc1)c1ccc([N+](=O)[O-])nc1 ZINC000362677254 476348499 /nfs/dbraw/zinc/34/84/99/476348499.db2.gz XLXJKBSNVUCTGF-RHSMWYFYSA-N 0 3 327.388 2.514 20 5 EFBDHN COc1ccc(NC(=O)c2cccc(CN(C)C)c2)cc1[N+](=O)[O-] ZINC000360741992 476360399 /nfs/dbraw/zinc/36/03/99/476360399.db2.gz ZJZSLNUHGVAYMS-UHFFFAOYSA-N 0 3 329.356 2.917 20 5 EFBDHN CC(C)[C@H](C(=O)NCCNc1ccc([N+](=O)[O-])cc1)N1CCCCC1 ZINC000354068264 476403148 /nfs/dbraw/zinc/40/31/48/476403148.db2.gz MZVOFCXDKMSNRG-QGZVFWFLSA-N 0 3 348.447 2.633 20 5 EFBDHN COc1c(C(=O)Nc2ccc(CN(C)C)cc2)cccc1[N+](=O)[O-] ZINC000354116245 476437584 /nfs/dbraw/zinc/43/75/84/476437584.db2.gz XOMLWPSPZOVZKN-UHFFFAOYSA-N 0 3 329.356 2.917 20 5 EFBDHN CC(C)[C@@H](C(=O)NCCNc1ccccc1[N+](=O)[O-])N1CCCCC1 ZINC000354137851 476455181 /nfs/dbraw/zinc/45/51/81/476455181.db2.gz HZUNPIHGSVDKRN-KRWDZBQOSA-N 0 3 348.447 2.633 20 5 EFBDHN CSc1cccc(C(=O)N[C@@H]2CN(C3CC3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000362927179 476486328 /nfs/dbraw/zinc/48/63/28/476486328.db2.gz GVNHLQYPLBSSDC-GXFFZTMASA-N 0 3 335.429 2.529 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCC1=CCN(C)CC1 ZINC000360945351 476494194 /nfs/dbraw/zinc/49/41/94/476494194.db2.gz RJBAGTGQQWHAEK-INIZCTEOSA-N 0 3 331.416 2.542 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCN(CCCO)Cc1ccccc1 ZINC000362950473 476498049 /nfs/dbraw/zinc/49/80/49/476498049.db2.gz CROOOPWUGDGNJF-UHFFFAOYSA-N 0 3 330.384 2.858 20 5 EFBDHN CS[C@H]1CN(c2cc([N+](=O)[O-])ccc2C(C)=O)C[C@H]1N1CCCC1 ZINC000361016524 476546278 /nfs/dbraw/zinc/54/62/78/476546278.db2.gz ZIYAMDSXHNAYKH-SJORKVTESA-N 0 3 349.456 2.813 20 5 EFBDHN CCn1c(C)nc([N+](=O)[O-])c1NCC1CCN(c2ccncc2)CC1 ZINC000361056364 476570805 /nfs/dbraw/zinc/57/08/05/476570805.db2.gz HGFDREYLULLQNT-UHFFFAOYSA-N 0 3 344.419 2.843 20 5 EFBDHN O=[N+]([O-])c1cc(CNc2cccc(CN3CC[C@@H](O)C3)c2)cs1 ZINC000361074546 476583348 /nfs/dbraw/zinc/58/33/48/476583348.db2.gz CFRWLYYVUMQMPH-OAHLLOKOSA-N 0 3 333.413 2.835 20 5 EFBDHN CNc1c(C(=O)NCc2ccccc2CN(C)C)cccc1[N+](=O)[O-] ZINC000361124878 476618063 /nfs/dbraw/zinc/61/80/63/476618063.db2.gz UZKUDVYCUQUHGK-UHFFFAOYSA-N 0 3 342.399 2.628 20 5 EFBDHN COc1cc(C[NH2+]C[C@@]2(C)CCO[C@@H]2C2CC2)c([N+](=O)[O-])cc1[O-] ZINC000375121554 476682046 /nfs/dbraw/zinc/68/20/46/476682046.db2.gz RWLQCRPPBBTDEH-IAGOWNOFSA-N 0 3 336.388 2.604 20 5 EFBDHN Cc1cc(N2CC[C@@H]3CCN(C)C[C@@H]32)c2cccc([N+](=O)[O-])c2n1 ZINC000378508161 476717092 /nfs/dbraw/zinc/71/70/92/476717092.db2.gz OWDSASWMSUMHJU-GUYCJALGSA-N 0 3 326.400 2.982 20 5 EFBDHN COc1cccc([C@@H]2C[C@H](C)CN2CCn2cc([N+](=O)[O-])cn2)c1 ZINC000378641702 476723783 /nfs/dbraw/zinc/72/37/83/476723783.db2.gz DBXHPCBPHIXYPY-GUYCJALGSA-N 0 3 330.388 2.883 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H](C)[C@@H](N)c1ccccc1 ZINC000429966119 476725953 /nfs/dbraw/zinc/72/59/53/476725953.db2.gz DVUGZIHUBHXSHB-SJKOYZFVSA-N 0 3 343.383 2.556 20 5 EFBDHN C[C@@H]1N(Cc2cc([N+](=O)[O-])cc3c2OCOC3)CCC12CCOCC2 ZINC000375242764 476735943 /nfs/dbraw/zinc/73/59/43/476735943.db2.gz QFAGJSGAGXSHMX-ZDUSSCGKSA-N 0 3 348.399 2.852 20 5 EFBDHN CN(C)C1(CN(C)c2nc(-c3ccc([N+](=O)[O-])cc3)no2)CCC1 ZINC000445663852 476757221 /nfs/dbraw/zinc/75/72/21/476757221.db2.gz IATAFBWNAZNIGL-UHFFFAOYSA-N 0 3 331.376 2.565 20 5 EFBDHN CCO[C@@H]1CCCC[C@H]1NCC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000452039242 476787736 /nfs/dbraw/zinc/78/77/36/476787736.db2.gz ZZVDPUWIFFXGNJ-UKRRQHHQSA-N 0 3 335.404 2.779 20 5 EFBDHN Cc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2)n(C2CCN(C)CC2)n1 ZINC000430435495 476833958 /nfs/dbraw/zinc/83/39/58/476833958.db2.gz FHVKCQYKHISTTH-UHFFFAOYSA-N 0 3 343.387 2.619 20 5 EFBDHN CC(C)(C)[C@H](CO)NCc1ccc(Br)cc1[N+](=O)[O-] ZINC000393975271 476837100 /nfs/dbraw/zinc/83/71/00/476837100.db2.gz UZKOICXTVCANIL-LBPRGKRZSA-N 0 3 331.210 2.854 20 5 EFBDHN CC(C)(CN1CCCC1)NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000457032619 476838784 /nfs/dbraw/zinc/83/87/84/476838784.db2.gz NBZOSFIFPRGCIB-UHFFFAOYSA-N 0 3 325.796 2.852 20 5 EFBDHN CC(C)N1CC[C@@H](N(C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000452125235 476843535 /nfs/dbraw/zinc/84/35/35/476843535.db2.gz XNVNZTXILGTYBS-OAHLLOKOSA-N 0 3 345.403 2.559 20 5 EFBDHN C[C@H](C(=O)N1CCN(C2CC2)C[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1F ZINC000452174023 476869489 /nfs/dbraw/zinc/86/94/89/476869489.db2.gz OQFSEQAMBKLBHH-OLZOCXBDSA-N 0 3 349.406 2.780 20 5 EFBDHN CC(C)N1CC[C@@H](N(C)C(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000457096611 476873396 /nfs/dbraw/zinc/87/33/96/476873396.db2.gz RAXDLLGTTCJGDC-TZMCWYRMSA-N 0 3 337.395 2.779 20 5 EFBDHN CC(C)(CN1CCCC1)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000457100045 476874815 /nfs/dbraw/zinc/87/48/15/476874815.db2.gz VWZMUGVYTDTDKA-UHFFFAOYSA-N 0 3 347.415 2.548 20 5 EFBDHN CN(C)CCN(Cc1ccco1)C(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000446441984 476876558 /nfs/dbraw/zinc/87/65/58/476876558.db2.gz HMWSRAFWCBOXLZ-UHFFFAOYSA-N 0 3 335.335 2.531 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N(C)[C@@H]2CCN(C(C)C)C2)c1 ZINC000457110080 476880510 /nfs/dbraw/zinc/88/05/10/476880510.db2.gz HREFYQGYHYYJTQ-OAHLLOKOSA-N 0 3 349.431 2.613 20 5 EFBDHN COC(=O)c1cc(NC(=O)[C@H](N)CC2CCCCC2)cc([N+](=O)[O-])c1 ZINC000423006833 476889913 /nfs/dbraw/zinc/88/99/13/476889913.db2.gz WOXNESVVFODLEX-OAHLLOKOSA-N 0 3 349.387 2.618 20 5 EFBDHN CN(C)C1(CNC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)CCC1 ZINC000446619338 476895772 /nfs/dbraw/zinc/89/57/72/476895772.db2.gz DYDLDRHGHOGNCI-UHFFFAOYSA-N 0 3 346.431 2.753 20 5 EFBDHN COc1ccc(CNC(=O)[C@@H](N)CC2CCCCC2)cc1[N+](=O)[O-] ZINC000423056127 476908310 /nfs/dbraw/zinc/90/83/10/476908310.db2.gz FBORBUQBWNOFMT-AWEZNQCLSA-N 0 3 335.404 2.517 20 5 EFBDHN CN(C)CC(C)(C)NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000457204665 476925136 /nfs/dbraw/zinc/92/51/36/476925136.db2.gz KDBHBDYBVCDBHW-UHFFFAOYSA-N 0 3 348.428 2.788 20 5 EFBDHN CN(C)CC(C)(C)NC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000457246497 476942828 /nfs/dbraw/zinc/94/28/28/476942828.db2.gz RUKFEMPMXKPIFB-UHFFFAOYSA-N 0 3 342.399 2.727 20 5 EFBDHN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCNCc2ccccc21 ZINC000430959764 476950926 /nfs/dbraw/zinc/95/09/26/476950926.db2.gz DLVCJRKCBZOHNJ-CYBMUJFWSA-N 0 3 340.383 2.532 20 5 EFBDHN Cc1occc1C(=O)N1CCC(NCc2ccccc2[N+](=O)[O-])CC1 ZINC000370773013 476978213 /nfs/dbraw/zinc/97/82/13/476978213.db2.gz LWZYJOZHHLGQJN-UHFFFAOYSA-N 0 3 343.383 2.891 20 5 EFBDHN Cc1occc1C(=O)N1CCC(NCc2csc([N+](=O)[O-])c2)CC1 ZINC000370775537 476980369 /nfs/dbraw/zinc/98/03/69/476980369.db2.gz RFERPJWAMVIDME-UHFFFAOYSA-N 0 3 349.412 2.952 20 5 EFBDHN O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2NCc2cn3ccccc3n2)n1 ZINC000447505799 477000790 /nfs/dbraw/zinc/00/07/90/477000790.db2.gz ASTWWXZHNQOIPZ-CABCVRRESA-N 0 3 340.387 2.713 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)C(C)(C)CN2CCCC2)c1 ZINC000416106074 477021623 /nfs/dbraw/zinc/02/16/23/477021623.db2.gz MKWSMIQTHRDRFJ-UHFFFAOYSA-N 0 3 349.431 2.940 20 5 EFBDHN O=[N+]([O-])c1ccc(CNC[C@H]2CC[C@@H](c3nc(C4CC4)no3)O2)cc1 ZINC000431714858 477081044 /nfs/dbraw/zinc/08/10/44/477081044.db2.gz XEZGSRPYRYVBQK-CABCVRRESA-N 0 3 344.371 2.865 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ccc2c(c1)CNCCO2 ZINC000423648921 477099083 /nfs/dbraw/zinc/09/90/83/477099083.db2.gz GCWOEJBSYGZPHN-UHFFFAOYSA-N 0 3 341.367 2.946 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@H](CO)[C@@H]3CCCO3)s2)cc1 ZINC000447974065 477107721 /nfs/dbraw/zinc/10/77/21/477107721.db2.gz WGIZCLJLZBLSAI-CVEARBPZSA-N 0 3 348.424 2.953 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@H](CO)[C@H]3CCCO3)s2)cc1 ZINC000447974067 477107875 /nfs/dbraw/zinc/10/78/75/477107875.db2.gz WGIZCLJLZBLSAI-HZPDHXFCSA-N 0 3 348.424 2.953 20 5 EFBDHN CN(CCOc1ccc([N+](=O)[O-])c(CO)c1)Cc1ccc(F)cc1 ZINC000431878026 477113140 /nfs/dbraw/zinc/11/31/40/477113140.db2.gz OGRFUUIWUWFLFF-UHFFFAOYSA-N 0 3 334.347 2.737 20 5 EFBDHN CN(CCC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@@H](CO)c1ccccc1 ZINC000411220575 477156362 /nfs/dbraw/zinc/15/63/62/477156362.db2.gz GDFSSZTVADOGJU-KRWDZBQOSA-N 0 3 343.383 2.589 20 5 EFBDHN CCN1CCN(C[C@@H](C)CNc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000432347519 477200565 /nfs/dbraw/zinc/20/05/65/477200565.db2.gz OLMPIOLQNBIHDB-ZDUSSCGKSA-N 0 3 340.855 2.934 20 5 EFBDHN CC(C)Oc1cc(C(=O)N[C@H](C)CN2CCCCC2)ccc1[N+](=O)[O-] ZINC000411381798 477212067 /nfs/dbraw/zinc/21/20/67/477212067.db2.gz FLGYAGHYECVDSM-CQSZACIVSA-N 0 3 349.431 2.986 20 5 EFBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])N[C@H]1CC(=O)N(CC)C1 ZINC000453352640 477212842 /nfs/dbraw/zinc/21/28/42/477212842.db2.gz JYHWDFNRXLWJJH-STQMWFEESA-N 0 3 337.445 2.676 20 5 EFBDHN C[C@H](CN1CCCCC1)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411385324 477213036 /nfs/dbraw/zinc/21/30/36/477213036.db2.gz JWQJLDFRJCGPQF-XOKHGSTOSA-N 0 3 331.416 2.689 20 5 EFBDHN O=C(CCN(Cc1ccccn1)C1CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411449302 477238685 /nfs/dbraw/zinc/23/86/85/477238685.db2.gz SPFMYTALSJMIAZ-UHFFFAOYSA-N 0 3 340.383 2.983 20 5 EFBDHN CCc1ccccc1[C@H](N)CNC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000423971689 477239500 /nfs/dbraw/zinc/23/95/00/477239500.db2.gz HFODIOIGGOBHEI-QGZVFWFLSA-N 0 3 327.384 2.516 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1C(=O)N1C[C@@H](c2cccc(F)c2)[C@H](N)C1 ZINC000424014063 477260778 /nfs/dbraw/zinc/26/07/78/477260778.db2.gz TYLKXSKELOWXTN-LSDHHAIUSA-N 0 3 343.358 2.609 20 5 EFBDHN CN1CCC[C@@H]1CNC(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000454625603 477299920 /nfs/dbraw/zinc/29/99/20/477299920.db2.gz FOTAOVNHDLYMEM-NVXWUHKLSA-N 0 3 346.431 2.578 20 5 EFBDHN Cc1ccc(CN2CCC(CCN3CCOCC3)CC2)cc1[N+](=O)[O-] ZINC000371415249 477304436 /nfs/dbraw/zinc/30/44/36/477304436.db2.gz ALOOXXMSASQYKQ-UHFFFAOYSA-N 0 3 347.459 2.838 20 5 EFBDHN CC1(C)C[C@@H](NC[C@H](O)COCC2CC2)c2cc([N+](=O)[O-])ccc21 ZINC000433164195 477312266 /nfs/dbraw/zinc/31/22/66/477312266.db2.gz ZOHAVIZUZDTUCT-WMLDXEAASA-N 0 3 334.416 2.694 20 5 EFBDHN C[C@@H](CN1CCN(C)CC1)N[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433169407 477314571 /nfs/dbraw/zinc/31/45/71/477314571.db2.gz RGUOYJQHLGLRJV-KBXCAEBGSA-N 0 3 346.475 2.543 20 5 EFBDHN CN(C)CCN(Cc1ccsc1)C(=O)c1csc([N+](=O)[O-])c1 ZINC000458205649 477318022 /nfs/dbraw/zinc/31/80/22/477318022.db2.gz SDVGMBQJVQDBCQ-UHFFFAOYSA-N 0 3 339.442 2.922 20 5 EFBDHN CC(C)N1C[C@@H](N[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1=O ZINC000433280893 477321514 /nfs/dbraw/zinc/32/15/14/477321514.db2.gz GIXAEPOPNSPNEA-LRDDRELGSA-N 0 3 331.416 2.916 20 5 EFBDHN CCCN(CCN1CCCC1)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000411720882 477345150 /nfs/dbraw/zinc/34/51/50/477345150.db2.gz QYOPVXLSFJLCIS-HNNXBMFYSA-N 0 3 348.447 2.730 20 5 EFBDHN O=C(CCN1CCC(c2cn[nH]c2)CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000376483774 477356033 /nfs/dbraw/zinc/35/60/33/477356033.db2.gz JSZBYNPEVZHVHO-UHFFFAOYSA-N 0 3 343.387 2.526 20 5 EFBDHN O=C([C@@H]1CC[C@H](NCc2ccc([N+](=O)[O-])cc2F)C1)N1CCCC1 ZINC000435736888 477363038 /nfs/dbraw/zinc/36/30/38/477363038.db2.gz CGTHFSZROZBZNY-OCCSQVGLSA-N 0 3 335.379 2.615 20 5 EFBDHN CC(C)N1CC[C@@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000412407991 477423055 /nfs/dbraw/zinc/42/30/55/477423055.db2.gz GMZAZEIMWHHNML-IXDOHACOSA-N 0 3 331.416 2.639 20 5 EFBDHN COc1ccc(NC(=O)N2CC[C@]3(C2)CCCN(C)C3)cc1[N+](=O)[O-] ZINC000455093544 477496692 /nfs/dbraw/zinc/49/66/92/477496692.db2.gz CGLCTSAGCWQVOP-QGZVFWFLSA-N 0 3 348.403 2.553 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])NCc1ccc2c(c1)C(=O)NCC2 ZINC000449236763 477499736 /nfs/dbraw/zinc/49/97/36/477499736.db2.gz LHJREUSFYUMKFZ-ZDUSSCGKSA-N 0 3 339.395 2.602 20 5 EFBDHN CC[C@H](NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C1CCC1 ZINC000449239534 477500525 /nfs/dbraw/zinc/50/05/25/477500525.db2.gz VTXVXAWNFZBHEW-HNNXBMFYSA-N 0 3 326.418 2.537 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cnc3c(c2)CNCC3)c1 ZINC000376806500 477510496 /nfs/dbraw/zinc/51/04/96/477510496.db2.gz JYMYRQAFELQCEP-UHFFFAOYSA-N 0 3 344.396 2.610 20 5 EFBDHN CN(C)CCOc1ccc(CCNc2ncc([N+](=O)[O-])cc2F)cc1 ZINC000413132109 477537021 /nfs/dbraw/zinc/53/70/21/477537021.db2.gz ZYDFZGRNRNNZMA-UHFFFAOYSA-N 0 3 348.378 2.724 20 5 EFBDHN COc1ccc(C2CCN(CCn3ccc([N+](=O)[O-])n3)CC2)cc1 ZINC000371886801 477542456 /nfs/dbraw/zinc/54/24/56/477542456.db2.gz ZYSPIGHYPHCFJH-UHFFFAOYSA-N 0 3 330.388 2.680 20 5 EFBDHN Cc1c(CNC(=O)N2CCN(C3CC3)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000458695688 477551246 /nfs/dbraw/zinc/55/12/46/477551246.db2.gz QDWVFTGNYZXMIU-CYBMUJFWSA-N 0 3 346.431 2.529 20 5 EFBDHN CN(C)[C@]1(CNc2ccc([N+](=O)[O-])c3ncccc23)CCSC1 ZINC000413173429 477554374 /nfs/dbraw/zinc/55/43/74/477554374.db2.gz PBFWIIFFCVKCCU-INIZCTEOSA-N 0 3 332.429 2.992 20 5 EFBDHN CN(C)CCN(Cc1ccccc1F)c1ncc([N+](=O)[O-])cc1F ZINC000413187165 477560908 /nfs/dbraw/zinc/56/09/08/477560908.db2.gz DDOYUAWWTKIPPU-UHFFFAOYSA-N 0 3 336.342 2.836 20 5 EFBDHN CN1CCC[C@]2(CCN(C(=O)Nc3cc(F)cc([N+](=O)[O-])c3)C2)C1 ZINC000455321033 477587836 /nfs/dbraw/zinc/58/78/36/477587836.db2.gz BLYQVCJLMPEHQJ-INIZCTEOSA-N 0 3 336.367 2.684 20 5 EFBDHN COc1cccc(CN(CCN(C)C)c2ncc([N+](=O)[O-])cc2F)c1 ZINC000413266461 477599200 /nfs/dbraw/zinc/59/92/00/477599200.db2.gz PEQZPOPJEGRSTO-UHFFFAOYSA-N 0 3 348.378 2.706 20 5 EFBDHN CN1CCN(CCNc2nccc3ccc([N+](=O)[O-])cc32)CC1(C)C ZINC000413287778 477612306 /nfs/dbraw/zinc/61/23/06/477612306.db2.gz UPBDMRRCWFIACW-UHFFFAOYSA-N 0 3 343.431 2.581 20 5 EFBDHN COC[C@H]1CCCCN(CCOc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000372095434 477637262 /nfs/dbraw/zinc/63/72/62/477637262.db2.gz OGZAKUAYSAONSD-AWEZNQCLSA-N 0 3 338.404 2.731 20 5 EFBDHN O=[N+]([O-])c1ccc(NC[C@H]2CCCN2CCCO)cc1C(F)(F)F ZINC000450590919 477644558 /nfs/dbraw/zinc/64/45/58/477644558.db2.gz FEOBBDNAOPGZGE-GFCCVEGCSA-N 0 3 347.337 2.872 20 5 EFBDHN CN(Cc1ccc(Br)cc1[N+](=O)[O-])C[C@H]1CCCN1C ZINC000425471754 477685939 /nfs/dbraw/zinc/68/59/39/477685939.db2.gz ICRVKWMICNOKIU-CYBMUJFWSA-N 0 3 342.237 2.883 20 5 EFBDHN CCn1c(C)nc([N+](=O)[O-])c1N(CCN(C)C)Cc1ccsc1 ZINC000413463054 477688709 /nfs/dbraw/zinc/68/87/09/477688709.db2.gz YDOGFIJDIBZTDR-UHFFFAOYSA-N 0 3 337.449 2.749 20 5 EFBDHN CCc1nc(C)c(CN[C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)o1 ZINC000426321365 477705316 /nfs/dbraw/zinc/70/53/16/477705316.db2.gz CHXAOAVRXOEYEK-OLZOCXBDSA-N 0 3 333.392 2.924 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN[C@@H]3[C@@H]4CCO[C@H]4C34CCCC4)nc2c1 ZINC000450863041 477741117 /nfs/dbraw/zinc/74/11/17/477741117.db2.gz PROGPKONWGTXGR-JCURWCKSSA-N 0 3 342.399 2.908 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)NCC(C)(C)N1CCCCC1 ZINC000426837615 477751081 /nfs/dbraw/zinc/75/10/81/477751081.db2.gz OOWPXHQHNXDOBQ-UHFFFAOYSA-N 0 3 335.404 2.598 20 5 EFBDHN O=C(N[C@@H]1CCN(C2CC2)C1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000437967616 477781294 /nfs/dbraw/zinc/78/12/94/477781294.db2.gz BYIKHHDYCDGTAN-CQSZACIVSA-N 0 3 344.415 2.506 20 5 EFBDHN CCOC(=O)C[C@H](C)CNc1cc(C)nc2ccc([N+](=O)[O-])cc21 ZINC000428136693 477826356 /nfs/dbraw/zinc/82/63/56/477826356.db2.gz VGNFVBSGTDCIKS-NSHDSACASA-N 0 3 331.372 2.875 20 5 EFBDHN CC(C)[C@@H](CN[C@@H]1CCc2c1cccc2[N+](=O)[O-])N1CCOCC1 ZINC000515501035 477833518 /nfs/dbraw/zinc/83/35/18/477833518.db2.gz YSZQNDGAZXCICN-SJLPKXTDSA-N 0 3 333.432 2.529 20 5 EFBDHN CC(C)[C@H](CN[C@H]1CCc2c1cccc2[N+](=O)[O-])N1CCOCC1 ZINC000515501036 477834033 /nfs/dbraw/zinc/83/40/33/477834033.db2.gz YSZQNDGAZXCICN-WMZOPIPTSA-N 0 3 333.432 2.529 20 5 EFBDHN CN1CC[C@@H]2[C@H](CCCN2c2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000428177776 477834663 /nfs/dbraw/zinc/83/46/63/477834663.db2.gz RJMIOQYFTHAKNK-UKRRQHHQSA-N 0 3 343.387 2.565 20 5 EFBDHN O=C(NCCNc1ccccc1[N+](=O)[O-])[C@@H]1CCCN1C1CCCC1 ZINC000438579280 477867741 /nfs/dbraw/zinc/86/77/41/477867741.db2.gz JNUZIMMMVPBMLQ-KRWDZBQOSA-N 0 3 346.431 2.530 20 5 EFBDHN C[C@H]1CC[C@H](O)CN1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000421013827 477902551 /nfs/dbraw/zinc/90/25/51/477902551.db2.gz KGYMQALGBDDJIK-WFASDCNBSA-N 0 3 331.372 2.638 20 5 EFBDHN C[C@H]1[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2)CCN1Cc1ccccc1 ZINC000494070147 477915716 /nfs/dbraw/zinc/91/57/16/477915716.db2.gz VGKSWBVMKXZVBB-KBXCAEBGSA-N 0 3 339.395 2.988 20 5 EFBDHN O=[N+]([O-])c1ccn(C2CCN(C[C@H]3CCC4(CCCC4)O3)CC2)n1 ZINC000558743745 477929598 /nfs/dbraw/zinc/92/95/98/477929598.db2.gz ZTPLCJUIJQTUHD-OAHLLOKOSA-N 0 3 334.420 2.920 20 5 EFBDHN COc1ccc2c(c1)C[C@@H](NCCOc1ccc([N+](=O)[O-])cc1)CO2 ZINC000516397836 477930913 /nfs/dbraw/zinc/93/09/13/477930913.db2.gz FZQKECBVASQTPK-CQSZACIVSA-N 0 3 344.367 2.576 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN[C@@H](c2ccccc2)C2(CO)CCCC2)c1 ZINC000459521651 477952151 /nfs/dbraw/zinc/95/21/51/477952151.db2.gz FNSQFOUBFGDAIB-KRWDZBQOSA-N 0 3 344.415 2.675 20 5 EFBDHN CC(C)[C@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])C1(CO)CCCC1 ZINC000459548318 477966936 /nfs/dbraw/zinc/96/69/36/477966936.db2.gz XSPHTHBYQMADQA-KRWDZBQOSA-N 0 3 349.431 2.700 20 5 EFBDHN C[C@H](N[C@@H]1[C@H]2CCCO[C@H]2C1(C)C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000439615276 478007112 /nfs/dbraw/zinc/00/71/12/478007112.db2.gz FOZQPVVRHAIWIT-AEAUEXCSSA-N 0 3 347.415 2.715 20 5 EFBDHN C[C@H](N[C@@H]1[C@H]2CCCO[C@@H]2C1(C)C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000439617145 478007487 /nfs/dbraw/zinc/00/74/87/478007487.db2.gz YORLJMPAICDLOE-OJDYBEQGSA-N 0 3 347.415 2.715 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C[C@@H](N)Cc1ccccc1 ZINC000516921536 478012195 /nfs/dbraw/zinc/01/21/95/478012195.db2.gz QFIFKMYHFTUWHR-INIZCTEOSA-N 0 3 327.384 2.513 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@@H]1[C@H]2CCCO[C@@H]2C1(C)C ZINC000451474534 478035673 /nfs/dbraw/zinc/03/56/73/478035673.db2.gz APSGHPUYRSTOAL-XYPHTWIQSA-N 0 3 347.415 2.635 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H](C)N1CCCC[C@@H]1C ZINC000494657239 478035759 /nfs/dbraw/zinc/03/57/59/478035759.db2.gz YXNFBVVWGCLWJZ-STQMWFEESA-N 0 3 335.404 2.596 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@@H]1[C@H]2CCCO[C@H]2C1(C)C ZINC000451474532 478036259 /nfs/dbraw/zinc/03/62/59/478036259.db2.gz APSGHPUYRSTOAL-KBRIMQKVSA-N 0 3 347.415 2.635 20 5 EFBDHN C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000487517538 478039722 /nfs/dbraw/zinc/03/97/22/478039722.db2.gz OOEHUBYMGFLYJZ-XJKSGUPXSA-N 0 3 342.399 2.563 20 5 EFBDHN CC1(C)[C@H](NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@@H]2CCCO[C@@H]21 ZINC000451480403 478040781 /nfs/dbraw/zinc/04/07/81/478040781.db2.gz QBRIVVLIVPWSGY-XZJROXQQSA-N 0 3 330.388 2.764 20 5 EFBDHN Cc1ccc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1F ZINC000517042959 478043552 /nfs/dbraw/zinc/04/35/52/478043552.db2.gz DXOQIIJKKGNWIM-OAHLLOKOSA-N 0 3 334.347 2.572 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCCN(C)[C@@H]1C ZINC000439917787 478049403 /nfs/dbraw/zinc/04/94/03/478049403.db2.gz SWUPHEAUMAZZNJ-YPMHNXCESA-N 0 3 336.392 2.598 20 5 EFBDHN COCCN(CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@H]1CCC[C@@H]1C ZINC000487959923 478091415 /nfs/dbraw/zinc/09/14/15/478091415.db2.gz SKKAUVDBHZLVDC-YOEHRIQHSA-N 0 3 349.431 2.979 20 5 EFBDHN CO[C@H]1C[C@@H](NCc2cc([N+](=O)[O-])cc3c2OCOC3)C12CCC2 ZINC000459793194 478095568 /nfs/dbraw/zinc/09/55/68/478095568.db2.gz TUVZOWWLCZFIAF-CABCVRRESA-N 0 3 334.372 2.509 20 5 EFBDHN COCCN(CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@H]1CCC[C@@H]1C ZINC000488001431 478104699 /nfs/dbraw/zinc/10/46/99/478104699.db2.gz JRNMJACNHQHPHS-YOEHRIQHSA-N 0 3 349.431 2.695 20 5 EFBDHN CCOc1cc(CN[C@H]2Cc3cccc(O)c3C2)ccc1[N+](=O)[O-] ZINC000429310637 478108688 /nfs/dbraw/zinc/10/86/88/478108688.db2.gz URRHTRMNBUNQTG-AWEZNQCLSA-N 0 3 328.368 2.956 20 5 EFBDHN CC(C)[C@@H](NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H](CO)C(C)C ZINC000451603606 478120234 /nfs/dbraw/zinc/12/02/34/478120234.db2.gz XIDYYVAZMYNYCL-SUMWQHHRSA-N 0 3 334.420 2.850 20 5 EFBDHN CC(C)Oc1cc(C(=O)N2CCCC[C@@H]2CN(C)C)ccc1[N+](=O)[O-] ZINC000560746913 478128932 /nfs/dbraw/zinc/12/89/32/478128932.db2.gz AHNNMXYELQINJW-OAHLLOKOSA-N 0 3 349.431 2.938 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCN[C@@]2(CO)CCCc3ccccc32)c1 ZINC000440823967 478167179 /nfs/dbraw/zinc/16/71/79/478167179.db2.gz XDINKCNGRXABJT-LJQANCHMSA-N 0 3 342.395 2.787 20 5 EFBDHN COc1cc(N2CCN([C@@H]3C[C@H]3C)C[C@@H](C)C2)c([N+](=O)[O-])cc1F ZINC000488743371 478177762 /nfs/dbraw/zinc/17/77/62/478177762.db2.gz HUHQMEQVRZVODN-YRGRVCCFSA-N 0 3 337.395 2.909 20 5 EFBDHN CC(=O)c1cc(N2CCN([C@@H]3C[C@H]3C)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000488750669 478179447 /nfs/dbraw/zinc/17/94/47/478179447.db2.gz OGPRWAMBIYHINH-SNUQEOBHSA-N 0 3 331.416 2.964 20 5 EFBDHN CC[C@H]1CN(CC)CCN1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000451738850 478186213 /nfs/dbraw/zinc/18/62/13/478186213.db2.gz JBTKWYYACWGEDW-ZDUSSCGKSA-N 0 3 325.384 2.659 20 5 EFBDHN CC[C@@H]1CN(CC)CCN1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000451738849 478186369 /nfs/dbraw/zinc/18/63/69/478186369.db2.gz JBTKWYYACWGEDW-CYBMUJFWSA-N 0 3 325.384 2.659 20 5 EFBDHN C[C@H]1C[C@@H]1N1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000561765879 478204223 /nfs/dbraw/zinc/20/42/23/478204223.db2.gz WRMJFZJIQCSFCN-MPGHIAIKSA-N 0 3 345.443 2.716 20 5 EFBDHN CN1CCCC(C)(C)[C@@H]1CNc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000562615209 478284952 /nfs/dbraw/zinc/28/49/52/478284952.db2.gz UCODQGRYQQDALF-HNNXBMFYSA-N 0 3 345.403 2.776 20 5 EFBDHN CCC(C)(C)N1CCN(C(=O)NCCc2cccc([N+](=O)[O-])c2)CC1 ZINC000594233915 478291583 /nfs/dbraw/zinc/29/15/83/478291583.db2.gz QTNZOZGRMKKUOY-UHFFFAOYSA-N 0 3 348.447 2.653 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000520304153 478295129 /nfs/dbraw/zinc/29/51/29/478295129.db2.gz DQNFORQSHCLLMU-CVEARBPZSA-N 0 3 346.431 2.671 20 5 EFBDHN C[C@H]1[C@@H](NC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])CCCN1C ZINC000489990653 478296533 /nfs/dbraw/zinc/29/65/33/478296533.db2.gz GAPCEGVRLBVARK-JSGCOSHPSA-N 0 3 334.420 2.612 20 5 EFBDHN O=c1ccccn1CCN1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000590757320 478322823 /nfs/dbraw/zinc/32/28/23/478322823.db2.gz MRNTYRSJGNOQEN-INIZCTEOSA-N 0 3 327.384 2.636 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H]1CCC[C@@H](S(C)(=O)=O)C1 ZINC000537985029 478342600 /nfs/dbraw/zinc/34/26/00/478342600.db2.gz QBERBCNFOFJBGY-GZBFAFLISA-N 0 3 340.445 2.910 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCNC2(c3ccc4c(c3)OCO4)CC2)c1 ZINC000538233679 478351816 /nfs/dbraw/zinc/35/18/16/478351816.db2.gz YRAXGTIVWFGXTO-UHFFFAOYSA-N 0 3 342.351 2.981 20 5 EFBDHN O=C(N[C@H]1CCCN2CCCC[C@H]12)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000594418468 478374594 /nfs/dbraw/zinc/37/45/94/478374594.db2.gz JFLMTVQWBUWCEU-DZGCQCFKSA-N 0 3 342.399 2.823 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CN[C@@H]1C[C@H]1c1cccc(F)c1 ZINC000562985073 478401784 /nfs/dbraw/zinc/40/17/84/478401784.db2.gz GTMNHNUOBRANEN-OWCLPIDISA-N 0 3 346.358 2.619 20 5 EFBDHN O=[N+]([O-])c1ccc(CNC2CCN([C@H]3CCOC3)CC2)c(Cl)c1 ZINC000594501120 478413912 /nfs/dbraw/zinc/41/39/12/478413912.db2.gz RHORDWAAEFTMNT-HNNXBMFYSA-N 0 3 339.823 2.591 20 5 EFBDHN COc1cc(CN[C@@H](C)Cc2ccccn2)c([N+](=O)[O-])cc1OC ZINC000594517210 478422593 /nfs/dbraw/zinc/42/25/93/478422593.db2.gz ICHXFGCVRIWUGB-LBPRGKRZSA-N 0 3 331.372 2.728 20 5 EFBDHN CC[C@@H](CN1CCCC1)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000591063139 478447579 /nfs/dbraw/zinc/44/75/79/478447579.db2.gz ZKLWSSPCXURSON-BHYGNILZSA-N 0 3 331.416 2.689 20 5 EFBDHN O=c1[nH]cnc2cc(N[C@@H]3CCCN4CCCC[C@H]34)c([N+](=O)[O-])cc21 ZINC000594603273 478462424 /nfs/dbraw/zinc/46/24/24/478462424.db2.gz SUCRYNNMQAZHEJ-IUODEOHRSA-N 0 3 343.387 2.672 20 5 EFBDHN O=c1[nH]cnc2cc(N[C@H]3CCCN4CCCC[C@H]34)c([N+](=O)[O-])cc21 ZINC000594603274 478462701 /nfs/dbraw/zinc/46/27/01/478462701.db2.gz SUCRYNNMQAZHEJ-SWLSCSKDSA-N 0 3 343.387 2.672 20 5 EFBDHN CSc1cccc(C(=O)N2CCC[C@]3(CCN(C)C3)C2)c1[N+](=O)[O-] ZINC000597709913 478474146 /nfs/dbraw/zinc/47/41/46/478474146.db2.gz CPCGWHXTIAOYCG-QGZVFWFLSA-N 0 3 349.456 2.875 20 5 EFBDHN CN1CC[C@@]2(C1)CCCN(C(=O)c1c(Cl)cccc1[N+](=O)[O-])C2 ZINC000597711443 478475132 /nfs/dbraw/zinc/47/51/32/478475132.db2.gz RVDQYBKERQINSD-MRXNPFEDSA-N 0 3 337.807 2.806 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@]2(CCN(C)C2)C1 ZINC000597709931 478475146 /nfs/dbraw/zinc/47/51/46/478475146.db2.gz DCDNEZFJPNEAIK-GOSISDBHSA-N 0 3 347.415 2.551 20 5 EFBDHN O=[N+]([O-])c1ccc2ccnc(NC3CCN([C@H]4CCOC4)CC3)c2c1 ZINC000591150692 478475872 /nfs/dbraw/zinc/47/58/72/478475872.db2.gz NZWLJBNLQBKRKV-INIZCTEOSA-N 0 3 342.399 2.808 20 5 EFBDHN C[C@H](NC[C@@H]1COCCN1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000600712238 478479563 /nfs/dbraw/zinc/47/95/63/478479563.db2.gz VEYNSEQQGHBNPB-QWHCGFSZSA-N 0 3 347.440 2.962 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC[C@H](CN2CCOC2=O)C1 ZINC000496017675 478482630 /nfs/dbraw/zinc/48/26/30/478482630.db2.gz YLBFPKCUPPPQBN-IDJPSDCMSA-N 0 3 345.399 2.772 20 5 EFBDHN COC(=O)c1cc(-c2cccc([C@H]3CNCCO3)c2)cc([N+](=O)[O-])c1 ZINC000600790118 478522487 /nfs/dbraw/zinc/52/24/87/478522487.db2.gz ZDRPVNPUCSMZRW-QGZVFWFLSA-N 0 3 342.351 2.709 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1CN1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000563362229 478530937 /nfs/dbraw/zinc/53/09/37/478530937.db2.gz BXGOITLBKSZLQR-MRXNPFEDSA-N 0 3 344.415 2.963 20 5 EFBDHN O=C(CCN[C@@H]1CCc2c1cccc2[N+](=O)[O-])Nc1ccccn1 ZINC000563418830 478554770 /nfs/dbraw/zinc/55/47/70/478554770.db2.gz QCTSDRIWHROZJZ-CQSZACIVSA-N 0 3 326.356 2.596 20 5 EFBDHN CSc1cccc(C(=O)N[C@H]2CCN(C(C)(C)C)C2)c1[N+](=O)[O-] ZINC000597920362 478574325 /nfs/dbraw/zinc/57/43/25/478574325.db2.gz AQLJMKXITIXOMF-NSHDSACASA-N 0 3 337.445 2.919 20 5 EFBDHN CSc1cccc(C(=O)N[C@@H]2CCN(C(C)(C)C)C2)c1[N+](=O)[O-] ZINC000597920361 478574652 /nfs/dbraw/zinc/57/46/52/478574652.db2.gz AQLJMKXITIXOMF-LLVKDONJSA-N 0 3 337.445 2.919 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CCN(C(C)(C)C)C1 ZINC000597921981 478576518 /nfs/dbraw/zinc/57/65/18/478576518.db2.gz IRIVCFVRNAPCRN-LBPRGKRZSA-N 0 3 335.404 2.596 20 5 EFBDHN CC(C)(C)N1CC[C@@H](NC(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000597922558 478576729 /nfs/dbraw/zinc/57/67/29/478576729.db2.gz GDWSEBPOVNGARL-GFCCVEGCSA-N 0 3 337.445 2.676 20 5 EFBDHN CCc1nncn1CCN[C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000563572225 478590409 /nfs/dbraw/zinc/59/04/09/478590409.db2.gz PFBVEEGXEAVDSH-MRXNPFEDSA-N 0 3 329.404 2.806 20 5 EFBDHN CC[C@H]1CC[C@H](C)N1Cc1ccc(OCC(=O)OC)c([N+](=O)[O-])c1 ZINC000582448068 478600359 /nfs/dbraw/zinc/60/03/59/478600359.db2.gz PZURWHYZRCVNOL-JSGCOSHPSA-N 0 3 336.388 2.910 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1cnc2c(c1)CNCC2 ZINC000591681399 478605887 /nfs/dbraw/zinc/60/58/87/478605887.db2.gz PTRZQYUZXHJYMW-UHFFFAOYSA-N 0 3 340.383 2.813 20 5 EFBDHN C[C@@H](O)[C@H]1CCCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000541890333 478609302 /nfs/dbraw/zinc/60/93/02/478609302.db2.gz RCZZXPIKCKCHRN-HIFRSBDPSA-N 0 3 344.415 2.588 20 5 EFBDHN C[C@]1(c2ccccc2)C[C@@H]1NC[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000591744335 478617996 /nfs/dbraw/zinc/61/79/96/478617996.db2.gz UFMLVEMMLUQWQF-YTQUADARSA-N 0 3 342.395 2.654 20 5 EFBDHN Cc1ccc2c(c1)CC[C@H]2NC[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000563748583 478626508 /nfs/dbraw/zinc/62/65/08/478626508.db2.gz VSACKMPHKQTIBG-NVXWUHKLSA-N 0 3 342.395 2.920 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC1CCN(CC(F)F)CC1 ZINC000595012935 478630031 /nfs/dbraw/zinc/63/00/31/478630031.db2.gz GCHZGTAOAMRDBZ-LLVKDONJSA-N 0 3 343.374 2.984 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NCC1(C(=O)N(C)C)CCCC1 ZINC000595019005 478631055 /nfs/dbraw/zinc/63/10/55/478631055.db2.gz PDPPFRVUQVJVHE-ZDUSSCGKSA-N 0 3 349.431 2.903 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCC1(C(=O)N(C)C)CCCC1 ZINC000595019003 478631426 /nfs/dbraw/zinc/63/14/26/478631426.db2.gz PDPPFRVUQVJVHE-CYBMUJFWSA-N 0 3 349.431 2.903 20 5 EFBDHN C[C@H](CN1CCC[C@@H](C)C1)NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000582580519 478633178 /nfs/dbraw/zinc/63/31/78/478633178.db2.gz LCGBUWULTMWGNJ-KFWWJZLASA-N 0 3 333.432 2.935 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCCc1ccc(CO)cc1 ZINC000595026626 478633579 /nfs/dbraw/zinc/63/35/79/478633579.db2.gz NKLWYNGRXSBEOR-CYBMUJFWSA-N 0 3 330.384 2.989 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@@H](O)Cc1cccc(F)c1 ZINC000595041370 478638516 /nfs/dbraw/zinc/63/85/16/478638516.db2.gz KOBDQLQRECTMGT-WBMJQRKESA-N 0 3 348.374 2.997 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@@H](O)Cc1cccc(F)c1 ZINC000595041368 478638922 /nfs/dbraw/zinc/63/89/22/478638922.db2.gz KOBDQLQRECTMGT-LRDDRELGSA-N 0 3 348.374 2.997 20 5 EFBDHN O=[N+]([O-])c1ccc(OC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1 ZINC000601069472 478639202 /nfs/dbraw/zinc/63/92/02/478639202.db2.gz MAWCFLLROYMSOF-GOSISDBHSA-N 0 3 328.368 2.611 20 5 EFBDHN Cc1cccc(OC[C@@]2(O)CCN(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000601069200 478639346 /nfs/dbraw/zinc/63/93/46/478639346.db2.gz KJHPZENQJJVVRI-LJQANCHMSA-N 0 3 342.395 2.919 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2c1ccc([N+](=O)[O-])c(OC(C)C)n1 ZINC000571657210 478648476 /nfs/dbraw/zinc/64/84/76/478648476.db2.gz LJNZNRLBMSAMIZ-KGLIPLIRSA-N 0 3 334.420 2.840 20 5 EFBDHN Cn1ncc(C2CC2)c1CN[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000595079842 478653888 /nfs/dbraw/zinc/65/38/88/478653888.db2.gz ZOMOBDJZGRJBBV-CABCVRRESA-N 0 3 344.419 2.676 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@H]1CC(=O)N(C(C)(C)C)C1 ZINC000595098583 478659385 /nfs/dbraw/zinc/65/93/85/478659385.db2.gz BZCBWMCCEMFRHZ-CHWSQXEVSA-N 0 3 349.431 2.901 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@@H]1CC(=O)N(C(C)(C)C)C1 ZINC000595098589 478659804 /nfs/dbraw/zinc/65/98/04/478659804.db2.gz BZCBWMCCEMFRHZ-STQMWFEESA-N 0 3 349.431 2.901 20 5 EFBDHN CS[C@@H]1CN(c2ccnc3ccc([N+](=O)[O-])cc32)C[C@@H]1N(C)C ZINC000601134404 478678509 /nfs/dbraw/zinc/67/85/09/478678509.db2.gz BPAULNPHAVVQLV-JKSUJKDBSA-N 0 3 332.429 2.625 20 5 EFBDHN CCOC(=O)Cc1ccc(NC2CCN(CC)CC2)c([N+](=O)[O-])c1 ZINC000591892124 478678863 /nfs/dbraw/zinc/67/88/63/478678863.db2.gz RLHPGIUONOVIOY-UHFFFAOYSA-N 0 3 335.404 2.597 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC000595258182 478703899 /nfs/dbraw/zinc/70/38/99/478703899.db2.gz RTAZGIZNHYQVSD-KRWDZBQOSA-N 0 3 341.367 2.816 20 5 EFBDHN CCc1ccc([C@H](CO)NCCOc2cccc([N+](=O)[O-])c2)cc1 ZINC000542913049 478706222 /nfs/dbraw/zinc/70/62/22/478706222.db2.gz CFANPDIBOGTDRY-SFHVURJKSA-N 0 3 330.384 2.859 20 5 EFBDHN C[C@@H](CN1CCC(C)CC1)NC(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000598261901 478730551 /nfs/dbraw/zinc/73/05/51/478730551.db2.gz IAUCVXNMRQRXJJ-ZDUSSCGKSA-N 0 3 337.395 2.513 20 5 EFBDHN CCCN(C(=O)NCc1cccc([N+](=O)[O-])c1C)[C@H]1CCN(C)C1 ZINC000592016670 478745461 /nfs/dbraw/zinc/74/54/61/478745461.db2.gz MKSYRIZGTCYGDX-HNNXBMFYSA-N 0 3 334.420 2.529 20 5 EFBDHN C[C@@H]1C[C@@H](N(C)C(=O)/C=C\c2ccc(F)cc2[N+](=O)[O-])CCN1C ZINC000491933953 478745573 /nfs/dbraw/zinc/74/55/73/478745573.db2.gz CSDZZNNSSDMMRR-BRDDXIKOSA-N 0 3 335.379 2.688 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@H]2CCN(CCOCc3ccccc3)C2)nc1 ZINC000595374586 478752700 /nfs/dbraw/zinc/75/27/00/478752700.db2.gz HBAFONSAJIDEGF-INIZCTEOSA-N 0 3 342.399 2.693 20 5 EFBDHN CCN(C[C@@H]1CCCN1CC)C(=O)c1cccc([N+](=O)[O-])c1NC ZINC000572195137 478772615 /nfs/dbraw/zinc/77/26/15/478772615.db2.gz MKQNDWDYMZYOCC-ZDUSSCGKSA-N 0 3 334.420 2.583 20 5 EFBDHN CCCN1CC[C@H](NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000598342475 478776353 /nfs/dbraw/zinc/77/63/53/478776353.db2.gz IZRZJEFIDMEYJX-OLZOCXBDSA-N 0 3 337.445 2.676 20 5 EFBDHN CS[C@H]1CN(Cc2ccc(F)cc2[N+](=O)[O-])C[C@@H]1N1CCCC1 ZINC000595433925 478779541 /nfs/dbraw/zinc/77/95/41/478779541.db2.gz WWYIIPNUAFYZHK-HOTGVXAUSA-N 0 3 339.436 2.746 20 5 EFBDHN CC[C@H](CC(F)(F)F)NC[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000583259182 478806321 /nfs/dbraw/zinc/80/63/21/478806321.db2.gz XEYZRDQIZKAPBF-ZYHUDNBSSA-N 0 3 336.310 2.655 20 5 EFBDHN CCCN1CC[C@H](NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000595520983 478832437 /nfs/dbraw/zinc/83/24/37/478832437.db2.gz UVZZVIJIRFVZEI-INIZCTEOSA-N 0 3 348.447 2.701 20 5 EFBDHN CCCN(C(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@H]1CCN(C)C1 ZINC000592249697 478841342 /nfs/dbraw/zinc/84/13/42/478841342.db2.gz MCELNVFDYUIIOO-ZDUSSCGKSA-N 0 3 336.392 2.551 20 5 EFBDHN CCCN1CC[C@@H](NC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000595544220 478844857 /nfs/dbraw/zinc/84/48/57/478844857.db2.gz NJNRSKZWHQRTKN-DZGCQCFKSA-N 0 3 334.420 2.748 20 5 EFBDHN CCCN1CC[C@H](NC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000595544226 478845315 /nfs/dbraw/zinc/84/53/15/478845315.db2.gz NJNRSKZWHQRTKN-ZFWWWQNUSA-N 0 3 334.420 2.748 20 5 EFBDHN CCCN1CC[C@H](NC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000595544222 478845985 /nfs/dbraw/zinc/84/59/85/478845985.db2.gz NJNRSKZWHQRTKN-HIFRSBDPSA-N 0 3 334.420 2.748 20 5 EFBDHN C[C@H](CN1CCC(C)CC1)NC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000595572293 478862507 /nfs/dbraw/zinc/86/25/07/478862507.db2.gz DORLENQKAWEQMI-OAHLLOKOSA-N 0 3 348.447 2.557 20 5 EFBDHN CC(C)(C)N(Cc1ccsc1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000595600046 478878460 /nfs/dbraw/zinc/87/84/60/478878460.db2.gz FXDNCTLVNWHBQI-CQSZACIVSA-N 0 3 338.433 2.514 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2nc(CN3C[C@@H]4C[C@H](O)CC[C@@H]4C3)co2)cc1 ZINC000595637877 478906415 /nfs/dbraw/zinc/90/64/15/478906415.db2.gz ZBZMXACRRKGTAR-JKIFEVAISA-N 0 3 343.383 2.843 20 5 EFBDHN CC(C)[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCN1 ZINC000598576585 478906683 /nfs/dbraw/zinc/90/66/83/478906683.db2.gz XGJCGJLSEGGTSJ-ZDUSSCGKSA-N 0 3 345.321 2.684 20 5 EFBDHN C[C@H]1CC2(CN1Cc1cc3c(cc1[N+](=O)[O-])OCCO3)CCOCC2 ZINC000592527781 478933575 /nfs/dbraw/zinc/93/35/75/478933575.db2.gz PZDPODOFVUPNRB-ZDUSSCGKSA-N 0 3 348.399 2.757 20 5 EFBDHN C[C@@H]1CC2(CN1Cc1cc3c(cc1[N+](=O)[O-])OCCO3)CCOCC2 ZINC000592527780 478934042 /nfs/dbraw/zinc/93/40/42/478934042.db2.gz PZDPODOFVUPNRB-CYBMUJFWSA-N 0 3 348.399 2.757 20 5 EFBDHN CC(C)[C@H]1CN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)CCN1 ZINC000592543461 478940052 /nfs/dbraw/zinc/94/00/52/478940052.db2.gz BPTVDCFVABKWEJ-OAHLLOKOSA-N 0 3 333.432 2.962 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CC[C@]2(CCN(C)C2)C1 ZINC000583863651 478957769 /nfs/dbraw/zinc/95/77/69/478957769.db2.gz WPBUEGIDJMAQCO-SFHVURJKSA-N 0 3 331.416 2.688 20 5 EFBDHN CCCN1CCC[C@H]1CNC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000511911893 478986142 /nfs/dbraw/zinc/98/61/42/478986142.db2.gz WMSVEUCXZQCLCM-INIZCTEOSA-N 0 3 348.447 2.653 20 5 EFBDHN CC(C)Oc1nc(N(CCN(C)C)Cc2ccco2)ccc1[N+](=O)[O-] ZINC000565432423 479007609 /nfs/dbraw/zinc/00/76/09/479007609.db2.gz MWZVDZSIQRTTMG-UHFFFAOYSA-N 0 3 348.403 2.938 20 5 EFBDHN Cc1ccc(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1F ZINC000584194852 479048299 /nfs/dbraw/zinc/04/82/99/479048299.db2.gz BWRVAZBVFQMCFC-AWEZNQCLSA-N 0 3 334.347 2.572 20 5 EFBDHN COc1ccc(NC(=O)[C@H](C)N(C)C[C@@H]2CC2(C)C)c([N+](=O)[O-])c1 ZINC000595907540 479063308 /nfs/dbraw/zinc/06/33/08/479063308.db2.gz AHJCBUPKOJEBNI-RYUDHWBXSA-N 0 3 335.404 2.908 20 5 EFBDHN COc1ccc(NC(=O)[C@@H](C)N(C)C[C@H]2CC2(C)C)c([N+](=O)[O-])c1 ZINC000595907541 479063504 /nfs/dbraw/zinc/06/35/04/479063504.db2.gz AHJCBUPKOJEBNI-VXGBXAGGSA-N 0 3 335.404 2.908 20 5 EFBDHN O=C(/C=C/c1cccc([N+](=O)[O-])c1)NC[C@H]1CCCCN1C1CC1 ZINC000493615060 479083015 /nfs/dbraw/zinc/08/30/15/479083015.db2.gz FMQDNRDNWRBYMW-PYUISTEWSA-N 0 3 329.400 2.741 20 5 EFBDHN O=[N+]([O-])c1ccc(SC[C@]2(O)CCN(Cc3ccccc3)C2)nc1 ZINC000601957281 479094323 /nfs/dbraw/zinc/09/43/23/479094323.db2.gz IIYVCAVEUBAYIF-KRWDZBQOSA-N 0 3 345.424 2.719 20 5 EFBDHN CC(C)N1CC[C@@H](N(C)C(=O)/C=C/c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000493671820 479108771 /nfs/dbraw/zinc/10/87/71/479108771.db2.gz COWHIXGLVNLLHB-KEDPEKRHSA-N 0 3 335.379 2.688 20 5 EFBDHN O=c1ccc([C@@H]2OCC[C@H]2NCC=Cc2ccccc2[N+](=O)[O-])c[nH]1 ZINC000599002321 479121759 /nfs/dbraw/zinc/12/17/59/479121759.db2.gz OJUWIMIUOITCFN-JKNDFLROSA-N 0 3 341.367 2.828 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H]2CCOC[C@H]2O)s1 ZINC000599011510 479125807 /nfs/dbraw/zinc/12/58/07/479125807.db2.gz JODDTQBFULTTJM-UKRRQHHQSA-N 0 3 334.397 2.563 20 5 EFBDHN CCN1CCN(C[C@H](C)CNc2cc(C)sc2[N+](=O)[O-])CC1 ZINC000596082160 479127674 /nfs/dbraw/zinc/12/76/74/479127674.db2.gz MQJWHWGMRDCGNL-GFCCVEGCSA-N 0 3 326.466 2.650 20 5 EFBDHN O=[N+]([O-])c1cc(NCCCN2CCC(O)CC2)ccc1C(F)(F)F ZINC000596085104 479129214 /nfs/dbraw/zinc/12/92/14/479129214.db2.gz JBINDTAXKLCABJ-UHFFFAOYSA-N 0 3 347.337 2.872 20 5 EFBDHN C[C@H](CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-])N1CCCC[C@H]1C ZINC000593027961 479132125 /nfs/dbraw/zinc/13/21/25/479132125.db2.gz HKNQPTMBXOHRAC-CHWSQXEVSA-N 0 3 337.395 2.656 20 5 EFBDHN CSC1(CNC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)CCN(C)CC1 ZINC000493752743 479145361 /nfs/dbraw/zinc/14/53/61/479145361.db2.gz LEHZKUPTYWJQGH-YVMONPNESA-N 0 3 349.456 2.552 20 5 EFBDHN C[NH+](C)CCCOc1ccc(CNc2cc[n-]c(=O)c2[N+](=O)[O-])cc1 ZINC000596112990 479146152 /nfs/dbraw/zinc/14/61/52/479146152.db2.gz YXRZEYDAVVDQOE-UHFFFAOYSA-N 0 3 346.387 2.638 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@H]1CCCN1CC(F)F ZINC000599066077 479146485 /nfs/dbraw/zinc/14/64/85/479146485.db2.gz ONMLWCILKBSXNV-WCQYABFASA-N 0 3 343.374 2.984 20 5 EFBDHN CC1(C)CN(c2cc[nH]c(=O)c2[N+](=O)[O-])CCN1Cc1ccccc1 ZINC000596113968 479146638 /nfs/dbraw/zinc/14/66/38/479146638.db2.gz GBFWDHGPTSBZRV-UHFFFAOYSA-N 0 3 342.399 2.796 20 5 EFBDHN CC[C@H]1COC(C)(C)CN1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000593057645 479147982 /nfs/dbraw/zinc/14/79/82/479147982.db2.gz VHEAERDKZNLLGP-AWEZNQCLSA-N 0 3 335.404 2.813 20 5 EFBDHN CC[C@@H](CN1CCCC1)NC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000610722168 479167056 /nfs/dbraw/zinc/16/70/56/479167056.db2.gz SFXRIZVNLHTSPV-HNNXBMFYSA-N 0 3 334.420 2.611 20 5 EFBDHN Cc1c(NC(=O)[C@H](C)N(C)CCN2CCCCC2)cccc1[N+](=O)[O-] ZINC000593111588 479181040 /nfs/dbraw/zinc/18/10/40/479181040.db2.gz GXKWQHVCPJVGDV-HNNXBMFYSA-N 0 3 348.447 2.648 20 5 EFBDHN O=[N+]([O-])c1cncc(Cl)c1NCC1CCN(c2ccncc2)CC1 ZINC000596184567 479185546 /nfs/dbraw/zinc/18/55/46/479185546.db2.gz MHKXKTFXNHUZKS-UHFFFAOYSA-N 0 3 347.806 2.789 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN(C)Cc1ccc(OC(F)F)cc1 ZINC000610782739 479187262 /nfs/dbraw/zinc/18/72/62/479187262.db2.gz TVWMOORBLAJPGL-UHFFFAOYSA-N 0 3 340.330 2.833 20 5 EFBDHN CS[C@@H]1CN(c2cc(C)sc2[N+](=O)[O-])C[C@@H]1N1CCCC1 ZINC000596195871 479191359 /nfs/dbraw/zinc/19/13/59/479191359.db2.gz PEERCRARTFJUKQ-QWHCGFSZSA-N 0 3 327.475 2.981 20 5 EFBDHN CCN1CCN(c2cccc(Nc3cc[nH]c(=O)c3[N+](=O)[O-])c2)CC1 ZINC000596195396 479191668 /nfs/dbraw/zinc/19/16/68/479191668.db2.gz DGRYTYMKWWZQKT-UHFFFAOYSA-N 0 3 343.387 2.581 20 5 EFBDHN COc1cc(NCCCN2CCCO[C@@H](C)C2)c([N+](=O)[O-])cc1C ZINC000596208784 479199689 /nfs/dbraw/zinc/19/96/89/479199689.db2.gz MEIVWAUKBSECDL-AWEZNQCLSA-N 0 3 337.420 2.825 20 5 EFBDHN CN1CCCC(C)(C)[C@@H]1CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000593144027 479202396 /nfs/dbraw/zinc/20/23/96/479202396.db2.gz SBZJBTAVCHVLJG-HNNXBMFYSA-N 0 3 337.395 2.513 20 5 EFBDHN CCCN(CCN1CCCC1)C(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000593153001 479206316 /nfs/dbraw/zinc/20/63/16/479206316.db2.gz JELWYLIGAMBALF-UHFFFAOYSA-N 0 3 337.395 2.611 20 5 EFBDHN C[C@H]1[C@@H](Nc2cc[n-]c(=O)c2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000596235842 479216212 /nfs/dbraw/zinc/21/62/12/479216212.db2.gz NFWLISVEQQPQRI-JSGCOSHPSA-N 0 3 328.372 2.770 20 5 EFBDHN C[C@H]1[C@@H](Nc2cc[n-]c(=O)c2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000596235842 479216221 /nfs/dbraw/zinc/21/62/21/479216221.db2.gz NFWLISVEQQPQRI-JSGCOSHPSA-N 0 3 328.372 2.770 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)F)ccc1NC[C@H]1CCCN1CCCO ZINC000596256645 479227479 /nfs/dbraw/zinc/22/74/79/479227479.db2.gz FEBPRKNBYGSNDY-GFCCVEGCSA-N 0 3 329.347 2.791 20 5 EFBDHN COc1cc(C(=O)N2CCCN(CC3CCC3)CC2)ccc1[N+](=O)[O-] ZINC000574287946 479258927 /nfs/dbraw/zinc/25/89/27/479258927.db2.gz OMTMZHYVAMJCKT-UHFFFAOYSA-N 0 3 347.415 2.551 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1[C@@H]2CC[C@H]1CCN(C)C2 ZINC000574438777 479287120 /nfs/dbraw/zinc/28/71/20/479287120.db2.gz NQHKGZJNQRIUEE-LSDHHAIUSA-N 0 3 331.416 2.829 20 5 EFBDHN O=[N+]([O-])c1cnc(NCC2CCN(Cc3ccncc3)CC2)c(F)c1 ZINC000596435980 479293711 /nfs/dbraw/zinc/29/37/11/479293711.db2.gz GPBYSYATQBHHJK-UHFFFAOYSA-N 0 3 345.378 2.848 20 5 EFBDHN CC[C@H](CN1CCCC1)NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000611196126 479307763 /nfs/dbraw/zinc/30/77/63/479307763.db2.gz RSCIHAIKUOADPR-GFCCVEGCSA-N 0 3 330.388 2.680 20 5 EFBDHN CCCN1CC[C@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000596483222 479313444 /nfs/dbraw/zinc/31/34/44/479313444.db2.gz XQSREGHVUBGWFQ-JTQLQIEISA-N 0 3 326.784 2.854 20 5 EFBDHN CC[C@@](C)(N)c1cn(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)nn1 ZINC000603232250 479313721 /nfs/dbraw/zinc/31/37/21/479313721.db2.gz VSSPLRFSZICQEY-CYBMUJFWSA-N 0 3 343.309 2.837 20 5 EFBDHN C[C@@H]1CN(C[C@@H](O)COc2ccccc2[N+](=O)[O-])C[C@@H](C)C1(F)F ZINC000599514183 479318566 /nfs/dbraw/zinc/31/85/66/479318566.db2.gz DZXICRSCZBEJQM-JHJVBQTASA-N 0 3 344.358 2.558 20 5 EFBDHN COc1ccc(CN[C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cc1O ZINC000574633128 479320227 /nfs/dbraw/zinc/32/02/27/479320227.db2.gz DAKKRUYMCYVVAU-KBPBESRZSA-N 0 3 346.387 2.779 20 5 EFBDHN CCOc1ccc([C@H](C)NCCOC[C@@H]2CCOC2)cc1[N+](=O)[O-] ZINC000611248452 479322673 /nfs/dbraw/zinc/32/26/73/479322673.db2.gz GDCPUWUUPLBTQM-UONOGXRCSA-N 0 3 338.404 2.697 20 5 EFBDHN Cc1ccc(CN2CCCN(C[C@H]3CCCO3)CC2)cc1[N+](=O)[O-] ZINC000611254055 479325239 /nfs/dbraw/zinc/32/52/39/479325239.db2.gz KIYVCFCNMSJEJH-QGZVFWFLSA-N 0 3 333.432 2.590 20 5 EFBDHN CCN1CCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000611271197 479332536 /nfs/dbraw/zinc/33/25/36/479332536.db2.gz WGMOYQNKRYBYQG-AWEZNQCLSA-N 0 3 343.431 2.521 20 5 EFBDHN O=[N+]([O-])c1cccc2ncnc(NC[C@@H]3CCN3Cc3ccccc3)c21 ZINC000596559473 479339118 /nfs/dbraw/zinc/33/91/18/479339118.db2.gz ZHLKETYVBZZOFL-HNNXBMFYSA-N 0 3 349.394 2.646 20 5 EFBDHN CCOc1cc(N2CCCN(C[C@@H]3CCCO3)CC2)ccc1[N+](=O)[O-] ZINC000611296549 479340140 /nfs/dbraw/zinc/34/01/40/479340140.db2.gz ZBJQKNAWNIIVKG-INIZCTEOSA-N 0 3 349.431 2.685 20 5 EFBDHN CC(C)(C)N1CCCN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000593437543 479340314 /nfs/dbraw/zinc/34/03/14/479340314.db2.gz IWXDPIXQSUHHHH-UHFFFAOYSA-N 0 3 337.395 2.609 20 5 EFBDHN CC[C@@H]1CCCCN1CCNC(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000593468631 479355392 /nfs/dbraw/zinc/35/53/92/479355392.db2.gz GVUNSLBFHKUXPL-OAHLLOKOSA-N 0 3 337.395 2.657 20 5 EFBDHN CC[C@H]1CCCCN1CCNC(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000593468624 479355832 /nfs/dbraw/zinc/35/58/32/479355832.db2.gz GVUNSLBFHKUXPL-HNNXBMFYSA-N 0 3 337.395 2.657 20 5 EFBDHN C[C@H](NC(=O)N1CCCC12CCN(C)CC2)c1ccccc1[N+](=O)[O-] ZINC000611397547 479367963 /nfs/dbraw/zinc/36/79/63/479367963.db2.gz QISZZNZWYHDEKI-AWEZNQCLSA-N 0 3 346.431 2.926 20 5 EFBDHN O=[N+]([O-])c1ccsc1NC1CCN([C@H]2CCCC[C@H]2O)CC1 ZINC000611413617 479371953 /nfs/dbraw/zinc/37/19/53/479371953.db2.gz IILGMQMRIXFYOS-GXTWGEPZSA-N 0 3 325.434 2.836 20 5 EFBDHN C[C@@H](CNCc1nc2cc([N+](=O)[O-])ccc2o1)N1CCC[C@@H](C)C1 ZINC000602513180 479375765 /nfs/dbraw/zinc/37/57/65/479375765.db2.gz AGSBLIIREBCEIC-OLZOCXBDSA-N 0 3 332.404 2.946 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(C)cc1N[C@@H]1CCN(CC2CC2)C1 ZINC000587973640 479378145 /nfs/dbraw/zinc/37/81/45/479378145.db2.gz BGZGHUNZGDJWSR-CYBMUJFWSA-N 0 3 333.388 2.586 20 5 EFBDHN COC[C@H](C)N(CCn1cc([N+](=O)[O-])cn1)[C@@H]1CCc2ccccc21 ZINC000599682507 479388392 /nfs/dbraw/zinc/38/83/92/479388392.db2.gz KVRNIQQDJAQTJH-KBXCAEBGSA-N 0 3 344.415 2.816 20 5 EFBDHN CCCN(CCN1CCCC1)c1ncnc2ccc([N+](=O)[O-])cc21 ZINC000588070204 479389362 /nfs/dbraw/zinc/38/93/62/479389362.db2.gz OPKRYDNBTGNHIZ-UHFFFAOYSA-N 0 3 329.404 2.850 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1CN1CCC[C@@H]1C1CCOCC1)OCCO2 ZINC000611479704 479390312 /nfs/dbraw/zinc/39/03/12/479390312.db2.gz SVQOSIKHYFUNIO-OAHLLOKOSA-N 0 3 348.399 2.757 20 5 EFBDHN CC(C)n1ccc(CNC2CCN(c3ccc([N+](=O)[O-])nc3)CC2)n1 ZINC000602553471 479394107 /nfs/dbraw/zinc/39/41/07/479394107.db2.gz USFVBGGKLXHBKJ-UHFFFAOYSA-N 0 3 344.419 2.526 20 5 EFBDHN CC(C)(CCO)CNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602556361 479395015 /nfs/dbraw/zinc/39/50/15/479395015.db2.gz DMPBMCPRHLCAIB-UHFFFAOYSA-N 0 3 337.239 2.917 20 5 EFBDHN CC(C)[C@H](CCO)NCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602557369 479395068 /nfs/dbraw/zinc/39/50/68/479395068.db2.gz WLWHAUNYJXXSKV-JTQLQIEISA-N 0 3 337.239 2.915 20 5 EFBDHN COC[C@H](NC1CCN(c2ccc([N+](=O)[O-])nc2)CC1)c1ccco1 ZINC000602564343 479399608 /nfs/dbraw/zinc/39/96/08/479399608.db2.gz MACYAXWZBACSEH-HNNXBMFYSA-N 0 3 346.387 2.529 20 5 EFBDHN O=[N+]([O-])c1ccc2oc(CN[C@@H]3CCO[C@]4(CCSC4)C3)nc2c1 ZINC000602566666 479400727 /nfs/dbraw/zinc/40/07/27/479400727.db2.gz AKWRLOGXOWLHOP-BDJLRTHQSA-N 0 3 349.412 2.880 20 5 EFBDHN O=[N+]([O-])c1sc(CN[C@H]2CC[C@H](O)CC2)cc1Br ZINC000602576075 479405224 /nfs/dbraw/zinc/40/52/24/479405224.db2.gz LBRGLQCAJUTMJG-ZKCHVHJHSA-N 0 3 335.223 2.812 20 5 EFBDHN CNC(=O)[C@@H]1CCC[C@@H]1NCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602576210 479406301 /nfs/dbraw/zinc/40/63/01/479406301.db2.gz JXNFNCIHKMQSCM-NEPJUHHUSA-N 0 3 345.321 2.618 20 5 EFBDHN COc1ccc(CN(C)C)cc1NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000603589861 479409984 /nfs/dbraw/zinc/40/99/84/479409984.db2.gz JUYIUTJPYOCUID-UHFFFAOYSA-N 0 3 343.383 2.846 20 5 EFBDHN O=[N+]([O-])c1sc(CNCCN2CCCC2)cc1Br ZINC000602588323 479412770 /nfs/dbraw/zinc/41/27/70/479412770.db2.gz VJHIDRBRBZVAQW-UHFFFAOYSA-N 0 3 334.239 2.604 20 5 EFBDHN COC(=O)COc1ccc(CNC2(C3CCC3)CC2)cc1[N+](=O)[O-] ZINC000593676653 479420335 /nfs/dbraw/zinc/42/03/35/479420335.db2.gz NMXNXPLITFCWTH-UHFFFAOYSA-N 0 3 334.372 2.569 20 5 EFBDHN O=[N+]([O-])c1sc(CN[C@H]2CCCC[C@@H]2O)cc1Br ZINC000602623849 479430698 /nfs/dbraw/zinc/43/06/98/479430698.db2.gz IRWCPTWVCDXPJT-UWVGGRQHSA-N 0 3 335.223 2.812 20 5 EFBDHN CN1CCN(CCOc2cccc([N+](=O)[O-])c2)CC12CCCCC2 ZINC000575327346 479430867 /nfs/dbraw/zinc/43/08/67/479430867.db2.gz UDQQVEQNXWUGHS-UHFFFAOYSA-N 0 3 333.432 2.924 20 5 EFBDHN O=[N+]([O-])c1ccsc1NCc1ccccc1CN1CC[C@@H](O)C1 ZINC000611617956 479430976 /nfs/dbraw/zinc/43/09/76/479430976.db2.gz IHEDQEWQGYDDDM-CQSZACIVSA-N 0 3 333.413 2.835 20 5 EFBDHN O=[N+]([O-])c1sccc1NCc1ccccc1CN1CC[C@H](O)C1 ZINC000611617967 479431115 /nfs/dbraw/zinc/43/11/15/479431115.db2.gz KMAAXCKTMPGMST-AWEZNQCLSA-N 0 3 333.413 2.835 20 5 EFBDHN COc1ccc([C@@H](CNc2cccnc2[N+](=O)[O-])N(C)C)cc1OC ZINC000603837191 479434526 /nfs/dbraw/zinc/43/45/26/479434526.db2.gz CZCUFLYKWXNPGT-CQSZACIVSA-N 0 3 346.387 2.722 20 5 EFBDHN Cc1cc(NC(=O)N2CCN(c3ccncc3)CC2)ccc1[N+](=O)[O-] ZINC000603838172 479436537 /nfs/dbraw/zinc/43/65/37/479436537.db2.gz DCCYKYVTBGPJIF-UHFFFAOYSA-N 0 3 341.371 2.652 20 5 EFBDHN O=[N+]([O-])c1sc(CNC[C@H]2CC[C@H](O)C2)cc1Br ZINC000602647096 479445530 /nfs/dbraw/zinc/44/55/30/479445530.db2.gz SSMBOTJYXYCGMA-YUMQZZPRSA-N 0 3 335.223 2.669 20 5 EFBDHN O=[N+]([O-])c1sc(CNC[C@@H]2CC[C@@H](O)C2)cc1Br ZINC000602647093 479445626 /nfs/dbraw/zinc/44/56/26/479445626.db2.gz SSMBOTJYXYCGMA-HTQZYQBOSA-N 0 3 335.223 2.669 20 5 EFBDHN C[C@@H](CCCO)CNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602672688 479465755 /nfs/dbraw/zinc/46/57/55/479465755.db2.gz FHYUZOHMDWTVGQ-QMMMGPOBSA-N 0 3 337.239 2.917 20 5 EFBDHN CCCN1CC[C@@H](NC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])C1 ZINC000596881132 479469825 /nfs/dbraw/zinc/46/98/25/479469825.db2.gz ILCMUYZJGGWWCN-CYBMUJFWSA-N 0 3 334.420 2.613 20 5 EFBDHN O=[N+]([O-])c1ccc(CCNCc2cccnc2N2CCCC2)cc1 ZINC000602704623 479489153 /nfs/dbraw/zinc/48/91/53/479489153.db2.gz BPMKLFCXOIPZEE-UHFFFAOYSA-N 0 3 326.400 2.922 20 5 EFBDHN CN(CCN1CCCCC1)C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000593884612 479496719 /nfs/dbraw/zinc/49/67/19/479496719.db2.gz UAMGYVDRIVBJBG-UHFFFAOYSA-N 0 3 330.388 2.634 20 5 EFBDHN CN(CCN1CCCCC1)C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000593884998 479497338 /nfs/dbraw/zinc/49/73/38/479497338.db2.gz ZGAZDJBFVFANML-UHFFFAOYSA-N 0 3 337.445 2.631 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC[C@@H](C(=O)N2CCCC2)C1 ZINC000575907890 479499341 /nfs/dbraw/zinc/49/93/41/479499341.db2.gz VQDCMEBWJWQMGN-GSPCDJLXSA-N 0 3 343.427 2.942 20 5 EFBDHN Cc1c([C@@H](C)NCc2ccc(CC(N)=O)cc2)cccc1[N+](=O)[O-] ZINC000589344825 479516269 /nfs/dbraw/zinc/51/62/69/479516269.db2.gz MRZMJYYPCJVRPY-CYBMUJFWSA-N 0 3 327.384 2.782 20 5 EFBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])NCCN1CCCC1=O ZINC000575994738 479518957 /nfs/dbraw/zinc/51/89/57/479518957.db2.gz UZUXVJODPKSITR-ZDUSSCGKSA-N 0 3 337.445 2.678 20 5 EFBDHN CC[C@@H](CN1CCCC1)NC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000614934753 479552001 /nfs/dbraw/zinc/55/20/01/479552001.db2.gz URQUDZYXQVGSBT-LBPRGKRZSA-N 0 3 336.392 2.599 20 5 EFBDHN CN(Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@@H]1CCC(=O)N(C)C1 ZINC000600179253 479566412 /nfs/dbraw/zinc/56/64/12/479566412.db2.gz XCANYPZSUVIHKI-CYBMUJFWSA-N 0 3 343.383 2.907 20 5 EFBDHN CC(C)OC(=O)C[C@H](NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(C)C ZINC000594047506 479566648 /nfs/dbraw/zinc/56/66/48/479566648.db2.gz XQHVMBXXDNWUTA-AWEZNQCLSA-N 0 3 348.403 2.927 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCCN2CCCC[C@@H]12 ZINC000594056129 479570735 /nfs/dbraw/zinc/57/07/35/479570735.db2.gz RCBQSDSWSGSVFF-ZFWWWQNUSA-N 0 3 348.403 2.742 20 5 EFBDHN COC[C@H](NCCn1c(C)ncc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000602817994 479573343 /nfs/dbraw/zinc/57/33/43/479573343.db2.gz MUGJAHCKKMPWOK-AWEZNQCLSA-N 0 3 338.795 2.730 20 5 EFBDHN CCOc1cc(N2CCN(C[C@H]3CCO[C@H]3C)CC2)ccc1[N+](=O)[O-] ZINC000602822095 479575877 /nfs/dbraw/zinc/57/58/77/479575877.db2.gz RKQOSIKULOUXMP-LSDHHAIUSA-N 0 3 349.431 2.541 20 5 EFBDHN COc1ccc(CN2CCCN(c3ccncc3)CC2)cc1[N+](=O)[O-] ZINC000602845871 479590919 /nfs/dbraw/zinc/59/09/19/479590919.db2.gz MIPRJHPKYQMNKC-UHFFFAOYSA-N 0 3 342.399 2.711 20 5 EFBDHN O=[N+]([O-])c1cccc2c(NC3CCN([C@@H]4CCOC4)CC3)ccnc21 ZINC000590083687 479601970 /nfs/dbraw/zinc/60/19/70/479601970.db2.gz HRGSQOXSIAIRON-CQSZACIVSA-N 0 3 342.399 2.808 20 5 EFBDHN C[C@H]1C[C@@H](CCNCc2cc3c(cc2[N+](=O)[O-])OCCO3)CCO1 ZINC000612201778 479609952 /nfs/dbraw/zinc/60/99/52/479609952.db2.gz XUSPMJNWHLFQQL-STQMWFEESA-N 0 3 336.388 2.661 20 5 EFBDHN CC1(C)CN(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)[C@@H]2CCC[C@@H]21 ZINC000590204432 479617719 /nfs/dbraw/zinc/61/77/19/479617719.db2.gz LBRBZAOLDQYNAU-JKSUJKDBSA-N 0 3 343.427 2.994 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)Nc1cccc2c1CCNC2 ZINC000578858668 479620121 /nfs/dbraw/zinc/62/01/21/479620121.db2.gz HLQURVYAOIGBPC-UHFFFAOYSA-N 0 3 341.367 2.892 20 5 EFBDHN C[C@H](C(=O)N[C@H]1CCCN2CCCC[C@@H]12)c1cccc([N+](=O)[O-])c1 ZINC000594195426 479626667 /nfs/dbraw/zinc/62/66/67/479626667.db2.gz GYDAQJXKKPFOHM-JQFCIGGWSA-N 0 3 331.416 2.831 20 5 EFBDHN O=C(N[C@H]1CCCN2CCCC[C@H]12)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000594195695 479626915 /nfs/dbraw/zinc/62/69/15/479626915.db2.gz HIDXNBQNMIITGJ-LSDHHAIUSA-N 0 3 337.807 2.995 20 5 EFBDHN O=C(N[C@@H]1CCCN2CCCC[C@H]12)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000594195694 479627074 /nfs/dbraw/zinc/62/70/74/479627074.db2.gz HIDXNBQNMIITGJ-HUUCEWRRSA-N 0 3 337.807 2.995 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@@H]1CCCN2CCCC[C@@H]12 ZINC000594195707 479627558 /nfs/dbraw/zinc/62/75/58/479627558.db2.gz HQOQGOGFPNPOMM-CVEARBPZSA-N 0 3 331.416 2.958 20 5 EFBDHN CCc1ccc(C(=O)N[C@H]2CCCN3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000594197843 479628374 /nfs/dbraw/zinc/62/83/74/479628374.db2.gz QPTWHWJLZMPWJC-HOTGVXAUSA-N 0 3 331.416 2.904 20 5 EFBDHN O=C(N[C@H]1CCCN2CCCC[C@@H]12)c1c(Cl)cccc1[N+](=O)[O-] ZINC000594198983 479629458 /nfs/dbraw/zinc/62/94/58/479629458.db2.gz WZMCEDVWSDVWQJ-STQMWFEESA-N 0 3 337.807 2.995 20 5 EFBDHN O=C(N[C@H]1CCCN2CCCC[C@H]12)c1c(Cl)cccc1[N+](=O)[O-] ZINC000594198982 479629631 /nfs/dbraw/zinc/62/96/31/479629631.db2.gz WZMCEDVWSDVWQJ-QWHCGFSZSA-N 0 3 337.807 2.995 20 5 EFBDHN CCOc1ccc(C(=O)N[C@H]2CCCN3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000594201735 479630262 /nfs/dbraw/zinc/63/02/62/479630262.db2.gz QOIFEEXYDVHFAX-GJZGRUSLSA-N 0 3 347.415 2.740 20 5 EFBDHN CC[C@@](C)(NCCn1cc([N+](=O)[O-])ccc1=O)c1ccc(F)cc1 ZINC000602922690 479632840 /nfs/dbraw/zinc/63/28/40/479632840.db2.gz BTGIVBUIMPLDGW-QGZVFWFLSA-N 0 3 333.363 2.811 20 5 EFBDHN COc1ccc(-c2ccc(CNC3([C@@H](C)O)CC3)o2)c([N+](=O)[O-])c1 ZINC000597234415 479635554 /nfs/dbraw/zinc/63/55/54/479635554.db2.gz KXKLPSUNCKMQIV-LLVKDONJSA-N 0 3 332.356 2.866 20 5 EFBDHN CC(C)c1ccc(C(=O)N[C@@H]2CCN(CC3CC3)C2)cc1[N+](=O)[O-] ZINC000615240679 479636075 /nfs/dbraw/zinc/63/60/75/479636075.db2.gz OOPYVRGLFMDPNG-OAHLLOKOSA-N 0 3 331.416 2.932 20 5 EFBDHN CCOC(=O)CC1(NC/C=C\c2ccccc2[N+](=O)[O-])CCOCC1 ZINC000597236894 479636861 /nfs/dbraw/zinc/63/68/61/479636861.db2.gz YJESHDXNDPTNMD-ALCCZGGFSA-N 0 3 348.399 2.700 20 5 EFBDHN CC1(C)C[C@@H](NCCOC[C@@H]2CCOC2)c2cc([N+](=O)[O-])ccc21 ZINC000618984302 479658878 /nfs/dbraw/zinc/65/88/78/479658878.db2.gz ZSXUGZNJZQGOHQ-CXAGYDPISA-N 0 3 334.416 2.960 20 5 EFBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H](N2CCOCC2)CC1 ZINC000590601423 479666996 /nfs/dbraw/zinc/66/69/96/479666996.db2.gz WJHSMIZCXOXGLU-HOTGVXAUSA-N 0 3 333.432 2.843 20 5 EFBDHN COc1c(C(=O)N2CCCN(C3CCCC3)CC2)cccc1[N+](=O)[O-] ZINC000619437269 479790080 /nfs/dbraw/zinc/79/00/80/479790080.db2.gz YOCDPDWCFDQFCH-UHFFFAOYSA-N 0 3 347.415 2.694 20 5 EFBDHN CCC(=O)c1ccc(NCCCN2CCCN(C)CC2)c([N+](=O)[O-])c1 ZINC000619479062 479806435 /nfs/dbraw/zinc/80/64/35/479806435.db2.gz HUKXRGPMCXRRSH-UHFFFAOYSA-N 0 3 348.447 2.627 20 5 EFBDHN CCn1nc(C)c([N+](=O)[O-])c1N1CC[C@H](N(C)Cc2ccccc2)C1 ZINC000619482998 479807753 /nfs/dbraw/zinc/80/77/53/479807753.db2.gz CKZBTQWHLFQTHM-INIZCTEOSA-N 0 3 343.431 2.830 20 5 EFBDHN CCOC1CC(CCNCc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC000616094555 479824622 /nfs/dbraw/zinc/82/46/22/479824622.db2.gz CKLPUXKBZYWMML-UHFFFAOYSA-N 0 3 336.388 2.661 20 5 EFBDHN CC[C@H]1CN(C)CCCN1C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000619578697 479834433 /nfs/dbraw/zinc/83/44/33/479834433.db2.gz NJAQBNUBFZAYCS-LBPRGKRZSA-N 0 3 325.796 2.805 20 5 EFBDHN CN(C)[C@H](CNc1ncnc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000609848396 480212083 /nfs/dbraw/zinc/21/20/83/480212083.db2.gz BAWPKRQQDXVVEC-QGZVFWFLSA-N 0 3 337.383 2.675 20 5 EFBDHN CC[C@H](CN1CCCC1)NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000609877096 480215084 /nfs/dbraw/zinc/21/50/84/480215084.db2.gz JQSMOBPEZJIPNE-CYBMUJFWSA-N 0 3 331.372 2.945 20 5 EFBDHN C[C@H]1CCCCC[C@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000614191515 480220627 /nfs/dbraw/zinc/22/06/27/480220627.db2.gz HDAMIGQVZQGRIK-XJKSGUPXSA-N 0 3 340.445 2.927 20 5 EFBDHN CN(C[C@@H]1CCN(Cc2ccccc2)C1)c1cccnc1[N+](=O)[O-] ZINC000610285203 480271837 /nfs/dbraw/zinc/27/18/37/480271837.db2.gz LOUZJEMLUCQQLT-INIZCTEOSA-N 0 3 326.400 2.948 20 5 EFBDHN CN(C[C@H]1CCN(Cc2ccccc2)C1)c1cccnc1[N+](=O)[O-] ZINC000610285204 480272382 /nfs/dbraw/zinc/27/23/82/480272382.db2.gz LOUZJEMLUCQQLT-MRXNPFEDSA-N 0 3 326.400 2.948 20 5 EFBDHN C[C@H](NC[C@@H]1CCCN1c1cccnn1)c1ccccc1[N+](=O)[O-] ZINC000610342231 480283484 /nfs/dbraw/zinc/28/34/84/480283484.db2.gz ALKLNQLSDNIRLK-KBPBESRZSA-N 0 3 327.388 2.704 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCCN(C[C@@H]2CCCO2)CC1 ZINC000610391578 480296012 /nfs/dbraw/zinc/29/60/12/480296012.db2.gz DGPPAXSXEHOGAP-CVEARBPZSA-N 0 3 333.432 2.843 20 5 EFBDHN CC[C@H](CN1CCCC1)Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000610575757 480341009 /nfs/dbraw/zinc/34/10/09/480341009.db2.gz MGDKXCKIAFHPJU-CYBMUJFWSA-N 0 3 332.404 2.766 20 5 EFBDHN CC[C@@H](CN1CCCC1)NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000610719287 480373811 /nfs/dbraw/zinc/37/38/11/480373811.db2.gz PKTOBLVMZZUZFV-ZFWWWQNUSA-N 0 3 334.420 2.829 20 5 EFBDHN C[C@@H](c1ccccc1)[C@@H](CO)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000618306373 480613551 /nfs/dbraw/zinc/61/35/51/480613551.db2.gz AKRAMMUHMJOGPM-YVEFUNNKSA-N 0 3 340.383 2.725 20 5 EFBDHN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000191371458 534055700 /nfs/dbraw/zinc/05/57/00/534055700.db2.gz AJSFRTHGSQEEIQ-CQSZACIVSA-N 0 3 330.388 2.690 20 5 EFBDHN CC(C)CO[C@H]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000119873948 519761646 /nfs/dbraw/zinc/76/16/46/519761646.db2.gz TXJJYVQVOSTPCJ-INIZCTEOSA-N 0 3 335.404 2.670 20 5 EFBDHN CCOc1ccc(C(=O)NC[C@H](C)N2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000067272584 520911767 /nfs/dbraw/zinc/91/17/67/520911767.db2.gz PXFUVWALDQFSKI-AWEZNQCLSA-N 0 3 349.431 2.844 20 5 EFBDHN CCN1CCCN(Cc2ccc(Br)c([N+](=O)[O-])c2)CC1 ZINC000155357509 521612083 /nfs/dbraw/zinc/61/20/83/521612083.db2.gz LZVQRVDPCPWAPQ-UHFFFAOYSA-N 0 3 342.237 2.885 20 5 EFBDHN CCCN(CCN(C)C)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000117791462 521654416 /nfs/dbraw/zinc/65/44/16/521654416.db2.gz NEDLZWUGDTWZDC-UHFFFAOYSA-N 0 3 327.812 2.591 20 5 EFBDHN CCS[C@H]1CC[C@H](N(C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000072837673 521733139 /nfs/dbraw/zinc/73/31/39/521733139.db2.gz JPOGONFEMULYRM-KBPBESRZSA-N 0 3 337.445 2.800 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)C1CCN(C)CC1 ZINC000154070494 521750985 /nfs/dbraw/zinc/75/09/85/521750985.db2.gz KPHBIRDTFBSUHR-UHFFFAOYSA-N 0 3 337.445 2.873 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)CCN[C@H](C)c1cccnc1 ZINC000181629569 522975926 /nfs/dbraw/zinc/97/59/26/522975926.db2.gz RXRBAUSAWGEHSY-GFCCVEGCSA-N 0 3 344.371 2.678 20 5 EFBDHN CN1CC[C@@H]2[C@H](CCCN2C(=O)CSc2ccccc2[N+](=O)[O-])C1 ZINC000157156806 523973639 /nfs/dbraw/zinc/97/36/39/523973639.db2.gz VFVCTYQZYAQAFK-ZIAGYGMSSA-N 0 3 349.456 2.630 20 5 EFBDHN C[C@@H](CN(C)Cc1ccccc1)NC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000182071900 524574675 /nfs/dbraw/zinc/57/46/75/524574675.db2.gz DSOOWXCOZDVFSJ-AWEZNQCLSA-N 0 3 327.384 2.845 20 5 EFBDHN Cc1cccc(OCCN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000118866836 524742098 /nfs/dbraw/zinc/74/20/98/524742098.db2.gz TVZBANOMLAOLGG-HNNXBMFYSA-N 0 3 342.399 2.863 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)c2ccccc2[N+](=O)[O-])CN1Cc1ccccc1 ZINC000137457300 524802654 /nfs/dbraw/zinc/80/26/54/524802654.db2.gz NQYBJGQNILBBBE-GOEBONIOSA-N 0 3 339.395 2.988 20 5 EFBDHN C[C@@H]1CN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H](C)CN1 ZINC000237386192 524883888 /nfs/dbraw/zinc/88/38/88/524883888.db2.gz ANJZLDGKTZWMJI-GHMZBOCLSA-N 0 3 346.412 2.541 20 5 EFBDHN Cc1c(Br)c(NC[C@H](C)N(C)C2CC2)ncc1[N+](=O)[O-] ZINC000230581631 525523816 /nfs/dbraw/zinc/52/38/16/525523816.db2.gz YFMXZKZTHQUXDX-QMMMGPOBSA-N 0 3 343.225 2.955 20 5 EFBDHN CC(=O)c1ccc(NCC2(N3CCCC3)CCOCC2)c([N+](=O)[O-])c1 ZINC000264354060 534868301 /nfs/dbraw/zinc/86/83/01/534868301.db2.gz ZZBGLGCWSIYTMR-UHFFFAOYSA-N 0 3 347.415 2.854 20 5 EFBDHN CSc1ccc(C(=O)NCCN2CCCCCC2)cc1[N+](=O)[O-] ZINC000193288848 525964480 /nfs/dbraw/zinc/96/44/80/525964480.db2.gz VRXKQJFSWCAKGA-UHFFFAOYSA-N 0 3 337.445 2.923 20 5 EFBDHN CCCN1CCC[C@H]1CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000343609695 534909100 /nfs/dbraw/zinc/90/91/00/534909100.db2.gz OIPPPCWVBVJPQP-NSHDSACASA-N 0 3 325.796 2.852 20 5 EFBDHN CCCN1CCC[C@H]1CNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000343631408 534908623 /nfs/dbraw/zinc/90/86/23/534908623.db2.gz BJAUPPIGBHMSQS-AWEZNQCLSA-N 0 3 331.372 2.945 20 5 EFBDHN CCCN1CCC[C@H]1CNC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000343556997 534910425 /nfs/dbraw/zinc/91/04/25/534910425.db2.gz SNIIVTNQPZOQEI-OCCSQVGLSA-N 0 3 337.395 2.828 20 5 EFBDHN O=C(NC[C@H]1CCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])s1 ZINC000193774393 526613775 /nfs/dbraw/zinc/61/37/75/526613775.db2.gz XRSMLUXBTVJCGO-CQSZACIVSA-N 0 3 345.424 2.908 20 5 EFBDHN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCC[C@@H](N2CCCC2)C1 ZINC000363369203 526680783 /nfs/dbraw/zinc/68/07/83/526680783.db2.gz IATQZYNKZCUFMY-CYBMUJFWSA-N 0 3 337.807 2.949 20 5 EFBDHN Cc1nn(C)c(Nc2cccc(CN3CCSCC3)c2)c1[N+](=O)[O-] ZINC000078727580 527679303 /nfs/dbraw/zinc/67/93/03/527679303.db2.gz DLCFJJNGUDSODK-UHFFFAOYSA-N 0 3 347.444 2.929 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000184233044 527899043 /nfs/dbraw/zinc/89/90/43/527899043.db2.gz UGRTUJPZWNWUHT-KGLIPLIRSA-N 0 3 337.395 2.801 20 5 EFBDHN CC1(CO)CCN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000186960991 528000414 /nfs/dbraw/zinc/00/04/14/528000414.db2.gz CNMYWQDATAWRPU-UHFFFAOYSA-N 0 3 345.399 2.887 20 5 EFBDHN CCOc1ccc([C@@H](C)NC[C@]2(O)CCSC2)cc1[N+](=O)[O-] ZINC000154118598 528596456 /nfs/dbraw/zinc/59/64/56/528596456.db2.gz GMMVRNHUJXHEHW-IAQYHMDHSA-N 0 3 326.418 2.512 20 5 EFBDHN CCOc1ccc([C@H](C)NCCCO[C@@H]2CCOC2)cc1[N+](=O)[O-] ZINC000154220272 528605597 /nfs/dbraw/zinc/60/55/97/528605597.db2.gz WPHVRXRDUJTXGI-DZGCQCFKSA-N 0 3 338.404 2.840 20 5 EFBDHN CCCn1ccnc1CCCN(C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000191520267 528864504 /nfs/dbraw/zinc/86/45/04/528864504.db2.gz IKWBUMHXKLZPPM-KRWDZBQOSA-N 0 3 346.431 2.799 20 5 EFBDHN CC(C)Oc1cc(C(=O)N2CC[C@H]3CCN(C)C[C@@H]32)ccc1[N+](=O)[O-] ZINC000412248099 534946707 /nfs/dbraw/zinc/94/67/07/534946707.db2.gz KUASJZUTFBWFEH-CJNGLKHVSA-N 0 3 347.415 2.548 20 5 EFBDHN CC(C)Oc1cc(C(=O)N[C@H]2CCN(C)[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000412134056 534951046 /nfs/dbraw/zinc/95/10/46/534951046.db2.gz LGWUKKMTNYQVDO-JSGCOSHPSA-N 0 3 335.404 2.595 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000346414178 535487749 /nfs/dbraw/zinc/48/77/49/535487749.db2.gz GPWHCNUGFYSSAD-CYBMUJFWSA-N 0 3 330.388 2.680 20 5 EFBDHN CN(C)CCN(Cc1ccc([N+](=O)[O-])cc1Cl)C[C@H]1CCCO1 ZINC000349070342 535862274 /nfs/dbraw/zinc/86/22/74/535862274.db2.gz BWQLHOGVDOKFPG-OAHLLOKOSA-N 0 3 341.839 2.791 20 5 EFBDHN CC[C@H](NCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])[C@@H]1CC1(C)C ZINC000419321819 535896090 /nfs/dbraw/zinc/89/60/90/535896090.db2.gz ROTOPSFQKIBKRO-STQMWFEESA-N 0 3 335.404 2.956 20 5 EFBDHN CCc1cnccc1[C@H](C)NC[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000343748553 536104856 /nfs/dbraw/zinc/10/48/56/536104856.db2.gz IAWHJKBHZBKLBJ-ZFWWWQNUSA-N 0 3 345.399 2.643 20 5 EFBDHN CN1CCC[C@]2(CCN(C(=O)c3cc4cccc([N+](=O)[O-])c4[nH]3)C2)C1 ZINC000356315893 536394422 /nfs/dbraw/zinc/39/44/22/536394422.db2.gz SGKRWGSEAKXHHJ-SFHVURJKSA-N 0 3 342.399 2.634 20 5 EFBDHN COc1cc(CN[C@H](CCO)C(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000266124341 536813235 /nfs/dbraw/zinc/81/32/35/536813235.db2.gz BCCYXKAQBRIVLZ-LLVKDONJSA-N 0 3 348.346 2.701 20 5 EFBDHN CN(C)[C@H]1CCCN(C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000173015187 537705396 /nfs/dbraw/zinc/70/53/96/537705396.db2.gz BNFJMJWCAKYRNX-NSHDSACASA-N 0 3 345.321 2.780 20 5 EFBDHN C[C@H](N[C@@]1(C)CCO[C@H]1C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000755170387 575555568 /nfs/dbraw/zinc/55/55/68/575555568.db2.gz QIIMIZPEBWOFSY-YHAQOWFVSA-N 0 3 341.795 2.732 20 5 EFBDHN C[C@H](N[C@]1(C)CCO[C@H]1C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000755170381 575555611 /nfs/dbraw/zinc/55/56/11/575555611.db2.gz QIIMIZPEBWOFSY-AMJWSMQMSA-N 0 3 341.795 2.732 20 5 EFBDHN C[C@@H]1C[C@H](NC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)CCN1C ZINC000756950061 575804357 /nfs/dbraw/zinc/80/43/57/575804357.db2.gz ASWNUONJCRJWID-ZYHUDNBSSA-N 0 3 340.811 2.530 20 5 EFBDHN C[C@H]1CC[C@H](C)N1CC(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000756998575 575809323 /nfs/dbraw/zinc/80/93/23/575809323.db2.gz MTUXJXABNBBKHH-QWRGUYRKSA-N 0 3 325.796 2.737 20 5 EFBDHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000757795336 575853153 /nfs/dbraw/zinc/85/31/53/575853153.db2.gz KXZMNGFCWGPOSJ-RNCFNFMXSA-N 0 3 338.795 2.852 20 5 EFBDHN Cc1cc(F)cc(C(=O)N(C)C2CCN(C(C)C)CC2)c1[N+](=O)[O-] ZINC000758394594 575868600 /nfs/dbraw/zinc/86/86/00/575868600.db2.gz GPQTUMYKEONHKP-UHFFFAOYSA-N 0 3 337.395 2.987 20 5 EFBDHN Cc1cc(F)cc(C(=O)N2CC[C@@H](N3CCCCC3)C2)c1[N+](=O)[O-] ZINC000758488005 575870841 /nfs/dbraw/zinc/87/08/41/575870841.db2.gz WHLZZCVSELOALS-CQSZACIVSA-N 0 3 335.379 2.743 20 5 EFBDHN O=[N+]([O-])c1ccc([C@H](O)CN2CCC(c3ccncc3)CC2)cc1 ZINC000759935083 575957913 /nfs/dbraw/zinc/95/79/13/575957913.db2.gz COGNIZMKCCFHKM-GOSISDBHSA-N 0 3 327.384 2.903 20 5 EFBDHN CN(Cc1ccc(Br)c([N+](=O)[O-])c1)CC1(O)CCC1 ZINC000761220180 576131470 /nfs/dbraw/zinc/13/14/70/576131470.db2.gz VOSBSPMXOHTRLT-UHFFFAOYSA-N 0 3 329.194 2.704 20 5 EFBDHN C[C@@H]1CN(C[C@H](O)COc2cccc([N+](=O)[O-])c2)Cc2ccccc21 ZINC000763629761 576383359 /nfs/dbraw/zinc/38/33/59/576383359.db2.gz SJCWQHBBSLJMOP-PBHICJAKSA-N 0 3 342.395 2.954 20 5 EFBDHN Cc1nn(CN2CCC3(C2)CCOCC3)c2ccc([N+](=O)[O-])cc12 ZINC000765047250 577000951 /nfs/dbraw/zinc/00/09/51/577000951.db2.gz JVZQHAXHSRFEDN-UHFFFAOYSA-N 0 3 330.388 2.713 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(N[C@H]2CCN(C)[C@@H](C)C2)cc1Cl ZINC000765508843 577048716 /nfs/dbraw/zinc/04/87/16/577048716.db2.gz LDCWEKXVSSKNNW-UWVGGRQHSA-N 0 3 341.795 2.929 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](CN(C)C)C(C)C ZINC000765517222 577049927 /nfs/dbraw/zinc/04/99/27/577049927.db2.gz WBWXFHDDIGJNHT-DOTOQJQBSA-N 0 3 335.448 2.866 20 5 EFBDHN O=C(NC[C@@H]1CCCCN1C1CC1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000765802050 577078610 /nfs/dbraw/zinc/07/86/10/577078610.db2.gz YAIOEQQVDLBAAD-LBPRGKRZSA-N 0 3 337.807 2.995 20 5 EFBDHN COc1cccc2c1CC[C@@H]2NC[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000765849337 577082481 /nfs/dbraw/zinc/08/24/81/577082481.db2.gz OQDQZLYETSIUNW-DLBZAZTESA-N 0 3 328.368 2.914 20 5 EFBDHN CS[C@@H]1CN(c2nc3ccc([N+](=O)[O-])cc3s2)C[C@@H]1N(C)C ZINC000767292986 577202957 /nfs/dbraw/zinc/20/29/57/577202957.db2.gz WHTJVWREZAJDTO-WCQYABFASA-N 0 3 338.458 2.686 20 5 EFBDHN CC[C@@H](CO)N(Cc1ccccc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000767816845 577235954 /nfs/dbraw/zinc/23/59/54/577235954.db2.gz BFKUECNWOYONRR-HKUYNNGSSA-N 0 3 344.411 2.901 20 5 EFBDHN Cc1c(CN2CCC[C@H]([C@@H](O)c3nccn3C)C2)cccc1[N+](=O)[O-] ZINC000769939718 577394569 /nfs/dbraw/zinc/39/45/69/577394569.db2.gz AGURYVFFSWPLNJ-DOTOQJQBSA-N 0 3 344.415 2.582 20 5 EFBDHN CCN(CC)CCOC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000772206232 581295263 /nfs/dbraw/zinc/29/52/63/581295263.db2.gz GOKLXWPPIMKRBX-UHFFFAOYSA-N 0 3 345.193 2.856 20 5 EFBDHN CCc1nnc([C@H](C)[NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)[n-]1 ZINC000773136181 581400005 /nfs/dbraw/zinc/40/00/05/581400005.db2.gz GLLKLYBMYUFVLD-LBPRGKRZSA-N 0 3 344.419 2.595 20 5 EFBDHN CN(Cc1cc(C(C)(C)C)[nH]n1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000773926630 581473801 /nfs/dbraw/zinc/47/38/01/581473801.db2.gz PZOVWFTUMVYGDZ-HNNXBMFYSA-N 0 3 332.404 2.781 20 5 EFBDHN O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2NCc2ccc([N+](=O)[O-])cc2)n1 ZINC000774232462 581487733 /nfs/dbraw/zinc/48/77/33/581487733.db2.gz YTKXSFHCKHWKLA-CABCVRRESA-N 0 3 345.359 2.973 20 5 EFBDHN O=[N+]([O-])c1ccc([C@H](O)CNC[C@@H](O)c2ccc(Cl)cc2)cc1 ZINC000774609139 581495100 /nfs/dbraw/zinc/49/51/00/581495100.db2.gz SQCAFIZTVFURMW-HZPDHXFCSA-N 0 3 336.775 2.605 20 5 EFBDHN O=[N+]([O-])c1ccc([C@@H](O)CNC[C@@H](O)c2ccc(Cl)cc2)cc1 ZINC000774609136 581495132 /nfs/dbraw/zinc/49/51/32/581495132.db2.gz SQCAFIZTVFURMW-CVEARBPZSA-N 0 3 336.775 2.605 20 5 EFBDHN CC([C@@H](OC(=O)c1c(Cl)cnn1C)c1ccccc1F)[N+](=O)[O-] ZINC000851107928 1250799753 /nfs/dbraw/zinc/79/97/53/1250799753.db2.gz FQJZUVJLZPNRAG-AMIZOPFISA-N 0 3 341.726 2.776 20 5 EFBDHN CC([C@H](OC(=O)c1ccnn1C(F)F)c1ccccc1F)[N+](=O)[O-] ZINC000851108954 1250806206 /nfs/dbraw/zinc/80/62/06/1250806206.db2.gz SUQUVKLINKGWAZ-PELKAZGASA-N 0 3 343.261 2.981 20 5 EFBDHN CC([C@H](OC(=O)c1cnc2n1CCC2)c1ccccc1F)[N+](=O)[O-] ZINC000851108872 1250806495 /nfs/dbraw/zinc/80/64/95/1250806495.db2.gz QMGHSQBVBDWZMP-BONVTDFDSA-N 0 3 333.319 2.532 20 5 EFBDHN CCC1(C(=O)N2CCC(NCc3csc([N+](=O)[O-])c3)CC2)CC1 ZINC000996977021 1256615394 /nfs/dbraw/zinc/61/53/94/1256615394.db2.gz IAMXJMBPUQPWSI-UHFFFAOYSA-N 0 3 337.445 2.927 20 5 EFBDHN Cc1c[nH]cc1C(=O)N1CCC(NCc2csc([N+](=O)[O-])c2)CC1 ZINC000997301863 1257341237 /nfs/dbraw/zinc/34/12/37/1257341237.db2.gz HCBXASRRIMYFBB-UHFFFAOYSA-N 0 3 348.428 2.687 20 5 EFBDHN O=C(/C=C\C1CC1)N1CCC(CNCc2csc([N+](=O)[O-])c2)CC1 ZINC000997637938 1258141711 /nfs/dbraw/zinc/14/17/11/1258141711.db2.gz OWDLQTXEOYWQGD-ARJAWSKDSA-N 0 3 349.456 2.951 20 5 EFBDHN O=C(NCCCNCc1ccccc1[N+](=O)[O-])C1(F)CCCCC1 ZINC001170155939 1278150610 /nfs/dbraw/zinc/15/06/10/1278150610.db2.gz QGZVLHHSDBTXAX-UHFFFAOYSA-N 0 3 337.395 2.863 20 5 EFBDHN C[C@@H](NC(=O)NC[C@@H]1CCCCN1C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000922205467 1264917308 /nfs/dbraw/zinc/91/73/08/1264917308.db2.gz LCCCFUWVWVROQK-DYVFJYSZSA-N 0 3 346.431 2.972 20 5 EFBDHN C[C@@H](CNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)N1CCCCC1 ZINC000736070585 1267490778 /nfs/dbraw/zinc/49/07/78/1267490778.db2.gz XUOQADUINNHJOU-NSHDSACASA-N 0 3 325.796 2.852 20 5 EFBDHN O=C(NC[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1)c1ccccc1 ZINC001086015183 1269528549 /nfs/dbraw/zinc/52/85/49/1269528549.db2.gz BRRFQQDNGDGMCS-KDYLLFBJSA-N 0 3 339.395 2.893 20 5 EFBDHN Cc1cc(Cl)c(C(=O)NC[C@H](C)N2CCCC2)cc1[N+](=O)[O-] ZINC000825441866 1278550395 /nfs/dbraw/zinc/55/03/95/1278550395.db2.gz ZFQKRNYPUNHWAQ-NSHDSACASA-N 0 3 325.796 2.771 20 5 EFBDHN CC(F)(F)C(=O)N[C@H]1CC[C@H](NCc2csc([N+](=O)[O-])c2)CC1 ZINC001034579732 1272290514 /nfs/dbraw/zinc/29/05/14/1272290514.db2.gz DXCHBEVMRIPBDT-XYPYZODXSA-N 0 3 347.387 2.829 20 5 EFBDHN CC1(C(=O)N[C@H]2CC[C@H](NCc3csc([N+](=O)[O-])c3)CC2)CC1 ZINC001034650339 1272439373 /nfs/dbraw/zinc/43/93/73/1272439373.db2.gz GAKSIROPHGUPFE-JOCQHMNTSA-N 0 3 337.445 2.973 20 5 EFBDHN C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H](C)N1[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169012913 1272585270 /nfs/dbraw/zinc/58/52/70/1272585270.db2.gz SMQFMRJTCYXZEM-XGUBFFRZSA-N 0 3 341.452 2.762 20 5 EFBDHN CC(C)(C)OC(=O)N1CC2(C1)CCCN2[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169011350 1272585712 /nfs/dbraw/zinc/58/57/12/1272585712.db2.gz KABSSAJQINCGNP-ZIAGYGMSSA-N 0 3 339.436 2.517 20 5 EFBDHN COc1ccc(-c2nc(CN[C@H]3CC[C@H](C[N+](=O)[O-])C3)co2)cc1 ZINC001168987923 1272588670 /nfs/dbraw/zinc/58/86/70/1272588670.db2.gz LIMATWMPWIQEMS-JSGCOSHPSA-N 0 3 331.372 2.885 20 5 EFBDHN O=[N+]([O-])C[C@H]1CC[C@H](N2CCN(Cc3cccc(Cl)c3)CC2)C1 ZINC001169028492 1272592271 /nfs/dbraw/zinc/59/22/71/1272592271.db2.gz SRBAWJBYCFCDDE-RDJZCZTQSA-N 0 3 337.851 2.903 20 5 EFBDHN CC[C@H]1CN([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CCN1C(=O)OC(C)(C)C ZINC001169034583 1272596494 /nfs/dbraw/zinc/59/64/94/1272596494.db2.gz IAYMXWPTDIBTGT-QLFBSQMISA-N 0 3 341.452 2.763 20 5 EFBDHN C[C@H]1CN([C@H]2CC[C@H](C[N+](=O)[O-])C2)[C@@H](C)CN1C(=O)OC(C)(C)C ZINC001169035133 1272599769 /nfs/dbraw/zinc/59/97/69/1272599769.db2.gz AKSLWYWRZGGDBS-AJNGGQMLSA-N 0 3 341.452 2.762 20 5 EFBDHN O=[N+]([O-])C[C@@H]1CC[C@@H](N2CCN(Cc3ccc(Cl)cc3)CC2)C1 ZINC001169037557 1272604189 /nfs/dbraw/zinc/60/41/89/1272604189.db2.gz SMIBNSRVQDYCMB-NVXWUHKLSA-N 0 3 337.851 2.903 20 5 EFBDHN CC(C)(C)OC(=O)N1CCN([C@H]2CC[C@@H](C[N+](=O)[O-])C2)C(C)(C)C1 ZINC001169038127 1272606671 /nfs/dbraw/zinc/60/66/71/1272606671.db2.gz VWLYRGKNUBBRNH-KGLIPLIRSA-N 0 3 341.452 2.763 20 5 EFBDHN NCc1ccnn1-c1c2ccc(Br)cc2ncc1[N+](=O)[O-] ZINC001162593839 1272829331 /nfs/dbraw/zinc/82/93/31/1272829331.db2.gz RJKKYZCXOSIEGX-UHFFFAOYSA-N 0 3 348.160 2.550 20 5 EFBDHN Cc1cc(C)c(C(=O)NCCCNCc2ccccc2[N+](=O)[O-])o1 ZINC001156321847 1272953009 /nfs/dbraw/zinc/95/30/09/1272953009.db2.gz XVENTIRHIDYPBJ-UHFFFAOYSA-N 0 3 331.372 2.714 20 5 EFBDHN CN(CCCNc1ccccc1[N+](=O)[O-])C(=O)CN1CCC(C)(C)C1 ZINC001109622845 1274481814 /nfs/dbraw/zinc/48/18/14/1274481814.db2.gz AEUQESGIHYEURN-UHFFFAOYSA-N 0 3 348.447 2.587 20 5 EFBDHN CN1CCC(NC(=S)N(Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000746532003 1275013025 /nfs/dbraw/zinc/01/30/25/1275013025.db2.gz GVKSDPGYLVXEIX-UHFFFAOYSA-N 0 3 348.472 2.528 20 5 EFBDHN COc1ccc(C[C@@H](C)NCC(=O)Nc2ccccc2)c([N+](=O)[O-])c1 ZINC001170305372 1278992079 /nfs/dbraw/zinc/99/20/79/1278992079.db2.gz JVDUHBUJYFLPAF-CYBMUJFWSA-N 0 3 343.383 2.763 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CNCCO[C@@H]2CCOC2)o1 ZINC000922939492 1276365535 /nfs/dbraw/zinc/36/55/35/1276365535.db2.gz PTCLSGMMIHYVDL-CQSZACIVSA-N 0 3 332.356 2.750 20 5 EFBDHN COc1ccc(C[C@H](C)N2CCC[C@]3(CCC(=O)O3)C2)c([N+](=O)[O-])c1 ZINC001170355236 1279034152 /nfs/dbraw/zinc/03/41/52/1279034152.db2.gz YAPCUNZFQYOTAL-UGSOOPFHSA-N 0 3 348.399 2.706 20 5 EFBDHN CCC(=O)Nc1cccc(CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000818963733 1276552370 /nfs/dbraw/zinc/55/23/70/1276552370.db2.gz ZDCSRXTXQFMUMG-QGZVFWFLSA-N 0 3 343.383 2.767 20 5 EFBDHN CC(C)Oc1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cn1 ZINC000818960833 1276559257 /nfs/dbraw/zinc/55/92/57/1276559257.db2.gz JVKVZDLGYILKBN-INIZCTEOSA-N 0 3 331.372 2.600 20 5 EFBDHN CCCOc1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cn1 ZINC000819040352 1276577666 /nfs/dbraw/zinc/57/76/66/1276577666.db2.gz WZYPABAKUYYBCP-INIZCTEOSA-N 0 3 331.372 2.602 20 5 EFBDHN COCc1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)ccc1F ZINC000819037334 1276596829 /nfs/dbraw/zinc/59/68/29/1276596829.db2.gz OEVPZEIFSGEAKC-KRWDZBQOSA-N 0 3 334.347 2.704 20 5 EFBDHN COc1ccc2c(c1)OCC[C@@H]2NC[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819103897 1276610026 /nfs/dbraw/zinc/61/00/26/1276610026.db2.gz MIUUMNAOIUJEAO-DLBZAZTESA-N 0 3 344.367 2.750 20 5 EFBDHN CCOc1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)ccc1OC ZINC000819069264 1276618693 /nfs/dbraw/zinc/61/86/93/1276618693.db2.gz NZMOOFYZZOUKKE-MRXNPFEDSA-N 0 3 346.383 2.825 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CNCc2cccc3c2OCCCO3)c1 ZINC000819177197 1276659174 /nfs/dbraw/zinc/65/91/74/1276659174.db2.gz CIVYANLWMHQHFF-MRXNPFEDSA-N 0 3 344.367 2.579 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCOc3c(F)cccc32)c1 ZINC000819251067 1276685225 /nfs/dbraw/zinc/68/52/25/1276685225.db2.gz AIWFSUQVPLZNIW-JKSUJKDBSA-N 0 3 332.331 2.881 20 5 EFBDHN NC(=O)C1=NO[C@H](CNCc2c3ccccc3cc3ccccc32)C1 ZINC000789562518 1276852599 /nfs/dbraw/zinc/85/25/99/1276852599.db2.gz YHBKJYQVXDYDEW-HNNXBMFYSA-N 0 3 333.391 2.713 20 5 EFBDHN Nc1ccc(NC(=O)[C@@H]2CCCCN2C2CCCC2)cc1[N+](=O)[O-] ZINC000819920817 1276948305 /nfs/dbraw/zinc/94/83/05/1276948305.db2.gz SGPCJZGLBWYJRY-HNNXBMFYSA-N 0 3 332.404 2.913 20 5 EFBDHN Nc1ccc(NC(=O)[C@H]2CCCCN2C2CCCC2)cc1[N+](=O)[O-] ZINC000819920820 1276948560 /nfs/dbraw/zinc/94/85/60/1276948560.db2.gz SGPCJZGLBWYJRY-OAHLLOKOSA-N 0 3 332.404 2.913 20 5 EFBDHN COc1ccc(C[C@H](C)NC2(c3cccnn3)CC2)c([N+](=O)[O-])c1 ZINC001170306575 1279028050 /nfs/dbraw/zinc/02/80/50/1279028050.db2.gz XSNCWIWNZPBRFZ-LBPRGKRZSA-N 0 3 328.372 2.603 20 5 EFBDHN COc1ccc(C[C@@H](C)NCc2cccnc2OC)c([N+](=O)[O-])c1 ZINC001170306984 1279030470 /nfs/dbraw/zinc/03/04/70/1279030470.db2.gz CLTMRVSKBLSDNY-GFCCVEGCSA-N 0 3 331.372 2.728 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1[C@@H]2CC[C@H]1CN(C)CC2 ZINC000923271512 1277440608 /nfs/dbraw/zinc/44/06/08/1277440608.db2.gz SAAQCAIUWLHXDC-JZXOWHBKSA-N 0 3 345.443 2.859 20 5 EFBDHN COc1cc(C(=O)OC[C@H]2CCN2C(C)(C)C)cc([N+](=O)[O-])c1C ZINC000845736047 1279808283 /nfs/dbraw/zinc/80/82/83/1279808283.db2.gz OCVDIVRWSWAHAH-CYBMUJFWSA-N 0 3 336.388 2.941 20 5 EFBDHN CC([C@H](OC(=O)/C=C/c1cnn(C)c1)c1ccccc1F)[N+](=O)[O-] ZINC000845872297 1279900690 /nfs/dbraw/zinc/90/06/90/1279900690.db2.gz GCWCHFIAMFJMSC-INAIPGEWSA-N 0 3 333.319 2.522 20 5 EFBDHN CC([C@H](OC(=O)c1n[nH]c2c1CCCC2)c1ccccc1F)[N+](=O)[O-] ZINC000845872131 1279901138 /nfs/dbraw/zinc/90/11/38/1279901138.db2.gz CISUBHODFZDDGX-QFYYESIMSA-N 0 3 347.346 2.991 20 5 EFBDHN CC([C@@H](OC(=O)C[C@@H](C)n1cccn1)c1ccccc1F)[N+](=O)[O-] ZINC000845875299 1279901701 /nfs/dbraw/zinc/90/17/01/1279901701.db2.gz BBRCGNIBRCORIM-BFQNTYOBSA-N 0 3 335.335 2.923 20 5 EFBDHN CC([C@@H](OC(=O)c1cc2n(n1)CCC2)c1ccccc1F)[N+](=O)[O-] ZINC000845875641 1279902042 /nfs/dbraw/zinc/90/20/42/1279902042.db2.gz ASWONGHJFJFHTG-ZUZCIYMTSA-N 0 3 333.319 2.532 20 5 EFBDHN CC([C@@H](OC(=O)COCc1cccnc1)c1ccccc1F)[N+](=O)[O-] ZINC000845878443 1279903056 /nfs/dbraw/zinc/90/30/56/1279903056.db2.gz GVEDBDVXOZXJTH-SJKOYZFVSA-N 0 3 348.330 2.687 20 5 EFBDHN CC([C@@H](OC(=O)COCc1cccnc1)c1ccccc1F)[N+](=O)[O-] ZINC000845878446 1279903366 /nfs/dbraw/zinc/90/33/66/1279903366.db2.gz GVEDBDVXOZXJTH-YVEFUNNKSA-N 0 3 348.330 2.687 20 5 EFBDHN CC([C@@H](OC(=O)c1ccn(C(F)F)n1)c1ccccc1F)[N+](=O)[O-] ZINC000845876747 1279903539 /nfs/dbraw/zinc/90/35/39/1279903539.db2.gz OFSSJBBMLFKAAA-QPUJVOFHSA-N 0 3 343.261 2.981 20 5 EFBDHN COc1cccc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])n1 ZINC000845877474 1279903568 /nfs/dbraw/zinc/90/35/68/1279903568.db2.gz PWQBPGXIKZUYSK-MEBBXXQBSA-N 0 3 334.303 2.793 20 5 EFBDHN COc1cccc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])n1 ZINC000845877471 1279903614 /nfs/dbraw/zinc/90/36/14/1279903614.db2.gz PWQBPGXIKZUYSK-BONVTDFDSA-N 0 3 334.303 2.793 20 5 EFBDHN CC([C@@H](OC(=O)c1ccn(C(F)F)n1)c1ccccc1F)[N+](=O)[O-] ZINC000845876745 1279903768 /nfs/dbraw/zinc/90/37/68/1279903768.db2.gz OFSSJBBMLFKAAA-PRHODGIISA-N 0 3 343.261 2.981 20 5 EFBDHN CC([C@@H](OC(=O)c1cc(Cl)n(C)n1)c1ccccc1F)[N+](=O)[O-] ZINC000845882066 1279905938 /nfs/dbraw/zinc/90/59/38/1279905938.db2.gz NVAYYAXDBYGZAJ-AMIZOPFISA-N 0 3 341.726 2.776 20 5 EFBDHN CC([C@H](OC(=O)C[C@@H]1CCCOC1)c1ccccc1F)[N+](=O)[O-] ZINC000845883830 1279906082 /nfs/dbraw/zinc/90/60/82/1279906082.db2.gz WHMDVUMJVMQFMJ-WQGACYEGSA-N 0 3 325.336 2.892 20 5 EFBDHN CCn1ccc(CC(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])n1 ZINC000845883099 1279906628 /nfs/dbraw/zinc/90/66/28/1279906628.db2.gz YNPBJUVJUQFOEE-MEDUHNTESA-N 0 3 335.335 2.534 20 5 EFBDHN CC([C@H](OC(=O)CCOCC(F)F)c1ccccc1F)[N+](=O)[O-] ZINC000845884401 1279907694 /nfs/dbraw/zinc/90/76/94/1279907694.db2.gz YZCVNIKZUASUQE-OTYXRUKQSA-N 0 3 335.278 2.747 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCN1CCO[C@H](C)C1 ZINC000872033977 1287406687 /nfs/dbraw/zinc/40/66/87/1287406687.db2.gz KUOFGJVFCHNJRJ-CHWSQXEVSA-N 0 3 339.461 2.688 20 5 EFBDHN CCn1cnnc1CCN[C@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872044456 1287409239 /nfs/dbraw/zinc/40/92/39/1287409239.db2.gz BHCQMCOIDNLSQA-LLVKDONJSA-N 0 3 335.433 2.821 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C)[C@H]1CN(C)CCO1 ZINC000872051231 1287412260 /nfs/dbraw/zinc/41/22/60/1287412260.db2.gz GOFPSPXDETYKTO-SLEUVZQESA-N 0 3 339.461 2.686 20 5 EFBDHN O=[N+]([O-])c1cc(CN[C@@H](C2CC2)[C@@]2(CO)CCCO2)ccc1Cl ZINC000815290621 1287413971 /nfs/dbraw/zinc/41/39/71/1287413971.db2.gz LPHSKYZRCCHSFL-HOTGVXAUSA-N 0 3 340.807 2.658 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@]1(O)CCO[C@@H]1C ZINC000872066087 1287417453 /nfs/dbraw/zinc/41/74/53/1287417453.db2.gz DMMQBQGLMUOVHW-FIXISWKDSA-N 0 3 326.418 2.507 20 5 EFBDHN Cc1noc(C(C)C)c1C(=O)NCCNCc1ccc([N+](=O)[O-])cc1 ZINC001129920558 1280375506 /nfs/dbraw/zinc/37/55/06/1280375506.db2.gz LYFOWIBZXQPHHL-UHFFFAOYSA-N 0 3 346.387 2.534 20 5 EFBDHN Cc1cc(F)c(C(=O)NCCNCc2cccc([N+](=O)[O-])c2)cc1F ZINC001129964891 1280380696 /nfs/dbraw/zinc/38/06/96/1280380696.db2.gz DZMCMXSKKFOHIG-UHFFFAOYSA-N 0 3 349.337 2.701 20 5 EFBDHN CCN(CC)CC(=O)NC[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(C)c2)C1 ZINC001091350343 1280384287 /nfs/dbraw/zinc/38/42/87/1280384287.db2.gz MVFQMXRPNZESSQ-FZNQNYSPSA-N 0 3 348.447 2.552 20 5 EFBDHN CCCN(C)CC(=O)NC[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(C)c2)C1 ZINC001091470966 1280760460 /nfs/dbraw/zinc/76/04/60/1280760460.db2.gz OUGINSXCMXFRHZ-KOMQPUFPSA-N 0 3 348.447 2.552 20 5 EFBDHN CCc1cccc(CC(=O)NCCNCc2cccc([N+](=O)[O-])c2)c1 ZINC001130401291 1280808908 /nfs/dbraw/zinc/80/89/08/1280808908.db2.gz XXCBPRZAHWWKKM-UHFFFAOYSA-N 0 3 341.411 2.606 20 5 EFBDHN CC(C)c1ncsc1C(=O)NCCNCc1ccc([N+](=O)[O-])cc1 ZINC001134983249 1287459508 /nfs/dbraw/zinc/45/95/08/1287459508.db2.gz NDYVLWSDHFZWQS-UHFFFAOYSA-N 0 3 348.428 2.694 20 5 EFBDHN CC(C)c1cccc(C(=O)NCCNCc2cccc([N+](=O)[O-])c2)n1 ZINC001130883763 1281259506 /nfs/dbraw/zinc/25/95/06/1281259506.db2.gz REFBEUVGDVJFAA-UHFFFAOYSA-N 0 3 342.399 2.633 20 5 EFBDHN CC[C@H](C)N[C@H](CNC(=O)c1ccc(N)c([N+](=O)[O-])c1)c1ccco1 ZINC000807681127 1281387694 /nfs/dbraw/zinc/38/76/94/1281387694.db2.gz ZBQGCJMVGSYAMV-SMDDNHRTSA-N 0 3 346.387 2.629 20 5 EFBDHN Cc1ccc(CCC(=O)NCCNCc2cccc([N+](=O)[O-])c2)cc1 ZINC001131093907 1281469346 /nfs/dbraw/zinc/46/93/46/1281469346.db2.gz FXLJHERPMLFAGA-UHFFFAOYSA-N 0 3 341.411 2.742 20 5 EFBDHN O=C(NCCNCc1ccc([N+](=O)[O-])cc1)C1CCC2(CC2)CC1 ZINC001131422337 1281867930 /nfs/dbraw/zinc/86/79/30/1281867930.db2.gz XRQSIDYYMJVIHY-UHFFFAOYSA-N 0 3 331.416 2.771 20 5 EFBDHN Cc1cc(F)cc(C)c1C(=O)NCCNCc1ccc([N+](=O)[O-])cc1 ZINC001132236579 1283194782 /nfs/dbraw/zinc/19/47/82/1283194782.db2.gz UNSTXDCAPWKQKP-UHFFFAOYSA-N 0 3 345.374 2.870 20 5 EFBDHN CC(C)c1[nH]ccc1C(=O)NCCNCc1cccc([N+](=O)[O-])c1 ZINC001132697127 1284158638 /nfs/dbraw/zinc/15/86/38/1284158638.db2.gz NTDKFLFVYDJOBX-UHFFFAOYSA-N 0 3 330.388 2.566 20 5 EFBDHN CCCCCCN(C)CC(=O)NCCNc1ccccc1[N+](=O)[O-] ZINC001093802824 1284533595 /nfs/dbraw/zinc/53/35/95/1284533595.db2.gz PFLVOVVQZIYPIR-UHFFFAOYSA-N 0 3 336.436 2.635 20 5 EFBDHN C[C@@H]1CCN(Cc2ccccc2)C[C@H]1Nc1ncc([N+](=O)[O-])cn1 ZINC000716203876 1285171262 /nfs/dbraw/zinc/17/12/62/1285171262.db2.gz LVFNPNAASVGEFK-CZUORRHYSA-N 0 3 327.388 2.707 20 5 EFBDHN C[C@H](N)c1ncc(-c2ccccc2)n1-c1ncnc2[nH]cc([N+](=O)[O-])c21 ZINC001170679566 1285222204 /nfs/dbraw/zinc/22/22/04/1285222204.db2.gz JWIMVTBFVYKMFZ-JTQLQIEISA-N 0 3 349.354 2.739 20 5 EFBDHN CON(C)C(=O)C1CCN(C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC1 ZINC000812778280 1285410054 /nfs/dbraw/zinc/41/00/54/1285410054.db2.gz DNWNFGLMEUDTJS-SDNWHVSQSA-N 0 3 347.415 2.730 20 5 EFBDHN CON(C)C(=O)C1CCN(C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC1 ZINC000812778278 1285410367 /nfs/dbraw/zinc/41/03/67/1285410367.db2.gz DNWNFGLMEUDTJS-KAMYIIQDSA-N 0 3 347.415 2.730 20 5 EFBDHN CC(COC(=O)CCc1nnc(-c2ccc(Cl)cc2)o1)[N+](=O)[O-] ZINC000813102342 1285653440 /nfs/dbraw/zinc/65/34/40/1285653440.db2.gz DUONHUQHMTTYPL-SECBINFHSA-N 0 3 339.735 2.531 20 5 EFBDHN COCc1nc(C(=O)OCC(C)[N+](=O)[O-])c(-c2ccccc2)s1 ZINC000813106113 1285678381 /nfs/dbraw/zinc/67/83/81/1285678381.db2.gz YQOIXRHMKPZURE-SNVBAGLBSA-N 0 3 336.369 2.779 20 5 EFBDHN CC(COC(=O)c1csc(-c2c(F)cccc2F)n1)[N+](=O)[O-] ZINC000813113480 1285683421 /nfs/dbraw/zinc/68/34/21/1285683421.db2.gz DSXNZFRHUYSDIW-ZETCQYMHSA-N 0 3 328.296 2.910 20 5 EFBDHN CC(COC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)[N+](=O)[O-] ZINC000813112526 1285684514 /nfs/dbraw/zinc/68/45/14/1285684514.db2.gz HSNYYGVSHGDREN-JTQLQIEISA-N 0 3 326.308 2.503 20 5 EFBDHN COc1ccccc1Nc1ncccc1C(=O)OCC(C)[N+](=O)[O-] ZINC000813114369 1285684980 /nfs/dbraw/zinc/68/49/80/1285684980.db2.gz QUAADJAHDDGIMH-LLVKDONJSA-N 0 3 331.328 2.656 20 5 EFBDHN CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)OCC(C)[N+](=O)[O-])O[C@@H](C)C2 ZINC000813115692 1285685917 /nfs/dbraw/zinc/68/59/17/1285685917.db2.gz YBFIHVNHJNJYRL-MPXAEWJHSA-N 0 3 349.383 2.721 20 5 EFBDHN COc1ccccc1C(=O)NCCCNCc1ccccc1[N+](=O)[O-] ZINC001171826278 1285796821 /nfs/dbraw/zinc/79/68/21/1285796821.db2.gz QEBWRACZVDRFAK-UHFFFAOYSA-N 0 3 343.383 2.513 20 5 EFBDHN COc1ccccc1C(=O)NCCCNCc1csc([N+](=O)[O-])c1 ZINC001171825989 1285796978 /nfs/dbraw/zinc/79/69/78/1285796978.db2.gz HPJXEMITIZSRCE-UHFFFAOYSA-N 0 3 349.412 2.575 20 5 EFBDHN COc1ccc(C(=O)NCCCNCc2csc([N+](=O)[O-])c2)cc1 ZINC001171844524 1285850977 /nfs/dbraw/zinc/85/09/77/1285850977.db2.gz NBKYVOHSIHJOTA-UHFFFAOYSA-N 0 3 349.412 2.575 20 5 EFBDHN CN(C)C[C@H](NC(=O)c1cc(F)ccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000813619306 1286026459 /nfs/dbraw/zinc/02/64/59/1286026459.db2.gz RXWVKBMJJOWABT-HNNXBMFYSA-N 0 3 349.337 2.906 20 5 EFBDHN COC(=O)[C@@]1(C)CCCN1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172904389 1286309372 /nfs/dbraw/zinc/30/93/72/1286309372.db2.gz MZPINFMKRVKEGT-CRAIPNDOSA-N 0 3 332.400 2.870 20 5 EFBDHN C[C@@H](CNC(=O)C(C)(C)c1ccccc1[N+](=O)[O-])N1CCCCC1 ZINC000814107753 1286322114 /nfs/dbraw/zinc/32/21/14/1286322114.db2.gz SLWCEVCQYUSAHA-AWEZNQCLSA-N 0 3 333.432 2.863 20 5 EFBDHN O=[N+]([O-])c1cc(F)c(N2CCC(N3CCSCC3)CC2)c(F)c1 ZINC001173011990 1286383385 /nfs/dbraw/zinc/38/33/85/1286383385.db2.gz BNSBHJGRSFCHCD-UHFFFAOYSA-N 0 3 343.399 2.891 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)NCc2cncc(F)c2)c1F ZINC001173175188 1286451602 /nfs/dbraw/zinc/45/16/02/1286451602.db2.gz AUCRDTMCXCVDST-SNVBAGLBSA-N 0 3 337.326 2.997 20 5 EFBDHN CCOC(CN[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-])OCC ZINC001173176643 1286452733 /nfs/dbraw/zinc/45/27/33/1286452733.db2.gz LEKCZOZBOOYVAI-LLVKDONJSA-N 0 3 344.383 2.662 20 5 EFBDHN COC[C@H]1CCN([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173178309 1286454041 /nfs/dbraw/zinc/45/40/41/1286454041.db2.gz AOIPCRCVPKIUPP-NEPJUHHUSA-N 0 3 326.368 2.642 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)N2CCC[C@H](CO)CC2)c1F ZINC001173180044 1286455079 /nfs/dbraw/zinc/45/50/79/1286455079.db2.gz ICRXHIQWTZNJMR-OLZOCXBDSA-N 0 3 340.395 2.768 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)N2C[C@H](C)N(C)C[C@H]2C)c1F ZINC001173184176 1286456056 /nfs/dbraw/zinc/45/60/56/1286456056.db2.gz DCSWGJSXCGSNTI-FRRDWIJNSA-N 0 3 339.411 2.698 20 5 EFBDHN COc1cccc(CN[C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])n1 ZINC001173182163 1286456220 /nfs/dbraw/zinc/45/62/20/1286456220.db2.gz IIFXAMDGAIHTQY-LLVKDONJSA-N 0 3 349.362 2.867 20 5 EFBDHN CCN1CCN([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])[C@H](C)C1 ZINC001173191537 1286457893 /nfs/dbraw/zinc/45/78/93/1286457893.db2.gz CZSNWBIHSOVWOB-CHWSQXEVSA-N 0 3 339.411 2.700 20 5 EFBDHN O=C(CCCC(F)(F)F)NCCNCc1cccc([N+](=O)[O-])c1 ZINC001134229380 1286475683 /nfs/dbraw/zinc/47/56/83/1286475683.db2.gz IKEPSEWPNVROEM-UHFFFAOYSA-N 0 3 333.310 2.533 20 5 EFBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CCC(Oc2cnccn2)CC1 ZINC001173231839 1286483426 /nfs/dbraw/zinc/48/34/26/1286483426.db2.gz NPGDPYYYPKBCPR-AWEZNQCLSA-N 0 3 342.399 2.859 20 5 EFBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N[C@H](C)c1nnc2ccccn21 ZINC001173210315 1286485396 /nfs/dbraw/zinc/48/53/96/1286485396.db2.gz ITGYMFZNVBEODT-CHWSQXEVSA-N 0 3 325.372 2.919 20 5 EFBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[C@H](Oc2ncc(F)cn2)C1 ZINC001173238319 1286496219 /nfs/dbraw/zinc/49/62/19/1286496219.db2.gz PHWBACCWTURABT-LRDDRELGSA-N 0 3 346.362 2.608 20 5 EFBDHN Cc1ccc(C(=O)NCCNCc2ccc([N+](=O)[O-])cc2)c(F)c1 ZINC001134302143 1286543840 /nfs/dbraw/zinc/54/38/40/1286543840.db2.gz LBENFOQGUWEKSS-UHFFFAOYSA-N 0 3 331.347 2.562 20 5 EFBDHN O=C(NCCNCc1cccc([N+](=O)[O-])c1)c1ccc2cc[nH]c2c1 ZINC001134367270 1286637903 /nfs/dbraw/zinc/63/79/03/1286637903.db2.gz CYQQUCBYXPXEJN-UHFFFAOYSA-N 0 3 338.367 2.596 20 5 EFBDHN CC(C)(C(=O)NCCCNCc1csc([N+](=O)[O-])c1)C(C)(F)F ZINC001174738691 1287145564 /nfs/dbraw/zinc/14/55/64/1287145564.db2.gz VKFBUMZQBVRTIK-UHFFFAOYSA-N 0 3 349.403 2.934 20 5 EFBDHN CC(C)(C(=O)NCCCNCc1ccccc1[N+](=O)[O-])C(C)(F)F ZINC001174738335 1287145672 /nfs/dbraw/zinc/14/56/72/1287145672.db2.gz ODGAEIOYLHGLOH-UHFFFAOYSA-N 0 3 343.374 2.872 20 5 EFBDHN Cc1ccc(CCC(=O)NCCCNCc2ccccc2[N+](=O)[O-])o1 ZINC001176897430 1288182318 /nfs/dbraw/zinc/18/23/18/1288182318.db2.gz DGDMTZPITQZNIA-UHFFFAOYSA-N 0 3 345.399 2.725 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@H](C2CC2)[C@]2(CO)CCCO2)cc1Cl ZINC000816667566 1288236268 /nfs/dbraw/zinc/23/62/68/1288236268.db2.gz PXVRRKWSJVOCIU-HZPDHXFCSA-N 0 3 340.807 2.658 20 5 EFBDHN C[C@H](N[C@H]1CSC[C@H]1C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000796402227 1299218401 /nfs/dbraw/zinc/21/84/01/1299218401.db2.gz HXLDSYQPEVFHJH-ZDMBXUJBSA-N 0 3 343.836 2.916 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N1CCN(C2CC2)C[C@H](C)C1 ZINC000823219115 1289246750 /nfs/dbraw/zinc/24/67/50/1289246750.db2.gz VUEBSSRLDMUBOB-LBPRGKRZSA-N 0 3 331.416 2.768 20 5 EFBDHN COc1cc(OC)cc([C@H](O)CNCc2cccc([N+](=O)[O-])c2C)c1 ZINC000873053827 1289541738 /nfs/dbraw/zinc/54/17/38/1289541738.db2.gz HERPFCRPNWNBCE-GOSISDBHSA-N 0 3 346.383 2.744 20 5 EFBDHN O=C(OCc1c(F)cc([N+](=O)[O-])cc1F)C1CCN(C2CC2)CC1 ZINC000803529160 1312765594 /nfs/dbraw/zinc/76/55/94/1312765594.db2.gz BCHKAFMWFKJKEU-UHFFFAOYSA-N 0 3 340.326 2.791 20 5 EFBDHN Cc1cc(Cl)c(C(=O)N(C)CCN2CCCC2)cc1[N+](=O)[O-] ZINC000825727258 1290262219 /nfs/dbraw/zinc/26/22/19/1290262219.db2.gz LSFJWTVRSMRRRD-UHFFFAOYSA-N 0 3 325.796 2.724 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1CCC(N2CCCC2=O)CC1 ZINC000876689830 1290980847 /nfs/dbraw/zinc/98/08/47/1290980847.db2.gz CEEQXAXEAZJEGJ-UHFFFAOYSA-N 0 3 331.416 2.798 20 5 EFBDHN C[C@H](C[C@@H]1CCCC(=O)N1)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000877087785 1291131163 /nfs/dbraw/zinc/13/11/63/1291131163.db2.gz RRAVJUKTSLBHMN-PWSUYJOCSA-N 0 3 325.796 2.785 20 5 EFBDHN C[C@H](C[C@H]1CCCC(=O)N1)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000877087786 1291131173 /nfs/dbraw/zinc/13/11/73/1291131173.db2.gz RRAVJUKTSLBHMN-ZYHUDNBSSA-N 0 3 325.796 2.785 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NC[C@@H]1Cc2ccccc2CN1 ZINC000877339405 1291198363 /nfs/dbraw/zinc/19/83/63/1291198363.db2.gz ZKVPPSCQXGDRDB-INIZCTEOSA-N 0 3 339.395 2.656 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN1CCC([C@@H](O)c2ccccc2)CC1 ZINC000877927771 1291419945 /nfs/dbraw/zinc/41/99/45/1291419945.db2.gz DPFJPINNNFXKHF-SFHVURJKSA-N 0 3 344.415 2.545 20 5 EFBDHN CCN(CC)CC(=O)N[C@H]1C[C@H](CNc2ccc(C)cc2[N+](=O)[O-])C1 ZINC001114773607 1291902177 /nfs/dbraw/zinc/90/21/77/1291902177.db2.gz VIPMOPIOIKLYDX-SHTZXODSSA-N 0 3 348.447 2.552 20 5 EFBDHN COc1ccc([C@H]2CN(Cc3cc(F)ccc3[N+](=O)[O-])CCN2)cc1 ZINC000879521474 1292171017 /nfs/dbraw/zinc/17/10/17/1292171017.db2.gz NMAZTNWANBTVOU-QGZVFWFLSA-N 0 3 345.374 2.889 20 5 EFBDHN CCOC(=O)Cc1ccc(N2CCN([C@@H](C)CC)CC2)c([N+](=O)[O-])c1 ZINC000826121670 1292241688 /nfs/dbraw/zinc/24/16/88/1292241688.db2.gz OJLJDBFPQFCUDC-AWEZNQCLSA-N 0 3 349.431 2.621 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2NCCc3ccccc32)c1C ZINC000884284315 1294081858 /nfs/dbraw/zinc/08/18/58/1294081858.db2.gz ILSCZMDAUMRZBB-INIZCTEOSA-N 0 3 339.395 2.828 20 5 EFBDHN CCOC(=O)Cc1ccc([N+](=O)[O-])c(O[C@@H]2CCCN(CC)C2)c1 ZINC001234409480 1313121889 /nfs/dbraw/zinc/12/18/89/1313121889.db2.gz AJBGLMPOROAWRI-CQSZACIVSA-N 0 3 336.388 2.564 20 5 EFBDHN C/C(=C\C(=O)NCCCN(C)Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001234530809 1313148397 /nfs/dbraw/zinc/14/83/97/1313148397.db2.gz ZOAGURGEPPUFJO-SDNWHVSQSA-N 0 3 331.416 2.889 20 5 EFBDHN C[C@@H]1[C@@H](C)N(Cc2ccc(Br)c([N+](=O)[O-])c2)CCN1C ZINC000775984563 1295571554 /nfs/dbraw/zinc/57/15/54/1295571554.db2.gz GXPULRSHJXABQH-GHMZBOCLSA-N 0 3 342.237 2.882 20 5 EFBDHN CC(=O)Nc1ccc(C(C)=O)c(O[C@H]2CCCN(C)CC2)c1[N+](=O)[O-] ZINC001234680233 1313182186 /nfs/dbraw/zinc/18/21/86/1313182186.db2.gz BZRZPAKCAVGQTF-ZDUSSCGKSA-N 0 3 349.387 2.619 20 5 EFBDHN C[C@@H]1CSC[C@H]1NCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000796401076 1299166327 /nfs/dbraw/zinc/16/63/27/1299166327.db2.gz CJBOBRDUUOEBQE-LDYMZIIASA-N 0 3 329.809 2.528 20 5 EFBDHN O=[N+]([O-])c1ccc([C@H](O)CN2CCC[C@H]2C[C@@H](O)c2ccco2)cc1 ZINC000776585991 1299650809 /nfs/dbraw/zinc/65/08/09/1299650809.db2.gz GMUOICBOLGMQMR-GVDBMIGSSA-N 0 3 346.383 2.809 20 5 EFBDHN COC[C@@H](NC[C@H](O)c1ccc([N+](=O)[O-])cc1)c1cccc(OC)c1 ZINC000852443016 1299705661 /nfs/dbraw/zinc/70/56/61/1299705661.db2.gz HZSNKNNYDUTDET-MSOLQXFVSA-N 0 3 346.383 2.614 20 5 EFBDHN COC[C@@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)c1cccc(OC)c1 ZINC000852444088 1299706456 /nfs/dbraw/zinc/70/64/56/1299706456.db2.gz SFTVHPKPWCSCDU-QZTJIDSGSA-N 0 3 346.383 2.614 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CCC([C@H]3CCCCO3)CC2)c1 ZINC000852593342 1299774850 /nfs/dbraw/zinc/77/48/50/1299774850.db2.gz FHWVELXVYOOMAX-QZTJIDSGSA-N 0 3 334.416 2.909 20 5 EFBDHN O=[N+]([O-])c1ccc([C@@H](O)CNC2(c3ccc4c(c3)OCO4)CC2)cc1 ZINC000776606129 1299791271 /nfs/dbraw/zinc/79/12/71/1299791271.db2.gz RWIHOIVPSBPVEC-HNNXBMFYSA-N 0 3 342.351 2.636 20 5 EFBDHN O=[N+]([O-])c1cn(CN(CC2CC2)CC2CC2)nc1-c1ccccn1 ZINC000853496560 1300136698 /nfs/dbraw/zinc/13/66/98/1300136698.db2.gz IPTFBWRWHPTERE-UHFFFAOYSA-N 0 3 327.388 2.933 20 5 EFBDHN CCN(C(=O)c1cc([N+](=O)[O-])ccc1Cl)C1CCN(C)CC1 ZINC000861893766 1302236170 /nfs/dbraw/zinc/23/61/70/1302236170.db2.gz SBQYVTWRVVUBIU-UHFFFAOYSA-N 0 3 325.796 2.805 20 5 EFBDHN CN(CC(=O)N[C@H]1C[C@H](Nc2ccccc2[N+](=O)[O-])C1)CC(C)(C)C ZINC001097103788 1313854343 /nfs/dbraw/zinc/85/43/43/1313854343.db2.gz QOYFSWANKHRODE-HDJSIYSDSA-N 0 3 348.447 2.632 20 5 EFBDHN O=[N+]([O-])c1ccc(OC[C@]2(O)CCN(Cc3ccccc3)C2)cc1F ZINC000865345169 1303224021 /nfs/dbraw/zinc/22/40/21/1303224021.db2.gz WBUVACJVLWPLIC-SFHVURJKSA-N 0 3 346.358 2.750 20 5 EFBDHN Cc1ccc(CN2CC[C@@H](NC(=O)CCC(C)(C)[N+](=O)[O-])C2)cc1 ZINC000871187620 1305875276 /nfs/dbraw/zinc/87/52/76/1305875276.db2.gz HJGJLUBZNGLHGN-MRXNPFEDSA-N 0 3 333.432 2.521 20 5 EFBDHN CN(C)C(=O)OC[C@@H]1CCCCN1CCc1ccc([N+](=O)[O-])cc1 ZINC000796551364 1306286170 /nfs/dbraw/zinc/28/61/70/1306286170.db2.gz XOFWCBZOVNEZHE-INIZCTEOSA-N 0 3 335.404 2.690 20 5 EFBDHN CN(C)CCN(C(=O)c1cc([N+](=O)[O-])c(F)cc1N)c1ccccc1 ZINC000801860367 1311028149 /nfs/dbraw/zinc/02/81/49/1311028149.db2.gz KWTXCBMWYJGTRV-UHFFFAOYSA-N 0 3 346.362 2.525 20 5 EFBDHN CC(C)(F)C(=O)NCC1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001222252379 1311105453 /nfs/dbraw/zinc/10/54/53/1311105453.db2.gz IZZZCBCOYZDAOR-UHFFFAOYSA-N 0 3 337.395 2.671 20 5 EFBDHN O=C(/C=C/C1CC1)NCC1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001222730899 1311177637 /nfs/dbraw/zinc/17/76/37/1311177637.db2.gz KKGOMOJBFSOFOW-VMPITWQZSA-N 0 3 343.427 2.889 20 5 EFBDHN CC(=O)O[C@H]1C[C@@H]2C[C@H](O[C@H](C)c3cccc([N+](=O)[O-])c3)C[C@H]1N2C ZINC001223427768 1311258973 /nfs/dbraw/zinc/25/89/73/1311258973.db2.gz UTLCLAPNNNOUAM-AJAORCOTSA-N 0 3 348.399 2.839 20 5 EFBDHN CC(=O)O[C@@H]1C[C@@H]2C[C@H](O[C@@H](C)c3cccc([N+](=O)[O-])c3)C[C@H]1N2C ZINC001223427769 1311259115 /nfs/dbraw/zinc/25/91/15/1311259115.db2.gz UTLCLAPNNNOUAM-PXALQNAGSA-N 0 3 348.399 2.839 20 5 EFBDHN O=[N+]([O-])c1ccc(CCO[C@H]2CC[C@@H](N3CCOCC3)CC2)cc1 ZINC001224334575 1311377669 /nfs/dbraw/zinc/37/76/69/1311377669.db2.gz ZOXZKNNPCBPPIA-MAEOIBBWSA-N 0 3 334.416 2.797 20 5 EFBDHN C[C@H](Nc1cc(Cl)nc2ccc([N+](=O)[O-])cc21)[C@@H]1CNCCO1 ZINC001159503764 1311528685 /nfs/dbraw/zinc/52/86/85/1311528685.db2.gz ZDTWDJNOZGBQNG-XPTSAGLGSA-N 0 3 336.779 2.585 20 5 EFBDHN C[C@@H](Nc1cc(Cl)nc2ccc([N+](=O)[O-])cc21)[C@@H]1CNCCO1 ZINC001159503761 1311528733 /nfs/dbraw/zinc/52/87/33/1311528733.db2.gz ZDTWDJNOZGBQNG-OTYXRUKQSA-N 0 3 336.779 2.585 20 5 EFBDHN O=C(CCc1ccsc1)NCCCNCc1ccccc1[N+](=O)[O-] ZINC001159944624 1311613551 /nfs/dbraw/zinc/61/35/51/1311613551.db2.gz XJQOPHIWISARLD-UHFFFAOYSA-N 0 3 347.440 2.885 20 5 EFBDHN O=C(NCCCNCc1ccccc1[N+](=O)[O-])c1ccc(F)c(F)c1 ZINC001159957401 1311617270 /nfs/dbraw/zinc/61/72/70/1311617270.db2.gz RNTYYPBOFSNJEP-UHFFFAOYSA-N 0 3 349.337 2.783 20 5 EFBDHN COC(=O)Cc1ccc(O[C@@H]2CCCN(C(C)C)C2)c([N+](=O)[O-])c1 ZINC001226216276 1311631547 /nfs/dbraw/zinc/63/15/47/1311631547.db2.gz HGOQCKHNQOSPKT-CQSZACIVSA-N 0 3 336.388 2.562 20 5 EFBDHN NCc1cc(-c2ccncc2)nn1-c1ncc([N+](=O)[O-])c2ccccc21 ZINC001160337385 1311692692 /nfs/dbraw/zinc/69/26/92/1311692692.db2.gz AVQVTVSXCSKZPB-UHFFFAOYSA-N 0 3 346.350 2.849 20 5 EFBDHN C[C@H]1CCN(Cc2ccccc2)C[C@H]1Oc1ncc([N+](=O)[O-])cn1 ZINC001226729197 1311714913 /nfs/dbraw/zinc/71/49/13/1311714913.db2.gz BPBXFQUTZKGHTR-XJKSGUPXSA-N 0 3 328.372 2.674 20 5 EFBDHN C[NH+](C)CC[C@H](Oc1ncc([N+](=O)[O-])c2nc[n-]c21)c1ccccc1 ZINC001227691143 1311839707 /nfs/dbraw/zinc/83/97/07/1311839707.db2.gz MVNZVHMBMVBZOC-AWEZNQCLSA-N 0 3 341.371 2.938 20 5 EFBDHN CC(C)[N@H+]1[C@@H]2CC[C@H]1C[C@@H](Oc1ncc([N+](=O)[O-])c3nc[n-]c31)C2 ZINC001227690727 1311839986 /nfs/dbraw/zinc/83/99/86/1311839986.db2.gz KEPJTEUUEUZRNY-GDNZZTSVSA-N 0 3 331.376 2.649 20 5 EFBDHN CC(C)[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](Oc1ncc([N+](=O)[O-])c3nc[n-]c31)C2 ZINC001227690727 1311839990 /nfs/dbraw/zinc/83/99/90/1311839990.db2.gz KEPJTEUUEUZRNY-GDNZZTSVSA-N 0 3 331.376 2.649 20 5 EFBDHN O=C(NCCCNCc1csc([N+](=O)[O-])c1)C12CCC(CC1)C2 ZINC001161025093 1311840793 /nfs/dbraw/zinc/84/07/93/1311840793.db2.gz BWTOPCBPTPJZOC-UHFFFAOYSA-N 0 3 337.445 2.833 20 5 EFBDHN CCc1ccc(C(=O)NCCCNCc2csc([N+](=O)[O-])c2)o1 ZINC001161135430 1311867211 /nfs/dbraw/zinc/86/72/11/1311867211.db2.gz GQCWJCBPZHEJOO-UHFFFAOYSA-N 0 3 337.401 2.721 20 5 EFBDHN O=C(COC1CCCCC1)NCCCNCc1ccccc1[N+](=O)[O-] ZINC001161602046 1311926807 /nfs/dbraw/zinc/92/68/07/1311926807.db2.gz CYTQSSRGSNPAPU-UHFFFAOYSA-N 0 3 349.431 2.540 20 5 EFBDHN Cc1c(Cl)nc(-c2ccc([N+](=O)[O-])cc2)nc1-n1cnc(CN)c1 ZINC001162298285 1312083728 /nfs/dbraw/zinc/08/37/28/1312083728.db2.gz CRGFQDIRNINOBE-UHFFFAOYSA-N 0 3 344.762 2.658 20 5 EFBDHN O=C(C=C1CCC1)N1C[C@H]2CN(Cc3ccccc3[N+](=O)[O-])C[C@H]2C1 ZINC001048758710 1312109906 /nfs/dbraw/zinc/10/99/06/1312109906.db2.gz HEENHLMQSIAHIG-CALCHBBNSA-N 0 3 341.411 2.595 20 5 EFBDHN CC(C)=C(F)C(=O)N1C[C@H]2CN(Cc3cccc([N+](=O)[O-])c3)C[C@H]2C1 ZINC001048761628 1312113282 /nfs/dbraw/zinc/11/32/82/1312113282.db2.gz UDHHOTGWOUGXDT-GASCZTMLSA-N 0 3 347.390 2.748 20 5 EFBDHN O=C(C1=CCCC1)N1C[C@H]2CN(Cc3cccc([N+](=O)[O-])c3)C[C@H]2C1 ZINC001048763559 1312115374 /nfs/dbraw/zinc/11/53/74/1312115374.db2.gz ZMJVDQXDMOTBMP-CALCHBBNSA-N 0 3 341.411 2.595 20 5 EFBDHN C[C@H](N)c1nc2ccccc2n1-c1cc2c(c([N+](=O)[O-])c1)NN(C)C2 ZINC001162779160 1312174263 /nfs/dbraw/zinc/17/42/63/1312174263.db2.gz VOMROHREMVCDQY-JTQLQIEISA-N 0 3 338.371 2.726 20 5 EFBDHN O=C(NCCC1(CNCc2ccccc2[N+](=O)[O-])CC1)C1CCC1 ZINC001163103321 1312241441 /nfs/dbraw/zinc/24/14/41/1312241441.db2.gz BSZZNPMIGHHAEG-UHFFFAOYSA-N 0 3 331.416 2.771 20 5 EFBDHN CCN(CC)CCNC(=N)Nc1nc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC001163125355 1312245442 /nfs/dbraw/zinc/24/54/42/1312245442.db2.gz AUWNSODNPMSREZ-UHFFFAOYSA-N 0 3 349.222 2.575 20 5 EFBDHN COC(=O)c1ccc([N+](=O)[O-])cc1N[C@H]1CNCc2ccsc21 ZINC001163228976 1312270279 /nfs/dbraw/zinc/27/02/79/1312270279.db2.gz NGUUOTGIHHARFS-ZDUSSCGKSA-N 0 3 333.369 2.699 20 5 EFBDHN CC(=O)Nc1ccc(N[C@H]2CNCc3ccsc32)cc1[N+](=O)[O-] ZINC001163230264 1312270596 /nfs/dbraw/zinc/27/05/96/1312270596.db2.gz UOKQMSVHXFBOQK-ZDUSSCGKSA-N 0 3 332.385 2.871 20 5 EFBDHN CN1CCC(Oc2c(Br)c(F)ccc2[N+](=O)[O-])CC1 ZINC001230683884 1312311666 /nfs/dbraw/zinc/31/16/66/1312311666.db2.gz GVVXAMGIXGCAIX-UHFFFAOYSA-N 0 3 333.157 2.969 20 5 EFBDHN O=C(NCCCNCc1ccccc1[N+](=O)[O-])C1(C2CC2)CCC1 ZINC001163409621 1312307243 /nfs/dbraw/zinc/30/72/43/1312307243.db2.gz IKSCYENFWJGRMV-UHFFFAOYSA-N 0 3 331.416 2.771 20 5 EFBDHN CC(C)C(=O)NCCC1(CNCc2csc([N+](=O)[O-])c2)CC1 ZINC001163458304 1312316628 /nfs/dbraw/zinc/31/66/28/1312316628.db2.gz CTUSFVMEDJVYSU-UHFFFAOYSA-N 0 3 325.434 2.688 20 5 EFBDHN CC1(C(=O)N2C[C@H]3CN(Cc4cccc([N+](=O)[O-])c4)C[C@H]3C2)CCC1 ZINC001048988497 1312328712 /nfs/dbraw/zinc/32/87/12/1312328712.db2.gz DOAPJXAKOCQMLW-IYBDPMFKSA-N 0 3 343.427 2.675 20 5 EFBDHN Cc1cc(CN)nn1-c1ccc(C(=O)OC(C)(C)C)c([N+](=O)[O-])c1 ZINC001163985496 1312420661 /nfs/dbraw/zinc/42/06/61/1312420661.db2.gz UQUBMSWCBPQLPX-UHFFFAOYSA-N 0 3 332.360 2.503 20 5 EFBDHN COCCN1CCC(Oc2cnc3c(cccc3[N+](=O)[O-])c2)CC1 ZINC001231156192 1312444474 /nfs/dbraw/zinc/44/44/74/1312444474.db2.gz IFYJGWDBVNYBBL-UHFFFAOYSA-N 0 3 331.372 2.633 20 5 EFBDHN C[N+](C)(C)C[C@H](O)CC(=O)Oc1ccccc1Oc1ccccc1[O-] ZINC001231222959 1312456641 /nfs/dbraw/zinc/45/66/41/1312456641.db2.gz LZZDYSASGMVQSF-CQSZACIVSA-O 0 3 346.403 2.547 20 5 EFBDHN CN(CCCNC(=O)/C=C/c1ccco1)Cc1cccc([N+](=O)[O-])c1 ZINC001231295149 1312473568 /nfs/dbraw/zinc/47/35/68/1312473568.db2.gz LTYKPWBBTOXTJH-CMDGGOBGSA-N 0 3 343.383 2.839 20 5 EFBDHN O=C(NCCCNCc1csc([N+](=O)[O-])c1)C1CC2(CCC2)C1 ZINC001164257945 1312480293 /nfs/dbraw/zinc/48/02/93/1312480293.db2.gz SACLPFJIMUHSLX-UHFFFAOYSA-N 0 3 337.445 2.833 20 5 EFBDHN CN(CCCNC(=O)c1cccc(F)c1)Cc1cccc([N+](=O)[O-])c1 ZINC001231394974 1312486265 /nfs/dbraw/zinc/48/62/65/1312486265.db2.gz JJNIDWDPCHBOOJ-UHFFFAOYSA-N 0 3 345.374 2.986 20 5 EFBDHN CC(C)c1[nH]ccc1C(=O)NCCCNCc1ccccc1[N+](=O)[O-] ZINC001164426685 1312511711 /nfs/dbraw/zinc/51/17/11/1312511711.db2.gz RPVZDFCFUKATNO-UHFFFAOYSA-N 0 3 344.415 2.956 20 5 EFBDHN Cc1cc(N2CC(C)(N(C)C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001165121640 1312572156 /nfs/dbraw/zinc/57/21/56/1312572156.db2.gz WXWPIPUCLMSSCW-UHFFFAOYSA-N 0 3 327.388 2.501 20 5 EFBDHN C[C@H]1CN(c2ccc([N+](=O)[O-])c(N)n2)[C@@H](C)CN1Cc1ccccc1 ZINC001165202993 1312585309 /nfs/dbraw/zinc/58/53/09/1312585309.db2.gz QYAYBLILXQGLHM-KBPBESRZSA-N 0 3 341.415 2.671 20 5 EFBDHN O=[N+]([O-])c1c(Cl)ccc2nc(-n3ncc4c3CCNC4)ccc21 ZINC001165219519 1312588631 /nfs/dbraw/zinc/58/86/31/1312588631.db2.gz UIAZYXDJMCFCSP-UHFFFAOYSA-N 0 3 329.747 2.628 20 5 EFBDHN CCc1[nH]ccc1C(=O)N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001020125542 1314622394 /nfs/dbraw/zinc/62/23/94/1314622394.db2.gz WRTKAZCGLRQEPX-HDJSIYSDSA-N 0 3 342.399 2.536 20 5 EFBDHN O=C(N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1)c1sccc1F ZINC001020126233 1314622594 /nfs/dbraw/zinc/62/25/94/1314622594.db2.gz HOPRJJATWAOICW-HAQNSBGRSA-N 0 3 349.387 2.846 20 5 EFBDHN COc1ccc(C[C@H](C)N2CCNC3=CCCC[C@H]32)c([N+](=O)[O-])c1 ZINC001246996784 1314727043 /nfs/dbraw/zinc/72/70/43/1314727043.db2.gz PMZVXTVYIDAUCE-SUMWQHHRSA-N 0 3 331.416 2.876 20 5 EFBDHN COc1ccc(C[C@H](C)N2CCNC3=CCCC[C@@H]32)c([N+](=O)[O-])c1 ZINC001246996783 1314727320 /nfs/dbraw/zinc/72/73/20/1314727320.db2.gz PMZVXTVYIDAUCE-GUYCJALGSA-N 0 3 331.416 2.876 20 5 EFBDHN Cc1cc(-c2nc(-c3ccc4c(n3)CCNC4)no2)ccc1[N+](=O)[O-] ZINC001215369989 1314826285 /nfs/dbraw/zinc/82/62/85/1314826285.db2.gz KOLDUDVQUCTLQH-UHFFFAOYSA-N 0 3 337.339 2.661 20 5 EFBDHN CN(C)Cc1ccc(-c2nc(-c3ncc(F)cc3[N+](=O)[O-])no2)cc1 ZINC001216088800 1314910286 /nfs/dbraw/zinc/91/02/86/1314910286.db2.gz JLTYKCCCDDVQRH-UHFFFAOYSA-N 0 3 343.318 2.908 20 5 EFBDHN O=[N+]([O-])c1cc(OC(F)(F)F)ccc1O[C@H]1CNCCC1(F)F ZINC001218447600 1315197074 /nfs/dbraw/zinc/19/70/74/1315197074.db2.gz KAOZIYSATNSVOZ-JTQLQIEISA-N 0 3 342.220 2.869 20 5 EFBDHN COC(=O)c1cc(O[C@@H]2CNCc3ccccc32)c(F)cc1[N+](=O)[O-] ZINC001218491072 1315204504 /nfs/dbraw/zinc/20/45/04/1315204504.db2.gz VBNOUSUORCJUQV-MRXNPFEDSA-N 0 3 346.314 2.744 20 5 EFBDHN C[C@H]1CCN[C@@H](C(=O)n2c3ccccc3cc3c(=O)c(N)ccc2-3)C1 ZINC001219254097 1315294545 /nfs/dbraw/zinc/29/45/45/1315294545.db2.gz UHDBERLXZLHKGD-BLLLJJGKSA-N 0 3 335.407 2.717 20 5 EFBDHN CC(C)Oc1cc(CN[C@H](C)Cc2ccccc2[N+](=O)[O-])ncn1 ZINC001254549859 1315722632 /nfs/dbraw/zinc/72/26/32/1315722632.db2.gz XUOXBOSFWCWCCU-CYBMUJFWSA-N 0 3 330.388 2.893 20 5 EFBDHN CC(C)Oc1cc(CN[C@@H](C)Cc2ccccc2[N+](=O)[O-])ncn1 ZINC001254549860 1315722870 /nfs/dbraw/zinc/72/28/70/1315722870.db2.gz XUOXBOSFWCWCCU-ZDUSSCGKSA-N 0 3 330.388 2.893 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N1CCC[C@@]2(CCCC(=O)N2)C1 ZINC001254557688 1315723335 /nfs/dbraw/zinc/72/33/35/1315723335.db2.gz QSILTBIWXPETHI-KSSFIOAISA-N 0 3 331.416 2.661 20 5 EFBDHN CCN(C(C)=O)C1CCN([C@@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC001254568555 1315725211 /nfs/dbraw/zinc/72/52/11/1315725211.db2.gz HEQXTEZDNVKQHI-AWEZNQCLSA-N 0 3 333.432 2.859 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N1CCC(Oc2ccncn2)CC1 ZINC001254569988 1315725474 /nfs/dbraw/zinc/72/54/74/1315725474.db2.gz LNKWVKQOKOSWHG-CQSZACIVSA-N 0 3 342.399 2.859 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N1CCC[C@H](Oc2ncccn2)C1 ZINC001254570572 1315725730 /nfs/dbraw/zinc/72/57/30/1315725730.db2.gz NYOAJHQVAWHVLQ-HOCLYGCPSA-N 0 3 342.399 2.859 20 5 EFBDHN CC(C)(C)OC(=O)N1CC(C)(N[C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254571972 1315726186 /nfs/dbraw/zinc/72/61/86/1315726186.db2.gz FNRHLQPGFNOKFC-AWEZNQCLSA-N 0 3 347.415 2.661 20 5 EFBDHN COc1cccc(OC)c1CN[C@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254580737 1315727059 /nfs/dbraw/zinc/72/70/59/1315727059.db2.gz FBZXJQTVCGYGCN-AWEZNQCLSA-N 0 3 328.368 2.869 20 5 EFBDHN COc1ccc2c(c1)c(CN)nn2[C@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254590859 1315728213 /nfs/dbraw/zinc/72/82/13/1315728213.db2.gz ZRCQXGJICBDBIL-AWEZNQCLSA-N 0 3 338.367 2.752 20 5 EFBDHN Cc1nc([C@@H]2CCCN([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)no1 ZINC001254593567 1315728367 /nfs/dbraw/zinc/72/83/67/1315728367.db2.gz NBBPMVVETTUBNH-CZUORRHYSA-N 0 3 328.372 2.633 20 5 EFBDHN Cc1nc(C2CCN([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)CC2)no1 ZINC001254597371 1315728827 /nfs/dbraw/zinc/72/88/27/1315728827.db2.gz CTVSTQWPOISCDX-MRXNPFEDSA-N 0 3 328.372 2.633 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@@H](N1CC[C@@H](Oc3ccncc3)C1)C2 ZINC001254606834 1315730287 /nfs/dbraw/zinc/73/02/87/1315730287.db2.gz IDYUNIYDELVYSO-FUHWJXTLSA-N 0 3 325.368 2.610 20 5 EFBDHN CCc1nc(C2CCN([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)CC2)no1 ZINC001254608356 1315730919 /nfs/dbraw/zinc/73/09/19/1315730919.db2.gz QVZCBGOXPJIFGF-MRXNPFEDSA-N 0 3 342.399 2.887 20 5 EFBDHN O=C1CCCCN1C1CCN([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254608771 1315731148 /nfs/dbraw/zinc/73/11/48/1315731148.db2.gz SMRRSYIAVACIDA-SFHVURJKSA-N 0 3 343.427 2.539 20 5 EFBDHN CCOC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254609395 1315731158 /nfs/dbraw/zinc/73/11/58/1315731158.db2.gz WAEINJDZCFLXTQ-NBMRYCAZSA-N 0 3 344.411 2.726 20 5 EFBDHN Cc1cccc(O[C@H]2CCN([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)n1 ZINC001254612090 1315731755 /nfs/dbraw/zinc/73/17/55/1315731755.db2.gz UYMZAMGOYCDCEN-ROUUACIJSA-N 0 3 339.395 2.919 20 5 EFBDHN Cc1cccc(O[C@@H]2CCN([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)n1 ZINC001254612093 1315731889 /nfs/dbraw/zinc/73/18/89/1315731889.db2.gz UYMZAMGOYCDCEN-ZWKOTPCHSA-N 0 3 339.395 2.919 20 5 EFBDHN C[C@@H]1[C@H](C)N(C)CCN1Cc1ccc([N+](=O)[O-])cc1Br ZINC001255184399 1315788243 /nfs/dbraw/zinc/78/82/43/1315788243.db2.gz NCMUSDXUFSEQCC-WDEREUQCSA-N 0 3 342.237 2.882 20 5 EFBDHN COc1cc(N2CCC(N3C[C@@H]4C[C@@H]4[C@@H](F)C3)CC2)ccc1[N+](=O)[O-] ZINC001256093088 1315903701 /nfs/dbraw/zinc/90/37/01/1315903701.db2.gz GGJIHIAXLVAXFE-RCBQFDQVSA-N 0 3 349.406 2.862 20 5 EFBDHN CC([C@@H](OC(=O)COC(F)(F)F)c1ccccc1F)[N+](=O)[O-] ZINC001263534899 1316548595 /nfs/dbraw/zinc/54/85/95/1316548595.db2.gz LUPGDCJULQKGDW-RDDDGLTNSA-N 0 3 325.214 2.612 20 5 EFBDHN C[C@H]1CCCN(C(=O)CCNCc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC001320561335 1329164542 /nfs/dbraw/zinc/16/45/42/1329164542.db2.gz BZQXZPNVDQYIRS-LBPRGKRZSA-N 0 3 339.823 2.986 20 5 EFBDHN O=C(c1ccccc1)N1CCC[C@H](NCc2cccc([N+](=O)[O-])c2)C1 ZINC001321652797 1329401289 /nfs/dbraw/zinc/40/12/89/1329401289.db2.gz DXBZILCZEUXHFL-KRWDZBQOSA-N 0 3 339.395 2.989 20 5 EFBDHN CCN1CCN(Cc2ccc([N+](=O)[O-])cc2Br)[C@@H](C)C1 ZINC001322439956 1329458403 /nfs/dbraw/zinc/45/84/03/1329458403.db2.gz FCZKDWIDTHTHRY-NSHDSACASA-N 0 3 342.237 2.883 20 5 EFBDHN C[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2Br)C[C@H](C)N1C ZINC001324222331 1329609449 /nfs/dbraw/zinc/60/94/49/1329609449.db2.gz NTWVPYFMEMOJEN-PHIMTYICSA-N 0 3 342.237 2.882 20 5 EFBDHN N[C@H](C(=O)NCCCCc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC001326338936 1329748749 /nfs/dbraw/zinc/74/87/49/1329748749.db2.gz MKUQLAYCTRBGPX-KRWDZBQOSA-N 0 3 333.432 2.941 20 5 EFBDHN Cc1cncc([N+](=O)[O-])c1NC[C@@H](c1ccccc1)N1CCCC1 ZINC001326352848 1329749673 /nfs/dbraw/zinc/74/96/73/1329749673.db2.gz UOYVIFZKMKCVAW-INIZCTEOSA-N 0 3 326.400 2.969 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)c1cccc([N+](=O)[O-])c1Cl ZINC001331587994 1330856582 /nfs/dbraw/zinc/85/65/82/1330856582.db2.gz LKQPFFOTYFYBMT-NSHDSACASA-N 0 3 325.796 2.852 20 5 EFBDHN O=C(Nc1nccc2c1cccc2[N+](=O)[O-])C12CCCN1CCC2 ZINC001331893574 1330886196 /nfs/dbraw/zinc/88/61/96/1330886196.db2.gz PPXGVUMXWJHIAA-UHFFFAOYSA-N 0 3 326.356 2.710 20 5 EFBDHN CC[NH+](CC)C1CCN(Cc2ccc([O-])c(OC)c2[N+](=O)[O-])CC1 ZINC001333666354 1331190434 /nfs/dbraw/zinc/19/04/34/1331190434.db2.gz NKTPLDBXBUPQFV-UHFFFAOYSA-N 0 3 337.420 2.615 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]CCc2ccc(N(C)C)cc2)c1[N+](=O)[O-] ZINC001333708208 1331198428 /nfs/dbraw/zinc/19/84/28/1331198428.db2.gz VJGPLUUPQQECFU-UHFFFAOYSA-N 0 3 345.399 2.707 20 5 EFBDHN CN1CCCC[C@H]1CNC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC001336222597 1331448385 /nfs/dbraw/zinc/44/83/85/1331448385.db2.gz ALWQWZRCFWRGRO-NSHDSACASA-N 0 3 343.786 2.530 20 5 EFBDHN CC(C)[C@@H](NC[C@H](O)COc1ccccc1[N+](=O)[O-])c1ccccn1 ZINC001336722643 1331496366 /nfs/dbraw/zinc/49/63/66/1331496366.db2.gz LGENTQZBGBTHTD-KBXCAEBGSA-N 0 3 345.399 2.716 20 5 EFBDHN CC(C)(C)C[C@@H]1C[C@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC001336841880 1331507562 /nfs/dbraw/zinc/50/75/62/1331507562.db2.gz YKWYGIIJUZHWJY-SWLSCSKDSA-N 0 3 340.445 2.783 20 5 EFBDHN CC([C@@H](OC(=O)/C=C/c1cn(C)cn1)c1ccccc1F)[N+](=O)[O-] ZINC001345207374 1332522014 /nfs/dbraw/zinc/52/20/14/1332522014.db2.gz KPGMBIPPUUQTEQ-RVDACILISA-N 0 3 333.319 2.522 20 5 EFBDHN O=C(CCNCc1ccc([N+](=O)[O-])cc1)Nc1cc(F)cc(F)c1 ZINC001346110767 1332600334 /nfs/dbraw/zinc/60/03/34/1332600334.db2.gz TXOVVPSKEOYCQB-UHFFFAOYSA-N 0 3 335.310 2.991 20 5 EFBDHN O=C(N[C@H]1CCCN2CCCC[C@H]12)c1cc([N+](=O)[O-])ccc1Cl ZINC000847253553 1333447892 /nfs/dbraw/zinc/44/78/92/1333447892.db2.gz HJCBEMUXSRDOSH-LSDHHAIUSA-N 0 3 337.807 2.995 20 5 EFBDHN O=C(N[C@@H]1CCCN2CCCC[C@H]12)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000847256728 1333451366 /nfs/dbraw/zinc/45/13/66/1333451366.db2.gz RJBWLVOCENORSP-UKRRQHHQSA-N 0 3 337.807 2.995 20 5 EFBDHN CN(C)C[C@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC001353274488 1334059698 /nfs/dbraw/zinc/05/96/98/1334059698.db2.gz UCHQKZALFUBIOR-ZWKOTPCHSA-N 0 3 347.390 2.660 20 5 EFBDHN C[C@H](NC(=O)[C@H]1CNCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC001354829486 1334544625 /nfs/dbraw/zinc/54/46/25/1334544625.db2.gz JXEWTBWBUJLJLU-SJCJKPOMSA-N 0 3 325.368 2.659 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2NC[C@H](O)COc1cccc(F)c1 ZINC000848524274 1334772800 /nfs/dbraw/zinc/77/28/00/1334772800.db2.gz RMYCMBCSIFSVKL-GUYCJALGSA-N 0 3 346.358 2.751 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2N[C@@H]1COc2ccccc2[C@@H]1O ZINC000848550108 1334789659 /nfs/dbraw/zinc/78/96/59/1334789659.db2.gz CMECUEAMYDMTGQ-DAYGRLMNSA-N 0 3 326.352 2.666 20 5 EFBDHN COc1cccc2c1OCC[C@H]2NC[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001356534369 1335050193 /nfs/dbraw/zinc/05/01/93/1335050193.db2.gz LZVSSLDQXZEKCA-HZPDHXFCSA-N 0 3 344.367 2.750 20 5 EFBDHN C[C@H](NC(=O)c1cc2c(s1)CCNC2)c1ccc([N+](=O)[O-])cc1 ZINC001358143455 1335363219 /nfs/dbraw/zinc/36/32/19/1335363219.db2.gz TYLMYUPQKMWWPO-JTQLQIEISA-N 0 3 331.397 2.793 20 5 EFBDHN O=C(N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1)c1ccc(Cl)[nH]1 ZINC001020560932 713188810 /nfs/dbraw/zinc/18/88/10/713188810.db2.gz OKKIUUFGXLSNKG-HAQNSBGRSA-N 0 3 348.790 2.627 20 5 EFBDHN O=C(N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1)C1CCCCC1 ZINC001021785759 714474616 /nfs/dbraw/zinc/47/46/16/714474616.db2.gz PIUQWZJLMJUITI-IYBDPMFKSA-N 0 3 331.416 2.912 20 5 EFBDHN Cc1ccccc1C(=O)N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001021787695 714476999 /nfs/dbraw/zinc/47/69/99/714476999.db2.gz DHLDYOYRYOSCHZ-IYBDPMFKSA-N 0 3 339.395 2.954 20 5 EFBDHN Cc1cc(C(=O)N[C@H]2C[C@@H](NCc3ccccc3[N+](=O)[O-])C2)co1 ZINC001022010269 714646566 /nfs/dbraw/zinc/64/65/66/714646566.db2.gz TXTHSLISFBRKHP-GASCZTMLSA-N 0 3 329.356 2.547 20 5 EFBDHN C[C@@H]1CN(Cc2cccc([N+](=O)[O-])c2Br)C[C@H](C)N1C ZINC000235668657 718000992 /nfs/dbraw/zinc/00/09/92/718000992.db2.gz QRIWWIUQAFGJPY-PHIMTYICSA-N 0 3 342.237 2.882 20 5 EFBDHN COc1cccc([C@@H](CNc2c([N+](=O)[O-])cnn2C)N2CCCC2)c1 ZINC000891513243 714793087 /nfs/dbraw/zinc/79/30/87/714793087.db2.gz FWSICLTZEAGEHC-OAHLLOKOSA-N 0 3 345.403 2.586 20 5 EFBDHN O=C(N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1)C1(C2CC2)CC1 ZINC001022247026 714916085 /nfs/dbraw/zinc/91/60/85/714916085.db2.gz ODDKHYVZZXJJRI-GASCZTMLSA-N 0 3 329.400 2.522 20 5 EFBDHN O=C(Cc1ccccc1)N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001022299060 714985455 /nfs/dbraw/zinc/98/54/55/714985455.db2.gz YCXWCCJHMHIYQT-CALCHBBNSA-N 0 3 339.395 2.574 20 5 EFBDHN CC(=O)N1CCC(N(Cc2csc([N+](=O)[O-])c2)CC2CC2)CC1 ZINC001039480501 715220813 /nfs/dbraw/zinc/22/08/13/715220813.db2.gz YVPQHKXHSUBPBL-UHFFFAOYSA-N 0 3 337.445 2.879 20 5 EFBDHN COc1c([O-])ccc(CN2CCC[C@H]([NH+]3CCCC3)CC2)c1[N+](=O)[O-] ZINC000892086528 715246056 /nfs/dbraw/zinc/24/60/56/715246056.db2.gz RHYBYQVTIKVGDQ-HNNXBMFYSA-N 0 3 349.431 2.759 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N(C)[C@@H]2CCCN(C)C2)cc1[N+](=O)[O-] ZINC000893453536 715571136 /nfs/dbraw/zinc/57/11/36/715571136.db2.gz PPKDYJAZTZNNIR-DZGCQCFKSA-N 0 3 334.420 2.700 20 5 EFBDHN O=C(N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1)C(C1CC1)C1CC1 ZINC001022951898 716008714 /nfs/dbraw/zinc/00/87/14/716008714.db2.gz KFMYCLVMAQVWDV-IYBDPMFKSA-N 0 3 343.427 2.768 20 5 EFBDHN Cc1cc(F)cc(C(=O)NCCN(C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000176785214 716182354 /nfs/dbraw/zinc/18/23/54/716182354.db2.gz UHJCKHZFZDRBKL-UHFFFAOYSA-N 0 3 345.374 2.904 20 5 EFBDHN C[C@@H](NCc1cccc([N+](=O)[O-])c1Br)[C@H]1CCOC1 ZINC000235188513 716667195 /nfs/dbraw/zinc/66/71/95/716667195.db2.gz AFIRBHHHQOLKSW-KOLCDFICSA-N 0 3 329.194 2.872 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]C[C@@H]2COc3ccccc3C2)c1[N+](=O)[O-] ZINC000892402435 717048174 /nfs/dbraw/zinc/04/81/74/717048174.db2.gz PCOVOXHXZAGSKR-GFCCVEGCSA-N 0 3 344.367 2.650 20 5 EFBDHN COc1ccc(CC[NH2+]Cc2ccc([O-])c(OC)c2[N+](=O)[O-])cc1 ZINC000892447219 717510252 /nfs/dbraw/zinc/51/02/52/717510252.db2.gz QSVFCJCSPCEFRD-UHFFFAOYSA-N 0 3 332.356 2.650 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)ccc1CNCCCOC[C@H]1CCCO1 ZINC000892460457 717624326 /nfs/dbraw/zinc/62/43/26/717624326.db2.gz CSGXKTZYRHZSJG-CQSZACIVSA-N 0 3 328.796 2.924 20 5 EFBDHN COc1c(O)ccc(CNC[C@@H](C)N(C)c2ccccc2)c1[N+](=O)[O-] ZINC000892570249 718293385 /nfs/dbraw/zinc/29/33/85/718293385.db2.gz IFMAWMRFCLTXHH-CYBMUJFWSA-N 0 3 345.399 2.924 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]C[C@@H](C)N(C)c2ccccc2)c1[N+](=O)[O-] ZINC000892570249 718293387 /nfs/dbraw/zinc/29/33/87/718293387.db2.gz IFMAWMRFCLTXHH-CYBMUJFWSA-N 0 3 345.399 2.924 20 5 EFBDHN Cc1cc(N2C[C@H](C)N(C)C[C@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000351507534 719242875 /nfs/dbraw/zinc/24/28/75/719242875.db2.gz BTZOGOHKKMPBJY-UONOGXRCSA-N 0 3 341.415 2.889 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]CCc2cccc(F)c2F)c1[N+](=O)[O-] ZINC000892947771 719308241 /nfs/dbraw/zinc/30/82/41/719308241.db2.gz PIHSONHCQTWQJV-UHFFFAOYSA-N 0 3 338.310 2.920 20 5 EFBDHN COc1c(O)ccc(CNCCc2cccc(F)c2F)c1[N+](=O)[O-] ZINC000892947771 719308242 /nfs/dbraw/zinc/30/82/42/719308242.db2.gz PIHSONHCQTWQJV-UHFFFAOYSA-N 0 3 338.310 2.920 20 5 EFBDHN CC(C)CN1CCN(c2nc(Cl)nc3ccc([N+](=O)[O-])cc32)CC1 ZINC001164651630 719331430 /nfs/dbraw/zinc/33/14/30/719331430.db2.gz GKYLCXCXFWGRFT-UHFFFAOYSA-N 0 3 349.822 2.969 20 5 EFBDHN O=C(N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1)C1CCCCC1 ZINC001019948660 719415413 /nfs/dbraw/zinc/41/54/13/719415413.db2.gz PIUQWZJLMJUITI-WKILWMFISA-N 0 3 331.416 2.912 20 5 EFBDHN O=C(N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1)C1(F)CCCC1 ZINC001020329089 719490713 /nfs/dbraw/zinc/49/07/13/719490713.db2.gz ZOLREYMUNWFKFG-HDJSIYSDSA-N 0 3 335.379 2.614 20 5 EFBDHN COc1c([O-])ccc(C[NH2+][C@H]2CCOC3(CCCC3)C2)c1[N+](=O)[O-] ZINC000893112818 719678535 /nfs/dbraw/zinc/67/85/35/719678535.db2.gz HVTPHANNHGSNCD-ZDUSSCGKSA-N 0 3 336.388 2.890 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]CCc2ccc(F)c(F)c2)c1[N+](=O)[O-] ZINC000893936067 720169748 /nfs/dbraw/zinc/16/97/48/720169748.db2.gz UUKSWHOCWDLLMH-UHFFFAOYSA-N 0 3 338.310 2.920 20 5 EFBDHN C[C@@H]1Cc2cc(CN3CCC(n4ccc([N+](=O)[O-])n4)CC3)ccc2O1 ZINC000894078698 720271145 /nfs/dbraw/zinc/27/11/45/720271145.db2.gz LFJIVTDKKAPOKY-CYBMUJFWSA-N 0 3 342.399 2.952 20 5 EFBDHN COc1c([O-])ccc(C[NH2+][C@H]2CCO[C@@H](C(C)(C)C)C2)c1[N+](=O)[O-] ZINC000893256277 720282374 /nfs/dbraw/zinc/28/23/74/720282374.db2.gz OWBHEBKKUFMRMP-GXTWGEPZSA-N 0 3 338.404 2.992 20 5 EFBDHN COc1c([O-])ccc(C[NH2+][C@H]2CCO[C@H](CC(C)C)C2)c1[N+](=O)[O-] ZINC000893320727 720607560 /nfs/dbraw/zinc/60/75/60/720607560.db2.gz UIHDWJGMGCTDKV-UONOGXRCSA-N 0 3 338.404 2.992 20 5 EFBDHN COc1c([O-])ccc(C[NH2+][C@H]2CCCC23CCOCC3)c1[N+](=O)[O-] ZINC000894256587 721763865 /nfs/dbraw/zinc/76/38/65/721763865.db2.gz HQZIRTARODUKHW-AWEZNQCLSA-N 0 3 336.388 2.748 20 5 EFBDHN COc1c(O)ccc(CN[C@H]2CCc3ccccc3OC2)c1[N+](=O)[O-] ZINC000894266038 721793256 /nfs/dbraw/zinc/79/32/56/721793256.db2.gz ZBKMQFRNJSJYBL-AWEZNQCLSA-N 0 3 344.367 2.792 20 5 EFBDHN COc1c([O-])ccc(C[NH2+][C@H]2CCc3ccccc3OC2)c1[N+](=O)[O-] ZINC000894266038 721793258 /nfs/dbraw/zinc/79/32/58/721793258.db2.gz ZBKMQFRNJSJYBL-AWEZNQCLSA-N 0 3 344.367 2.792 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]CCC2C[C@@H](C)O[C@H](C)C2)c1[N+](=O)[O-] ZINC000894275203 721882810 /nfs/dbraw/zinc/88/28/10/721882810.db2.gz QIDHKHDOCAUHTQ-VXGBXAGGSA-N 0 3 338.404 2.992 20 5 EFBDHN COc1c(O)ccc(CN[C@H]2COc3c(C)cccc3C2)c1[N+](=O)[O-] ZINC000894555066 722781362 /nfs/dbraw/zinc/78/13/62/722781362.db2.gz PMZRFOZXTKNDOK-CQSZACIVSA-N 0 3 344.367 2.711 20 5 EFBDHN COc1c(O)ccc(CN2CCN(C)Cc3ccccc32)c1[N+](=O)[O-] ZINC000894602612 722789990 /nfs/dbraw/zinc/78/99/90/722789990.db2.gz VMADVSFGAMJZBO-UHFFFAOYSA-N 0 3 343.383 2.761 20 5 EFBDHN Cc1coc(C(=O)N[C@H]2C[C@H](CNCc3csc([N+](=O)[O-])c3)C2)c1 ZINC000984614621 723172658 /nfs/dbraw/zinc/17/26/58/723172658.db2.gz HOZNYIMEYXJVLN-AULYBMBSSA-N 0 3 349.412 2.856 20 5 EFBDHN CC(C)N1CC[C@@H](N(C)C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)C1 ZINC000909438398 723209169 /nfs/dbraw/zinc/20/91/69/723209169.db2.gz KJMRQICEZYNMMG-LLVKDONJSA-N 0 3 343.786 2.942 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C1CCN(C(=O)C2CCC2)CC1 ZINC000985198477 723965507 /nfs/dbraw/zinc/96/55/07/723965507.db2.gz KQZSHXFLUBDMJP-UHFFFAOYSA-N 0 3 331.416 2.818 20 5 EFBDHN CC(C)CN1CCN(Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000728896273 724875673 /nfs/dbraw/zinc/87/56/73/724875673.db2.gz PGLILUWDEYKIQU-UHFFFAOYSA-N 0 3 343.431 2.689 20 5 EFBDHN CCN1CCCN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000910281931 727427066 /nfs/dbraw/zinc/42/70/66/727427066.db2.gz NQAOLWFUHKDRDR-AWEZNQCLSA-N 0 3 333.432 2.815 20 5 EFBDHN CCOc1ccc(C(=O)N2CCCN(CC)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000910294827 727431050 /nfs/dbraw/zinc/43/10/50/727431050.db2.gz JCBKTTBYHHZIKG-ZDUSSCGKSA-N 0 3 335.404 2.550 20 5 EFBDHN CCN1CCCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000910296450 727431205 /nfs/dbraw/zinc/43/12/05/727431205.db2.gz NEVACDHENLQSGS-LLVKDONJSA-N 0 3 325.796 2.805 20 5 EFBDHN C[C@@H]1CCN(Cc2ccccc2)C[C@@H]1NC(=O)CCC(C)(C)[N+](=O)[O-] ZINC000913098182 727781188 /nfs/dbraw/zinc/78/11/88/727781188.db2.gz ZVAKLUROEKYTGW-WBVHZDCISA-N 0 3 347.459 2.849 20 5 EFBDHN C[C@H]1CCN(Cc2ccccc2)C[C@@H]1NC(=O)CCC(C)(C)[N+](=O)[O-] ZINC000913098181 727781240 /nfs/dbraw/zinc/78/12/40/727781240.db2.gz ZVAKLUROEKYTGW-RDJZCZTQSA-N 0 3 347.459 2.849 20 5 EFBDHN COc1ccc(OC)c([C@H](O)CN[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173307982 728622160 /nfs/dbraw/zinc/62/21/60/728622160.db2.gz VPXDWNZCTFIJDM-YVEFUNNKSA-N 0 3 346.383 2.996 20 5 EFBDHN CC(C)N1CCN(Cc2cccc([N+](=O)[O-])c2Br)CC1 ZINC000232638985 728671881 /nfs/dbraw/zinc/67/18/81/728671881.db2.gz QPPFMGZPJLGCBB-UHFFFAOYSA-N 0 3 342.237 2.883 20 5 EFBDHN C[C@H]1CCCN(CCNC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000154939119 728999168 /nfs/dbraw/zinc/99/91/68/728999168.db2.gz CJPWFAUHZDYLJH-NSHDSACASA-N 0 3 325.796 2.710 20 5 EFBDHN C[C@H]1CCCN(CCNC(=O)c2cccc(Cl)c2[N+](=O)[O-])C1 ZINC000175521333 729506814 /nfs/dbraw/zinc/50/68/14/729506814.db2.gz PDEHUYBIJWEMPF-NSHDSACASA-N 0 3 325.796 2.710 20 5 EFBDHN COc1ccccc1C[C@@](C)(CO)NCc1ccccc1[N+](=O)[O-] ZINC000931606195 1126137236 /nfs/dbraw/zinc/13/72/36/1126137236.db2.gz YXRRWRLWWJOZFY-SFHVURJKSA-N 0 3 330.384 2.687 20 5 EFBDHN CC(C)(C)c1ccc(C(=O)Nc2ncccc2CN)cc1[N+](=O)[O-] ZINC001575273429 1088357057 /nfs/dbraw/zinc/35/70/57/1088357057.db2.gz YDSUGIWFVOBOAO-UHFFFAOYSA-N 0 3 328.372 2.998 20 5 EFBDHN C[C@@H]1CN[C@@H](C)[C@H](C)N1C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC001576881464 1089505433 /nfs/dbraw/zinc/50/54/33/1089505433.db2.gz VKSUQHOVKRBGAT-VGMNWLOBSA-N 0 3 329.759 2.598 20 5 EFBDHN Cc1ccc(NC(=O)C[C@H]2NCc3ccccc32)c(N)c1[N+](=O)[O-] ZINC001579715628 1090669258 /nfs/dbraw/zinc/66/92/58/1090669258.db2.gz ZIEDUYGBMUKWOH-CQSZACIVSA-N 0 3 326.356 2.659 20 5 EFBDHN N[C@H](CC(=O)N1CCc2c1ccc([N+](=O)[O-])c2F)c1ccccc1 ZINC001580117906 1090777675 /nfs/dbraw/zinc/77/76/75/1090777675.db2.gz FEBWMTBPXOGIHY-CYBMUJFWSA-N 0 3 329.331 2.713 20 5 EFBDHN O=C(Nc1ccc([N+](=O)[O-])c2ccncc12)c1ccc2c(c1)CNC2 ZINC001580769709 1091003004 /nfs/dbraw/zinc/00/30/04/1091003004.db2.gz ADLLPEUMEJGECP-UHFFFAOYSA-N 0 3 334.335 2.999 20 5 EFBDHN CC(C)N(C)CC(=O)NCC1(Nc2ccc([N+](=O)[O-])cc2)CCCC1 ZINC001104396879 1092432556 /nfs/dbraw/zinc/43/25/56/1092432556.db2.gz KXFFCTLDHSRYAV-UHFFFAOYSA-N 0 3 348.447 2.776 20 5 EFBDHN C[C@@H]1CCC[C@@H](C)C1[NH2+]Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001590238473 1093324625 /nfs/dbraw/zinc/32/46/25/1093324625.db2.gz HJINBKFPLSRLGZ-GHMZBOCLSA-N 0 3 330.392 2.689 20 5 EFBDHN C[C@@H]1CCC[C@@H](C)C1[NH2+]Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001590238473 1093324634 /nfs/dbraw/zinc/32/46/34/1093324634.db2.gz HJINBKFPLSRLGZ-GHMZBOCLSA-N 0 3 330.392 2.689 20 5 EFBDHN C[C@@H]1C[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])[C@@H]2CCCC[C@H]21 ZINC001590307015 1093366709 /nfs/dbraw/zinc/36/67/09/1093366709.db2.gz DAZBMFOTEXHUNL-TYNCELHUSA-N 0 3 342.403 2.785 20 5 EFBDHN C[C@@H]1C[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])[C@@H]2CCCC[C@H]21 ZINC001590307015 1093366716 /nfs/dbraw/zinc/36/67/16/1093366716.db2.gz DAZBMFOTEXHUNL-TYNCELHUSA-N 0 3 342.403 2.785 20 5 EFBDHN C[C@@H]1C[N@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])[C@@H]2CCCC[C@H]21 ZINC001590307015 1093366723 /nfs/dbraw/zinc/36/67/23/1093366723.db2.gz DAZBMFOTEXHUNL-TYNCELHUSA-N 0 3 342.403 2.785 20 5 EFBDHN C[C@@H]1C[N@@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])[C@@H]2CCCC[C@H]21 ZINC001590307015 1093366731 /nfs/dbraw/zinc/36/67/31/1093366731.db2.gz DAZBMFOTEXHUNL-TYNCELHUSA-N 0 3 342.403 2.785 20 5 EFBDHN CCC(CC)[C@H](CNc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])[NH+](C)C ZINC001590433021 1093419719 /nfs/dbraw/zinc/41/97/19/1093419719.db2.gz WDYIECOSWUERNG-AWEZNQCLSA-N 0 3 347.423 2.553 20 5 EFBDHN CCC(CC)[C@H](CNc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])[NH+](C)C ZINC001590433021 1093419721 /nfs/dbraw/zinc/41/97/21/1093419721.db2.gz WDYIECOSWUERNG-AWEZNQCLSA-N 0 3 347.423 2.553 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[N@@H+]1CCC[C@@H](C2CCC2)C1 ZINC001593467364 1094311681 /nfs/dbraw/zinc/31/16/81/1094311681.db2.gz PKEYOVZQNUSZQU-CQSZACIVSA-N 0 3 342.403 2.787 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[N@H+]1CCC[C@@H](C2CCC2)C1 ZINC001593467364 1094311688 /nfs/dbraw/zinc/31/16/88/1094311688.db2.gz PKEYOVZQNUSZQU-CQSZACIVSA-N 0 3 342.403 2.787 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1C[N@@H+]1CCC[C@@H](C2CCC2)C1 ZINC001593467364 1094311696 /nfs/dbraw/zinc/31/16/96/1094311696.db2.gz PKEYOVZQNUSZQU-CQSZACIVSA-N 0 3 342.403 2.787 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1C[N@H+]1CCC[C@@H](C2CCC2)C1 ZINC001593467364 1094311702 /nfs/dbraw/zinc/31/17/02/1094311702.db2.gz PKEYOVZQNUSZQU-CQSZACIVSA-N 0 3 342.403 2.787 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[NH+]1CCC2(CCC2)CC1 ZINC001593482143 1094325503 /nfs/dbraw/zinc/32/55/03/1094325503.db2.gz LPZGTUYTZDWOQF-UHFFFAOYSA-N 0 3 328.376 2.541 20 5 EFBDHN Cc1cc(Br)cc([N+](=O)[O-])c1O[C@H]1CCNC[C@H]1F ZINC001218071411 1095532166 /nfs/dbraw/zinc/53/21/66/1095532166.db2.gz PJYDUJACJAAWPU-KOLCDFICSA-N 0 3 333.157 2.745 20 5 EFBDHN Cc1sccc1CC(=O)NCCCNCc1ccccc1[N+](=O)[O-] ZINC001167698716 1095999350 /nfs/dbraw/zinc/99/93/50/1095999350.db2.gz JPKBPKGIVIBMND-UHFFFAOYSA-N 0 3 347.440 2.803 20 5 EFBDHN C[C@@H]1CC[C@]2(CC[N@H+](Cc3c(-c4nnn[n-]4)cccc3[N+](=O)[O-])C2)C1 ZINC001603880075 1096653443 /nfs/dbraw/zinc/65/34/43/1096653443.db2.gz DQHFHPDLBUPIBT-PXAZEXFGSA-N 0 3 342.403 2.787 20 5 EFBDHN C[C@@H]1CC[C@]2(CC[N@@H+](Cc3c(-c4nnn[n-]4)cccc3[N+](=O)[O-])C2)C1 ZINC001603880075 1096653447 /nfs/dbraw/zinc/65/34/47/1096653447.db2.gz DQHFHPDLBUPIBT-PXAZEXFGSA-N 0 3 342.403 2.787 20 5 EFBDHN C[C@@H]1CC[C@]2(CC[N@H+](Cc3c(-c4nn[n-]n4)cccc3[N+](=O)[O-])C2)C1 ZINC001603880075 1096653448 /nfs/dbraw/zinc/65/34/48/1096653448.db2.gz DQHFHPDLBUPIBT-PXAZEXFGSA-N 0 3 342.403 2.787 20 5 EFBDHN C[C@@H]1CC[C@]2(CC[N@@H+](Cc3c(-c4nn[n-]n4)cccc3[N+](=O)[O-])C2)C1 ZINC001603880075 1096653451 /nfs/dbraw/zinc/65/34/51/1096653451.db2.gz DQHFHPDLBUPIBT-PXAZEXFGSA-N 0 3 342.403 2.787 20 5 EFBDHN C[C@@H]1CC[C@H]([NH2+]Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])[C@@H](C)C1 ZINC001603883164 1096655137 /nfs/dbraw/zinc/65/51/37/1096655137.db2.gz XSCXSOAJGYHWMA-SUNKGSAMSA-N 0 3 330.392 2.689 20 5 EFBDHN C[C@@H]1CC[C@H]([NH2+]Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])[C@@H](C)C1 ZINC001603883164 1096655140 /nfs/dbraw/zinc/65/51/40/1096655140.db2.gz XSCXSOAJGYHWMA-SUNKGSAMSA-N 0 3 330.392 2.689 20 5 EFBDHN C[C@H]1CCCC[C@H]1[N@H+](C)Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001603891564 1096661581 /nfs/dbraw/zinc/66/15/81/1096661581.db2.gz STQDPUBYFYCEGQ-SMDDNHRTSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@H]1CCCC[C@H]1[N@@H+](C)Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001603891564 1096661583 /nfs/dbraw/zinc/66/15/83/1096661583.db2.gz STQDPUBYFYCEGQ-SMDDNHRTSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@H]1CCCC[C@H]1[N@H+](C)Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001603891564 1096661588 /nfs/dbraw/zinc/66/15/88/1096661588.db2.gz STQDPUBYFYCEGQ-SMDDNHRTSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@H]1CCCC[C@H]1[N@@H+](C)Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001603891564 1096661595 /nfs/dbraw/zinc/66/15/95/1096661595.db2.gz STQDPUBYFYCEGQ-SMDDNHRTSA-N 0 3 330.392 2.785 20 5 EFBDHN CC[C@H]([NH2+]Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])[C@@H]1CC1(C)C ZINC001604063244 1096716866 /nfs/dbraw/zinc/71/68/66/1096716866.db2.gz XCFXAYLMSDCZRY-STQMWFEESA-N 0 3 330.392 2.689 20 5 EFBDHN CC[C@H]([NH2+]Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])[C@@H]1CC1(C)C ZINC001604063244 1096716871 /nfs/dbraw/zinc/71/68/71/1096716871.db2.gz XCFXAYLMSDCZRY-STQMWFEESA-N 0 3 330.392 2.689 20 5 EFBDHN CCC[C@H]([NH2+]Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])C1CCC1 ZINC001604144854 1096750676 /nfs/dbraw/zinc/75/06/76/1096750676.db2.gz NBWFRTIHZLCIIC-AWEZNQCLSA-N 0 3 330.392 2.833 20 5 EFBDHN CCC[C@H]([NH2+]Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])C1CCC1 ZINC001604144854 1096750679 /nfs/dbraw/zinc/75/06/79/1096750679.db2.gz NBWFRTIHZLCIIC-AWEZNQCLSA-N 0 3 330.392 2.833 20 5 EFBDHN C[C@H]([NH2+]Cc1cccc(F)c1-c1nnn[n-]1)c1ccc([N+](=O)[O-])cc1 ZINC001605440377 1097125584 /nfs/dbraw/zinc/12/55/84/1097125584.db2.gz HINUKELCNHMUHL-JTQLQIEISA-N 0 3 342.334 2.765 20 5 EFBDHN CN1CC[C@H]2[C@@H]1CCN2C(=O)c1ccnc2c1ccc1cccnc12 ZINC001269224196 1097959784 /nfs/dbraw/zinc/95/97/84/1097959784.db2.gz GQPFFATUIUBRAB-IRXDYDNUSA-N 0 3 332.407 2.702 20 5 EFBDHN C[C@@H]1C[C@H](C)[C@H](C)[N@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001609153922 1098170948 /nfs/dbraw/zinc/17/09/48/1098170948.db2.gz FWBJFHFMMJIQOO-WOPDTQHZSA-N 0 3 330.392 2.641 20 5 EFBDHN C[C@@H]1C[C@H](C)[C@H](C)[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001609153922 1098170952 /nfs/dbraw/zinc/17/09/52/1098170952.db2.gz FWBJFHFMMJIQOO-WOPDTQHZSA-N 0 3 330.392 2.641 20 5 EFBDHN C[C@@H]1C[C@H](C)[C@H](C)[N@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001609153922 1098170957 /nfs/dbraw/zinc/17/09/57/1098170957.db2.gz FWBJFHFMMJIQOO-WOPDTQHZSA-N 0 3 330.392 2.641 20 5 EFBDHN C[C@@H]1C[C@H](C)[C@H](C)[N@@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001609153922 1098170961 /nfs/dbraw/zinc/17/09/61/1098170961.db2.gz FWBJFHFMMJIQOO-WOPDTQHZSA-N 0 3 330.392 2.641 20 5 EFBDHN CC[NH+](CC)CCC[C@H](C)Nc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1 ZINC001609223213 1098210904 /nfs/dbraw/zinc/21/09/04/1098210904.db2.gz ZFZNBDNOLXSZRY-LBPRGKRZSA-N 0 3 347.423 2.697 20 5 EFBDHN CC[NH+](CC)CCC[C@H](C)Nc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1 ZINC001609223213 1098210908 /nfs/dbraw/zinc/21/09/08/1098210908.db2.gz ZFZNBDNOLXSZRY-LBPRGKRZSA-N 0 3 347.423 2.697 20 5 EFBDHN CN1CC2(C1)CCN(C(=O)c1cccc3nc4ccccc4nc31)CC2 ZINC001271027412 1100394046 /nfs/dbraw/zinc/39/40/46/1100394046.db2.gz JBEKUROFSPXWTP-UHFFFAOYSA-N 0 3 346.434 2.951 20 5 EFBDHN Cc1cc(F)cc(C(=O)NCCCNCc2ccccc2[N+](=O)[O-])c1 ZINC001167259708 1102181022 /nfs/dbraw/zinc/18/10/22/1102181022.db2.gz BVFBYNCNBHYDBQ-UHFFFAOYSA-N 0 3 345.374 2.952 20 5 EFBDHN Cc1cc(C(=O)NCCCNCc2ccccc2[N+](=O)[O-])cs1 ZINC001168391604 1104187732 /nfs/dbraw/zinc/18/77/32/1104187732.db2.gz SOCIEZMRDWDCTF-UHFFFAOYSA-N 0 3 333.413 2.874 20 5 EFBDHN O=C(CCC1CC1)N1CCC(NCc2csc([N+](=O)[O-])c2)CC1 ZINC000990356195 1107656123 /nfs/dbraw/zinc/65/61/23/1107656123.db2.gz AKRZSKULSNBPDG-UHFFFAOYSA-N 0 3 337.445 2.927 20 5 EFBDHN O=C(/C=C/C1CC1)N1CCC(NCc2csc([N+](=O)[O-])c2)CC1 ZINC000990613194 1108390006 /nfs/dbraw/zinc/39/00/06/1108390006.db2.gz YOBFJYQAKYXIHO-ONEGZZNKSA-N 0 3 335.429 2.703 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1NCc1ccc(OC3COC3)cc1)CNC2 ZINC001168464289 1111084696 /nfs/dbraw/zinc/08/46/96/1111084696.db2.gz ZEVOQUZAKSIXLH-UHFFFAOYSA-N 0 3 341.367 2.588 20 5 EFBDHN O=[N+]([O-])c1ccc(NCCN2CCc3ccccc3C2)c2nonc21 ZINC000914863718 1111450109 /nfs/dbraw/zinc/45/01/09/1111450109.db2.gz WZDHPTRORCOKST-UHFFFAOYSA-N 0 3 339.355 2.601 20 5 EFBDHN CCCN(C)CC(=O)N(CC)CCNc1cc(C)ccc1[N+](=O)[O-] ZINC001106810974 1111870078 /nfs/dbraw/zinc/87/00/78/1111870078.db2.gz XOLMMAJRCSJTSV-UHFFFAOYSA-N 0 3 336.436 2.505 20 5 EFBDHN CN(c1ccc(Br)cc1[N+](=O)[O-])[C@H]1CCCN(C)C1 ZINC000053250794 214173129 /nfs/dbraw/zinc/17/31/29/214173129.db2.gz VKJSBJXQUJVSHQ-NSHDSACASA-N 0 3 328.210 2.888 20 5 EFBDHN CN(C)C[C@H]1CCc2ccccc2N1C(=O)c1ccc([N+](=O)[O-])o1 ZINC000425616107 282135955 /nfs/dbraw/zinc/13/59/55/282135955.db2.gz BICVGFWAUGAYNI-CYBMUJFWSA-N 0 3 329.356 2.711 20 5 EFBDHN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N1CC[C@H](N2CC=CC2)C1 ZINC000174451505 231211751 /nfs/dbraw/zinc/21/17/51/231211751.db2.gz WHEKZHBEUXXJLJ-LBPRGKRZSA-N 0 3 336.779 2.726 20 5 EFBDHN CC[C@H](O)[C@H]1CCCCN1CCOc1ccc(OC)cc1[N+](=O)[O-] ZINC000173778712 529711905 /nfs/dbraw/zinc/71/19/05/529711905.db2.gz YQLLWGQLCFSILZ-ZBFHGGJFSA-N 0 3 338.404 2.608 20 5 EFBDHN CN(C)[C@H]1Cc2ccccc2N(C(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000067206785 282273102 /nfs/dbraw/zinc/27/31/02/282273102.db2.gz SEVFBMOXWUMSJB-INIZCTEOSA-N 0 3 325.368 2.728 20 5 EFBDHN CCc1nn(C)c(N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000160233048 529767757 /nfs/dbraw/zinc/76/77/57/529767757.db2.gz VTOJENHMZXZMCB-BBRMVZONSA-N 0 3 343.431 2.823 20 5 EFBDHN COc1cccc(C(=O)NCCN[C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000178642003 232327999 /nfs/dbraw/zinc/32/79/99/232327999.db2.gz ICUSFZNLQAUOAJ-CYBMUJFWSA-N 0 3 343.383 2.684 20 5 EFBDHN CCCC(=O)NC[C@@H]1CCCN(CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000101912602 219172597 /nfs/dbraw/zinc/17/25/97/219172597.db2.gz FHLNPUQIEJNIMZ-HNNXBMFYSA-N 0 3 349.431 2.602 20 5 EFBDHN CCN(Cc1ccc(CN(C)C)cc1)C(=O)c1ccc([N+](=O)[O-])o1 ZINC000066726849 215074199 /nfs/dbraw/zinc/07/41/99/215074199.db2.gz UZJPQBWXXOVZNS-UHFFFAOYSA-N 0 3 331.372 2.912 20 5 EFBDHN C[C@H]1CCCN(C(C)(C)CNC(=O)c2cc(F)ccc2[N+](=O)[O-])C1 ZINC000102637287 219216966 /nfs/dbraw/zinc/21/69/66/219216966.db2.gz RVESVMFIFDHDSD-LBPRGKRZSA-N 0 3 337.395 2.974 20 5 EFBDHN O=[N+]([O-])c1ccc(CN2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)cc1 ZINC000179499197 233105030 /nfs/dbraw/zinc/10/50/30/233105030.db2.gz HXFOMAGBRPPDFU-AWEZNQCLSA-N 0 3 327.388 2.970 20 5 EFBDHN Cc1cc(NC(=O)CCN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)no1 ZINC000179519267 233128036 /nfs/dbraw/zinc/12/80/36/233128036.db2.gz GSCUFTULLWZCIQ-UHFFFAOYSA-N 0 3 344.371 2.884 20 5 EFBDHN Cc1cc(NCCCN2CCOC2=O)c2cc([N+](=O)[O-])ccc2n1 ZINC000181501478 234208736 /nfs/dbraw/zinc/20/87/36/234208736.db2.gz NTCNOLCNVOOOLT-UHFFFAOYSA-N 0 3 330.344 2.706 20 5 EFBDHN O=C(NCCN1CCCCCC1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000040091054 213262982 /nfs/dbraw/zinc/26/29/82/213262982.db2.gz RQSDGRPOIHYRPU-UHFFFAOYSA-N 0 3 325.796 2.854 20 5 EFBDHN Cc1c([C@H](C)NCCC(=O)Nc2cc([N+](=O)[O-])ccc2C)cnn1C ZINC000183391195 235045284 /nfs/dbraw/zinc/04/52/84/235045284.db2.gz BJXPFPOILPHMRH-LBPRGKRZSA-N 0 3 345.403 2.625 20 5 EFBDHN CN(C)C1(CN(C)C(=O)c2cc([N+](=O)[O-])ccc2Cl)CCC1 ZINC000187888767 236327327 /nfs/dbraw/zinc/32/73/27/236327327.db2.gz QFXALHAGSLHZIU-UHFFFAOYSA-N 0 3 325.796 2.805 20 5 EFBDHN CCC1(CC)[C@H](NCc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@@H](C)[C@H]1OC ZINC000248846358 545604814 /nfs/dbraw/zinc/60/48/14/545604814.db2.gz RXQLDXFTSITLAM-HFBAOOFYSA-N 0 3 349.431 2.623 20 5 EFBDHN CN1[C@@H]2CC[C@H]1CCN(C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000072930017 216328128 /nfs/dbraw/zinc/32/81/28/216328128.db2.gz FMURITSTZHEMRZ-CMPLNLGQSA-N 0 3 338.795 2.949 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CC[C@@H](OCCCc3ccccc3)C2)c1 ZINC000175959246 239293066 /nfs/dbraw/zinc/29/30/66/239293066.db2.gz SFDQXDMQRBKILK-GOSISDBHSA-N 0 3 344.415 2.515 20 5 EFBDHN O=C(CN1C[C@@H]2CCCC[C@@H]2C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000177535283 239379905 /nfs/dbraw/zinc/37/99/05/239379905.db2.gz XVUQZJLFZLYPDW-GASCZTMLSA-N 0 3 329.400 2.606 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN[C@@H]2CCO[C@@H]2c2ccc(Cl)cc2)c1 ZINC000192043576 239463172 /nfs/dbraw/zinc/46/31/72/239463172.db2.gz OXNJEBQKGQDMGL-HUUCEWRRSA-N 0 3 336.779 2.565 20 5 EFBDHN C[C@H]1[C@H](N2CCCC2)CCN1C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000376486116 291306182 /nfs/dbraw/zinc/30/61/82/291306182.db2.gz GVEWLDUNSYLIMN-SMDDNHRTSA-N 0 3 337.807 2.947 20 5 EFBDHN O=C(C1CCN(C2CC2)CC1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000192748605 239863835 /nfs/dbraw/zinc/86/38/35/239863835.db2.gz GECSIWUMCWFWKR-UHFFFAOYSA-N 0 3 343.427 2.960 20 5 EFBDHN CCOCCCN1CC[C@@H](Nc2ncc([N+](=O)[O-])s2)[C@H](C)C1 ZINC000192456753 240048067 /nfs/dbraw/zinc/04/80/67/240048067.db2.gz VGJHCGRPPOYSDY-VXGBXAGGSA-N 0 3 328.438 2.600 20 5 EFBDHN COc1cccc(CN(CCN(C)C)c2ncc([N+](=O)[O-])s2)c1 ZINC000192550256 240050708 /nfs/dbraw/zinc/05/07/08/240050708.db2.gz QKBXXADJVARJQZ-UHFFFAOYSA-N 0 3 336.417 2.628 20 5 EFBDHN C[C@H](N[C@@H]1CC(C)(C)OC1(C)C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000132623839 223348639 /nfs/dbraw/zinc/34/86/39/223348639.db2.gz UMUKNXALUVFCQT-SMDDNHRTSA-N 0 3 335.404 2.858 20 5 EFBDHN CCC[C@]1(COC)CCCN1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000194942253 240191104 /nfs/dbraw/zinc/19/11/04/240191104.db2.gz VSKCMBKQCLRIFG-GOSISDBHSA-N 0 3 349.431 2.839 20 5 EFBDHN C[C@@H]1CCNC(=O)[C@@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000193700803 240273152 /nfs/dbraw/zinc/27/31/52/240273152.db2.gz KVRMFXVSDWSICS-BDJLRTHQSA-N 0 3 345.424 2.938 20 5 EFBDHN C[C@H](N[C@@H]1CC(C)(C)OC1(C)C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000132660824 223352167 /nfs/dbraw/zinc/35/21/67/223352167.db2.gz USJKBZWJNDJQDH-SMDDNHRTSA-N 0 3 335.404 2.858 20 5 EFBDHN CCN1CCC(Nc2c(Br)cncc2[N+](=O)[O-])CC1 ZINC000231628788 242269674 /nfs/dbraw/zinc/26/96/74/242269674.db2.gz RSLICFYEPGXWKJ-UHFFFAOYSA-N 0 3 329.198 2.649 20 5 EFBDHN Cc1n[nH]c([C@H]2CCN(Cc3cc([N+](=O)[O-])ccc3OC(C)C)C2)n1 ZINC000412032727 243081090 /nfs/dbraw/zinc/08/10/90/243081090.db2.gz REGDSTFKIQDPJD-ZDUSSCGKSA-N 0 3 345.403 2.798 20 5 EFBDHN Cc1nc([C@H]2CCN(Cc3cc([N+](=O)[O-])ccc3OC(C)C)C2)n[nH]1 ZINC000412032727 243081099 /nfs/dbraw/zinc/08/10/99/243081099.db2.gz REGDSTFKIQDPJD-ZDUSSCGKSA-N 0 3 345.403 2.798 20 5 EFBDHN Cc1nnc([C@H]2CCN(Cc3cc([N+](=O)[O-])ccc3OC(C)C)C2)[nH]1 ZINC000412032727 243081105 /nfs/dbraw/zinc/08/11/05/243081105.db2.gz REGDSTFKIQDPJD-ZDUSSCGKSA-N 0 3 345.403 2.798 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N(C)[C@H]2CCN(C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000246149373 243202300 /nfs/dbraw/zinc/20/23/00/243202300.db2.gz CSZIHUSJHDUTTI-YCPHGPKFSA-N 0 3 348.447 2.946 20 5 EFBDHN CN1CCCC(C)(C)[C@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412312894 243260980 /nfs/dbraw/zinc/26/09/80/243260980.db2.gz VJRQSGMCUJITQK-GVDBMIGSSA-N 0 3 345.443 2.935 20 5 EFBDHN CC[C@@H]1CN2CCC[C@H]2CN1C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000246945494 243339112 /nfs/dbraw/zinc/33/91/12/243339112.db2.gz LEMLGTMEMBIFQU-HIFRSBDPSA-N 0 3 349.456 2.772 20 5 EFBDHN C[C@H](CNC(=O)c1cc(F)ccc1[N+](=O)[O-])N(C)Cc1ccccc1 ZINC000110348703 220031261 /nfs/dbraw/zinc/03/12/61/220031261.db2.gz DOUPDCHHZTYEIR-CYBMUJFWSA-N 0 3 345.374 2.984 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@@H]1CCN(C2CCCC2)C1 ZINC000421766412 246105672 /nfs/dbraw/zinc/10/56/72/246105672.db2.gz FCMLHMMXRPOHRN-CQSZACIVSA-N 0 3 331.416 2.958 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](N2CCCC2)C1 ZINC000421765878 246106593 /nfs/dbraw/zinc/10/65/93/246106593.db2.gz AUGBTBMIZRFLAA-OAHLLOKOSA-N 0 3 331.416 2.912 20 5 EFBDHN CCN(CCCN1CCCC1)c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000425257134 247019037 /nfs/dbraw/zinc/01/90/37/247019037.db2.gz QICFLGILPDKZGD-UHFFFAOYSA-N 0 3 345.403 2.957 20 5 EFBDHN COCC(C)(C)N1CCN(c2ccc([N+](=O)[O-])c3ncccc23)CC1 ZINC000425273089 247024377 /nfs/dbraw/zinc/02/43/77/247024377.db2.gz ASOSIFCSOSATEU-UHFFFAOYSA-N 0 3 344.415 2.690 20 5 EFBDHN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CCC[C@H]2CN(C)C[C@H]21 ZINC000425656980 247159380 /nfs/dbraw/zinc/15/93/80/247159380.db2.gz AKIAATOHSPZUPZ-XJKSGUPXSA-N 0 3 332.404 2.770 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CCC[C@H]2CN(C)C[C@H]21 ZINC000425664766 247162330 /nfs/dbraw/zinc/16/23/30/247162330.db2.gz UVSLNIMAMFQBAR-DZGCQCFKSA-N 0 3 332.404 2.770 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N2CCC[C@H]3CN(C)C[C@H]32)cc1[N+](=O)[O-] ZINC000425694689 247170563 /nfs/dbraw/zinc/17/05/63/247170563.db2.gz XJVXOYMOQLKZPX-JLJPHGGASA-N 0 3 346.431 2.700 20 5 EFBDHN CCc1nc(C)c(CN[C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)o1 ZINC000426321364 247261069 /nfs/dbraw/zinc/26/10/69/247261069.db2.gz CHXAOAVRXOEYEK-CHWSQXEVSA-N 0 3 333.392 2.924 20 5 EFBDHN CN(C[C@@H]1CCCN(C)C1)C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000265259966 247348313 /nfs/dbraw/zinc/34/83/13/247348313.db2.gz DKOMXZLRLUUAPY-OAHLLOKOSA-N 0 3 348.447 2.587 20 5 EFBDHN CCCN(C)CC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000427601149 247369567 /nfs/dbraw/zinc/36/95/67/247369567.db2.gz KBRCGKQJHAHQHJ-UHFFFAOYSA-N 0 3 333.310 2.572 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCN1CCC[C@H](c2ccccc2)C1 ZINC000433075365 248012583 /nfs/dbraw/zinc/01/25/83/248012583.db2.gz HASFOGPFKFEXCX-INIZCTEOSA-N 0 3 327.384 2.636 20 5 EFBDHN O=C1CCC[C@@H](CNCc2ccc(-c3ccccc3[N+](=O)[O-])o2)N1 ZINC000433202767 248028010 /nfs/dbraw/zinc/02/80/10/248028010.db2.gz TZLNHYSFJYATTB-LBPRGKRZSA-N 0 3 329.356 2.613 20 5 EFBDHN Cc1c(NC(=O)[C@H](C)N[C@@H]2[C@H]3CCO[C@H]3C2(C)C)cccc1[N+](=O)[O-] ZINC000266012233 248028323 /nfs/dbraw/zinc/02/83/23/248028323.db2.gz QCHXVEKBGPNILM-UAXWRAGISA-N 0 3 347.415 2.633 20 5 EFBDHN COCCN(Cc1ccc(OC)c([N+](=O)[O-])c1)[C@H]1CCCSC1 ZINC000433203224 248028585 /nfs/dbraw/zinc/02/85/85/248028585.db2.gz WQLZGSCNORDSHF-AWEZNQCLSA-N 0 3 340.445 2.947 20 5 EFBDHN O=[N+]([O-])c1ccc2nc(NC[C@H]3CCCCN3C3CC3)ccc2c1 ZINC000433812257 248092215 /nfs/dbraw/zinc/09/22/15/248092215.db2.gz VGNBXSJGFKBJHC-MRXNPFEDSA-N 0 3 326.400 2.994 20 5 EFBDHN COc1cc(CN[C@@H](CCO)C(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000266124345 248114469 /nfs/dbraw/zinc/11/44/69/248114469.db2.gz BCCYXKAQBRIVLZ-NSHDSACASA-N 0 3 348.346 2.701 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000091892569 218084067 /nfs/dbraw/zinc/08/40/67/218084067.db2.gz FZCRESZFYNPURO-CABCVRRESA-N 0 3 349.431 2.671 20 5 EFBDHN Cc1cc(C(=O)NC[C@@H](c2ccccc2)N(C)C)ccc1[N+](=O)[O-] ZINC000010017724 211141549 /nfs/dbraw/zinc/14/15/49/211141549.db2.gz AZPYIKMDHISLPJ-KRWDZBQOSA-N 0 3 327.384 2.936 20 5 EFBDHN COC1CCN(C2(CNc3ncc([N+](=O)[O-])s3)CCCC2)CC1 ZINC000443516501 250203676 /nfs/dbraw/zinc/20/36/76/250203676.db2.gz NLWVRMRQGWDNQJ-UHFFFAOYSA-N 0 3 340.449 2.887 20 5 EFBDHN CC(C)(C(=O)NCc1ccc2c(c1)CNC2)c1ccc([N+](=O)[O-])cc1 ZINC000444261827 250278701 /nfs/dbraw/zinc/27/87/01/250278701.db2.gz STYWTOVAFGDCHA-UHFFFAOYSA-N 0 3 339.395 2.792 20 5 EFBDHN CCN(C)CCNC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000444033535 250251741 /nfs/dbraw/zinc/25/17/41/250251741.db2.gz SOLARVXSNVZKPT-UHFFFAOYSA-N 0 3 341.386 2.502 20 5 EFBDHN CCOC[C@@H]1CCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000093838638 218252510 /nfs/dbraw/zinc/25/25/10/218252510.db2.gz BJFNISSMWOZBMT-CQSZACIVSA-N 0 3 344.415 2.854 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCCN1CCC[C@H](C)C1 ZINC000093970200 218258119 /nfs/dbraw/zinc/25/81/19/218258119.db2.gz BLSAOUPVQJQDGS-LBPRGKRZSA-N 0 3 333.432 2.982 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@]2(CCO)CCOC2)s1 ZINC000447065342 250538663 /nfs/dbraw/zinc/53/86/63/250538663.db2.gz HEGDDXSCFSPFGA-KRWDZBQOSA-N 0 3 348.424 2.954 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N[C@@H](C)C(=O)NCc1ccccc1 ZINC000449088761 250910520 /nfs/dbraw/zinc/91/05/20/250910520.db2.gz CCNAWZOASCJRME-GJZGRUSLSA-N 0 3 341.411 2.820 20 5 EFBDHN Cc1cc(CN[C@H](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2)ccn1 ZINC000449404292 251015117 /nfs/dbraw/zinc/01/51/17/251015117.db2.gz UHBKUZOQFDYKHY-CYBMUJFWSA-N 0 3 328.372 2.805 20 5 EFBDHN COC(=O)COc1ccc(CN2C[C@@H]3CCCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000449504795 251047280 /nfs/dbraw/zinc/04/72/80/251047280.db2.gz WCCKBRFBBDTENG-GASCZTMLSA-N 0 3 348.399 2.769 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000267481243 251097772 /nfs/dbraw/zinc/09/77/72/251097772.db2.gz VASBKSBCXZZFRZ-HIFRSBDPSA-N 0 3 342.399 2.563 20 5 EFBDHN CCn1cc([C@H](C)N[C@H](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2)cn1 ZINC000449676449 251112945 /nfs/dbraw/zinc/11/29/45/251112945.db2.gz HEPQQDMIXGJAJF-OLZOCXBDSA-N 0 3 345.403 2.879 20 5 EFBDHN CCn1cc([C@@H](C)N[C@H](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2)cn1 ZINC000449676448 251113777 /nfs/dbraw/zinc/11/37/77/251113777.db2.gz HEPQQDMIXGJAJF-CHWSQXEVSA-N 0 3 345.403 2.879 20 5 EFBDHN CC[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C(=O)NC ZINC000449782746 251155082 /nfs/dbraw/zinc/15/50/82/251155082.db2.gz YWOBTDXFXBHPBF-AWEZNQCLSA-N 0 3 333.413 2.938 20 5 EFBDHN COC(=O)Cc1ccc(N[C@@H](C)CN2CCCCC2)c([N+](=O)[O-])c1 ZINC000450250600 251315721 /nfs/dbraw/zinc/31/57/21/251315721.db2.gz LVMQAKBRHNDWDO-ZDUSSCGKSA-N 0 3 335.404 2.597 20 5 EFBDHN CCN1CCN([C@@H](C)CNc2nccc3c2cccc3[N+](=O)[O-])CC1 ZINC000450255397 251317125 /nfs/dbraw/zinc/31/71/25/251317125.db2.gz BKWFNMIAJNYGFU-AWEZNQCLSA-N 0 3 343.431 2.581 20 5 EFBDHN CCc1ccc([C@@H](CNc2ncc([N+](=O)[O-])c(C)n2)N(C)C)cc1 ZINC000450215849 251300969 /nfs/dbraw/zinc/30/09/69/251300969.db2.gz ONFQEJBDRGQZKF-MRXNPFEDSA-N 0 3 329.404 2.970 20 5 EFBDHN CN(C)[C@@]1(CNc2nccc3c2cccc3[N+](=O)[O-])CCSC1 ZINC000450361645 251360207 /nfs/dbraw/zinc/36/02/07/251360207.db2.gz DEIUEFRJBPMPNJ-MRXNPFEDSA-N 0 3 332.429 2.992 20 5 EFBDHN CCOC(=O)[C@@H]1CCCC[C@@H]1NCc1ccc([N+](=O)[O-])cc1OC ZINC000451601003 251621055 /nfs/dbraw/zinc/62/10/55/251621055.db2.gz SXTYEPNNDAJYAH-CABCVRRESA-N 0 3 336.388 2.815 20 5 EFBDHN C[C@H](CCc1ccccc1[N+](=O)[O-])N[C@H]1C[C@@H]2CCCCN2C1=O ZINC000453452447 252040817 /nfs/dbraw/zinc/04/08/17/252040817.db2.gz SGXWNFHEOIVZDG-KBMXLJTQSA-N 0 3 331.416 2.659 20 5 EFBDHN Cc1ccc([C@H](C)NC[C@@H](O)COc2ccccc2)cc1[N+](=O)[O-] ZINC000268737702 252187256 /nfs/dbraw/zinc/18/72/56/252187256.db2.gz CASIDSQHRNNRJW-GOEBONIOSA-N 0 3 330.384 2.994 20 5 EFBDHN CN(Cc1ccccc1)C1(CNC(=O)c2cc([N+](=O)[O-])c[nH]2)CCC1 ZINC000454311503 252209663 /nfs/dbraw/zinc/20/96/63/252209663.db2.gz UXCQGEWQAIKHFC-UHFFFAOYSA-N 0 3 342.399 2.707 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(NCC2(N3CCCCC3)CCOCC2)n1 ZINC000268837201 252286212 /nfs/dbraw/zinc/28/62/12/252286212.db2.gz UVZLWWIRCUSBOS-UHFFFAOYSA-N 0 3 334.420 2.745 20 5 EFBDHN Cc1cccc(OC[C@H](O)CN[C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000268853581 252301198 /nfs/dbraw/zinc/30/11/98/252301198.db2.gz QIBKITBDHMNJSG-RHSMWYFYSA-N 0 3 330.384 2.994 20 5 EFBDHN COc1cc(OC)cc([C@H](O)CN[C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000131057726 533086367 /nfs/dbraw/zinc/08/63/67/533086367.db2.gz VFSAHLYBZYYSCW-KZULUSFZSA-N 0 3 346.383 2.996 20 5 EFBDHN COc1ccc([C@@H](NCCn2cc([N+](=O)[O-])ccc2=O)C2CC2)cc1 ZINC000179686881 533132362 /nfs/dbraw/zinc/13/23/62/533132362.db2.gz MDSLIJUIZINCQC-SFHVURJKSA-N 0 3 343.383 2.506 20 5 EFBDHN COc1cc(CNC(C)(C)CN(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000459541235 255894647 /nfs/dbraw/zinc/89/46/47/255894647.db2.gz STKQJMKSICQVQT-UHFFFAOYSA-N 0 3 347.362 2.635 20 5 EFBDHN C[C@H](CN(C)CCOc1ccccc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000459786122 255932568 /nfs/dbraw/zinc/93/25/68/255932568.db2.gz BDHBPUVHZJPULA-CYBMUJFWSA-N 0 3 338.404 2.883 20 5 EFBDHN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NC1CCN(C2CC2)CC1 ZINC000117748521 221085139 /nfs/dbraw/zinc/08/51/39/221085139.db2.gz UCXDLWFRCLNAPK-UHFFFAOYSA-N 0 3 337.807 2.534 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CNC[C@H]1CN(CC(C)C)CCO1 ZINC000468650443 256017726 /nfs/dbraw/zinc/01/77/26/256017726.db2.gz HFHHBGKEWBBMSE-QHVUTBCBSA-N 0 3 347.459 2.945 20 5 EFBDHN O=C(Cc1cccc([N+](=O)[O-])c1)N1CCN(C2CCCCC2)CC1 ZINC000154737917 224297758 /nfs/dbraw/zinc/29/77/58/224297758.db2.gz OHSCYJCUOZZCCQ-UHFFFAOYSA-N 0 3 331.416 2.614 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@@H]1CC(C)(C)OC1(C)C ZINC000119661999 221369792 /nfs/dbraw/zinc/36/97/92/221369792.db2.gz HYARGTVJWLCQSJ-CQSZACIVSA-N 0 3 335.404 2.777 20 5 EFBDHN CC1(C)C[C@@H](N[C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C(C)(C)O1 ZINC000119720156 221385543 /nfs/dbraw/zinc/38/55/43/221385543.db2.gz WKDFMEQZANSQDJ-HUUCEWRRSA-N 0 3 347.415 2.636 20 5 EFBDHN C[C@@H](NCc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000181520158 533444082 /nfs/dbraw/zinc/44/40/82/533444082.db2.gz IBHOGRJEPLPEIC-CHWSQXEVSA-N 0 3 327.384 2.976 20 5 EFBDHN C[C@@H](N[C@@H]1CC(C)(C)OC1(C)C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000132661031 533517315 /nfs/dbraw/zinc/51/73/15/533517315.db2.gz USJKBZWJNDJQDH-BXUZGUMPSA-N 0 3 335.404 2.858 20 5 EFBDHN C[C@@H]1C[C@@H](Nc2ncc(Br)cc2[N+](=O)[O-])CN1C1CC1 ZINC000131310136 533664245 /nfs/dbraw/zinc/66/42/45/533664245.db2.gz JUBZCYXPDBBQOE-PSASIEDQSA-N 0 3 341.209 2.789 20 5 EFBDHN CCn1ccnc1[C@@H]1OCC[C@@H]1NC/C=C\c1ccccc1[N+](=O)[O-] ZINC000343409025 141992189 /nfs/dbraw/zinc/99/21/89/141992189.db2.gz ZSNHXVJGPMBQHY-NKHHLTQSSA-N 0 3 342.399 2.944 20 5 EFBDHN CN1CCCC(C)(C)[C@@H]1CNC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000344639544 142053525 /nfs/dbraw/zinc/05/35/25/142053525.db2.gz GSDWCKQRNZQQLW-INIZCTEOSA-N 0 3 333.432 2.764 20 5 EFBDHN Cc1c(CC(=O)NC[C@@H]2N(C)CCCC2(C)C)cccc1[N+](=O)[O-] ZINC000344678391 142059921 /nfs/dbraw/zinc/05/99/21/142059921.db2.gz XCLGITBXSJQWJR-INIZCTEOSA-N 0 3 333.432 2.682 20 5 EFBDHN COc1ccc(-c2ccc(CNC[C@@H](C)CCO)o2)c([N+](=O)[O-])c1 ZINC000344723158 142067903 /nfs/dbraw/zinc/06/79/03/142067903.db2.gz KAKKWTMBLODDQH-LBPRGKRZSA-N 0 3 334.372 2.972 20 5 EFBDHN Cc1ccc(C(=O)N2CCN([C@@H]3C[C@H]3C)C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000346135962 142152496 /nfs/dbraw/zinc/15/24/96/142152496.db2.gz LHRPWAKAVMLNLV-XNRPHZJLSA-N 0 3 331.416 2.706 20 5 EFBDHN C[C@H]1C[C@@H]1N1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000346152986 142156015 /nfs/dbraw/zinc/15/60/15/142156015.db2.gz FKUFKWURNFBULZ-MKBNYLNASA-N 0 3 335.379 2.536 20 5 EFBDHN Cc1cccc(C(=O)N2CCN([C@@H]3C[C@H]3C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000346160228 142158008 /nfs/dbraw/zinc/15/80/08/142158008.db2.gz FEOFWTABEPXWCJ-JGGQBBKZSA-N 0 3 331.416 2.706 20 5 EFBDHN Cc1c(CC(=O)N2CCN([C@@H]3C[C@H]3C)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000346221974 142170634 /nfs/dbraw/zinc/17/06/34/142170634.db2.gz LAHPAPOOLPLSSH-HBUWYVDXSA-N 0 3 345.443 2.634 20 5 EFBDHN Cc1cc(C(=O)N2CCN([C@@H]3C[C@H]3C)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000346286916 142183419 /nfs/dbraw/zinc/18/34/19/142183419.db2.gz ZROPILYNSRJDQR-DXCKQFNASA-N 0 3 331.416 2.706 20 5 EFBDHN CN(CCn1ccc([N+](=O)[O-])n1)[C@H]1C[C@@H](Oc2ccccc2)C1(C)C ZINC000347484601 142224300 /nfs/dbraw/zinc/22/43/00/142224300.db2.gz WNXXWZVGWLFOBA-JKSUJKDBSA-N 0 3 344.415 2.969 20 5 EFBDHN COCC[C@H](NCCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000347926455 142294422 /nfs/dbraw/zinc/29/44/22/142294422.db2.gz HMPNFYXFDXOWRI-HNNXBMFYSA-N 0 3 347.371 2.884 20 5 EFBDHN CC(C)N1CCCN(C(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000347931970 142295351 /nfs/dbraw/zinc/29/53/51/142295351.db2.gz CVWJVFHOGIMRTB-CYBMUJFWSA-N 0 3 337.395 2.780 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)CCN1C ZINC000341166984 145004920 /nfs/dbraw/zinc/00/49/20/145004920.db2.gz OEDYRMUFYHRYBM-GOEBONIOSA-N 0 3 348.447 2.699 20 5 EFBDHN C[C@@H]1C[C@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CCN1C ZINC000341194623 145010304 /nfs/dbraw/zinc/01/03/04/145010304.db2.gz HULKDMDYXIXDRB-NXEZZACHSA-N 0 3 326.784 2.852 20 5 EFBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCN(C)[C@H](C)C1 ZINC000341205068 145012352 /nfs/dbraw/zinc/01/23/52/145012352.db2.gz QKRJYXHMLNRHEQ-GDBMZVCRSA-N 0 3 348.447 2.998 20 5 EFBDHN Cc1ccsc1CN(C)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000342345835 145105305 /nfs/dbraw/zinc/10/53/05/145105305.db2.gz PNYNMSPQIKTLDJ-ZDUSSCGKSA-N 0 3 336.413 2.836 20 5 EFBDHN C[C@@H]1CCCC[C@H]1CNCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000342350432 145106605 /nfs/dbraw/zinc/10/66/05/145106605.db2.gz YGTAXCXHLQLMBE-KGLIPLIRSA-N 0 3 340.445 2.784 20 5 EFBDHN C[C@@H](CN(C)Cc1ccccc1)NC(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000342422192 145122396 /nfs/dbraw/zinc/12/23/96/145122396.db2.gz CEQOZTAGINHTBT-ZDUSSCGKSA-N 0 3 345.374 2.984 20 5 EFBDHN CCCN(CCN1CCCCC1)C(=O)COc1cccc([N+](=O)[O-])c1 ZINC000342793300 145194472 /nfs/dbraw/zinc/19/44/72/145194472.db2.gz HYYOHWJYFASOLP-UHFFFAOYSA-N 0 3 349.431 2.698 20 5 EFBDHN Cc1cc(N[C@H]2CCCN(C)[C@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000343598875 145248568 /nfs/dbraw/zinc/24/85/68/145248568.db2.gz IHSTUYFIEBLRFR-BBRMVZONSA-N 0 3 341.415 2.677 20 5 EFBDHN CCCN1CCC[C@@H]1CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000343609693 145251016 /nfs/dbraw/zinc/25/10/16/145251016.db2.gz OIPPPCWVBVJPQP-LLVKDONJSA-N 0 3 325.796 2.852 20 5 EFBDHN CCCN1CCC[C@@H]1CNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000343631409 145257395 /nfs/dbraw/zinc/25/73/95/145257395.db2.gz BJAUPPIGBHMSQS-CQSZACIVSA-N 0 3 331.372 2.945 20 5 EFBDHN CCCN1CCC[C@@H]1CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000343641148 145259834 /nfs/dbraw/zinc/25/98/34/145259834.db2.gz NYRLFXIZYPFBDX-CYBMUJFWSA-N 0 3 330.388 2.680 20 5 EFBDHN CNC(=O)CCNCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000343856806 145310188 /nfs/dbraw/zinc/31/01/88/145310188.db2.gz UYCQQOULKVQLOF-UHFFFAOYSA-N 0 3 347.346 2.752 20 5 EFBDHN C[C@H](NCc1ccncc1OCCN(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000343917706 145324060 /nfs/dbraw/zinc/32/40/60/145324060.db2.gz BDYUUOHEYQUHEL-AWEZNQCLSA-N 0 3 344.415 2.781 20 5 EFBDHN CCO[C@H]1C[C@@H](NCC(=O)Nc2ccccc2[N+](=O)[O-])C12CCCC2 ZINC000344097116 145367560 /nfs/dbraw/zinc/36/75/60/145367560.db2.gz IETRKMULAPPULE-CVEARBPZSA-N 0 3 347.415 2.861 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@@H]1C1CCOCC1 ZINC000348919962 146024263 /nfs/dbraw/zinc/02/42/63/146024263.db2.gz NUVQDKBMWWKHHC-QGZVFWFLSA-N 0 3 347.415 2.733 20 5 EFBDHN COCCN(CCN(C)C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000349295857 146075952 /nfs/dbraw/zinc/07/59/52/146075952.db2.gz KNOWTXPGFBRBMS-UHFFFAOYSA-N 0 3 347.415 2.865 20 5 EFBDHN COc1ccc(CN(CCN(C)C)Cc2ccccn2)cc1[N+](=O)[O-] ZINC000349299211 146076818 /nfs/dbraw/zinc/07/68/18/146076818.db2.gz QBXUFUIOJSQYBM-UHFFFAOYSA-N 0 3 344.415 2.562 20 5 EFBDHN COc1cc(NC[C@@]2(N(C)C)CCSC2)c(F)cc1[N+](=O)[O-] ZINC000351477982 146126657 /nfs/dbraw/zinc/12/66/57/146126657.db2.gz BBUSLNVEGBVCBQ-AWEZNQCLSA-N 0 3 329.397 2.592 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CN2CC[C@H]2Cc2ccccc2)c1 ZINC000353039792 146382812 /nfs/dbraw/zinc/38/28/12/146382812.db2.gz LTMYRDKCSKGHEH-FUHWJXTLSA-N 0 3 342.395 2.652 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CN2CC[C@@H]2Cc2ccccc2)c1 ZINC000353039791 146382832 /nfs/dbraw/zinc/38/28/32/146382832.db2.gz LTMYRDKCSKGHEH-AEFFLSMTSA-N 0 3 342.395 2.652 20 5 EFBDHN COC(=O)COc1ccc(CN2CCC[C@H](C)[C@H]2C)cc1[N+](=O)[O-] ZINC000355765152 147056768 /nfs/dbraw/zinc/05/67/68/147056768.db2.gz YBPPSHRZJQPICH-QWHCGFSZSA-N 0 3 336.388 2.767 20 5 EFBDHN COC(=O)COc1ccc(CN2CC[C@@H](C)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000355779257 147060740 /nfs/dbraw/zinc/06/07/40/147060740.db2.gz ZHEQXECWSDHUHY-CHWSQXEVSA-N 0 3 336.388 2.625 20 5 EFBDHN C[C@H](C(=O)N1CC[C@@]2(C1)CCCN(C)C2)c1ccc([N+](=O)[O-])cc1F ZINC000356295679 147204294 /nfs/dbraw/zinc/20/42/94/147204294.db2.gz UXAXNLNJYYYFHY-UGSOOPFHSA-N 0 3 349.406 2.782 20 5 EFBDHN C[C@H](C(=O)N1CC[C@]2(C1)CCCN(C)C2)c1ccc([N+](=O)[O-])cc1F ZINC000356295678 147204542 /nfs/dbraw/zinc/20/45/42/147204542.db2.gz UXAXNLNJYYYFHY-SCLBCKFNSA-N 0 3 349.406 2.782 20 5 EFBDHN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCN(C)CC ZINC000356572756 147280203 /nfs/dbraw/zinc/28/02/03/147280203.db2.gz GIPRZGUKDZMALL-UHFFFAOYSA-N 0 3 325.434 2.778 20 5 EFBDHN Cc1c(CNC(=O)N2CC[C@H](N3CCCCC3)C2)cccc1[N+](=O)[O-] ZINC000359546351 148117669 /nfs/dbraw/zinc/11/76/69/148117669.db2.gz LBIUQAXBLICXKX-INIZCTEOSA-N 0 3 346.431 2.673 20 5 EFBDHN Cc1c(CNC(=O)N2CC[C@@H](N3CCCCC3)C2)cccc1[N+](=O)[O-] ZINC000359546352 148117950 /nfs/dbraw/zinc/11/79/50/148117950.db2.gz LBIUQAXBLICXKX-MRXNPFEDSA-N 0 3 346.431 2.673 20 5 EFBDHN C[C@@H](C(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1)N1[C@H](C)CC[C@H]1C ZINC000359628198 148143760 /nfs/dbraw/zinc/14/37/60/148143760.db2.gz ZHKIGKWWAPPYPY-MCIONIFRSA-N 0 3 347.415 2.577 20 5 EFBDHN CO[C@@]1(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCOC1 ZINC000359643736 148148964 /nfs/dbraw/zinc/14/89/64/148148964.db2.gz DROUZRHFMIZKMB-QGZVFWFLSA-N 0 3 332.356 2.750 20 5 EFBDHN Cc1cc(NCc2ccncc2OCCN(C)C)c(F)cc1[N+](=O)[O-] ZINC000359969711 148238486 /nfs/dbraw/zinc/23/84/86/148238486.db2.gz WJWWITJINKKAAY-UHFFFAOYSA-N 0 3 348.378 2.990 20 5 EFBDHN Cc1cc(OCC(=O)NC[C@@H](C)N2CCCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000360229260 148305365 /nfs/dbraw/zinc/30/53/65/148305365.db2.gz ZYWXFIUHLUUBHN-LSDHHAIUSA-N 0 3 349.431 2.661 20 5 EFBDHN Cc1cc(NC[C@@H]2CN3CCC[C@@H]3CO2)c2cccc([N+](=O)[O-])c2n1 ZINC000364031901 149051475 /nfs/dbraw/zinc/05/14/75/149051475.db2.gz CMIOYAUELJDUMG-ZIAGYGMSSA-N 0 3 342.399 2.727 20 5 EFBDHN COc1cc(C[NH2+]CC2(c3ccccn3)CCC2)c([N+](=O)[O-])cc1[O-] ZINC000367596956 149910783 /nfs/dbraw/zinc/91/07/83/149910783.db2.gz KPQOHSRHUYFSLR-UHFFFAOYSA-N 0 3 343.383 2.916 20 5 EFBDHN COc1c(C(=O)NC[C@H](c2ccccc2)N(C)C)cccc1[N+](=O)[O-] ZINC000353587055 286177596 /nfs/dbraw/zinc/17/75/96/286177596.db2.gz AZCVIXVGIZMNSR-MRXNPFEDSA-N 0 3 343.383 2.636 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CCC(c3ccc(F)c(F)c3)CC2)n1 ZINC000372711175 151050191 /nfs/dbraw/zinc/05/01/91/151050191.db2.gz BQIRSEUGGDYFLU-UHFFFAOYSA-N 0 3 336.342 2.949 20 5 EFBDHN COc1ccc(CNC[C@@H]2CCCn3cc(C)nc32)cc1[N+](=O)[O-] ZINC000374146008 151291009 /nfs/dbraw/zinc/29/10/09/151291009.db2.gz VKDFGGGEYBIVQE-AWEZNQCLSA-N 0 3 330.388 2.776 20 5 EFBDHN Cc1ccc(CN2CCC[C@@H]2C[C@H](O)c2cnn(C)c2)cc1[N+](=O)[O-] ZINC000374256247 151309530 /nfs/dbraw/zinc/30/95/30/151309530.db2.gz NCLBMNPVWCGGTP-AEFFLSMTSA-N 0 3 344.415 2.725 20 5 EFBDHN Cc1ccc(CN2CCC[C@H]2C[C@H](O)c2cnn(C)c2)cc1[N+](=O)[O-] ZINC000374256250 151310287 /nfs/dbraw/zinc/31/02/87/151310287.db2.gz NCLBMNPVWCGGTP-WMZOPIPTSA-N 0 3 344.415 2.725 20 5 EFBDHN COc1cccc([C@H]2C[C@H](C)CN2CCn2cc([N+](=O)[O-])cn2)c1 ZINC000378641703 152134570 /nfs/dbraw/zinc/13/45/70/152134570.db2.gz DBXHPCBPHIXYPY-SUMWQHHRSA-N 0 3 330.388 2.883 20 5 EFBDHN C[C@@H](CN1CCCCC1)NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000152825980 286830724 /nfs/dbraw/zinc/83/07/24/286830724.db2.gz FZJMMWMPIPOAKT-ZDUSSCGKSA-N 0 3 344.415 2.609 20 5 EFBDHN COC(=O)N1CCC([C@H](C)NCc2csc([N+](=O)[O-])c2)CC1 ZINC000186354787 265063331 /nfs/dbraw/zinc/06/33/31/265063331.db2.gz WHRNSCYBNOUHCP-JTQLQIEISA-N 0 3 327.406 2.613 20 5 EFBDHN COC(=O)[C@](C)(CNCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000191577385 265270011 /nfs/dbraw/zinc/27/00/11/265270011.db2.gz FCGNJRLNGBKELS-GOSISDBHSA-N 0 3 328.368 2.815 20 5 EFBDHN CN(C)Cc1cccc(CNC(=O)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000054773328 272988433 /nfs/dbraw/zinc/98/84/33/272988433.db2.gz OIMYLTBTEHJWNB-UHFFFAOYSA-N 0 3 331.347 2.726 20 5 EFBDHN CCOc1ccc([C@H](C)NCCCc2nc(C)no2)cc1[N+](=O)[O-] ZINC000271419940 265971695 /nfs/dbraw/zinc/97/16/95/265971695.db2.gz BOCBHIQDKVWWTP-NSHDSACASA-N 0 3 334.376 2.968 20 5 EFBDHN C[C@@](O)(CN[C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)C(F)(F)F ZINC000271474825 265987124 /nfs/dbraw/zinc/98/71/24/265987124.db2.gz ITPPIWNPEWXCRG-GXTWGEPZSA-N 0 3 332.322 2.819 20 5 EFBDHN CC(C)N1C[C@H](N[C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1=O ZINC000271536610 266002806 /nfs/dbraw/zinc/00/28/06/266002806.db2.gz SRFVMRWAAOXEJT-HZPDHXFCSA-N 0 3 331.416 2.515 20 5 EFBDHN COc1cc(CNCC(C)(C)CCCO)c([N+](=O)[O-])cc1OC ZINC000271593585 266016134 /nfs/dbraw/zinc/01/61/34/266016134.db2.gz XLABTADCHWZDRE-UHFFFAOYSA-N 0 3 326.393 2.500 20 5 EFBDHN C[C@@H](CN(C)Cc1ccccc1)Nc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000271769295 266056694 /nfs/dbraw/zinc/05/66/94/266056694.db2.gz GATILJJJTOVLCG-ZDUSSCGKSA-N 0 3 342.399 2.626 20 5 EFBDHN CN1CC=C(CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1 ZINC000271900906 266090245 /nfs/dbraw/zinc/09/02/45/266090245.db2.gz PYSZWYDOBVIZMG-UHFFFAOYSA-N 0 3 343.305 2.605 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[C@H]2CCN(C)C[C@H]21 ZINC000272413096 266257480 /nfs/dbraw/zinc/25/74/80/266257480.db2.gz LDVACMUYANMAAF-UKRRQHHQSA-N 0 3 332.404 2.770 20 5 EFBDHN COc1ccc(NC(=O)NCCN2CCCCCC2)cc1[N+](=O)[O-] ZINC000272784535 266380820 /nfs/dbraw/zinc/38/08/20/266380820.db2.gz FNTDUIFRURHSLJ-UHFFFAOYSA-N 0 3 336.392 2.601 20 5 EFBDHN Cc1cc(NCCCN2CCOCC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000272832041 266393170 /nfs/dbraw/zinc/39/31/70/266393170.db2.gz LFLOJMHCJHCGEM-UHFFFAOYSA-N 0 3 330.388 2.586 20 5 EFBDHN CS[C@@H]1CN(c2ncc([N+](=O)[O-])cc2Cl)C[C@H]1N1CCCC1 ZINC000274681734 266690665 /nfs/dbraw/zinc/69/06/65/266690665.db2.gz OAMKQTYDAAENCB-CHWSQXEVSA-N 0 3 342.852 2.659 20 5 EFBDHN CN1CCC[C@H](CNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000108433673 273009748 /nfs/dbraw/zinc/00/97/48/273009748.db2.gz LPZHGMLYZYVWJU-SNVBAGLBSA-N 0 3 326.784 2.712 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@@H](C)C(=O)N(C)CC ZINC000276578809 267017340 /nfs/dbraw/zinc/01/73/40/267017340.db2.gz HVRDOHMLBKRGPR-QWHCGFSZSA-N 0 3 339.461 2.922 20 5 EFBDHN CCOc1cc(CN2CCC[C@@H](c3n[nH]c(C)n3)C2)ccc1[N+](=O)[O-] ZINC000276948774 267083234 /nfs/dbraw/zinc/08/32/34/267083234.db2.gz TYDHMNSVDJPCPU-CQSZACIVSA-N 0 3 345.403 2.800 20 5 EFBDHN CCOc1cc(CN2CCC[C@@H](c3nc(C)n[nH]3)C2)ccc1[N+](=O)[O-] ZINC000276948774 267083237 /nfs/dbraw/zinc/08/32/37/267083237.db2.gz TYDHMNSVDJPCPU-CQSZACIVSA-N 0 3 345.403 2.800 20 5 EFBDHN CCOc1cc(CN2CCC[C@@H](c3nnc(C)[nH]3)C2)ccc1[N+](=O)[O-] ZINC000276948774 267083239 /nfs/dbraw/zinc/08/32/39/267083239.db2.gz TYDHMNSVDJPCPU-CQSZACIVSA-N 0 3 345.403 2.800 20 5 EFBDHN COc1cc(C(=O)N2CC[C@H](N3CCCCC3)C2)cc([N+](=O)[O-])c1C ZINC000277221395 267131292 /nfs/dbraw/zinc/13/12/92/267131292.db2.gz IBPNNXBUXFZIHU-HNNXBMFYSA-N 0 3 347.415 2.612 20 5 EFBDHN COCc1cc([N+](=O)[O-])ccc1NCCCN1CCCO[C@@H](C)C1 ZINC000277458345 267183460 /nfs/dbraw/zinc/18/34/60/267183460.db2.gz KISAAYIXGBIWCQ-AWEZNQCLSA-N 0 3 337.420 2.654 20 5 EFBDHN O=C(NC[C@H]1CCCCN1C1CC1)Nc1ccc([N+](=O)[O-])cc1F ZINC000277484071 267185547 /nfs/dbraw/zinc/18/55/47/267185547.db2.gz MOXFZYKPYKPLCE-CYBMUJFWSA-N 0 3 336.367 2.872 20 5 EFBDHN O=[N+]([O-])c1ccc(CNC2CCN(c3cccnn3)CC2)c(Cl)c1 ZINC000277767958 267258495 /nfs/dbraw/zinc/25/84/95/267258495.db2.gz XTJSAHKNIUVGRK-UHFFFAOYSA-N 0 3 347.806 2.797 20 5 EFBDHN CCOC(=O)C1CCC(NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000278142835 267352012 /nfs/dbraw/zinc/35/20/12/267352012.db2.gz AFWCKPLTUCWHDN-UHFFFAOYSA-N 0 3 346.387 2.683 20 5 EFBDHN COCCCN1CCC(Nc2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC000269643269 273087181 /nfs/dbraw/zinc/08/71/81/273087181.db2.gz OJXVLASWZJIVLQ-UHFFFAOYSA-N 0 3 329.347 2.786 20 5 EFBDHN CCOc1ccc([C@H](C)NCCN(C)CCCOC)cc1[N+](=O)[O-] ZINC000271128506 273100173 /nfs/dbraw/zinc/10/01/73/273100173.db2.gz LFODWQYQZADPGF-AWEZNQCLSA-N 0 3 339.436 2.612 20 5 EFBDHN Cc1nn2c(nc(C)c2CNCCc2ccc([N+](=O)[O-])cc2)s1 ZINC000271236640 273102721 /nfs/dbraw/zinc/10/27/21/273102721.db2.gz SHRMUJPZQCFVRO-UHFFFAOYSA-N 0 3 331.401 2.648 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2CO)cc1 ZINC000271565195 273105335 /nfs/dbraw/zinc/10/53/35/273105335.db2.gz APAIDXOBNRDHGO-VQIMIIECSA-N 0 3 341.411 2.890 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@@H]2CCN(Cc3ccccc3)C[C@H]2CO)cc1 ZINC000271565192 273105348 /nfs/dbraw/zinc/10/53/48/273105348.db2.gz APAIDXOBNRDHGO-QFBILLFUSA-N 0 3 341.411 2.890 20 5 EFBDHN COCCN1CCC(Nc2cc(C)nc3ccc([N+](=O)[O-])cc32)CC1 ZINC000272899600 273114290 /nfs/dbraw/zinc/11/42/90/273114290.db2.gz ZPCOQGBTMVTZRV-UHFFFAOYSA-N 0 3 344.415 2.974 20 5 EFBDHN CC[C@H](C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N(C)C ZINC000279317623 273202118 /nfs/dbraw/zinc/20/21/18/273202118.db2.gz OIIMCIMSBRWBOK-GFCCVEGCSA-N 0 3 333.310 2.570 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000274269656 273128829 /nfs/dbraw/zinc/12/88/29/273128829.db2.gz MFWNGUULHUMXSO-CYBMUJFWSA-N 0 3 332.404 2.984 20 5 EFBDHN CCC(=O)N1CC[C@@H](N[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000279058424 273171714 /nfs/dbraw/zinc/17/17/14/273171714.db2.gz KPLYRTZNXIFBST-WBMJQRKESA-N 0 3 331.416 2.918 20 5 EFBDHN CC1(C)C[C@@H](NC[C@H](O)C2CCOCC2)c2cc([N+](=O)[O-])ccc21 ZINC000279212919 273189175 /nfs/dbraw/zinc/18/91/75/273189175.db2.gz YJVIOEBPJRVYAJ-SJORKVTESA-N 0 3 334.416 2.694 20 5 EFBDHN COc1ccc(OCCN2CCCC[C@H]2C[C@@H](C)O)c([N+](=O)[O-])c1 ZINC000279745588 273248797 /nfs/dbraw/zinc/24/87/97/273248797.db2.gz KXTDXXWWRKIKHT-KGLIPLIRSA-N 0 3 338.404 2.608 20 5 EFBDHN CC(C)N(CCN(C)C)C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000279856737 273261052 /nfs/dbraw/zinc/26/10/52/273261052.db2.gz PMNULNKUFMDQSR-UHFFFAOYSA-N 0 3 345.802 2.728 20 5 EFBDHN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])NCCN1CCCCC1 ZINC000280062629 273286397 /nfs/dbraw/zinc/28/63/97/273286397.db2.gz HCZNFYBIDFEUDH-UHFFFAOYSA-N 0 3 343.786 2.532 20 5 EFBDHN COC(=O)C[C@@H]1CC[C@@H](NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@H]1C ZINC000280604868 273346063 /nfs/dbraw/zinc/34/60/63/273346063.db2.gz OITDCCKTFNAGJW-GMXVVIOVSA-N 0 3 346.387 2.539 20 5 EFBDHN COC(=O)C[C@@H]1CC[C@@H](NCc2cc([N+](=O)[O-])ccc2OC)[C@H]1C ZINC000280769875 273364808 /nfs/dbraw/zinc/36/48/08/273364808.db2.gz FBCCCJJDSHGGRT-SLEUVZQESA-N 0 3 336.388 2.671 20 5 EFBDHN COC(=O)C[C@@H]1CC[C@H](NCc2cc([N+](=O)[O-])ccc2OC)[C@@H]1C ZINC000280769883 273364898 /nfs/dbraw/zinc/36/48/98/273364898.db2.gz FBCCCJJDSHGGRT-XUJVJEKNSA-N 0 3 336.388 2.671 20 5 EFBDHN COC[C@H](CO)N[C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000280935539 273383064 /nfs/dbraw/zinc/38/30/64/273383064.db2.gz IMBIKNBBUHFASJ-RYUDHWBXSA-N 0 3 336.413 2.981 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)CN2CCCCC2)c1 ZINC000283551508 273729431 /nfs/dbraw/zinc/72/94/31/273729431.db2.gz TZLPQEHOPHBSBO-CYBMUJFWSA-N 0 3 335.404 2.598 20 5 EFBDHN O=[N+]([O-])c1cc(CN2CCC3(CCOCC3)CC2)c2c(c1)COCO2 ZINC000283926278 273775748 /nfs/dbraw/zinc/77/57/48/273775748.db2.gz ARGLWYJGMJIIHT-UHFFFAOYSA-N 0 3 348.399 2.854 20 5 EFBDHN C[C@@H](N[C@H]1CCCN(C(=O)N2CCCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000285142080 273949172 /nfs/dbraw/zinc/94/91/72/273949172.db2.gz OSNVQJFRAFZTJX-ZBFHGGJFSA-N 0 3 346.431 2.926 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CNCCC3(O)CCOCC3)o2)cc1 ZINC000285420443 273996108 /nfs/dbraw/zinc/99/61/08/273996108.db2.gz GRSDXCYUYFWRQA-UHFFFAOYSA-N 0 3 346.383 2.876 20 5 EFBDHN CS(=O)(=O)C1(CNC/C=C/c2ccccc2[N+](=O)[O-])CCCC1 ZINC000285488837 274009975 /nfs/dbraw/zinc/00/99/75/274009975.db2.gz MELRAZRXHBQKJK-SOFGYWHQSA-N 0 3 338.429 2.555 20 5 EFBDHN COc1cc(C(=O)N2C[C@H](N3CCCC3)C[C@H]2C)cc([N+](=O)[O-])c1C ZINC000285792301 274076099 /nfs/dbraw/zinc/07/60/99/274076099.db2.gz MISZPRPAYYJAGS-IUODEOHRSA-N 0 3 347.415 2.611 20 5 EFBDHN COc1cc(C(=O)N2C[C@H](N3CCCC3)C[C@@H]2C)cc([N+](=O)[O-])c1C ZINC000285792304 274076118 /nfs/dbraw/zinc/07/61/18/274076118.db2.gz MISZPRPAYYJAGS-SWLSCSKDSA-N 0 3 347.415 2.611 20 5 EFBDHN CC(C)C[C@H](CNc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1)N(C)C ZINC000286099936 274133456 /nfs/dbraw/zinc/13/34/56/274133456.db2.gz LCGJWQIPGGYICR-GFCCVEGCSA-N 0 3 333.392 2.632 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1C[C@@H](N2CCOCC2)C[C@H]1C ZINC000286144397 274142274 /nfs/dbraw/zinc/14/22/74/274142274.db2.gz VQVHGFRAXOSANQ-VYDXJSESSA-N 0 3 333.432 2.759 20 5 EFBDHN CCS[C@@H]1CCC[C@@H]1NCC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000286325439 274178669 /nfs/dbraw/zinc/17/86/69/274178669.db2.gz WWJAANXRPUQNOM-GOEBONIOSA-N 0 3 349.456 2.748 20 5 EFBDHN C[C@H]1C[C@H](N2CCCC2)CN1c1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000286333971 274180364 /nfs/dbraw/zinc/18/03/64/274180364.db2.gz LQXJXZVTRRWWLF-JSGCOSHPSA-N 0 3 344.415 2.543 20 5 EFBDHN CS[C@@H]1CN(c2cc(C)nc3ccc([N+](=O)[O-])cc32)C[C@H]1N(C)C ZINC000340783291 274182366 /nfs/dbraw/zinc/18/23/66/274182366.db2.gz QWCMRAFGXJEUFG-IAGOWNOFSA-N 0 3 346.456 2.933 20 5 EFBDHN CS[C@H]1CN(c2ccc([N+](=O)[O-])c3ncccc32)C[C@@H]1N(C)C ZINC000413211923 274186611 /nfs/dbraw/zinc/18/66/11/274186611.db2.gz QLZHUTPCUXSSCQ-GJZGRUSLSA-N 0 3 332.429 2.625 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N[C@@H](C)c1nnc2ccccn21 ZINC000449067260 274231189 /nfs/dbraw/zinc/23/11/89/274231189.db2.gz JVHQXJVKMSNPGA-STQMWFEESA-N 0 3 325.372 2.919 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@H](C(=O)N2CCCC2)C1 ZINC000286702746 274255118 /nfs/dbraw/zinc/25/51/18/274255118.db2.gz AFDPASFULCMMHI-GJZGRUSLSA-N 0 3 331.416 2.909 20 5 EFBDHN O=[N+]([O-])c1ccc(CCN2CC[C@H](C(F)(F)F)[C@@H](CO)C2)cc1 ZINC000286765835 274269056 /nfs/dbraw/zinc/26/90/56/274269056.db2.gz ZMMKZDGVOFMKQV-OCCSQVGLSA-N 0 3 332.322 2.630 20 5 EFBDHN CCCN(CCN(CC)CC)c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000286878924 274292033 /nfs/dbraw/zinc/29/20/33/274292033.db2.gz OAHJKMNKQBCLCD-UHFFFAOYSA-N 0 3 347.419 2.802 20 5 EFBDHN Cc1cc(NC(=O)N2C[C@H](N3CCCC3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000286985200 274315320 /nfs/dbraw/zinc/31/53/20/274315320.db2.gz DMUZUKAUJUQPAI-DZGCQCFKSA-N 0 3 332.404 2.994 20 5 EFBDHN COc1cc(C(=O)N2CC[C@@H](N3CCCC3)[C@H]2C)cc([N+](=O)[O-])c1C ZINC000287086732 274338625 /nfs/dbraw/zinc/33/86/25/274338625.db2.gz KSGMKTASSUAAIZ-UKRRQHHQSA-N 0 3 347.415 2.611 20 5 EFBDHN CCC[C@H](NC[C@@H]1CCCS(=O)(=O)C1)c1cccc([N+](=O)[O-])c1 ZINC000287149203 274354322 /nfs/dbraw/zinc/35/43/22/274354322.db2.gz SQXUQCYHTNJIPH-BBRMVZONSA-N 0 3 340.445 2.850 20 5 EFBDHN C[C@H]1[C@@H](N2CCCC2)CCN1C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000287244597 274376776 /nfs/dbraw/zinc/37/67/76/274376776.db2.gz RFGQAMFZOKDMPZ-BBRMVZONSA-N 0 3 349.456 2.772 20 5 EFBDHN C[C@@H]1[C@@H](N2CCCC2)CCN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000287296060 274387895 /nfs/dbraw/zinc/38/78/95/274387895.db2.gz UCJDSGULMVOXIL-DOMZBBRYSA-N 0 3 342.399 2.775 20 5 EFBDHN CC(=O)c1cc(NCC2(N3CCCC3)CCOCC2)ccc1[N+](=O)[O-] ZINC000287726145 274477868 /nfs/dbraw/zinc/47/78/68/274477868.db2.gz GBYDTVLLEQYUBO-UHFFFAOYSA-N 0 3 347.415 2.854 20 5 EFBDHN C[C@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H]1COc2ccccc21 ZINC000185579548 274511240 /nfs/dbraw/zinc/51/12/40/274511240.db2.gz CLUPDLBBHZTMRN-JSGCOSHPSA-N 0 3 341.367 2.688 20 5 EFBDHN CCCN(CCN1CCCC1)C(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000288041193 274519406 /nfs/dbraw/zinc/51/94/06/274519406.db2.gz OKRVCLUWDRSXSF-UHFFFAOYSA-N 0 3 348.447 2.655 20 5 EFBDHN C[C@H]1[C@H](N2CCCC2)CCN1C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000288108735 274528816 /nfs/dbraw/zinc/52/88/16/274528816.db2.gz IOZMGSHBKZIRHR-XHDPSFHLSA-N 0 3 337.807 2.947 20 5 EFBDHN C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000288564635 274619299 /nfs/dbraw/zinc/61/92/99/274619299.db2.gz WKTIYMYXCIBRBI-NEPJUHHUSA-N 0 3 337.807 2.947 20 5 EFBDHN Cn1cc(N2CC[C@H](N[C@@H]3CCCc4ccc([N+](=O)[O-])cc43)C2)cn1 ZINC000375717197 274893185 /nfs/dbraw/zinc/89/31/85/274893185.db2.gz DEVRJAZTOLMQAR-KBXCAEBGSA-N 0 3 341.415 2.574 20 5 EFBDHN O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2NCc2cnn3ccccc23)n1 ZINC000353864437 275040719 /nfs/dbraw/zinc/04/07/19/275040719.db2.gz IZMZKMVHDGKHIK-ZBFHGGJFSA-N 0 3 340.387 2.713 20 5 EFBDHN CC(C)(C)N1C[C@@H](N[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1=O ZINC000193012670 275816950 /nfs/dbraw/zinc/81/69/50/275816950.db2.gz PPKPTWKIXUBFIW-XJKSGUPXSA-N 0 3 331.416 2.961 20 5 EFBDHN CC1(C)CN(c2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)CCN1 ZINC000420263844 275850293 /nfs/dbraw/zinc/85/02/93/275850293.db2.gz AHVVOVAWGOMRCB-UHFFFAOYSA-N 0 3 330.363 2.984 20 5 EFBDHN CC1(C)C[C@H](NCCC2(O)CCOCC2)c2cc([N+](=O)[O-])ccc21 ZINC000353822886 275867398 /nfs/dbraw/zinc/86/73/98/275867398.db2.gz UZTVIPMEBNJFDY-INIZCTEOSA-N 0 3 334.416 2.838 20 5 EFBDHN CCO[C@H]1COCC[C@@H]1NCc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339089987 276360520 /nfs/dbraw/zinc/36/05/20/276360520.db2.gz FHKYAANKFBKKJN-KBPBESRZSA-N 0 3 348.321 2.897 20 5 EFBDHN CCn1ncnc1CN[C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000355578748 276727417 /nfs/dbraw/zinc/72/74/17/276727417.db2.gz FVQWBMFSDUJFPI-DZGCQCFKSA-N 0 3 329.404 2.707 20 5 EFBDHN CNC(=O)[C@@H]1CCC[C@@H]1N[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433281433 277008453 /nfs/dbraw/zinc/00/84/53/277008453.db2.gz JECWGOYSLXSMST-UHOFOFEASA-N 0 3 331.416 2.822 20 5 EFBDHN C[C@@H](C(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1)N1[C@H](C)CC[C@@H]1C ZINC000359628200 278194609 /nfs/dbraw/zinc/19/46/09/278194609.db2.gz ZHKIGKWWAPPYPY-MJBXVCDLSA-N 0 3 347.415 2.577 20 5 EFBDHN C[C@@H](CCS(C)(=O)=O)N[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433288794 278235208 /nfs/dbraw/zinc/23/52/08/278235208.db2.gz OCKFVHDCXJYHDX-NHYWBVRUSA-N 0 3 340.445 2.730 20 5 EFBDHN C[C@@H](CNC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N(C)C1CC1 ZINC000079966175 278281793 /nfs/dbraw/zinc/28/17/93/278281793.db2.gz CKDSBCBTUBIYMX-VIFPVBQESA-N 0 3 345.321 2.826 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])NCC(=O)N1Cc2ccccc2C1 ZINC000449292536 278298471 /nfs/dbraw/zinc/29/84/71/278298471.db2.gz DGDRJKFUFQANIP-AWEZNQCLSA-N 0 3 339.395 2.658 20 5 EFBDHN C[S@@](=O)C[C@H](NCCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000183120746 278573647 /nfs/dbraw/zinc/57/36/47/278573647.db2.gz OVDHFILXVKWQQR-GAJHUEQPSA-N 0 3 332.425 2.847 20 5 EFBDHN CCN(CCNC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000338444918 279203363 /nfs/dbraw/zinc/20/33/63/279203363.db2.gz BUVXPGCQDFRFPY-GFCCVEGCSA-N 0 3 337.445 2.676 20 5 EFBDHN C[C@@H]1CN(CCC2CCN(c3ncccc3[N+](=O)[O-])CC2)C[C@@H](C)O1 ZINC000267434827 288157073 /nfs/dbraw/zinc/15/70/73/288157073.db2.gz XNPSTVWMXHAEOD-HUUCEWRRSA-N 0 3 348.447 2.706 20 5 EFBDHN O=C(Nc1ccc([N+](=O)[O-])c2ncccc12)C12CCCN1CCC2 ZINC000370607273 280022410 /nfs/dbraw/zinc/02/24/10/280022410.db2.gz VLIOGFQCKKAETA-UHFFFAOYSA-N 0 3 326.356 2.710 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2NCCc3ccccc32)c1 ZINC000261606323 281008531 /nfs/dbraw/zinc/00/85/31/281008531.db2.gz CUASBQARVRJNDL-INIZCTEOSA-N 0 3 325.368 2.520 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000345528877 281257738 /nfs/dbraw/zinc/25/77/38/281257738.db2.gz KNLDVPPCOSIRNZ-MRXNPFEDSA-N 0 3 341.411 2.806 20 5 EFBDHN C[C@@H](CNC(=O)NCc1ccc([N+](=O)[O-])cc1)N1CCC(C)CC1 ZINC000065478541 292683943 /nfs/dbraw/zinc/68/39/43/292683943.db2.gz RLFJDGIFNOJLHD-AWEZNQCLSA-N 0 3 334.420 2.514 20 5 EFBDHN CN(C)CCN(Cc1cccc(F)c1)C(=O)c1ccc([N+](=O)[O-])o1 ZINC000068313823 292702216 /nfs/dbraw/zinc/70/22/16/292702216.db2.gz MAXKRVQZVXOXIE-UHFFFAOYSA-N 0 3 335.335 2.531 20 5 EFBDHN CN(C)Cc1cccc(C(=O)NCCc2cccc([N+](=O)[O-])c2)c1 ZINC000089306161 292831877 /nfs/dbraw/zinc/83/18/77/292831877.db2.gz UBXVSDWGNWKPBG-UHFFFAOYSA-N 0 3 327.384 2.629 20 5 EFBDHN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)CCN1CCCC1 ZINC000089899839 292844873 /nfs/dbraw/zinc/84/48/73/292844873.db2.gz INIONGAWPMXIKT-ZDUSSCGKSA-N 0 3 345.403 2.733 20 5 EFBDHN CN(C)[C@@H](CNC(=O)c1ccc(F)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000131781926 293208016 /nfs/dbraw/zinc/20/80/16/293208016.db2.gz XEKGUYYNAUZSKC-OAHLLOKOSA-N 0 3 345.374 2.637 20 5 EFBDHN CCOc1ccc([C@@H](C)NCCOC[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000153812334 293395283 /nfs/dbraw/zinc/39/52/83/293395283.db2.gz XFTLMROWVFFUBW-UKRRQHHQSA-N 0 3 338.404 2.840 20 5 EFBDHN CCCCN(C)C[C@@H](C)Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000290735693 294170835 /nfs/dbraw/zinc/17/08/35/294170835.db2.gz BKKATMWZOZFBMD-GFCCVEGCSA-N 0 3 343.449 2.531 20 5 EFBDHN CC(C)NC(=O)c1ccc(N[C@@H]2C[C@H](C)N(C3CC3)C2)c([N+](=O)[O-])c1 ZINC000290865966 294206979 /nfs/dbraw/zinc/20/69/79/294206979.db2.gz ZDURZDMPSMLDMU-GXTWGEPZSA-N 0 3 346.431 2.770 20 5 EFBDHN C[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])cc2N2CCOC2=O)CN1C1CC1 ZINC000290871173 294208156 /nfs/dbraw/zinc/20/81/56/294208156.db2.gz ZQTRZHYGDSYEQJ-NEPJUHHUSA-N 0 3 346.387 2.589 20 5 EFBDHN C[C@H](NCCC(=O)N1CCCCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000293563464 295000226 /nfs/dbraw/zinc/00/02/26/295000226.db2.gz CZPLPRWIVBZNCO-ZDUSSCGKSA-N 0 3 334.420 2.620 20 5 EFBDHN Cn1ncc(CCCNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])n1 ZINC000293698840 295030273 /nfs/dbraw/zinc/03/02/73/295030273.db2.gz RJLINJACNQACSV-UHFFFAOYSA-N 0 3 344.202 2.753 20 5 EFBDHN CCNC(=O)c1ccc(CN[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000293801285 295052967 /nfs/dbraw/zinc/05/29/67/295052967.db2.gz RDUAJEHETKXYST-GFCCVEGCSA-N 0 3 342.399 2.778 20 5 EFBDHN CN1CCC[C@]2(CCN(C(=O)c3ccc([N+](=O)[O-])c(Cl)c3)C2)C1 ZINC000293918538 295079391 /nfs/dbraw/zinc/07/93/91/295079391.db2.gz IINACAOTIUYFKI-INIZCTEOSA-N 0 3 337.807 2.806 20 5 EFBDHN C[C@@H](N[C@@H]1CCC(=O)N[C@H]1C(C)(C)C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294045176 295102523 /nfs/dbraw/zinc/10/25/23/295102523.db2.gz GIFYKZJOSIWMAS-CKUKBARFSA-N 0 3 334.420 2.521 20 5 EFBDHN CN1CCC[C@]2(CCN(C(=O)c3ccc(Cl)cc3[N+](=O)[O-])C2)C1 ZINC000294160480 295120693 /nfs/dbraw/zinc/12/06/93/295120693.db2.gz NYCAMXWJNYAIJM-INIZCTEOSA-N 0 3 337.807 2.806 20 5 EFBDHN CN1CCC[C@]2(CCN(C(=O)c3cc(Cl)ccc3[N+](=O)[O-])C2)C1 ZINC000294177718 295122995 /nfs/dbraw/zinc/12/29/95/295122995.db2.gz OVCROWXKHRCRQK-INIZCTEOSA-N 0 3 337.807 2.806 20 5 EFBDHN CN1CCC[C@]2(CCN(C(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000294190236 295125312 /nfs/dbraw/zinc/12/53/12/295125312.db2.gz PLUHURGOMNMOHX-IBGZPJMESA-N 0 3 345.443 2.817 20 5 EFBDHN CC(C)(CCC(=O)NC1CCN(Cc2ccccc2)CC1)[N+](=O)[O-] ZINC000294251093 295135447 /nfs/dbraw/zinc/13/54/47/295135447.db2.gz PAGCDWDDZWEFQR-UHFFFAOYSA-N 0 3 333.432 2.603 20 5 EFBDHN CC(C)(CCC(=O)NC[C@@H](c1cccs1)N1CCCC1)[N+](=O)[O-] ZINC000294491266 295175485 /nfs/dbraw/zinc/17/54/85/295175485.db2.gz RJQQZNTVSHIUDT-ZDUSSCGKSA-N 0 3 339.461 2.837 20 5 EFBDHN CN(C)CCN(Cc1cccc(F)c1)C(=O)CCC(C)(C)[N+](=O)[O-] ZINC000294644016 295199742 /nfs/dbraw/zinc/19/97/42/295199742.db2.gz GYFYKBFOPNREKY-UHFFFAOYSA-N 0 3 339.411 2.551 20 5 EFBDHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)CCC(C)(C)[N+](=O)[O-] ZINC000294658260 295201969 /nfs/dbraw/zinc/20/19/69/295201969.db2.gz HZDVOWKOEZBMKS-UHFFFAOYSA-N 0 3 339.411 2.551 20 5 EFBDHN CCN(Cc1ccc(CN(C)C)cc1)C(=O)CCC(C)(C)[N+](=O)[O-] ZINC000294755451 295221508 /nfs/dbraw/zinc/22/15/08/295221508.db2.gz ZHUZPCDYBKPZHH-UHFFFAOYSA-N 0 3 335.448 2.932 20 5 EFBDHN CC[C@H](C)[C@@H](CNCc1cc(OC)c(OC)cc1[N+](=O)[O-])OC ZINC000294764283 295223102 /nfs/dbraw/zinc/22/31/02/295223102.db2.gz JJFPQOALHFPEPB-MEDUHNTESA-N 0 3 326.393 2.763 20 5 EFBDHN CN(C(=O)CCC(C)(C)[N+](=O)[O-])[C@H]1CCCN(Cc2ccccc2)C1 ZINC000294794872 295228831 /nfs/dbraw/zinc/22/88/31/295228831.db2.gz BCBYZMMTXSPKAY-KRWDZBQOSA-N 0 3 347.459 2.945 20 5 EFBDHN C[C@H](NC[C@]1(O)CCc2ccccc21)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294826111 295233190 /nfs/dbraw/zinc/23/31/90/295233190.db2.gz QSAJNGGCMGORJB-KPZWWZAWSA-N 0 3 327.384 2.662 20 5 EFBDHN C[C@@H](NC[C@@]1(O)CCc2ccccc21)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294826154 295233535 /nfs/dbraw/zinc/23/35/35/295233535.db2.gz QSAJNGGCMGORJB-XIKOKIGWSA-N 0 3 327.384 2.662 20 5 EFBDHN C[C@H](CCN1CCN(C)CC1)Nc1nccc2cc([N+](=O)[O-])ccc21 ZINC000294843305 295235737 /nfs/dbraw/zinc/23/57/37/295235737.db2.gz BRAWXSABFOWPMI-CQSZACIVSA-N 0 3 343.431 2.581 20 5 EFBDHN Cc1nc(N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)ncc1[N+](=O)[O-] ZINC000294939230 295248560 /nfs/dbraw/zinc/24/85/60/295248560.db2.gz JOKLWZUOESBHAP-IUODEOHRSA-N 0 3 327.388 2.626 20 5 EFBDHN CCOc1ccc([C@H](C)NCCc2nccnc2C)cc1[N+](=O)[O-] ZINC000294967581 295252286 /nfs/dbraw/zinc/25/22/86/295252286.db2.gz JSFXJDJHMDOFRY-LBPRGKRZSA-N 0 3 330.388 2.985 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)CCC(C)(C)[N+](=O)[O-])CCN1Cc1ccccc1 ZINC000295010731 295257389 /nfs/dbraw/zinc/25/73/89/295257389.db2.gz CRTMIEORZWNWAC-RDJZCZTQSA-N 0 3 347.459 2.991 20 5 EFBDHN C[C@H](N(C)Cc1ccc(Br)c([N+](=O)[O-])c1)C(C)(C)O ZINC000295040399 295260416 /nfs/dbraw/zinc/26/04/16/295260416.db2.gz AGMZPCOKFJHVNO-VIFPVBQESA-N 0 3 331.210 2.949 20 5 EFBDHN CN(CC1CCN(C)CC1)C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000295111011 295269415 /nfs/dbraw/zinc/26/94/15/295269415.db2.gz LBRDBCZINHKLLP-UHFFFAOYSA-N 0 3 325.796 2.662 20 5 EFBDHN COc1cccc(C(=O)N(CCN(C)C)c2ccccc2)c1[N+](=O)[O-] ZINC000194177795 295283148 /nfs/dbraw/zinc/28/31/48/295283148.db2.gz LODZOUPYHWAIGF-UHFFFAOYSA-N 0 3 343.383 2.812 20 5 EFBDHN CN1CCC(N(Cc2ccccc2)C(=O)CCC(C)(C)[N+](=O)[O-])CC1 ZINC000295220117 295284099 /nfs/dbraw/zinc/28/40/99/295284099.db2.gz YCEYWSDNWLSUNS-UHFFFAOYSA-N 0 3 347.459 2.945 20 5 EFBDHN CSc1ccc(C(=O)N2CCN(C3CC3)C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000295436065 295320093 /nfs/dbraw/zinc/32/00/93/295320093.db2.gz VJHNZSAIZZANDA-GFCCVEGCSA-N 0 3 349.456 2.873 20 5 EFBDHN CC(C)(C[C@H]1CCCN(CCOc2ccccc2[N+](=O)[O-])C1)C(N)=O ZINC000295590133 295345860 /nfs/dbraw/zinc/34/58/60/295345860.db2.gz MJHPULPSQQRBHU-CQSZACIVSA-N 0 3 349.431 2.587 20 5 EFBDHN CN1CCC[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3Cl)C2)C1 ZINC000295647251 295354321 /nfs/dbraw/zinc/35/43/21/295354321.db2.gz RDGQYCWYIQWWGZ-INIZCTEOSA-N 0 3 337.807 2.806 20 5 EFBDHN CCN1CCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])c(C)cc1Cl ZINC000295646519 295354607 /nfs/dbraw/zinc/35/46/07/295354607.db2.gz IMDKCGBDPZAXSM-LLVKDONJSA-N 0 3 325.796 2.771 20 5 EFBDHN C[C@@H](c1ccc(N)c([N+](=O)[O-])c1)N1CCC[C@@H](CC(C)(C)C(N)=O)C1 ZINC000295836788 295383348 /nfs/dbraw/zinc/38/33/48/295383348.db2.gz AGANHCALYUOJTP-STQMWFEESA-N 0 3 348.447 2.852 20 5 EFBDHN C[C@H](CN1CCCCC1)NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000345601997 298560451 /nfs/dbraw/zinc/56/04/51/298560451.db2.gz XGNFMVSOARXZTM-CQSZACIVSA-N 0 3 344.415 2.540 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NC2CCN(C3CCC3)CC2)c1 ZINC000297124093 310855714 /nfs/dbraw/zinc/85/57/14/310855714.db2.gz KDPBKLFVUCRJTJ-UHFFFAOYSA-N 0 3 347.415 2.740 20 5 EFBDHN CCN1CCC[C@@H]1CNC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000298643753 311010500 /nfs/dbraw/zinc/01/05/00/311010500.db2.gz MGTYIZIEZMHUEH-GXTWGEPZSA-N 0 3 337.445 2.676 20 5 EFBDHN CC(C)N1CCC(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000298654364 311011612 /nfs/dbraw/zinc/01/16/12/311011612.db2.gz FZJVMRQUCLWMAQ-UHFFFAOYSA-N 0 3 331.372 2.944 20 5 EFBDHN C[C@@H]1CCCN(CCNC(=O)c2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000298760604 311021186 /nfs/dbraw/zinc/02/11/86/311021186.db2.gz RCPNIXQZFQAFOQ-LLVKDONJSA-N 0 3 325.796 2.710 20 5 EFBDHN C[C@H]1CCCN(CCNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC000299055053 311046161 /nfs/dbraw/zinc/04/61/61/311046161.db2.gz TUNBGDLYXZJSRS-LBPRGKRZSA-N 0 3 330.388 2.538 20 5 EFBDHN C[C@@H]1CCCN(CCNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C1 ZINC000299316669 311072108 /nfs/dbraw/zinc/07/21/08/311072108.db2.gz WWGHQHBPWAGLOH-GFCCVEGCSA-N 0 3 330.388 2.538 20 5 EFBDHN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCC[C@@H]1CN1CCCC1 ZINC000299577650 311098793 /nfs/dbraw/zinc/09/87/93/311098793.db2.gz UUTVXVXUNOZZEG-CYBMUJFWSA-N 0 3 337.807 2.949 20 5 EFBDHN O=C(CCN[C@H](CCO)c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000299585258 311099602 /nfs/dbraw/zinc/09/96/02/311099602.db2.gz HWWDFCWTBVFQRT-OAHLLOKOSA-N 0 3 343.383 2.637 20 5 EFBDHN CC(C)NC(=O)c1ccc(N(C)C[C@H]2CCCN(C)C2)c([N+](=O)[O-])c1 ZINC000301373873 311134282 /nfs/dbraw/zinc/13/42/82/311134282.db2.gz UWDSGUBLSULQHV-AWEZNQCLSA-N 0 3 348.447 2.511 20 5 EFBDHN CCN1CCN([C@@H](C)CNc2ccc([N+](=O)[O-])c3cccnc23)CC1 ZINC000301503489 311141354 /nfs/dbraw/zinc/14/13/54/311141354.db2.gz FXSBACYKWOZWBT-AWEZNQCLSA-N 0 3 343.431 2.581 20 5 EFBDHN CC1CCN(C[C@@H](O)CNc2ccc3cc([N+](=O)[O-])ccc3n2)CC1 ZINC000301547855 311143655 /nfs/dbraw/zinc/14/36/55/311143655.db2.gz PPFHFADMKDYCPP-INIZCTEOSA-N 0 3 344.415 2.648 20 5 EFBDHN CCN1CCCC[C@H]1CNc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000301562348 311144481 /nfs/dbraw/zinc/14/44/81/311144481.db2.gz VBORBPNNQXQTKI-NSHDSACASA-N 0 3 331.376 2.530 20 5 EFBDHN CCOc1cc(N2CCN(c3ccncc3)CC2)ccc1[N+](=O)[O-] ZINC000301567683 311145142 /nfs/dbraw/zinc/14/51/42/311145142.db2.gz ZPIQFBUSKAVORL-UHFFFAOYSA-N 0 3 328.372 2.715 20 5 EFBDHN COCCN1[C@H](C)CN(c2ccc([N+](=O)[O-])c3cccnc32)C[C@@H]1C ZINC000301779248 311157631 /nfs/dbraw/zinc/15/76/31/311157631.db2.gz QNEWFJMAVBEUIG-OKILXGFUSA-N 0 3 344.415 2.688 20 5 EFBDHN Cc1cc(N(C)[C@@H]2CCCN(C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000301839435 311161715 /nfs/dbraw/zinc/16/17/15/311161715.db2.gz XLJQUKAPZXJFLH-MRXNPFEDSA-N 0 3 341.415 2.891 20 5 EFBDHN COC1CCN(CCNc2cc(C)nc3ccc([N+](=O)[O-])cc32)CC1 ZINC000302105551 311177875 /nfs/dbraw/zinc/17/78/75/311177875.db2.gz XEPWZNSOVPQMSX-UHFFFAOYSA-N 0 3 344.415 2.974 20 5 EFBDHN CC(C)N1CCN(c2cccc(Nc3ncc([N+](=O)[O-])cn3)c2)CC1 ZINC000302210270 311185018 /nfs/dbraw/zinc/18/50/18/311185018.db2.gz GGGZWZPMFOPECN-UHFFFAOYSA-N 0 3 342.403 2.659 20 5 EFBDHN Cc1cc(N[C@@H](C)[C@H](C)N2CCOCC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302212662 311185045 /nfs/dbraw/zinc/18/50/45/311185045.db2.gz YYDQZYBDNUARCZ-KBPBESRZSA-N 0 3 344.415 2.973 20 5 EFBDHN Cc1cccc(NC[C@H](O)CN2CCc3ccccc3C2)c1[N+](=O)[O-] ZINC000302478425 311190936 /nfs/dbraw/zinc/19/09/36/311190936.db2.gz FWABTCSGLYCSBZ-KRWDZBQOSA-N 0 3 341.411 2.734 20 5 EFBDHN Cc1cccc(NC[C@@H]2C[C@H](O)CN2Cc2ccccc2)c1[N+](=O)[O-] ZINC000302494363 311191519 /nfs/dbraw/zinc/19/15/19/311191519.db2.gz LIEJVJRHJPDBSP-IRXDYDNUSA-N 0 3 341.411 2.951 20 5 EFBDHN C[C@H](c1cc2ccccc2o1)N(C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000304358607 311212060 /nfs/dbraw/zinc/21/20/60/311212060.db2.gz SVPSJYGSDGEEKR-DOMZBBRYSA-N 0 3 344.371 2.591 20 5 EFBDHN COc1ccc(-c2ccc(CN(CCO)C3CC3)o2)c([N+](=O)[O-])c1 ZINC000305729493 311224582 /nfs/dbraw/zinc/22/45/82/311224582.db2.gz KKWDXBYDLURJII-UHFFFAOYSA-N 0 3 332.356 2.820 20 5 EFBDHN CCN1C[C@H](C)N(CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C[C@@H]1C ZINC000330581127 311322690 /nfs/dbraw/zinc/32/26/90/311322690.db2.gz QMSUFPOLBGHXCC-KBPBESRZSA-N 0 3 348.447 2.646 20 5 EFBDHN CCN1C[C@@H](C)N(CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C[C@H]1C ZINC000330581130 311322808 /nfs/dbraw/zinc/32/28/08/311322808.db2.gz QMSUFPOLBGHXCC-ZIAGYGMSSA-N 0 3 348.447 2.646 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCN(C)[C@H](C)C1 ZINC000330897761 311342319 /nfs/dbraw/zinc/34/23/19/311342319.db2.gz HVBTUVJEXSYZDS-FRRDWIJNSA-N 0 3 337.445 2.674 20 5 EFBDHN Cc1c(CC(=O)NCCN2CCCC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000330954398 311345777 /nfs/dbraw/zinc/34/57/77/311345777.db2.gz GLSWLLDVAPBPDJ-UHFFFAOYSA-N 0 3 333.432 2.684 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCN(C)C[C@H]1C(C)C ZINC000330971462 311346619 /nfs/dbraw/zinc/34/66/19/311346619.db2.gz JYQQVLUZUYGKLB-KRWDZBQOSA-N 0 3 348.447 2.504 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCN(C)C[C@@H]1C(C)C ZINC000330971463 311346737 /nfs/dbraw/zinc/34/67/37/311346737.db2.gz JYQQVLUZUYGKLB-QGZVFWFLSA-N 0 3 348.447 2.504 20 5 EFBDHN CCN1C[C@H](C)N(Cc2cc(OC)c(F)cc2[N+](=O)[O-])C[C@H]1C ZINC000330988220 311347490 /nfs/dbraw/zinc/34/74/90/311347490.db2.gz RBGVBVCOUPRSSB-NEPJUHHUSA-N 0 3 325.384 2.657 20 5 EFBDHN CCN1C[C@@H](C)N(Cc2cc(OC)c(F)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000331312058 311366919 /nfs/dbraw/zinc/36/69/19/311366919.db2.gz CAMLROJUZFWJHN-TXEJJXNPSA-N 0 3 325.384 2.657 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H](c2ccnc(N)n2)C1 ZINC000331495636 311383013 /nfs/dbraw/zinc/38/30/13/311383013.db2.gz GSJWFBPMPXFYND-CHWSQXEVSA-N 0 3 327.388 2.738 20 5 EFBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@H](c2ccnc(N)n2)C1 ZINC000331623399 311398659 /nfs/dbraw/zinc/39/86/59/311398659.db2.gz YCQJIIGNWQXEIU-OCCSQVGLSA-N 0 3 327.388 2.738 20 5 EFBDHN CN1CCC(NC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000331768408 311418087 /nfs/dbraw/zinc/41/80/87/311418087.db2.gz BLMFTQWKDYPNAJ-OAHLLOKOSA-N 0 3 346.431 2.578 20 5 EFBDHN CC[C@H]1C[C@H](CN2CCN(c3ccccc3[N+](=O)[O-])CC2)CCO1 ZINC000332399328 311499035 /nfs/dbraw/zinc/49/90/35/311499035.db2.gz RNAXZFMCLOMHOW-CVEARBPZSA-N 0 3 333.432 2.922 20 5 EFBDHN Cc1ccc(CN2CCC[C@@H](N3CCCC3=O)CC2)cc1[N+](=O)[O-] ZINC000414558421 312051095 /nfs/dbraw/zinc/05/10/95/312051095.db2.gz YVQWLXULLWRVTD-MRXNPFEDSA-N 0 3 331.416 2.880 20 5 EFBDHN COCCN1CC[C@H](N[C@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417304784 312206372 /nfs/dbraw/zinc/20/63/72/312206372.db2.gz FOGGAWCMTZAHIT-YJBOKZPZSA-N 0 3 333.432 2.673 20 5 EFBDHN O=C1C[C@H](N[C@H]2CCCCc3ccc([N+](=O)[O-])cc32)CN1C1CC1 ZINC000417308736 312207070 /nfs/dbraw/zinc/20/70/70/312207070.db2.gz IEOPXKQGVFFFDE-GUYCJALGSA-N 0 3 329.400 2.715 20 5 EFBDHN Cc1nc2n(n1)C[C@@H](N[C@@H]1CCCCc3ccc([N+](=O)[O-])cc31)CC2 ZINC000417311999 312207293 /nfs/dbraw/zinc/20/72/93/312207293.db2.gz MYJNQDFTEREIOJ-WMLDXEAASA-N 0 3 341.415 2.867 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](NC[C@@H]1CN(C3CC3)CCO1)CCCC2 ZINC000417311208 312207327 /nfs/dbraw/zinc/20/73/27/312207327.db2.gz OAELQKGCHJFLKY-IEBWSBKVSA-N 0 3 345.443 2.815 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](NC[C@H](O)C1CCOCC1)CCCC2 ZINC000417314192 312207599 /nfs/dbraw/zinc/20/75/99/312207599.db2.gz YHVYWWQIPRSNTB-ROUUACIJSA-N 0 3 334.416 2.739 20 5 EFBDHN O=C(NCCN[C@@H]1CCCCc2ccc([N+](=O)[O-])cc21)c1ccco1 ZINC000417331380 312209830 /nfs/dbraw/zinc/20/98/30/312209830.db2.gz WBNKDWPVIXBGOT-MRXNPFEDSA-N 0 3 343.383 2.975 20 5 EFBDHN CCc1ccccc1[C@@H](N)CNC(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000423950502 312487798 /nfs/dbraw/zinc/48/77/98/312487798.db2.gz YLXFSYQYIZSOGU-HNNXBMFYSA-N 0 3 327.384 2.895 20 5 EFBDHN CCN1CCN([C@H](C)CNc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000432339192 312557903 /nfs/dbraw/zinc/55/79/03/312557903.db2.gz ZRVWZRURLCSBRU-GFCCVEGCSA-N 0 3 326.828 2.686 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N[C@H](CC(N)=O)c1ccccc1 ZINC000449343011 312686593 /nfs/dbraw/zinc/68/65/93/312686593.db2.gz HCWCUSVKEKLLHP-CZUORRHYSA-N 0 3 327.384 2.732 20 5 EFBDHN CCOc1ccc([C@@H](C)NCCc2cnc(C)cn2)cc1[N+](=O)[O-] ZINC000453396373 312897752 /nfs/dbraw/zinc/89/77/52/312897752.db2.gz IMDZEAYOYBIDPA-CYBMUJFWSA-N 0 3 330.388 2.985 20 5 EFBDHN C[C@@]1(CNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCC(=O)N1 ZINC000453587479 312913282 /nfs/dbraw/zinc/91/32/82/312913282.db2.gz JXNPGHCDLIHSGP-KRWDZBQOSA-N 0 3 329.356 2.613 20 5 EFBDHN C[C@]1(CNCc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCC(=O)N1 ZINC000453585910 312913564 /nfs/dbraw/zinc/91/35/64/312913564.db2.gz HUFLYEIDDYKGGM-QGZVFWFLSA-N 0 3 329.356 2.613 20 5 EFBDHN C[C@@H]1CC[C@@H](C)N1CC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000469671490 313124487 /nfs/dbraw/zinc/12/44/87/313124487.db2.gz SQPQQOXYYSVWIA-HUUCEWRRSA-N 0 3 333.432 2.907 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN[C@@](C)(CO)C1CCCCC1 ZINC000471229195 313140441 /nfs/dbraw/zinc/14/04/41/313140441.db2.gz UUHWYPAQKSDPDH-SFHVURJKSA-N 0 3 349.431 2.763 20 5 EFBDHN CC[C@H]1C[C@@H](C)CN1Cc1ccc(OCC(=O)OC)c([N+](=O)[O-])c1 ZINC000475703713 313224986 /nfs/dbraw/zinc/22/49/86/313224986.db2.gz YAOGKIZRDZEOEM-OCCSQVGLSA-N 0 3 336.388 2.767 20 5 EFBDHN CCOC(=O)c1cc(N2CCN(C)[C@H](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000487072111 313363206 /nfs/dbraw/zinc/36/32/06/313363206.db2.gz WHDFEFOIKPHWAJ-INIZCTEOSA-N 0 3 335.404 2.548 20 5 EFBDHN CCOC(=O)c1cc(N2CCN(C)[C@@H](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000487072113 313363437 /nfs/dbraw/zinc/36/34/37/313363437.db2.gz WHDFEFOIKPHWAJ-MRXNPFEDSA-N 0 3 335.404 2.548 20 5 EFBDHN CS[C@H]1CN(Cc2c(Cl)cccc2[N+](=O)[O-])C[C@@H]1N(C)C ZINC000492262585 313928351 /nfs/dbraw/zinc/92/83/51/313928351.db2.gz XMAQMIDWXOPWSW-KBPBESRZSA-N 0 3 329.853 2.726 20 5 EFBDHN C[C@@H](C1CCN(C)CC1)N(C)C(=O)/C=C\c1ccccc1[N+](=O)[O-] ZINC000492323016 313950696 /nfs/dbraw/zinc/95/06/96/313950696.db2.gz UGRJVIMXOXOWCF-CKXPSTMWSA-N 0 3 331.416 2.797 20 5 EFBDHN C[C@H](C1CCN(C)CC1)N(C)C(=O)/C=C\c1ccc(F)cc1[N+](=O)[O-] ZINC000492344332 313958192 /nfs/dbraw/zinc/95/81/92/313958192.db2.gz XIAFKAUWTRLWEO-SCXUMTSISA-N 0 3 349.406 2.936 20 5 EFBDHN C[C@H](C1CCN(C)CC1)N(C)C(=O)/C=C/c1ccc(F)cc1[N+](=O)[O-] ZINC000492344334 313958313 /nfs/dbraw/zinc/95/83/13/313958313.db2.gz XIAFKAUWTRLWEO-VUDGCMKMSA-N 0 3 349.406 2.936 20 5 EFBDHN C[C@H](NC(=O)/C=C/c1ccc(F)cc1[N+](=O)[O-])C1=CCN(C)CC1 ZINC000492486420 314008474 /nfs/dbraw/zinc/00/84/74/314008474.db2.gz GDFXSUKFEFAIKD-FUEXJSSKSA-N 0 3 333.363 2.514 20 5 EFBDHN C[C@H]1C[C@H]1N1CCN(C(=O)/C=C/c2cccc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000492797563 314129028 /nfs/dbraw/zinc/12/90/28/314129028.db2.gz JGQBISKUDHZITL-PNJTVDSWSA-N 0 3 343.427 2.797 20 5 EFBDHN C[C@@H]1CN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)CCN(C2CCC2)C1 ZINC000492805521 314132690 /nfs/dbraw/zinc/13/26/90/314132690.db2.gz ZHOWKWGBHGENED-XMELGKRDSA-N 0 3 343.427 2.941 20 5 EFBDHN CN1CCC[C@]2(CCN(C(=O)/C=C\c3cccc([N+](=O)[O-])c3)C2)C1 ZINC000493487203 314374202 /nfs/dbraw/zinc/37/42/02/314374202.db2.gz MHTFAJDYZSOVMU-MJRGOJFPSA-N 0 3 329.400 2.552 20 5 EFBDHN CC(COC(=O)c1ccc(CNC(=O)OC(C)(C)C)cc1)[N+](=O)[O-] ZINC000496777192 315192165 /nfs/dbraw/zinc/19/21/65/315192165.db2.gz QPKHILKQNPTSPS-LLVKDONJSA-N 0 3 338.360 2.533 20 5 EFBDHN CC(COC(=O)Cc1ccc(NC(=O)OC(C)(C)C)cc1)[N+](=O)[O-] ZINC000497010832 315277350 /nfs/dbraw/zinc/27/73/50/315277350.db2.gz KWVWKGLWPXGVSC-LLVKDONJSA-N 0 3 338.360 2.785 20 5 EFBDHN CCOC(=O)c1cc(N2C[C@H](C)N(CC)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000497515448 315393191 /nfs/dbraw/zinc/39/31/91/315393191.db2.gz MVUMMAWYAPGXDS-QWHCGFSZSA-N 0 3 335.404 2.690 20 5 EFBDHN C[C@@H](N[C@@H]1CCC[C@H]1OC(F)F)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000503516587 315444185 /nfs/dbraw/zinc/44/41/85/315444185.db2.gz MXJUWPRMHLQHGA-OASPWFOLSA-N 0 3 343.330 2.672 20 5 EFBDHN O=C(CCN[C@@H]1COc2ccccc2C1)Nc1ccccc1[N+](=O)[O-] ZINC000519141344 315846474 /nfs/dbraw/zinc/84/64/74/315846474.db2.gz AMIHRBRGNUDPQO-AWEZNQCLSA-N 0 3 341.367 2.517 20 5 EFBDHN C[C@@H](NC(C)(C)CNC(=O)c1cc([N+](=O)[O-])cn1C)c1ccccc1 ZINC000521339180 316016060 /nfs/dbraw/zinc/01/60/60/316016060.db2.gz PNOYFOJGYBQGBP-CYBMUJFWSA-N 0 3 344.415 2.793 20 5 EFBDHN O=C(Nc1cccc([N+](=O)[O-])c1)[C@@H]1CCCN(Cc2cccnc2)C1 ZINC000522175290 316077643 /nfs/dbraw/zinc/07/76/43/316077643.db2.gz FFKDNINYJHTNHB-OAHLLOKOSA-N 0 3 340.383 2.841 20 5 EFBDHN C[C@H]1CCN(CCNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 ZINC000525291600 316206755 /nfs/dbraw/zinc/20/67/55/316206755.db2.gz MLFLDXBIWMKMQH-NSHDSACASA-N 0 3 333.413 2.881 20 5 EFBDHN C[C@@H]1CCN(C)CCN1C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000525354200 316211792 /nfs/dbraw/zinc/21/17/92/316211792.db2.gz DXMABBMMSMPTHX-OAHLLOKOSA-N 0 3 348.447 2.653 20 5 EFBDHN CC(C)[C@@H]1CCC[C@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000541741824 317788223 /nfs/dbraw/zinc/78/82/23/317788223.db2.gz ZDBVJGRJEDURSJ-JKSUJKDBSA-N 0 3 340.445 2.783 20 5 EFBDHN CCc1ccc([C@H](CO)NCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000543836158 317867903 /nfs/dbraw/zinc/86/79/03/317867903.db2.gz JJTJIRVGFXIZLG-SFHVURJKSA-N 0 3 330.384 2.859 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000548087763 318071655 /nfs/dbraw/zinc/07/16/55/318071655.db2.gz SQFHAKWXFJNTMD-KGLIPLIRSA-N 0 3 336.367 2.824 20 5 EFBDHN CCN(C[C@@H]1CCCN1CC)C(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000548454784 318109939 /nfs/dbraw/zinc/10/99/39/318109939.db2.gz CDIAPHCGADZHJS-LBPRGKRZSA-N 0 3 325.434 2.911 20 5 EFBDHN CC(C)(C)N1CCCN(C(=O)NCCc2ccccc2[N+](=O)[O-])CC1 ZINC000548751121 318140002 /nfs/dbraw/zinc/14/00/02/318140002.db2.gz UJDFNOLWKATJNH-UHFFFAOYSA-N 0 3 348.447 2.653 20 5 EFBDHN O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2NCc2cnc3n2CCCC3)n1 ZINC000551573080 318210109 /nfs/dbraw/zinc/21/01/09/318210109.db2.gz ZRGUJSYMQCQWMR-HUUCEWRRSA-N 0 3 344.419 2.598 20 5 EFBDHN C[C@@H](C(=O)N1CCN([C@@H]2C[C@H]2C)C[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000554113789 318301519 /nfs/dbraw/zinc/30/15/19/318301519.db2.gz XKLNIDURGLVNNL-LUXYFRNMSA-N 0 3 345.443 2.887 20 5 EFBDHN CCOc1cccc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000555574077 318361862 /nfs/dbraw/zinc/36/18/62/318361862.db2.gz GUDBGDRVEBKYQL-INIZCTEOSA-N 0 3 346.383 2.523 20 5 EFBDHN Cc1ccc(CN2CCC[C@@H](N3CCOCC3)CC2)cc1[N+](=O)[O-] ZINC000567179651 319146855 /nfs/dbraw/zinc/14/68/55/319146855.db2.gz NROSLARFTSWYTH-QGZVFWFLSA-N 0 3 333.432 2.590 20 5 EFBDHN CS(=O)(=O)[C@@H]1CCC[C@@H](N[C@H]2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000568531370 319293487 /nfs/dbraw/zinc/29/34/87/319293487.db2.gz CBVVIYBCXZAPIU-JMSVASOKSA-N 0 3 338.429 2.528 20 5 EFBDHN CS(=O)(=O)[C@@H]1CCC[C@H](N[C@@H]2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000568531372 319293565 /nfs/dbraw/zinc/29/35/65/319293565.db2.gz CBVVIYBCXZAPIU-YWPYICTPSA-N 0 3 338.429 2.528 20 5 EFBDHN CC(C)C[C@H](CN[C@@H]1CCc2c1cccc2[N+](=O)[O-])N1CCOCC1 ZINC000568780301 319318761 /nfs/dbraw/zinc/31/87/61/319318761.db2.gz WIKLXTFATWPLRJ-CRAIPNDOSA-N 0 3 347.459 2.919 20 5 EFBDHN C[C@@H]1CCN(CCNC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC000569555800 319391233 /nfs/dbraw/zinc/39/12/33/319391233.db2.gz PFVGSWORGNZOLX-SNVBAGLBSA-N 0 3 345.321 2.685 20 5 EFBDHN Cc1cccc(OCCNCCC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000570836346 319517715 /nfs/dbraw/zinc/51/77/15/319517715.db2.gz GCIXKWVQAMWQGA-UHFFFAOYSA-N 0 3 343.383 2.900 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2N[C@@H]1CCN(c2ncccc2F)C1 ZINC000572422617 319668653 /nfs/dbraw/zinc/66/86/53/319668653.db2.gz DIGJCANCWDADDD-WBMJQRKESA-N 0 3 342.374 2.985 20 5 EFBDHN O=C(CC1CCCC1)NCCN[C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000576052818 319979126 /nfs/dbraw/zinc/97/91/26/319979126.db2.gz VWIMLQQOCNQBFW-MRXNPFEDSA-N 0 3 331.416 2.868 20 5 EFBDHN CN(C)C[C@H]1CCCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000576908573 320059396 /nfs/dbraw/zinc/05/93/96/320059396.db2.gz WAWUASGREQDOOK-MRXNPFEDSA-N 0 3 347.415 2.500 20 5 EFBDHN CCC(C)(C)[C@H](C)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000577351597 320101971 /nfs/dbraw/zinc/10/19/71/320101971.db2.gz VKHCURSHGPDUJG-LBPRGKRZSA-N 0 3 328.434 2.783 20 5 EFBDHN C[C@H](C(=O)N1[C@@H]2CC[C@H]1CCN(C)C2)c1ccc([N+](=O)[O-])cc1F ZINC000577647267 320131106 /nfs/dbraw/zinc/13/11/06/320131106.db2.gz KQANYOWVDOUROO-SGMGOOAPSA-N 0 3 335.379 2.533 20 5 EFBDHN Cc1cccc(OC[C@H](O)CN[C@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000577963419 320160549 /nfs/dbraw/zinc/16/05/49/320160549.db2.gz ZCIPBBRCQFIIEN-KDOFPFPSSA-N 0 3 342.395 2.920 20 5 EFBDHN C[C@@H](C(=O)NCCN1CCCC(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000578062567 320169577 /nfs/dbraw/zinc/16/95/77/320169577.db2.gz QXNONFMSHSONCL-CQSZACIVSA-N 0 3 333.432 2.937 20 5 EFBDHN C[C@H](C(=O)N1CCCC12CCN(C)CC2)c1cccc([N+](=O)[O-])c1 ZINC000578271134 320190050 /nfs/dbraw/zinc/19/00/50/320190050.db2.gz GHHSBFHRQZMYFS-AWEZNQCLSA-N 0 3 331.416 2.785 20 5 EFBDHN CC(C)Oc1cc(C(=O)NC[C@H](C)N2CCCC2)ccc1[N+](=O)[O-] ZINC000578603076 320220458 /nfs/dbraw/zinc/22/04/58/320220458.db2.gz RSKBXEYJJUDOGI-ZDUSSCGKSA-N 0 3 335.404 2.596 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN[C@@H]1C[C@H]1c1ccc(F)cc1 ZINC000578741247 320234583 /nfs/dbraw/zinc/23/45/83/320234583.db2.gz NFECMDIENCURHY-HRCADAONSA-N 0 3 346.358 2.619 20 5 EFBDHN CC[C@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCCO1 ZINC000182251006 323272647 /nfs/dbraw/zinc/27/26/47/323272647.db2.gz XPKOZHXVEQHYQP-GXTWGEPZSA-N 0 3 341.795 2.734 20 5 EFBDHN Cc1ccc([C@@H](C)NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC000182331198 323276971 /nfs/dbraw/zinc/27/69/71/323276971.db2.gz IGVUYDVNNPOHMI-RHSMWYFYSA-N 0 3 330.384 2.994 20 5 EFBDHN C[C@@H](NCC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)C1CCCCC1 ZINC000182683131 323296221 /nfs/dbraw/zinc/29/62/21/323296221.db2.gz MBISNTDKHFYTKW-LLVKDONJSA-N 0 3 349.387 2.820 20 5 EFBDHN C[S@](=O)C[C@H](NCCOc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000183069172 323314582 /nfs/dbraw/zinc/31/45/82/323314582.db2.gz MQPSDGHIDVHZCQ-XDHUDOTRSA-N 0 3 348.424 2.683 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CCCN(C)C1 ZINC000184769240 323373738 /nfs/dbraw/zinc/37/37/38/323373738.db2.gz BHZLTJVNSCYQMA-HZPDHXFCSA-N 0 3 333.432 2.622 20 5 EFBDHN C[C@@H](C(=O)NCCN1CCCCCC1)c1ccc([N+](=O)[O-])cc1F ZINC000184941369 323378265 /nfs/dbraw/zinc/37/82/65/323378265.db2.gz HXIKDTFWOXXRFI-CYBMUJFWSA-N 0 3 337.395 2.830 20 5 EFBDHN C[C@H](C(=O)NCCN1CCC(C)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000185008222 323379860 /nfs/dbraw/zinc/37/98/60/323379860.db2.gz UKTXTWSGXRQTFB-ZDUSSCGKSA-N 0 3 337.395 2.686 20 5 EFBDHN O=C(CCN[C@H]1CCc2c1cccc2O)Nc1ccccc1[N+](=O)[O-] ZINC000296863592 323656877 /nfs/dbraw/zinc/65/68/77/323656877.db2.gz UGGVAVXNAOFMLA-AWEZNQCLSA-N 0 3 341.367 2.906 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2N[C@H](CO)Cc1ccc(F)cc1 ZINC000581200519 324328238 /nfs/dbraw/zinc/32/82/38/324328238.db2.gz QTNHRLDZGWNOFK-YOEHRIQHSA-N 0 3 330.359 2.914 20 5 EFBDHN Cn1cc([C@@H]2CN(CCOc3ccccc3[N+](=O)[O-])CC2(C)C)cn1 ZINC000581407879 324369107 /nfs/dbraw/zinc/36/91/07/324369107.db2.gz NTYMSYOOKZVGRV-HNNXBMFYSA-N 0 3 344.415 2.833 20 5 EFBDHN Cc1ccc(NCCCNC[C@@](C)(O)C(F)(F)F)c([N+](=O)[O-])c1 ZINC000581603439 324417404 /nfs/dbraw/zinc/41/74/04/324417404.db2.gz XGBFYKPVBPOFIX-CYBMUJFWSA-N 0 3 335.326 2.608 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CN(CCN(C)C)Cc1ccccn1 ZINC000582070536 324513821 /nfs/dbraw/zinc/51/38/21/324513821.db2.gz NWKHBNAFMOWVCV-UHFFFAOYSA-N 0 3 344.415 2.562 20 5 EFBDHN Cc1cccc2c1CC[C@@H]2NC[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000582840405 324681575 /nfs/dbraw/zinc/68/15/75/324681575.db2.gz VZOHXJCNQVWAIO-KXBFYZLASA-N 0 3 342.395 2.920 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@@H]2CCc3nc(C)nn3C2)cc1[N+](=O)[O-] ZINC000095982158 473241966 /nfs/dbraw/zinc/24/19/66/473241966.db2.gz XKQQNPDYCCUQJA-SMDDNHRTSA-N 0 3 345.403 2.559 20 5 EFBDHN Cn1cnc([N+](=O)[O-])c1Nc1ccc(CCN2CCSCC2)cc1 ZINC000141143852 473251689 /nfs/dbraw/zinc/25/16/89/473251689.db2.gz ARPKRWSKVPMWBA-UHFFFAOYSA-N 0 3 347.444 2.663 20 5 EFBDHN CCCCN(C)CCNC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000112310050 473255189 /nfs/dbraw/zinc/25/51/89/473255189.db2.gz PCKUNLGSZXBKBQ-ZDUSSCGKSA-N 0 3 339.461 2.924 20 5 EFBDHN COc1cc(C(=O)NC[C@@H](C)N2CCC(C)CC2)cc([N+](=O)[O-])c1C ZINC000190406867 473262468 /nfs/dbraw/zinc/26/24/68/473262468.db2.gz VGWHEJUDWZZSKG-CYBMUJFWSA-N 0 3 349.431 2.762 20 5 EFBDHN C[C@@H]1CCCC[N@@H+]1CC[N-]c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000486954893 468015155 /nfs/dbraw/zinc/01/51/55/468015155.db2.gz JWZRQNLBEUJDRS-GFCCVEGCSA-N 0 3 331.376 2.931 20 5 EFBDHN C[C@@H]1CCCC[N@H+]1CC[N-]c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000486954893 468015158 /nfs/dbraw/zinc/01/51/58/468015158.db2.gz JWZRQNLBEUJDRS-GFCCVEGCSA-N 0 3 331.376 2.931 20 5 EFBDHN C[C@@H]1CCCCN1CCNc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000486954893 468015161 /nfs/dbraw/zinc/01/51/61/468015161.db2.gz JWZRQNLBEUJDRS-GFCCVEGCSA-N 0 3 331.376 2.931 20 5 EFBDHN C[C@@H](N[C@@H](C)CCc1ccccc1[N+](=O)[O-])C(=O)NCc1ccco1 ZINC000162022599 473295082 /nfs/dbraw/zinc/29/50/82/473295082.db2.gz NTKFTAVOQNKZAJ-UONOGXRCSA-N 0 3 345.399 2.803 20 5 EFBDHN C[C@H](C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21)c1ccc([N+](=O)[O-])cc1F ZINC000185025104 473304862 /nfs/dbraw/zinc/30/48/62/473304862.db2.gz GOIRZPLRVAKOSR-DCGLDWPTSA-N 0 3 349.406 2.780 20 5 EFBDHN CSc1ccc(C(=O)N[C@H]2C[C@@H](C)N(C3CC3)C2)cc1[N+](=O)[O-] ZINC000177134476 473313250 /nfs/dbraw/zinc/31/32/50/473313250.db2.gz OWEORFDEALYLPJ-PWSUYJOCSA-N 0 3 335.429 2.672 20 5 EFBDHN CN(C)CCN(Cc1ccco1)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000162244392 473320252 /nfs/dbraw/zinc/32/02/52/473320252.db2.gz MSKFXQFRAZKIMV-UHFFFAOYSA-N 0 3 334.332 2.664 20 5 EFBDHN CC(C)[C@H](CCO)N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000162259549 473322271 /nfs/dbraw/zinc/32/22/71/473322271.db2.gz NUWRHZSXVPYYMR-GWCFXTLKSA-N 0 3 343.811 2.572 20 5 EFBDHN C[C@@H]1C[C@H](NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CN1C1CC1 ZINC000177186437 473326766 /nfs/dbraw/zinc/32/67/66/473326766.db2.gz LXQZNFCZYIJVNF-RISCZKNCSA-N 0 3 344.415 2.524 20 5 EFBDHN COc1ccc([C@H](CO)N(C)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000112995836 473344231 /nfs/dbraw/zinc/34/42/31/473344231.db2.gz YFJHDEPZPRLTMX-KRWDZBQOSA-N 0 3 346.383 2.648 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN[C@H]1CCCC12CCOCC2 ZINC000619723170 479866253 /nfs/dbraw/zinc/86/62/53/479866253.db2.gz TVRBKSOGKYBSCU-HNNXBMFYSA-N 0 3 347.415 2.781 20 5 EFBDHN CN(Cc1ccccc1)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])o1)C1CC1 ZINC000185304583 473390282 /nfs/dbraw/zinc/39/02/82/473390282.db2.gz XOWTYORZNITUPS-HNNXBMFYSA-N 0 3 343.383 2.828 20 5 EFBDHN Cc1c(CN2CC[C@@H]3[C@H](CCC(=O)N3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000125304757 473390895 /nfs/dbraw/zinc/39/08/95/473390895.db2.gz NVFFJICULGKUOK-CRAIPNDOSA-N 0 3 343.427 2.879 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)CN1C[C@H](C)C[C@H](C)C1 ZINC000346953999 475986250 /nfs/dbraw/zinc/98/62/50/475986250.db2.gz MZERYEFBMOZZKK-GUTXKFCHSA-N 0 3 333.432 2.999 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC(C)(C)[C@@H]2COC[C@@H]21 ZINC000452115881 476834506 /nfs/dbraw/zinc/83/45/06/476834506.db2.gz LBGINCWOCMGWLY-ZBFHGGJFSA-N 0 3 347.415 2.589 20 5 EFBDHN O=C(NCc1ccccc1)[C@H]1CCN(Cc2cccc([N+](=O)[O-])c2)C1 ZINC000592154759 478800460 /nfs/dbraw/zinc/80/04/60/478800460.db2.gz JFHITMBQUOJNKM-KRWDZBQOSA-N 0 3 339.395 2.733 20 5 EFBDHN O=C(NCc1ccccc1)[C@@H]1CCN(Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000592155897 478800955 /nfs/dbraw/zinc/80/09/55/478800955.db2.gz TXFKVENEENQCDR-QGZVFWFLSA-N 0 3 339.395 2.733 20 5 EFBDHN C[C@H]1CN(C(=O)c2c(F)cccc2[N+](=O)[O-])CCN(C2CCC2)C1 ZINC000601596781 478898054 /nfs/dbraw/zinc/89/80/54/478898054.db2.gz SSPILXNGTTVEIH-GFCCVEGCSA-N 0 3 335.379 2.680 20 5 EFBDHN C[C@@H]1CN(C(=O)c2c(F)cccc2[N+](=O)[O-])CCN(C2CCC2)C1 ZINC000601596782 478898502 /nfs/dbraw/zinc/89/85/02/478898502.db2.gz SSPILXNGTTVEIH-LBPRGKRZSA-N 0 3 335.379 2.680 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN[C@H]3[C@@H]4CCO[C@@H]4C34CCC4)nc2c1 ZINC000602639089 479440707 /nfs/dbraw/zinc/44/07/07/479440707.db2.gz ZTIFIHPZTSTCSV-UVBJJODRSA-N 0 3 328.372 2.518 20 5 EFBDHN O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1NC[C@@H](O)C(F)(F)F ZINC000616362980 479889269 /nfs/dbraw/zinc/88/92/69/479889269.db2.gz MROCXCDJZRNSQM-VHRBIJSZSA-N 0 3 332.322 2.819 20 5 EFBDHN CC[C@H](CN1CCCC1)NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000619819438 479889822 /nfs/dbraw/zinc/88/98/22/479889822.db2.gz GAZZRLZXEXHAAI-MRXNPFEDSA-N 0 3 348.447 2.653 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCCN(CC2CCC2)CC1 ZINC000619868383 479897990 /nfs/dbraw/zinc/89/79/90/479897990.db2.gz BFAOQBRWCUIKDV-UHFFFAOYSA-N 0 3 331.416 2.851 20 5 EFBDHN CN(CCCNC(=O)c1ccc([N+](=O)[O-])s1)Cc1ccccc1 ZINC000009982454 471725315 /nfs/dbraw/zinc/72/53/15/471725315.db2.gz DHOMBMATUSKSCQ-UHFFFAOYSA-N 0 3 333.413 2.908 20 5 EFBDHN Cc1ccc([C@H](CNC(=O)c2ccc([N+](=O)[O-])cc2)N(C)C)cc1 ZINC000010017893 471726475 /nfs/dbraw/zinc/72/64/75/471726475.db2.gz WZKLTJFGZBITMP-KRWDZBQOSA-N 0 3 327.384 2.936 20 5 EFBDHN CN(C)[C@@H]1Cc2ccccc2N(C(=O)Cc2ccccc2[N+](=O)[O-])C1 ZINC000067203667 472005150 /nfs/dbraw/zinc/00/51/50/472005150.db2.gz HFGZREVBJYFSQP-MRXNPFEDSA-N 0 3 339.395 2.657 20 5 EFBDHN Cc1ccc([C@@H](CNC(=O)Cc2ccccc2[N+](=O)[O-])N(C)C)cc1 ZINC000067269094 472012850 /nfs/dbraw/zinc/01/28/50/472012850.db2.gz YQMMHHSSOWVAIE-GOSISDBHSA-N 0 3 341.411 2.865 20 5 EFBDHN Cn1cnc([N+](=O)[O-])c1NC[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000067384797 472027298 /nfs/dbraw/zinc/02/72/98/472027298.db2.gz JXGMFBZJDNTMQX-HNNXBMFYSA-N 0 3 329.404 2.652 20 5 EFBDHN CN(C)[C@H](CNC(=O)Nc1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000024367729 472053221 /nfs/dbraw/zinc/05/32/21/472053221.db2.gz JRBQXAGCXFXYDM-KRWDZBQOSA-N 0 3 342.399 2.889 20 5 EFBDHN C[C@H](CNC(=O)NCc1ccccc1[N+](=O)[O-])N1CCC(C)CC1 ZINC000067706322 472076019 /nfs/dbraw/zinc/07/60/19/472076019.db2.gz IOBCXVRVOLEUGG-CQSZACIVSA-N 0 3 334.420 2.514 20 5 EFBDHN CN(C)Cc1ccc(CNC(=O)NCc2cccc([N+](=O)[O-])c2)cc1 ZINC000067725814 472079567 /nfs/dbraw/zinc/07/95/67/472079567.db2.gz IQWVYGMQSSJWSC-UHFFFAOYSA-N 0 3 342.399 2.656 20 5 EFBDHN CN(C)[C@H](CNC(=O)NCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000067725299 472079597 /nfs/dbraw/zinc/07/95/97/472079597.db2.gz JDGBOQLXAQSVBL-QGZVFWFLSA-N 0 3 342.399 2.697 20 5 EFBDHN CN(C)[C@@H](CNC(=O)NCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000067725294 472079682 /nfs/dbraw/zinc/07/96/82/472079682.db2.gz JDGBOQLXAQSVBL-KRWDZBQOSA-N 0 3 342.399 2.697 20 5 EFBDHN CCN(CC)[C@@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]1)c1ccccc1 ZINC000054374044 472082787 /nfs/dbraw/zinc/08/27/87/472082787.db2.gz AJSTVHNTJDVSFD-INIZCTEOSA-N 0 3 330.388 2.736 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)NCc2ccccc2CN(C)C)c1 ZINC000067785214 472089161 /nfs/dbraw/zinc/08/91/61/472089161.db2.gz WCFYDXLYTDLUMF-UHFFFAOYSA-N 0 3 343.383 2.595 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1CN1CCCCC1 ZINC000068132615 472139036 /nfs/dbraw/zinc/13/90/36/472139036.db2.gz CNFXWWMVPQXMIL-MRXNPFEDSA-N 0 3 331.416 2.994 20 5 EFBDHN O=C(Cc1ccccc1[N+](=O)[O-])N1CCC[C@@H]1CN1CCCCC1 ZINC000068134708 472140190 /nfs/dbraw/zinc/14/01/90/472140190.db2.gz UHJQXQRVKLUEAD-MRXNPFEDSA-N 0 3 331.416 2.614 20 5 EFBDHN CN(C[C@@H](O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CCc2ccccc21 ZINC000042626985 472152438 /nfs/dbraw/zinc/15/24/38/472152438.db2.gz HQIKAGHFDVKPHB-VQIMIIECSA-N 0 3 342.395 2.954 20 5 EFBDHN CN(C)CCN(Cc1cccs1)C(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000084250257 472160084 /nfs/dbraw/zinc/16/00/84/472160084.db2.gz XMTPUMNASMKKCW-UHFFFAOYSA-N 0 3 347.440 2.789 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H](CN2CCOCC2)C1 ZINC000075739305 472191035 /nfs/dbraw/zinc/19/10/35/472191035.db2.gz KDAYITYLYVDKCE-HZPDHXFCSA-N 0 3 333.432 2.700 20 5 EFBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H](CN2CCOCC2)C1 ZINC000075739303 472191075 /nfs/dbraw/zinc/19/10/75/472191075.db2.gz KDAYITYLYVDKCE-JKSUJKDBSA-N 0 3 333.432 2.700 20 5 EFBDHN C[C@@H](CN1CCCCC1)NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000027752975 472193592 /nfs/dbraw/zinc/19/35/92/472193592.db2.gz KWYFEWKTAPXPRT-NSHDSACASA-N 0 3 325.796 2.852 20 5 EFBDHN CCN1CCC(NC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000043331561 472224040 /nfs/dbraw/zinc/22/40/40/472224040.db2.gz RZVUGRDAGRRKCX-UHFFFAOYSA-N 0 3 326.784 2.854 20 5 EFBDHN CCN1CCC(NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000043342988 472224821 /nfs/dbraw/zinc/22/48/21/472224821.db2.gz FHAUPLPNALAHMY-UHFFFAOYSA-N 0 3 326.784 2.854 20 5 EFBDHN CN(C)[C@H]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000075956265 472227180 /nfs/dbraw/zinc/22/71/80/472227180.db2.gz YYXKYCRBNUVJCN-NSHDSACASA-N 0 3 326.784 2.806 20 5 EFBDHN Cc1cccc(C(=O)N[C@H](C)CN2C[C@H](C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000055757874 472235990 /nfs/dbraw/zinc/23/59/90/472235990.db2.gz AZBUBJQNVDVZBR-VNHYZAJKSA-N 0 3 333.432 2.999 20 5 EFBDHN CCOC(=O)[C@H]1CCCN(CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000055897503 472253169 /nfs/dbraw/zinc/25/31/69/472253169.db2.gz TYWRZTDXPLECSM-AWEZNQCLSA-N 0 3 336.388 2.639 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCCN2CCN(C3CCCC3)CC2)cc1 ZINC000055901372 472254044 /nfs/dbraw/zinc/25/40/44/472254044.db2.gz FYXSAJKBNUFMHF-UHFFFAOYSA-N 0 3 333.432 2.924 20 5 EFBDHN CN(C)Cc1ccc(NC(=O)COc2ccc([N+](=O)[O-])cc2)cc1 ZINC000029279037 472264605 /nfs/dbraw/zinc/26/46/05/472264605.db2.gz AJCXLGYSMAGRTP-UHFFFAOYSA-N 0 3 329.356 2.674 20 5 EFBDHN C[C@H](C1CC1)N(CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C1CC1 ZINC000029726173 472292191 /nfs/dbraw/zinc/29/21/91/472292191.db2.gz DBNDCBLUMLXKJM-GFCCVEGCSA-N 0 3 329.400 2.747 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000087102219 472306316 /nfs/dbraw/zinc/30/63/16/472306316.db2.gz ZROGUAYVDGMVFI-QGZVFWFLSA-N 0 3 346.431 2.537 20 5 EFBDHN CCn1ccc(CN(C)CCOc2ccc(OC)cc2[N+](=O)[O-])c1 ZINC000616786277 479976723 /nfs/dbraw/zinc/97/67/23/479976723.db2.gz RXIMFIVTKOQXFG-UHFFFAOYSA-N 0 3 333.388 2.936 20 5 EFBDHN C[C@H](CNC(=O)CCc1cccc([N+](=O)[O-])c1)N1CCC(C)CC1 ZINC000087204600 472315448 /nfs/dbraw/zinc/31/54/48/472315448.db2.gz UAFKJAPAUHQTGK-OAHLLOKOSA-N 0 3 333.432 2.764 20 5 EFBDHN C[C@H](CN1CCC[C@H](C)C1)NC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000056788695 472352848 /nfs/dbraw/zinc/35/28/48/472352848.db2.gz FTIKXTKHZQZMRQ-UONOGXRCSA-N 0 3 334.420 2.514 20 5 EFBDHN CN(C)Cc1cccc(CNC(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000031726023 472390836 /nfs/dbraw/zinc/39/08/36/472390836.db2.gz FKCHIBNAAHGPBY-UHFFFAOYSA-N 0 3 328.372 2.978 20 5 EFBDHN Cc1cccc(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)c1[N+](=O)[O-] ZINC000057288195 472409955 /nfs/dbraw/zinc/40/99/55/472409955.db2.gz CQGZPGRMYXWQTJ-MRXNPFEDSA-N 0 3 341.411 2.806 20 5 EFBDHN Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCCN1CC(C)C ZINC000154303733 472413710 /nfs/dbraw/zinc/41/37/10/472413710.db2.gz ZSXJUQLEZLRVLB-CQSZACIVSA-N 0 3 334.420 2.539 20 5 EFBDHN Cc1ccc(CN(C)C[C@H](O)COc2cccc([N+](=O)[O-])c2)s1 ZINC000077211537 472474510 /nfs/dbraw/zinc/47/45/10/472474510.db2.gz FZPFVCSNZKKRIV-AWEZNQCLSA-N 0 3 336.413 2.836 20 5 EFBDHN C[C@@H]1[C@H](C)SCCN1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000128671645 472482459 /nfs/dbraw/zinc/48/24/59/472482459.db2.gz SYLIHKHDKAIUQF-MNOVXSKESA-N 0 3 341.408 2.888 20 5 EFBDHN CN(C)CCOc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000046027053 472497175 /nfs/dbraw/zinc/49/71/75/472497175.db2.gz JNSRJJSYGKNWBC-UHFFFAOYSA-N 0 3 329.356 2.788 20 5 EFBDHN CC(C)(NCCOc1ccc([N+](=O)[O-])cc1)C(=O)NCC1CCCC1 ZINC000155141617 472513408 /nfs/dbraw/zinc/51/34/08/472513408.db2.gz ZJILKVUVMFUEKM-UHFFFAOYSA-N 0 3 349.431 2.648 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2nc(CN3CCN(CC4CC4)CC3)co2)cc1 ZINC000089886280 472534234 /nfs/dbraw/zinc/53/42/34/472534234.db2.gz WHFQMHAKEBUKKO-UHFFFAOYSA-N 0 3 342.399 2.777 20 5 EFBDHN COc1ccc(CNCCOc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000077506263 472542282 /nfs/dbraw/zinc/54/22/82/472542282.db2.gz CZLBOZVLGUAPSY-UHFFFAOYSA-N 0 3 332.356 2.781 20 5 EFBDHN COc1ccc(CNCCC(=O)Nc2ccccc2)cc1[N+](=O)[O-] ZINC000101586874 472543357 /nfs/dbraw/zinc/54/33/57/472543357.db2.gz HVJCQAQAXKXFEB-UHFFFAOYSA-N 0 3 329.356 2.722 20 5 EFBDHN CN(C)CCN(C(=O)Cc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000077542699 472550987 /nfs/dbraw/zinc/55/09/87/472550987.db2.gz KYVQEDZVHPRQKO-UHFFFAOYSA-N 0 3 333.432 2.860 20 5 EFBDHN C[C@]1(CNCc2cc3c(cc2[N+](=O)[O-])OCCO3)CCO[C@H]1C1CC1 ZINC000613426169 479995657 /nfs/dbraw/zinc/99/56/57/479995657.db2.gz SVQOHEZTRKRCBV-ZWKOTPCHSA-N 0 3 348.399 2.661 20 5 EFBDHN C[C@@]1(CNCc2cc3c(cc2[N+](=O)[O-])OCCO3)CCO[C@@H]1C1CC1 ZINC000613426149 479995667 /nfs/dbraw/zinc/99/56/67/479995667.db2.gz SVQOHEZTRKRCBV-MSOLQXFVSA-N 0 3 348.399 2.661 20 5 EFBDHN CC(C)(C)CNC(=O)C(C)(C)NCCOc1cccc([N+](=O)[O-])c1 ZINC000155533783 472563442 /nfs/dbraw/zinc/56/34/42/472563442.db2.gz MDDCFZQMDFFDMM-UHFFFAOYSA-N 0 3 337.420 2.504 20 5 EFBDHN CCN(C)CCNCc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000102425136 472577311 /nfs/dbraw/zinc/57/73/11/472577311.db2.gz JLEFAIUEZQWMCP-UHFFFAOYSA-N 0 3 333.388 2.905 20 5 EFBDHN C[C@@H](CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CCC[C@H](C)C1 ZINC000058891398 472610744 /nfs/dbraw/zinc/61/07/44/472610744.db2.gz RAWBYLONCZZGGR-STQMWFEESA-N 0 3 344.415 2.926 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[C@@H](N2CC=CC2)C1 ZINC000120040366 472619815 /nfs/dbraw/zinc/61/98/15/472619815.db2.gz XNXQXUXIBVKWKX-CQSZACIVSA-N 0 3 330.388 2.690 20 5 EFBDHN C[C@@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(-n2cnnn2)cc1 ZINC000155814727 472621132 /nfs/dbraw/zinc/62/11/32/472621132.db2.gz BPECKVZBIKQZGS-OLZOCXBDSA-N 0 3 338.371 2.982 20 5 EFBDHN C[C@@H](NCCn1cc([N+](=O)[O-])cn1)c1cccc(OC(F)F)c1 ZINC000090538942 472631323 /nfs/dbraw/zinc/63/13/23/472631323.db2.gz XELVLZQPTMQKQU-SNVBAGLBSA-N 0 3 326.303 2.744 20 5 EFBDHN C[C@H](NCCn1cc([N+](=O)[O-])cn1)c1ccc(Br)s1 ZINC000090537775 472632178 /nfs/dbraw/zinc/63/21/78/472632178.db2.gz FMSLCGIEKJRZDY-QMMMGPOBSA-N 0 3 345.222 2.966 20 5 EFBDHN CCN(CCn1cc([N+](=O)[O-])ccc1=O)[C@H](C)c1cccc(O)c1 ZINC000090551807 472635083 /nfs/dbraw/zinc/63/50/83/472635083.db2.gz APNZBVJCDIDXCK-CYBMUJFWSA-N 0 3 331.372 2.545 20 5 EFBDHN C[C@H]1[C@H](c2ccccc2)CCN1CCn1cc([N+](=O)[O-])ccc1=O ZINC000090552051 472635465 /nfs/dbraw/zinc/63/54/65/472635465.db2.gz SSFOZIJYRADJAM-WMLDXEAASA-N 0 3 327.384 2.635 20 5 EFBDHN CCN(CCNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)C1CC1 ZINC000120269761 472660090 /nfs/dbraw/zinc/66/00/90/472660090.db2.gz JKOZUCVSJSIMCS-UHFFFAOYSA-N 0 3 346.431 2.753 20 5 EFBDHN C[C@H]1CCCN(CCNC(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000047145597 472661070 /nfs/dbraw/zinc/66/10/70/472661070.db2.gz CFVFQXUPRVDELY-NSHDSACASA-N 0 3 325.796 2.710 20 5 EFBDHN C[C@@H](NCCc1cccc([N+](=O)[O-])c1)c1ccc(S(C)(=O)=O)cc1 ZINC000090909973 472663987 /nfs/dbraw/zinc/66/39/87/472663987.db2.gz IBENAPWLBUKRMA-CYBMUJFWSA-N 0 3 348.424 2.892 20 5 EFBDHN C[C@@H](NCc1ccnc(OCCN(C)C)c1)c1ccc([N+](=O)[O-])cc1 ZINC000090937404 472665918 /nfs/dbraw/zinc/66/59/18/472665918.db2.gz RQXXFSQMWASLFN-CQSZACIVSA-N 0 3 344.415 2.781 20 5 EFBDHN CC(C)CN(CCN(C)C)C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000104528811 472676284 /nfs/dbraw/zinc/67/62/84/472676284.db2.gz FZDGUNSFHPQIKS-UHFFFAOYSA-N 0 3 327.812 2.908 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCN(c3ccncc3)CC2)c2ccncc21 ZINC000072751716 472711826 /nfs/dbraw/zinc/71/18/26/472711826.db2.gz PILCMAAPZQZTJR-UHFFFAOYSA-N 0 3 335.367 2.865 20 5 EFBDHN COc1ccc(C(=O)Nc2cccc(CN(C)C)c2)cc1[N+](=O)[O-] ZINC000047452764 472715359 /nfs/dbraw/zinc/71/53/59/472715359.db2.gz NFNBHEWFSLGETB-UHFFFAOYSA-N 0 3 329.356 2.917 20 5 EFBDHN C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000120615686 472719660 /nfs/dbraw/zinc/71/96/60/472719660.db2.gz WKSJSZZNUJTDPV-LRDDRELGSA-N 0 3 346.431 2.581 20 5 EFBDHN Cc1ccc(NC(=O)COc2cccc([N+](=O)[O-])c2)c(CN(C)C)c1 ZINC000072840176 472726237 /nfs/dbraw/zinc/72/62/37/472726237.db2.gz FVXHULGLHLMCQL-UHFFFAOYSA-N 0 3 343.383 2.982 20 5 EFBDHN CN1CCO[C@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000105471018 472754281 /nfs/dbraw/zinc/75/42/81/472754281.db2.gz HLRSBGVTVFBRAN-OAHLLOKOSA-N 0 3 347.440 2.744 20 5 EFBDHN C[C@@H]1CN(CC2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C[C@@H](C)O1 ZINC000091478890 472771615 /nfs/dbraw/zinc/77/16/15/472771615.db2.gz VZINTOXJBNXSKZ-HUUCEWRRSA-N 0 3 333.432 2.920 20 5 EFBDHN CC(C)N(C)C(=O)C1CCN(CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000047925563 472782655 /nfs/dbraw/zinc/78/26/55/472782655.db2.gz SVTCMENSKVQFIJ-UHFFFAOYSA-N 0 3 349.431 2.552 20 5 EFBDHN Cc1ccc(CN(CCN(C)C)C(=O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000063497834 472782845 /nfs/dbraw/zinc/78/28/45/472782845.db2.gz DHQOGUHUYKAZTM-UHFFFAOYSA-N 0 3 331.372 2.700 20 5 EFBDHN CCc1nn(C)c(N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000091739537 472801021 /nfs/dbraw/zinc/80/10/21/472801021.db2.gz BDDLKVLPXRTQRG-UKRRQHHQSA-N 0 3 343.431 2.966 20 5 EFBDHN CC(C)(C)N1CCCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000063725865 472805956 /nfs/dbraw/zinc/80/59/56/472805956.db2.gz BUVOUSVGLZZDDR-MDZDMXLPSA-N 0 3 331.416 2.941 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CCC(OCc3ccc(F)cc3)CC2)n1 ZINC000091889882 472821484 /nfs/dbraw/zinc/82/14/84/472821484.db2.gz KGXLLTATYPZIOL-UHFFFAOYSA-N 0 3 348.378 2.612 20 5 EFBDHN COc1ccc(CN(C)CCO)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000157756609 472855545 /nfs/dbraw/zinc/85/55/45/472855545.db2.gz CHCILOJEDSEUDR-UHFFFAOYSA-N 0 3 346.383 2.607 20 5 EFBDHN C[C@H]1CCCN(C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000064820930 472880122 /nfs/dbraw/zinc/88/01/22/472880122.db2.gz WUUYURIMHWCFCN-NSHDSACASA-N 0 3 325.434 2.897 20 5 EFBDHN C[C@H](CN1CCC[C@@H](C)C1)NC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000073827660 472885063 /nfs/dbraw/zinc/88/50/63/472885063.db2.gz MFWIZNCMWDLYBK-HUUCEWRRSA-N 0 3 348.447 2.557 20 5 EFBDHN O=C(NCCN1CCCCCC1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000134584671 472933664 /nfs/dbraw/zinc/93/36/64/472933664.db2.gz FKQJJVXXKZEDEL-UHFFFAOYSA-N 0 3 325.796 2.854 20 5 EFBDHN C[C@@H](CN1CCCCC1)NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000134593964 472935223 /nfs/dbraw/zinc/93/52/23/472935223.db2.gz MLACHVJLUWSOCW-NSHDSACASA-N 0 3 325.796 2.852 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)ccc1N1CCC(CN2CCOCC2)CC1 ZINC000079929508 472944069 /nfs/dbraw/zinc/94/40/69/472944069.db2.gz NUUNKLXPHJIDJM-UHFFFAOYSA-N 0 3 339.823 2.797 20 5 EFBDHN C[C@H](CNC(=O)NCCc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](C)C1 ZINC000065511741 472960343 /nfs/dbraw/zinc/96/03/43/472960343.db2.gz XGGVQKWGJFDJTA-HUUCEWRRSA-N 0 3 348.447 2.557 20 5 EFBDHN CC(C)C[C@@H](CN[C@H](C)c1cccc([N+](=O)[O-])c1)N1CCOCC1 ZINC000122254205 472992890 /nfs/dbraw/zinc/99/28/90/472992890.db2.gz ZNUVCQUDOXDFRU-QAPCUYQASA-N 0 3 335.448 2.992 20 5 EFBDHN CCN1CCC[C@@H]1CNC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000074380875 472997819 /nfs/dbraw/zinc/99/78/19/472997819.db2.gz QVOSBMSBZLLAEH-QGZVFWFLSA-N 0 3 348.447 2.701 20 5 EFBDHN C[C@H]1C[C@@H](Nc2c([N+](=O)[O-])ncn2C)CCN1Cc1ccccc1 ZINC000080230979 472999133 /nfs/dbraw/zinc/99/91/33/472999133.db2.gz BYTALFDAEMGYCB-ZFWWWQNUSA-N 0 3 329.404 2.793 20 5 EFBDHN CC(C)N(CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)C1CCCC1 ZINC000108365570 473018906 /nfs/dbraw/zinc/01/89/06/473018906.db2.gz BHEGCCDMJCYGMM-UHFFFAOYSA-N 0 3 349.387 2.915 20 5 EFBDHN O=C1C[C@H]([C@H]2CCCCN2Cc2ccc([N+](=O)[O-])cc2Cl)CN1 ZINC000108495854 473033199 /nfs/dbraw/zinc/03/31/99/473033199.db2.gz IOAVQWGANKJWFZ-SWLSCSKDSA-N 0 3 337.807 2.739 20 5 EFBDHN Cc1ccccc1[C@H]1C[C@H](C)N(CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000159838281 473064094 /nfs/dbraw/zinc/06/40/94/473064094.db2.gz DGUQUJBETSSHAD-HOTGVXAUSA-N 0 3 341.411 2.943 20 5 EFBDHN CCN1CCCN(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000159890654 473069840 /nfs/dbraw/zinc/06/98/40/473069840.db2.gz HHYCRRJGKLBGOP-UHFFFAOYSA-N 0 3 348.447 2.655 20 5 EFBDHN COc1cc(C(=O)NCc2cccc(CN(C)C)c2)ccc1[N+](=O)[O-] ZINC000159989656 473078738 /nfs/dbraw/zinc/07/87/38/473078738.db2.gz PLNYQDLWYHIDDD-UHFFFAOYSA-N 0 3 343.383 2.595 20 5 EFBDHN C[C@H]1C[C@H](N(C)C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CCN1C ZINC000135655116 473104316 /nfs/dbraw/zinc/10/43/16/473104316.db2.gz IVGAUQYVYJMNMA-GXTWGEPZSA-N 0 3 344.415 2.560 20 5 EFBDHN COC(=O)CCN(C/C=C/c1ccccc1[N+](=O)[O-])C[C@H]1CCCO1 ZINC000093460583 473112718 /nfs/dbraw/zinc/11/27/18/473112718.db2.gz CVTMWMSSTOLBAF-IEXSPKMKSA-N 0 3 348.399 2.652 20 5 EFBDHN COCc1ccc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000093534376 473116128 /nfs/dbraw/zinc/11/61/28/473116128.db2.gz OCUKOVJBSMVFOS-MRXNPFEDSA-N 0 3 342.399 2.823 20 5 EFBDHN CN(Cc1ccccc1)[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000081121142 473150244 /nfs/dbraw/zinc/15/02/44/473150244.db2.gz WQCXGJQCNKBDCV-SFHVURJKSA-N 0 3 339.395 2.941 20 5 EFBDHN C[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1)N(C)Cc1ccccc1 ZINC000110355768 473153874 /nfs/dbraw/zinc/15/38/74/473153874.db2.gz HEJQQAUVOSQLSR-CQSZACIVSA-N 0 3 327.384 2.845 20 5 EFBDHN CCN(CCc1ccccc1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000052968896 473169519 /nfs/dbraw/zinc/16/95/19/473169519.db2.gz IICRWWNECUBWRZ-UHFFFAOYSA-N 0 3 327.384 2.758 20 5 EFBDHN COc1ccc(OCCN(C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000136819567 473177389 /nfs/dbraw/zinc/17/73/89/473177389.db2.gz QPYIOBNNYZDENY-GOSISDBHSA-N 0 3 346.383 2.648 20 5 EFBDHN CCOc1ccc(C(=O)N2CCC[C@@H]2CN2CCCC2)cc1[N+](=O)[O-] ZINC000066945422 473180755 /nfs/dbraw/zinc/18/07/55/473180755.db2.gz DJVWKSLJRRMIPZ-OAHLLOKOSA-N 0 3 347.415 2.694 20 5 EFBDHN CC(C)(C)CCN1CCN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000136984647 473189232 /nfs/dbraw/zinc/18/92/32/473189232.db2.gz WJHUNVKFMWJYQI-QGZVFWFLSA-N 0 3 335.448 2.682 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H]2CC[C@@H](C1)N2C ZINC000185428256 473423468 /nfs/dbraw/zinc/42/34/68/473423468.db2.gz AVXHMTRLUIRYTF-JZXOWHBKSA-N 0 3 345.443 2.859 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H]2CC[C@@H](C1)N2C ZINC000185428275 473424049 /nfs/dbraw/zinc/42/40/49/473424049.db2.gz AVXHMTRLUIRYTF-NUJGCVRESA-N 0 3 345.443 2.859 20 5 EFBDHN COc1cc(C(=O)N[C@H](C)CN2CCCCCC2)ccc1[N+](=O)[O-] ZINC000185436733 473426643 /nfs/dbraw/zinc/42/66/43/473426643.db2.gz MQEIPUZFHJCJLJ-CYBMUJFWSA-N 0 3 335.404 2.598 20 5 EFBDHN CCOC(=O)CC1CCN(CCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000125561107 473427176 /nfs/dbraw/zinc/42/71/76/473427176.db2.gz SNZIHONNYXGDIS-UHFFFAOYSA-N 0 3 336.388 2.639 20 5 EFBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H](C)N(C)C1CC1 ZINC000171695756 473440725 /nfs/dbraw/zinc/44/07/25/473440725.db2.gz YZCVHKBRBAVTEV-AWEZNQCLSA-N 0 3 348.447 2.998 20 5 EFBDHN CC(C)N(Cc1cccnc1)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000125673677 473444286 /nfs/dbraw/zinc/44/42/86/473444286.db2.gz JKEJHTSYJVFKNH-KRWDZBQOSA-N 0 3 345.399 2.640 20 5 EFBDHN CC(C)C[C@@H](CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)N(C)C ZINC000114377741 473457416 /nfs/dbraw/zinc/45/74/16/473457416.db2.gz GQHOPGUFNKDANP-HNNXBMFYSA-N 0 3 348.447 2.875 20 5 EFBDHN C[C@@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])[C@H]1COc2ccccc21 ZINC000185579602 473460719 /nfs/dbraw/zinc/46/07/19/473460719.db2.gz CLUPDLBBHZTMRN-TZMCWYRMSA-N 0 3 341.367 2.688 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCN(CCO)[C@@H]2CCc3ccccc32)c1 ZINC000114467065 473469007 /nfs/dbraw/zinc/46/90/07/473469007.db2.gz CGXQOPFNZVVBBD-LJQANCHMSA-N 0 3 342.395 2.955 20 5 EFBDHN COC(=O)COc1ccc([C@H](C)NCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000185655076 473480272 /nfs/dbraw/zinc/48/02/72/473480272.db2.gz KFZGFUVESYVDIN-ZDUSSCGKSA-N 0 3 344.367 2.997 20 5 EFBDHN COC(=O)COc1ccc([C@@H](C)NCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000185655098 473480884 /nfs/dbraw/zinc/48/08/84/473480884.db2.gz KFZGFUVESYVDIN-CYBMUJFWSA-N 0 3 344.367 2.997 20 5 EFBDHN CCn1c(SC[C@H]2CCN(C)C2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000191197779 473504512 /nfs/dbraw/zinc/50/45/12/473504512.db2.gz XFWUVQJXINEFNF-LBPRGKRZSA-N 0 3 347.444 2.917 20 5 EFBDHN CC(C)N(CCN(C)C)C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000151892438 473504763 /nfs/dbraw/zinc/50/47/63/473504763.db2.gz SISHBJQZUFJKEB-ZDUSSCGKSA-N 0 3 339.461 2.874 20 5 EFBDHN CC(C)N(CCN(C)C)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000151899495 473506029 /nfs/dbraw/zinc/50/60/29/473506029.db2.gz JVXZGBIOGSCBPH-UHFFFAOYSA-N 0 3 348.447 2.607 20 5 EFBDHN Cc1c(Br)c(NC[C@H]2CCCN(C)C2)ncc1[N+](=O)[O-] ZINC000165750011 473515387 /nfs/dbraw/zinc/51/53/87/473515387.db2.gz NAOIZQAFRZYHQA-SNVBAGLBSA-N 0 3 343.225 2.814 20 5 EFBDHN C[C@H](NC(=O)N(C)C[C@@H]1CCCN(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000172138955 473532322 /nfs/dbraw/zinc/53/23/22/473532322.db2.gz SPVKVKBZWPYKQF-UONOGXRCSA-N 0 3 334.420 2.639 20 5 EFBDHN CCC1(CC)[C@H](NCc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@H](C)[C@@H]1OC ZINC000191395194 473534680 /nfs/dbraw/zinc/53/46/80/473534680.db2.gz RXQLDXFTSITLAM-XZJROXQQSA-N 0 3 349.431 2.623 20 5 EFBDHN CC(C)(C)OC(=O)NC[C@@H]1CCN(CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000170647412 473573478 /nfs/dbraw/zinc/57/34/78/473573478.db2.gz MACZHVKGDIVNMF-HNNXBMFYSA-N 0 3 349.431 2.984 20 5 EFBDHN CC(=O)N1CC[C@@H](NCc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000152888404 473598122 /nfs/dbraw/zinc/59/81/22/473598122.db2.gz CQJPZOHFYZRAKD-CYBMUJFWSA-N 0 3 329.356 2.565 20 5 EFBDHN O=C(c1ccc([N+](=O)[O-])cc1F)N1CCCN(C2CCCC2)CC1 ZINC000172416931 473605616 /nfs/dbraw/zinc/60/56/16/473605616.db2.gz FHJXYRKIBMSLAB-UHFFFAOYSA-N 0 3 335.379 2.824 20 5 EFBDHN C[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N(C)C1CC1 ZINC000170794120 473615847 /nfs/dbraw/zinc/61/58/47/473615847.db2.gz PZZGJNCYVGMAJS-SECBINFHSA-N 0 3 326.784 2.852 20 5 EFBDHN CC(C)C[C@@H]1OCCC[C@H]1NCC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000186305400 473644258 /nfs/dbraw/zinc/64/42/58/473644258.db2.gz RWKLMDAZOCBRIW-SJORKVTESA-N 0 3 349.431 2.741 20 5 EFBDHN C[C@@H]1c2ccccc2CCN1C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000170956271 473654799 /nfs/dbraw/zinc/65/47/99/473654799.db2.gz BLEWYGBFFYMVTR-PBHICJAKSA-N 0 3 342.395 2.954 20 5 EFBDHN O=C(NCC1CC1)[C@H]1CCCN(C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000179341034 473676846 /nfs/dbraw/zinc/67/68/46/473676846.db2.gz ZDGFIQNLHCYETF-ZVVFDCPKSA-N 0 3 343.427 2.846 20 5 EFBDHN CCn1nc(C)c([N+](=O)[O-])c1NCCCN1CCc2ccccc2C1 ZINC000192486664 473684687 /nfs/dbraw/zinc/68/46/87/473684687.db2.gz BVMWOANCYXYWOK-UHFFFAOYSA-N 0 3 343.431 2.980 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@H](C)CN2CCCC2=O)cc1[N+](=O)[O-] ZINC000179405583 473684749 /nfs/dbraw/zinc/68/47/49/473684749.db2.gz KTWXVBLNKYTNDL-OLZOCXBDSA-N 0 3 335.404 2.655 20 5 EFBDHN CCn1nc(C)c([N+](=O)[O-])c1NCc1ccc(OCCN(C)C)cc1 ZINC000192506709 473687173 /nfs/dbraw/zinc/68/71/73/473687173.db2.gz KFXSZDAEBAQEMJ-UHFFFAOYSA-N 0 3 347.419 2.672 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CN2CC[C@@]3(C2)OCc2ccccc23)c1 ZINC000186614522 473699918 /nfs/dbraw/zinc/69/99/18/473699918.db2.gz JJJIGLZSMVOOQR-OALUTQOASA-N 0 3 340.379 2.760 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)C2CCN(C3CC3)CC2)cc1[N+](=O)[O-] ZINC000192681088 473704804 /nfs/dbraw/zinc/70/48/04/473704804.db2.gz HUQFQEQGGPACOH-ZDUSSCGKSA-N 0 3 331.416 2.955 20 5 EFBDHN CC[C@@H]1CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)CCCO1 ZINC000281398328 473706082 /nfs/dbraw/zinc/70/60/82/473706082.db2.gz NJFDRVSZPQEYNJ-OAHLLOKOSA-N 0 3 335.404 2.733 20 5 EFBDHN C[C@@H]1[C@H](C)NCCN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000262763012 473720783 /nfs/dbraw/zinc/72/07/83/473720783.db2.gz ISLKRYJPNJJHGG-WDEREUQCSA-N 0 3 346.412 2.541 20 5 EFBDHN C[C@@H]1NCCN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H]1C ZINC000262763011 473721002 /nfs/dbraw/zinc/72/10/02/473721002.db2.gz ISLKRYJPNJJHGG-QWRGUYRKSA-N 0 3 346.412 2.541 20 5 EFBDHN C[C@@H]1CCCC[C@@H]1N(C)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000192799202 473727822 /nfs/dbraw/zinc/72/78/22/473727822.db2.gz SWDYRKRKWBGNDM-YPMHNXCESA-N 0 3 349.387 2.773 20 5 EFBDHN CN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC000269204577 473731058 /nfs/dbraw/zinc/73/10/58/473731058.db2.gz PPFFFNIDKKGEJG-DZGCQCFKSA-N 0 3 342.399 2.632 20 5 EFBDHN CC1(C)COCCN1CCN[C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192816601 473731441 /nfs/dbraw/zinc/73/14/41/473731441.db2.gz VCBGCDMSYJNSNN-KRWDZBQOSA-N 0 3 333.432 2.673 20 5 EFBDHN C[C@H](NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCOCC1 ZINC000179841988 473739073 /nfs/dbraw/zinc/73/90/73/473739073.db2.gz BYGNMCMBZNXJIK-NSHDSACASA-N 0 3 332.360 2.550 20 5 EFBDHN CN1CCN(CCNc2ccc(Cl)cc2[N+](=O)[O-])CC1(C)C ZINC000281560610 473765596 /nfs/dbraw/zinc/76/55/96/473765596.db2.gz CZQBFRTVIDRHRH-UHFFFAOYSA-N 0 3 326.828 2.686 20 5 EFBDHN CC(C)(C)CCN1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000173188096 473765997 /nfs/dbraw/zinc/76/59/97/473765997.db2.gz GKGWWLKCHIRUDK-UHFFFAOYSA-N 0 3 333.432 2.718 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)CN2C[C@@H](C)C[C@H](C)C2)c1 ZINC000173229593 473775089 /nfs/dbraw/zinc/77/50/89/473775089.db2.gz INDFQVPJDAXFED-SOUVJXGZSA-N 0 3 333.432 2.999 20 5 EFBDHN CC(C)(NC[C@@H](O)COc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000263667875 473798917 /nfs/dbraw/zinc/79/89/17/473798917.db2.gz FTODYMKDTYPDLT-MRXNPFEDSA-N 0 3 330.384 2.859 20 5 EFBDHN CC(C)(NC[C@H](O)COc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000263667872 473799098 /nfs/dbraw/zinc/79/90/98/473799098.db2.gz FTODYMKDTYPDLT-INIZCTEOSA-N 0 3 330.384 2.859 20 5 EFBDHN Cc1ccc(CN(CCN(C)C)C(=O)Cc2cccc([N+](=O)[O-])c2)o1 ZINC000173309080 473801608 /nfs/dbraw/zinc/80/16/08/473801608.db2.gz GVHYJALXVUQRMZ-UHFFFAOYSA-N 0 3 345.399 2.629 20 5 EFBDHN CSc1cccc(C(=O)N(C)CC2(N(C)C)CCC2)c1[N+](=O)[O-] ZINC000187030073 473804648 /nfs/dbraw/zinc/80/46/48/473804648.db2.gz PJMUNNYZLYDHGO-UHFFFAOYSA-N 0 3 337.445 2.873 20 5 EFBDHN CN1CCC(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000173359613 473816081 /nfs/dbraw/zinc/81/60/81/473816081.db2.gz ZWIWPROVMGMMRR-UHFFFAOYSA-N 0 3 332.429 2.902 20 5 EFBDHN C[C@H]1CN(CC2CCN(Cc3ccccc3[N+](=O)[O-])CC2)C[C@H](C)O1 ZINC000263739043 473827959 /nfs/dbraw/zinc/82/79/59/473827959.db2.gz NEAHHEQMGTVEJE-HOTGVXAUSA-N 0 3 347.459 2.916 20 5 EFBDHN O=C1CC[C@H]2CN(CCc3ccc([N+](=O)[O-])cc3)CC[C@H]2N1C1CC1 ZINC000246322344 473828962 /nfs/dbraw/zinc/82/89/62/473828962.db2.gz RUHKNSIRJNKLDX-MAUKXSAKSA-N 0 3 343.427 2.613 20 5 EFBDHN COc1cc(OC)cc([C@@H](O)CN[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173426416 473834605 /nfs/dbraw/zinc/83/46/05/473834605.db2.gz UKYMBBWIBAZPFL-XIKOKIGWSA-N 0 3 346.383 2.996 20 5 EFBDHN Cc1ccoc1C(=O)NCCCN[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000173432622 473836569 /nfs/dbraw/zinc/83/65/69/473836569.db2.gz BSCKLSVNVLIMAJ-CYBMUJFWSA-N 0 3 331.372 2.967 20 5 EFBDHN CN(C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H](CCO)c1ccccc1 ZINC000269632497 473850656 /nfs/dbraw/zinc/85/06/56/473850656.db2.gz FZWRZSHXYHIHPN-ZWKOTPCHSA-N 0 3 330.384 2.684 20 5 EFBDHN O=C(NCCc1ccccc1[N+](=O)[O-])[C@H]1CCCN1C1CCCC1 ZINC000269658496 473856223 /nfs/dbraw/zinc/85/62/23/473856223.db2.gz JKPGCKNYKAXSDR-QGZVFWFLSA-N 0 3 331.416 2.661 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CN2CCN(CC3CCCCC3)CC2)c1 ZINC000269677250 473856656 /nfs/dbraw/zinc/85/66/56/473856656.db2.gz QAUGLJLXUSPVFL-IBGZPJMESA-N 0 3 347.459 2.826 20 5 EFBDHN CCn1c(C)nc([N+](=O)[O-])c1N1CCCN(Cc2ccccc2)CC1 ZINC000288200132 473873055 /nfs/dbraw/zinc/87/30/55/473873055.db2.gz SPMYZCIHTKDDHT-UHFFFAOYSA-N 0 3 343.431 2.832 20 5 EFBDHN Cc1ccccc1OC[C@@H](O)CN[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180435953 473876976 /nfs/dbraw/zinc/87/69/76/473876976.db2.gz KIFOWHMDYUPPDD-PBHICJAKSA-N 0 3 330.384 2.994 20 5 EFBDHN Cc1ccccc1OC[C@H](O)CN[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180435902 473876989 /nfs/dbraw/zinc/87/69/89/473876989.db2.gz KIFOWHMDYUPPDD-WMLDXEAASA-N 0 3 330.384 2.994 20 5 EFBDHN CS[C@H]1CN(c2ccc(F)cc2[N+](=O)[O-])C[C@H]1N1CCCC1 ZINC000274677923 473917740 /nfs/dbraw/zinc/91/77/40/473917740.db2.gz MZZDNNIABVWOKX-CABCVRRESA-N 0 3 325.409 2.750 20 5 EFBDHN C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000288389062 473927432 /nfs/dbraw/zinc/92/74/32/473927432.db2.gz MDJVOWQJZOFACH-YPMHNXCESA-N 0 3 337.807 2.947 20 5 EFBDHN CS[C@H]1CN(c2ccc([N+](=O)[O-])cc2F)C[C@H]1N1CCCC1 ZINC000274713170 473930916 /nfs/dbraw/zinc/93/09/16/473930916.db2.gz YSKNJVXDXUQMTQ-CABCVRRESA-N 0 3 325.409 2.750 20 5 EFBDHN C[C@H](N[C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])c1nncn1C ZINC000269989486 473944710 /nfs/dbraw/zinc/94/47/10/473944710.db2.gz GDVHZQUGNGZROX-GZBFAFLISA-N 0 3 329.404 2.785 20 5 EFBDHN C[C@H](N[C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])c1nncn1C ZINC000269989484 473944831 /nfs/dbraw/zinc/94/48/31/473944831.db2.gz GDVHZQUGNGZROX-GUTXKFCHSA-N 0 3 329.404 2.785 20 5 EFBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@@H](CN2CCOCC2)C1 ZINC000282121205 473952875 /nfs/dbraw/zinc/95/28/75/473952875.db2.gz JLWIXUJBZFQBPH-HOTGVXAUSA-N 0 3 333.432 2.700 20 5 EFBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H](CN2CCOCC2)C1 ZINC000282130964 473955195 /nfs/dbraw/zinc/95/51/95/473955195.db2.gz KDAYITYLYVDKCE-HOTGVXAUSA-N 0 3 333.432 2.700 20 5 EFBDHN CSc1cccc(C(=O)NCCN2CCC[C@@H](C)C2)c1[N+](=O)[O-] ZINC000188058897 473966424 /nfs/dbraw/zinc/96/64/24/473966424.db2.gz PXULZZGFCNUPHI-GFCCVEGCSA-N 0 3 337.445 2.778 20 5 EFBDHN CSc1cccc(C(=O)N[C@H]2C[C@H](C)N(C3CC3)C2)c1[N+](=O)[O-] ZINC000188188643 474012989 /nfs/dbraw/zinc/01/29/89/474012989.db2.gz ZUXPHDFABWYRLI-QWRGUYRKSA-N 0 3 335.429 2.672 20 5 EFBDHN CSc1cccc(C(=O)N[C@@H]2C[C@@H](C)N(C3CC3)C2)c1[N+](=O)[O-] ZINC000188188669 474013159 /nfs/dbraw/zinc/01/31/59/474013159.db2.gz ZUXPHDFABWYRLI-GHMZBOCLSA-N 0 3 335.429 2.672 20 5 EFBDHN Cc1c(NC(=O)N2CC[C@H](N3CCCCC3)C2)cccc1[N+](=O)[O-] ZINC000264525505 474024460 /nfs/dbraw/zinc/02/44/60/474024460.db2.gz XGEXHYSPWBNZPC-AWEZNQCLSA-N 0 3 332.404 2.995 20 5 EFBDHN CCn1nc(C)c([N+](=O)[O-])c1N1CCCN(Cc2ccccc2)CC1 ZINC000195340856 474061295 /nfs/dbraw/zinc/06/12/95/474061295.db2.gz DYSFNPBCWYZTRS-UHFFFAOYSA-N 0 3 343.431 2.832 20 5 EFBDHN CC[NH+](CC)Cc1ccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)cc1 ZINC000188353569 474068070 /nfs/dbraw/zinc/06/80/70/474068070.db2.gz PGLOOHXKTFKVOE-UHFFFAOYSA-N 0 3 344.371 2.790 20 5 EFBDHN CCOc1ccc([C@@H](C)NCC2([S@@](C)=O)CC2)cc1[N+](=O)[O-] ZINC000282476956 474079983 /nfs/dbraw/zinc/07/99/83/474079983.db2.gz WRKKQIASHXKGPX-RKFFSXRUSA-N 0 3 326.418 2.555 20 5 EFBDHN CN(C)Cc1ccc(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000195473274 474080760 /nfs/dbraw/zinc/08/07/60/474080760.db2.gz SLIHLBQGPRBPEF-UHFFFAOYSA-N 0 3 327.384 2.929 20 5 EFBDHN C[C@H](CNc1ccc(C(N)=O)cc1[N+](=O)[O-])N(C)Cc1ccccc1 ZINC000264684114 474086785 /nfs/dbraw/zinc/08/67/85/474086785.db2.gz APIZDRMIWCLIAK-CYBMUJFWSA-N 0 3 342.399 2.626 20 5 EFBDHN C[C@H](NCCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)c1cn[nH]c1 ZINC000275182522 474096222 /nfs/dbraw/zinc/09/62/22/474096222.db2.gz NLBOXQKUHOFDJN-NSHDSACASA-N 0 3 327.344 2.866 20 5 EFBDHN CSc1ccc(C(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)cc1[N+](=O)[O-] ZINC000247303337 474112716 /nfs/dbraw/zinc/11/27/16/474112716.db2.gz PMRUSLNELAIKJD-KBPBESRZSA-N 0 3 349.456 2.873 20 5 EFBDHN Cc1ccccc1[C@@H](C)NC[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182176291 474115795 /nfs/dbraw/zinc/11/57/95/474115795.db2.gz PMPFANFFDVAMMF-HUUCEWRRSA-N 0 3 330.384 2.994 20 5 EFBDHN Cc1nn(C)c(C)c1[C@H]1OCC[C@@H]1NCc1cccc([N+](=O)[O-])c1C ZINC000275246840 474117201 /nfs/dbraw/zinc/11/72/01/474117201.db2.gz GELYVULYRJMXAL-YJBOKZPZSA-N 0 3 344.415 2.873 20 5 EFBDHN CC(C)N(CCn1cc([N+](=O)[O-])ccc1=O)Cc1ccc(F)cc1 ZINC000270460483 474128144 /nfs/dbraw/zinc/12/81/44/474128144.db2.gz AECVLMAQRDILRF-UHFFFAOYSA-N 0 3 333.363 2.806 20 5 EFBDHN COc1cc(C(=O)N[C@H](C)CN2CCCCC2)cc([N+](=O)[O-])c1C ZINC000188589980 474135373 /nfs/dbraw/zinc/13/53/73/474135373.db2.gz RDCICGIIRADOMP-GFCCVEGCSA-N 0 3 335.404 2.516 20 5 EFBDHN Cc1cc(N2CCC(N3CCN(C(C)C)CC3)CC2)ccc1[N+](=O)[O-] ZINC000270519073 474152598 /nfs/dbraw/zinc/15/25/98/474152598.db2.gz ZPKMGVGLJXIXGJ-UHFFFAOYSA-N 0 3 346.475 2.898 20 5 EFBDHN COc1ccc([C@H](CCO)NCCOc2cccc([N+](=O)[O-])c2)cc1 ZINC000182389163 474164079 /nfs/dbraw/zinc/16/40/79/474164079.db2.gz RAGMLYGYFQIZHO-SFHVURJKSA-N 0 3 346.383 2.696 20 5 EFBDHN CN(CCc1ccc([N+](=O)[O-])cc1)C[C@@H](O)COCc1ccccc1 ZINC000265017927 474164651 /nfs/dbraw/zinc/16/46/51/474164651.db2.gz IMFOAQSYIVOSGL-LJQANCHMSA-N 0 3 344.411 2.647 20 5 EFBDHN C[C@H](NC(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21)c1cccc([N+](=O)[O-])c1 ZINC000182406042 474167895 /nfs/dbraw/zinc/16/78/95/474167895.db2.gz NYALQTLXRURIMD-LXZKKBNFSA-N 0 3 346.431 2.782 20 5 EFBDHN CCCN(CCn1cc([N+](=O)[O-])ccc1=O)Cc1ccc(F)cc1 ZINC000270571824 474173400 /nfs/dbraw/zinc/17/34/00/474173400.db2.gz NWDAHWFAHVBMCG-UHFFFAOYSA-N 0 3 333.363 2.808 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC1(c2cccc(F)c2)CC1 ZINC000182430403 474173982 /nfs/dbraw/zinc/17/39/82/474173982.db2.gz FGIXZHDYAGOJAN-HNNXBMFYSA-N 0 3 346.358 2.753 20 5 EFBDHN CC(C)(NC[C@@H](O)COc1ccccc1[N+](=O)[O-])c1cccc(F)c1 ZINC000182426949 474174135 /nfs/dbraw/zinc/17/41/35/474174135.db2.gz NOJNFNJALFNKNC-OAHLLOKOSA-N 0 3 348.374 2.999 20 5 EFBDHN CC(C)(NC[C@H](O)COc1ccccc1[N+](=O)[O-])c1cccc(F)c1 ZINC000182426929 474174418 /nfs/dbraw/zinc/17/44/18/474174418.db2.gz NOJNFNJALFNKNC-HNNXBMFYSA-N 0 3 348.374 2.999 20 5 EFBDHN CS[C@H]1CN(c2cccc(F)c2[N+](=O)[O-])C[C@@H]1N1CCCC1 ZINC000275431886 474183425 /nfs/dbraw/zinc/18/34/25/474183425.db2.gz ISGFOKDNZFAGPA-KBPBESRZSA-N 0 3 325.409 2.750 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nc(CNC[C@@H]3CC[C@H](O)C3)cs2)c1 ZINC000188846930 474214533 /nfs/dbraw/zinc/21/45/33/474214533.db2.gz XAJNOTXOSKWBHV-ABAIWWIYSA-N 0 3 333.413 2.969 20 5 EFBDHN CN(C)[C@@H](CNc1nc2sccn2c1[N+](=O)[O-])Cc1ccccc1 ZINC000248146037 474270332 /nfs/dbraw/zinc/27/03/32/474270332.db2.gz VWJUBLXOSXJLCC-CYBMUJFWSA-N 0 3 345.428 2.889 20 5 EFBDHN CC(C)(CNC(=O)CCNc1ccccc1[N+](=O)[O-])N1CCCCC1 ZINC000248148793 474271021 /nfs/dbraw/zinc/27/10/21/474271021.db2.gz FWXYTAITRBXPMC-UHFFFAOYSA-N 0 3 348.447 2.778 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCCN(C(C)C)C2)c1 ZINC000283109013 474305972 /nfs/dbraw/zinc/30/59/72/474305972.db2.gz MKRAAETVVACUPK-CYBMUJFWSA-N 0 3 335.404 2.596 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCCN(C(C)C)C2)c1 ZINC000283109016 474306733 /nfs/dbraw/zinc/30/67/33/474306733.db2.gz MKRAAETVVACUPK-ZDUSSCGKSA-N 0 3 335.404 2.596 20 5 EFBDHN CN1CC[C@@H]2CCN(C(=O)Nc3cccc([N+](=O)[O-])c3Cl)[C@H]2C1 ZINC000289540488 474314642 /nfs/dbraw/zinc/31/46/42/474314642.db2.gz DNMNQBJUJXDWKQ-MFKMUULPSA-N 0 3 338.795 2.806 20 5 EFBDHN CN1CC[C@@H]2CCN(C(=O)Nc3cccc([N+](=O)[O-])c3Cl)[C@@H]2C1 ZINC000289540490 474315467 /nfs/dbraw/zinc/31/54/67/474315467.db2.gz DNMNQBJUJXDWKQ-ZWNOBZJWSA-N 0 3 338.795 2.806 20 5 EFBDHN C[C@@H]1CN(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)[C@@H]2CCCC[C@H]21 ZINC000248437618 474322630 /nfs/dbraw/zinc/32/26/30/474322630.db2.gz SOVYYXCVYHLGIG-RPVQJOFSSA-N 0 3 343.427 2.994 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@@H](N2CCCCC2)C1 ZINC000275814533 474327447 /nfs/dbraw/zinc/32/74/47/474327447.db2.gz VXUSFRPWIMPCPW-CQSZACIVSA-N 0 3 348.403 2.696 20 5 EFBDHN Cn1cccc1[C@H]1CCCN1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248457609 474330672 /nfs/dbraw/zinc/33/06/72/474330672.db2.gz MMJBCWIEZYNKSP-GDBMZVCRSA-N 0 3 345.399 2.510 20 5 EFBDHN C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000289588426 474335918 /nfs/dbraw/zinc/33/59/18/474335918.db2.gz IFORYXVDERPTIE-WCQYABFASA-N 0 3 337.807 2.947 20 5 EFBDHN COc1ccc(C(=O)Nc2ccccc2CCN(C)C)cc1[N+](=O)[O-] ZINC000275841618 474337511 /nfs/dbraw/zinc/33/75/11/474337511.db2.gz MKYFJPQHPQZCPD-UHFFFAOYSA-N 0 3 343.383 2.960 20 5 EFBDHN CC(C)N(CCN(C)C)C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000183174668 474344235 /nfs/dbraw/zinc/34/42/35/474344235.db2.gz PLVPDFWUUMHFLZ-UHFFFAOYSA-N 0 3 345.346 2.608 20 5 EFBDHN C[C@H](C1CCN(C)CC1)N(C)C(=O)/C=C/c1ccccc1[N+](=O)[O-] ZINC000271053642 474386468 /nfs/dbraw/zinc/38/64/68/474386468.db2.gz UGRJVIMXOXOWCF-MYSGNRETSA-N 0 3 331.416 2.797 20 5 EFBDHN C[C@@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])o2)CCN1Cc1ccccc1 ZINC000176126946 474390110 /nfs/dbraw/zinc/39/01/10/474390110.db2.gz PNILHWGXUBTCTA-UKRRQHHQSA-N 0 3 343.383 2.971 20 5 EFBDHN C[C@H]1CN(CC(C)(C)O)CCN1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000189424608 474391741 /nfs/dbraw/zinc/39/17/41/474391741.db2.gz WIQHBWZATFCPBA-LBPRGKRZSA-N 0 3 341.839 2.525 20 5 EFBDHN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H]2CC[C@@H](C1)N2C ZINC000289726289 474396399 /nfs/dbraw/zinc/39/63/99/474396399.db2.gz IPJYEFGLPDQKDZ-HIFRSBDPSA-N 0 3 332.404 2.858 20 5 EFBDHN CCCNC(=O)CN[C@@H](CC)CSc1ccccc1[N+](=O)[O-] ZINC000271159313 474410767 /nfs/dbraw/zinc/41/07/67/474410767.db2.gz RUUWQBMHWAMHOC-LBPRGKRZSA-N 0 3 325.434 2.581 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CCC(Cc3cccc(F)c3)CC2)n1 ZINC000176211209 474411082 /nfs/dbraw/zinc/41/10/82/474411082.db2.gz PMARYQFHSFAYRK-UHFFFAOYSA-N 0 3 332.379 2.885 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1 ZINC000248714583 474412449 /nfs/dbraw/zinc/41/24/49/474412449.db2.gz BSTKBIWUBHPLFN-FVQBIDKESA-N 0 3 345.443 2.905 20 5 EFBDHN C[C@H]1CN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)[C@@H](C)CN1 ZINC000237588908 474434528 /nfs/dbraw/zinc/43/45/28/474434528.db2.gz MFVMIMPBBNCUNG-QWRGUYRKSA-N 0 3 346.412 2.541 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[C@@H](N2CCOCC2)[C@H]1C ZINC000289824531 474442835 /nfs/dbraw/zinc/44/28/35/474442835.db2.gz OHFVKDHSXBHEMY-IIDMSEBBSA-N 0 3 333.432 2.759 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NCCN2CCCC[C@@H]2C)c1 ZINC000283604115 474446929 /nfs/dbraw/zinc/44/69/29/474446929.db2.gz YSUZRIGHSKEHPP-ZDUSSCGKSA-N 0 3 335.404 2.598 20 5 EFBDHN CS[C@@H]1CN(c2ccc([N+](=O)[O-])c3cccnc32)C[C@@H]1N(C)C ZINC000271290402 474477463 /nfs/dbraw/zinc/47/74/63/474477463.db2.gz DYASYXPOHBEWFO-LSDHHAIUSA-N 0 3 332.429 2.625 20 5 EFBDHN Cc1cnn([C@H]2CCN(CCCOc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000289910529 474481731 /nfs/dbraw/zinc/48/17/31/474481731.db2.gz NXYMNEWUUFRIJU-INIZCTEOSA-N 0 3 330.388 2.816 20 5 EFBDHN CC(C)CN1CCO[C@H](CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000248997799 474503163 /nfs/dbraw/zinc/50/31/63/474503163.db2.gz PKWKVCIVIAJYOG-MJGOQNOKSA-N 0 3 347.459 2.919 20 5 EFBDHN Cn1cc(CNC[C@@H]2CCCCO2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000237925627 474505347 /nfs/dbraw/zinc/50/53/47/474505347.db2.gz VGWOVOQSMPDULR-INIZCTEOSA-N 0 3 330.388 2.654 20 5 EFBDHN Cc1ccc(C(=O)NC2CCN(CCOC(C)C)CC2)cc1[N+](=O)[O-] ZINC000176672945 474515649 /nfs/dbraw/zinc/51/56/49/474515649.db2.gz ULZAOSMGDDORJI-UHFFFAOYSA-N 0 3 349.431 2.522 20 5 EFBDHN CC[C@@H](NC(=O)N1CCN2CCC[C@@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000176687645 474516986 /nfs/dbraw/zinc/51/69/86/474516986.db2.gz MJOLBCWXQWBXRT-HZPDHXFCSA-N 0 3 332.404 2.536 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N2CCC[C@@H](N(C)C)C2)cc1[N+](=O)[O-] ZINC000176747169 474524916 /nfs/dbraw/zinc/52/49/16/474524916.db2.gz QMWWKMDNSQPQRU-DZGCQCFKSA-N 0 3 334.420 2.700 20 5 EFBDHN CSc1cccc(C(=O)N(C)[C@@H]2CCN(C)C[C@H]2C)c1[N+](=O)[O-] ZINC000249131815 474534889 /nfs/dbraw/zinc/53/48/89/474534889.db2.gz LYJNBCCRVUJYOO-DGCLKSJQSA-N 0 3 337.445 2.729 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@H](C)CC[S@@](C)=O)cc1[N+](=O)[O-] ZINC000271449112 474551719 /nfs/dbraw/zinc/55/17/19/474551719.db2.gz FLGBRRXBZQDYEG-HIMNYSJASA-N 0 3 328.434 2.801 20 5 EFBDHN Cc1cc(F)c(NC(=O)N(C)C[C@H]2CCCN(C)C2)cc1[N+](=O)[O-] ZINC000284114938 474576375 /nfs/dbraw/zinc/57/63/75/474576375.db2.gz TYHAHLVUGYHLPJ-LBPRGKRZSA-N 0 3 338.383 2.848 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCN1CCCCC1 ZINC000184693725 474586967 /nfs/dbraw/zinc/58/69/67/474586967.db2.gz BWPGISKUIOQUCG-INIZCTEOSA-N 0 3 333.432 2.766 20 5 EFBDHN COCc1cc([N+](=O)[O-])ccc1NC[C@]1(N(C)C)CCSC1 ZINC000267111858 474593692 /nfs/dbraw/zinc/59/36/92/474593692.db2.gz RGKIKDUBCSBKMX-OAHLLOKOSA-N 0 3 325.434 2.590 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H](N2CCCC2)C1 ZINC000184726513 474595175 /nfs/dbraw/zinc/59/51/75/474595175.db2.gz YNUFVKBYAWQNNL-WMZOPIPTSA-N 0 3 345.443 2.860 20 5 EFBDHN COc1ccc([C@H](CN(C)C)NCc2cccc([N+](=O)[O-])c2)cc1 ZINC000284209275 474596499 /nfs/dbraw/zinc/59/64/99/474596499.db2.gz ZKOFREDQILRROV-SFHVURJKSA-N 0 3 329.400 2.996 20 5 EFBDHN C[C@@H](NC(=O)NCCN1CCC[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000249692175 474604687 /nfs/dbraw/zinc/60/46/87/474604687.db2.gz VJVGGQPYNGYXLE-UONOGXRCSA-N 0 3 334.420 2.687 20 5 EFBDHN C[C@H](CN1CCCCC1)Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000267202931 474617248 /nfs/dbraw/zinc/61/72/48/474617248.db2.gz JSENYUZNWDGNLR-CYBMUJFWSA-N 0 3 346.431 2.773 20 5 EFBDHN CC1CCC(NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000272916759 474640804 /nfs/dbraw/zinc/64/08/04/474640804.db2.gz HUUFZJUKEWAEJV-UHFFFAOYSA-N 0 3 326.418 2.537 20 5 EFBDHN C[C@@H]1CCC[C@@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000272954354 474650055 /nfs/dbraw/zinc/65/00/55/474650055.db2.gz QSGHIEMVUXKSAZ-CHWSQXEVSA-N 0 3 326.418 2.537 20 5 EFBDHN CN1CC[C@]2(CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)C2)C1 ZINC000291711595 474655677 /nfs/dbraw/zinc/65/56/77/474655677.db2.gz GKQBANXONXKZLC-HNNXBMFYSA-N 0 3 338.795 2.808 20 5 EFBDHN C[C@H]1CN(CCC2CCN(c3ccc([N+](=O)[O-])cn3)CC2)C[C@H](C)O1 ZINC000267366338 474659617 /nfs/dbraw/zinc/65/96/17/474659617.db2.gz JBGQYQSMTRRHLC-GJZGRUSLSA-N 0 3 348.447 2.706 20 5 EFBDHN CC(C)(C)[C@@H](CO)NCc1ccc(Br)c([N+](=O)[O-])c1 ZINC000278493231 474660181 /nfs/dbraw/zinc/66/01/81/474660181.db2.gz LTTYPDDQTQSDPR-GFCCVEGCSA-N 0 3 331.210 2.854 20 5 EFBDHN CN(C[C@H]1CCCN(C)C1)c1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000278506390 474667834 /nfs/dbraw/zinc/66/78/34/474667834.db2.gz XSKCLVHPNNBURL-JTQLQIEISA-N 0 3 332.326 2.787 20 5 EFBDHN COc1cc(CNCC[C@H]2CCO[C@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000273034627 474682760 /nfs/dbraw/zinc/68/27/60/474682760.db2.gz GXIYWWULUWGZNL-OLZOCXBDSA-N 0 3 338.404 2.907 20 5 EFBDHN CC(C)[C@@H]1N(C[C@H](O)COc2ccccc2[N+](=O)[O-])CC12CCC2 ZINC000291796129 474691681 /nfs/dbraw/zinc/69/16/81/474691681.db2.gz AHDBNTHIBFNIJI-YOEHRIQHSA-N 0 3 334.416 2.845 20 5 EFBDHN COCC1(CCNCc2cc(OC)c(OC)cc2[N+](=O)[O-])CCC1 ZINC000292881165 474692504 /nfs/dbraw/zinc/69/25/04/474692504.db2.gz DYGJPQJETBDCNW-UHFFFAOYSA-N 0 3 338.404 2.908 20 5 EFBDHN C[C@]1(NCc2cc([N+](=O)[O-])cc3c2OCOC3)CCO[C@H]1C1CC1 ZINC000273052908 474692585 /nfs/dbraw/zinc/69/25/85/474692585.db2.gz KTVGKAWZWZGSHQ-IRXDYDNUSA-N 0 3 334.372 2.509 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CC[C@@H](Oc3ccc(Cl)cc3)C2)c1 ZINC000292901951 474705583 /nfs/dbraw/zinc/70/55/83/474705583.db2.gz AKNCRINGLIWVNE-OAHLLOKOSA-N 0 3 336.779 2.598 20 5 EFBDHN COc1ccc(OCCN2CCC[C@@H]2[C@@H]2CCCO2)c([N+](=O)[O-])c1 ZINC000284663345 474712870 /nfs/dbraw/zinc/71/28/70/474712870.db2.gz GOHMJIIVAACFBR-ZBFHGGJFSA-N 0 3 336.388 2.626 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@H](C(C)C)C1(CO)CCC1 ZINC000292926799 474718763 /nfs/dbraw/zinc/71/87/63/474718763.db2.gz CEDGFPAFVKDZBZ-QGZVFWFLSA-N 0 3 349.431 2.619 20 5 EFBDHN CN(Cc1ccccc1)C[C@H](O)COc1ccc([N+](=O)[O-])cc1F ZINC000305275786 474725376 /nfs/dbraw/zinc/72/53/76/474725376.db2.gz AVFOQBKFVNMJOD-HNNXBMFYSA-N 0 3 334.347 2.606 20 5 EFBDHN Cc1cccc(CN(C)C[C@H](O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000338951915 474770467 /nfs/dbraw/zinc/77/04/67/474770467.db2.gz WILFGQICFYDPJJ-KRWDZBQOSA-N 0 3 330.384 2.775 20 5 EFBDHN O=[N+]([O-])c1ccccc1NCc1ccccc1CN1CC[C@H](O)C1 ZINC000273242890 474798176 /nfs/dbraw/zinc/79/81/76/474798176.db2.gz UDBOPGPCMIVGOG-INIZCTEOSA-N 0 3 327.384 2.774 20 5 EFBDHN C[C@@H](CNC(=O)NCCc1ccccc1[N+](=O)[O-])N1CCC[C@H](C)C1 ZINC000340940346 474799749 /nfs/dbraw/zinc/79/97/49/474799749.db2.gz RBCPWAWBLIOMOC-GJZGRUSLSA-N 0 3 348.447 2.557 20 5 EFBDHN CN(C)CCOc1cccc(NC(=O)c2ccccc2[N+](=O)[O-])c1 ZINC000337236136 474810405 /nfs/dbraw/zinc/81/04/05/474810405.db2.gz CBRHOVDSMLAHKA-UHFFFAOYSA-N 0 3 329.356 2.788 20 5 EFBDHN COCC[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccc(C)o1 ZINC000273295418 474828278 /nfs/dbraw/zinc/82/82/78/474828278.db2.gz NEHNKMPLGSDIGM-HOTGVXAUSA-N 0 3 334.372 2.897 20 5 EFBDHN C[C@H](NCc1ccc2c(c1)OCCO2)c1ccc(N)c([N+](=O)[O-])c1 ZINC000284934108 474831076 /nfs/dbraw/zinc/83/10/76/474831076.db2.gz DNUPIHWGSABZGP-NSHDSACASA-N 0 3 329.356 2.799 20 5 EFBDHN COCCn1cc(CNC/C(C)=C\c2cccc([N+](=O)[O-])c2)cn1 ZINC000337258790 474834994 /nfs/dbraw/zinc/83/49/94/474834994.db2.gz ORQAKDPPILUPBY-ZSOIEALJSA-N 0 3 330.388 2.631 20 5 EFBDHN O=[N+]([O-])c1ccc(N2C[C@H]3CN(Cc4ccccc4)CC[C@@H]3C2)nc1 ZINC000311234512 474836726 /nfs/dbraw/zinc/83/67/26/474836726.db2.gz SLBCGGJUCLRICT-IAGOWNOFSA-N 0 3 338.411 2.948 20 5 EFBDHN CCCNC(=O)[C@H]1CCCN(C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000255336952 474837320 /nfs/dbraw/zinc/83/73/20/474837320.db2.gz UKYABIPMSAQKHH-SBSDFTTDSA-N 0 3 331.416 2.846 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N2CC[C@]3(CCN(C)C3)C2)cc1[N+](=O)[O-] ZINC000293153087 474842107 /nfs/dbraw/zinc/84/21/07/474842107.db2.gz BYKYGPCIKGKSDR-KSSFIOAISA-N 0 3 346.431 2.701 20 5 EFBDHN Cc1ccc(CN2CCN(C3CCOCC3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000278843508 474867190 /nfs/dbraw/zinc/86/71/90/474867190.db2.gz ZXOBSDOYNOPNJC-HNNXBMFYSA-N 0 3 333.432 2.588 20 5 EFBDHN CS[C@@H]1CN(c2cc(C)nc3c2cccc3[N+](=O)[O-])C[C@@H]1N(C)C ZINC000345077548 474870552 /nfs/dbraw/zinc/87/05/52/474870552.db2.gz USTYADXNGCMUMB-JKSUJKDBSA-N 0 3 346.456 2.933 20 5 EFBDHN C[C@H](NC[C@H]1COC2(CCCCC2)O1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000285054154 474876155 /nfs/dbraw/zinc/87/61/55/474876155.db2.gz IOICPUPBQJLQJC-JSGCOSHPSA-N 0 3 335.404 2.903 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1CN(C)C[C@@H]1CCCN1c1cccnn1 ZINC000273409267 474882495 /nfs/dbraw/zinc/88/24/95/474882495.db2.gz HNZXJWBZFPKISR-KRWDZBQOSA-N 0 3 341.415 2.794 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CN(C2CC2)C[C@H]1C ZINC000268241753 474883126 /nfs/dbraw/zinc/88/31/26/474883126.db2.gz VELVVWIBTZHOCX-BFQNTYOBSA-N 0 3 349.456 2.674 20 5 EFBDHN CN(CCC(=O)Nc1ccccc1[N+](=O)[O-])CCc1ccccc1O ZINC000337324279 474898504 /nfs/dbraw/zinc/89/85/04/474898504.db2.gz UGAPSIBHYFQBHN-UHFFFAOYSA-N 0 3 343.383 2.804 20 5 EFBDHN CS[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2C)C[C@H]1N1CCCC1 ZINC000273451888 474905531 /nfs/dbraw/zinc/90/55/31/474905531.db2.gz CVBNGTJTOLGCII-HZPDHXFCSA-N 0 3 349.456 2.555 20 5 EFBDHN CS[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2C)C[C@@H]1N1CCCC1 ZINC000273451884 474905981 /nfs/dbraw/zinc/90/59/81/474905981.db2.gz CVBNGTJTOLGCII-HOTGVXAUSA-N 0 3 349.456 2.555 20 5 EFBDHN CCOCC(C)(C)NCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000293289420 474910437 /nfs/dbraw/zinc/91/04/37/474910437.db2.gz OQZRJEOVOIJRBQ-UHFFFAOYSA-N 0 3 329.784 2.591 20 5 EFBDHN Cc1cc(NCCN2CCSCC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000323850805 474956469 /nfs/dbraw/zinc/95/64/69/474956469.db2.gz PMCDHQYPUUAQOV-UHFFFAOYSA-N 0 3 332.429 2.912 20 5 EFBDHN COCC[C@@]1(NCc2cc([N+](=O)[O-])ccc2C(F)(F)F)CCOC1 ZINC000339130923 474959733 /nfs/dbraw/zinc/95/97/33/474959733.db2.gz QFASPXZNMHNLNH-CQSZACIVSA-N 0 3 348.321 2.899 20 5 EFBDHN COCC[C@]1(NCc2cc([N+](=O)[O-])ccc2C(F)(F)F)CCOC1 ZINC000339130920 474960271 /nfs/dbraw/zinc/96/02/71/474960271.db2.gz QFASPXZNMHNLNH-AWEZNQCLSA-N 0 3 348.321 2.899 20 5 EFBDHN CCN(CC)[C@@H](CNc1ncc([N+](=O)[O-])cn1)c1cccc(OC)c1 ZINC000273601634 474984144 /nfs/dbraw/zinc/98/41/44/474984144.db2.gz JOXFZZHCQFNTIT-INIZCTEOSA-N 0 3 345.403 2.888 20 5 EFBDHN CCC[C@H](NC[C@H]1CN2CCC[C@H]2CO1)c1cccc([N+](=O)[O-])c1 ZINC000325810942 474994482 /nfs/dbraw/zinc/99/44/82/474994482.db2.gz KDIYOUJVTFONGM-BZSNNMDCSA-N 0 3 333.432 2.889 20 5 EFBDHN COc1ccc([C@H](CN2CCCC2)Nc2ncc([N+](=O)[O-])cn2)cc1 ZINC000273716070 475024749 /nfs/dbraw/zinc/02/47/49/475024749.db2.gz FYHPVPIARIFFFZ-INIZCTEOSA-N 0 3 343.387 2.642 20 5 EFBDHN Cc1ccc(C(=O)NC[C@@H]2NCCc3ccccc32)cc1[N+](=O)[O-] ZINC000261711765 475035364 /nfs/dbraw/zinc/03/53/64/475035364.db2.gz PTDLIFYDKMKAHD-INIZCTEOSA-N 0 3 325.368 2.520 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCN2CCNC[C@H]2c2cccc(F)c2)c1 ZINC000261764307 475055370 /nfs/dbraw/zinc/05/53/70/475055370.db2.gz OJDXXZZNEUWJOU-SFHVURJKSA-N 0 3 345.374 2.759 20 5 EFBDHN Cn1c(C(=O)NC[C@H](c2ccccc2)N2CCCC2)ccc1[N+](=O)[O-] ZINC000345312412 475084931 /nfs/dbraw/zinc/08/49/31/475084931.db2.gz ZBQYJNJCVMVVKK-MRXNPFEDSA-N 0 3 342.399 2.500 20 5 EFBDHN C[C@@H](c1ccccc1)N1CCC(Nc2c([N+](=O)[O-])ncn2C)CC1 ZINC000341492086 475087605 /nfs/dbraw/zinc/08/76/05/475087605.db2.gz WEKICYKNPWXHKN-ZDUSSCGKSA-N 0 3 329.404 2.966 20 5 EFBDHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)NC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000292625660 475122912 /nfs/dbraw/zinc/12/29/12/475122912.db2.gz OUUQBJLGPZLJMH-IUODEOHRSA-N 0 3 346.431 2.612 20 5 EFBDHN CC(C)(C(=O)NCCN1CCCCC1)c1ccc([N+](=O)[O-])cc1F ZINC000273961943 475137215 /nfs/dbraw/zinc/13/72/15/475137215.db2.gz PBAGBXLHKXWZOK-UHFFFAOYSA-N 0 3 337.395 2.614 20 5 EFBDHN CCc1nnc(CN[C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])[nH]1 ZINC000296035787 475173590 /nfs/dbraw/zinc/17/35/90/475173590.db2.gz NPWRQTBZKIYGRZ-GXTWGEPZSA-N 0 3 329.404 2.776 20 5 EFBDHN CCc1nnc(C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])[n-]1 ZINC000296035787 475173598 /nfs/dbraw/zinc/17/35/98/475173598.db2.gz NPWRQTBZKIYGRZ-GXTWGEPZSA-N 0 3 329.404 2.776 20 5 EFBDHN CN1CC[C@@H]2[C@H](CCCN2C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C1 ZINC000269115737 475177689 /nfs/dbraw/zinc/17/76/89/475177689.db2.gz NGGKYAMNTZQLSU-SJKOYZFVSA-N 0 3 342.399 2.632 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@]2(C1)CCCN(C)C2 ZINC000296159826 475211870 /nfs/dbraw/zinc/21/18/70/475211870.db2.gz KJVQJIQIOVIQAZ-QGZVFWFLSA-N 0 3 332.404 2.853 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCN1CCNC[C@@H]1c1cccc(F)c1 ZINC000262309310 475218236 /nfs/dbraw/zinc/21/82/36/475218236.db2.gz YRSSALCFKMFFFQ-QGZVFWFLSA-N 0 3 345.374 2.759 20 5 EFBDHN CCCCN(C)C[C@H](C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000296186693 475218798 /nfs/dbraw/zinc/21/87/98/475218798.db2.gz UPZLJYJLVGKVGC-AWEZNQCLSA-N 0 3 349.431 2.794 20 5 EFBDHN CCN(C(=O)c1cc([N+](=O)[O-])c[nH]1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000354538656 475231480 /nfs/dbraw/zinc/23/14/80/475231480.db2.gz FMSDRHCTUITREH-OAHLLOKOSA-N 0 3 342.399 2.660 20 5 EFBDHN C[C@H](C(=O)NC[C@@H]1CCCCN1C1CC1)c1ccc([N+](=O)[O-])cc1F ZINC000347328435 475235479 /nfs/dbraw/zinc/23/54/79/475235479.db2.gz AHUWBESNACVISU-WFASDCNBSA-N 0 3 349.406 2.971 20 5 EFBDHN CNc1c(C(=O)NCC(C)(C)N2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000361162373 475235512 /nfs/dbraw/zinc/23/55/12/475235512.db2.gz SRRQIBCDOBPCEH-CYBMUJFWSA-N 0 3 348.447 2.877 20 5 EFBDHN CNc1c(C(=O)N[C@H](C)CN2C[C@H](C)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000361180712 475250123 /nfs/dbraw/zinc/25/01/23/475250123.db2.gz UETWBTDCTSYILC-MGPQQGTHSA-N 0 3 348.447 2.733 20 5 EFBDHN COCCOC[C@H]1CCN(C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000347354036 475258869 /nfs/dbraw/zinc/25/88/69/475258869.db2.gz HZKWQGPTNQFGFK-MJSCBBHESA-N 0 3 334.416 2.983 20 5 EFBDHN O=C(NC[C@H]1CCCCN1C1CC1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000347354936 475259877 /nfs/dbraw/zinc/25/98/77/475259877.db2.gz GXKCFNREYLHSCM-CQSZACIVSA-N 0 3 337.807 2.995 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC2(CNC(=O)C2)CC1 ZINC000347373593 475275375 /nfs/dbraw/zinc/27/53/75/475275375.db2.gz RRSPFUGXPZDBPS-NTEUORMPSA-N 0 3 329.400 2.600 20 5 EFBDHN Cn1c(C(=O)NCCN2CCC3(CCCCC3)CC2)ccc1[N+](=O)[O-] ZINC000337760846 475302165 /nfs/dbraw/zinc/30/21/65/475302165.db2.gz ZIIVJEPWQLCLTF-UHFFFAOYSA-N 0 3 348.447 2.709 20 5 EFBDHN C[C@H]1CN(C)C[C@H]1c1nc(Cc2c[nH]c3ccc([N+](=O)[O-])cc23)no1 ZINC000361262775 475312557 /nfs/dbraw/zinc/31/25/57/475312557.db2.gz PKCIJNIAJPELTD-IINYFYTJSA-N 0 3 341.371 2.715 20 5 EFBDHN CCN(C(=O)c1ccc([N+](=O)[O-])[nH]1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000354763564 475390983 /nfs/dbraw/zinc/39/09/83/475390983.db2.gz BRFBGNDJRCTNRI-HNNXBMFYSA-N 0 3 342.399 2.660 20 5 EFBDHN C[C@@H]1C[C@H](NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)CCN1C ZINC000358094064 475395334 /nfs/dbraw/zinc/39/53/34/475395334.db2.gz MVYTYFPOESNGMY-VXGBXAGGSA-N 0 3 337.395 2.610 20 5 EFBDHN Cc1cc(F)c(NC(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000296685657 475429460 /nfs/dbraw/zinc/42/94/60/475429460.db2.gz IZJRCEOSYUVQKX-NWDGAFQWSA-N 0 3 338.383 2.989 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000296697926 475434180 /nfs/dbraw/zinc/43/41/80/475434180.db2.gz RSGPKDQCLYRILI-BBRMVZONSA-N 0 3 334.420 2.829 20 5 EFBDHN COc1cc(C(=O)NC[C@H](C)N2CCCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000337999760 475495557 /nfs/dbraw/zinc/49/55/57/475495557.db2.gz LDKKEASVESTYGB-OLZOCXBDSA-N 0 3 335.404 2.596 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[C@H](N2CCCC2)[C@H]1C ZINC000332081280 475504544 /nfs/dbraw/zinc/50/45/44/475504544.db2.gz LPTHBNFYLYQKHD-ZBFHGGJFSA-N 0 3 331.416 2.910 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1C(=O)NCc1ccc(CN(C)C)cc1 ZINC000338015794 475508257 /nfs/dbraw/zinc/50/82/57/475508257.db2.gz DSKARFBQTYIAQS-UHFFFAOYSA-N 0 3 327.384 2.895 20 5 EFBDHN O=C(CCN[C@@H]1CCc2c1cccc2O)Nc1ccccc1[N+](=O)[O-] ZINC000296863597 475511184 /nfs/dbraw/zinc/51/11/84/475511184.db2.gz UGGVAVXNAOFMLA-CQSZACIVSA-N 0 3 341.367 2.906 20 5 EFBDHN Cc1nc(N2CC[C@@H](C)N(Cc3ccccc3)CC2)ncc1[N+](=O)[O-] ZINC000296985453 475563974 /nfs/dbraw/zinc/56/39/74/475563974.db2.gz FADHEPZBTKZSOU-CQSZACIVSA-N 0 3 341.415 2.794 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCN([C@@H]3C[C@H]3C)C[C@@H](C)C2)c1 ZINC000346253131 475577226 /nfs/dbraw/zinc/57/72/26/475577226.db2.gz ZTOLBCMLXKUKEX-CKEIUWERSA-N 0 3 331.416 2.706 20 5 EFBDHN CCOc1ccc([C@@H](C)N[C@H](CO)CCSC)cc1[N+](=O)[O-] ZINC000358315905 475585872 /nfs/dbraw/zinc/58/58/72/475585872.db2.gz HRLKMCXILWDAEH-YPMHNXCESA-N 0 3 328.434 2.758 20 5 EFBDHN C[C@@H]1CSC[C@H]1NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000352789290 475628312 /nfs/dbraw/zinc/62/83/12/475628312.db2.gz BQUVZMPWGYCBCK-PRHODGIISA-N 0 3 329.809 2.528 20 5 EFBDHN COc1ccc(OCCN2C[C@H]3CCCCN3C[C@@H]2C)c([N+](=O)[O-])c1 ZINC000332423293 475632637 /nfs/dbraw/zinc/63/26/37/475632637.db2.gz AQWQHRKPSXTMDG-LSDHHAIUSA-N 0 3 349.431 2.541 20 5 EFBDHN C[C@@H]1CSC[C@H]1NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000352803193 475639282 /nfs/dbraw/zinc/63/92/82/475639282.db2.gz XXMXRRRQTVLQGD-LDYMZIIASA-N 0 3 329.809 2.528 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@H]1CC(=O)N(C2CC2)C1 ZINC000358391754 475643496 /nfs/dbraw/zinc/64/34/96/475643496.db2.gz FOEIZXBQAQFSLP-OLZOCXBDSA-N 0 3 349.456 2.818 20 5 EFBDHN COc1ccc2c(c1)ncc([N+](=O)[O-])c2N1CC[C@H]2CC[C@@H](C1)N2C ZINC000297187695 475647917 /nfs/dbraw/zinc/64/79/17/475647917.db2.gz QLUDDOGMCMYTQN-OLZOCXBDSA-N 0 3 342.399 2.825 20 5 EFBDHN COc1cc(CN2C[C@@H]3CCCCN3C[C@H]2C)c([N+](=O)[O-])cc1F ZINC000332524399 475659154 /nfs/dbraw/zinc/65/91/54/475659154.db2.gz RBMSBONXKLFTSK-OCCSQVGLSA-N 0 3 337.395 2.801 20 5 EFBDHN Cc1nc(N(C)C2CCN(Cc3ccccc3)CC2)ncc1[N+](=O)[O-] ZINC000297253632 475676595 /nfs/dbraw/zinc/67/65/95/475676595.db2.gz VOHCMYNDPXHOTC-UHFFFAOYSA-N 0 3 341.415 2.794 20 5 EFBDHN CCOC[C@@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)C ZINC000348477878 475689366 /nfs/dbraw/zinc/68/93/66/475689366.db2.gz KTNVHUOUGHNYRH-CQSZACIVSA-N 0 3 343.811 2.837 20 5 EFBDHN COc1cc(C(=O)NC[C@H](C)N2CCCC[C@@H]2C)cc([N+](=O)[O-])c1C ZINC000358499788 475727447 /nfs/dbraw/zinc/72/74/47/475727447.db2.gz UAYSVNYTWBBRMR-STQMWFEESA-N 0 3 349.431 2.905 20 5 EFBDHN Cc1c(CNC(=O)NC[C@H](C)N2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000358557176 475770220 /nfs/dbraw/zinc/77/02/20/475770220.db2.gz KEBUEKSPXWFUIF-KBPBESRZSA-N 0 3 348.447 2.823 20 5 EFBDHN Cc1ccc(NC(=O)CCN(C)CCc2cccc([N+](=O)[O-])c2)nc1 ZINC000338350300 475815238 /nfs/dbraw/zinc/81/52/38/475815238.db2.gz NIFJXXAMCSVQTL-UHFFFAOYSA-N 0 3 342.399 2.801 20 5 EFBDHN CC1=CCN(CCNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)CC1 ZINC000355331070 475834057 /nfs/dbraw/zinc/83/40/57/475834057.db2.gz DUQVDKWATXBWHZ-UHFFFAOYSA-N 0 3 346.431 2.555 20 5 EFBDHN CN(CCCN1CCCC1)c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000358659964 475842194 /nfs/dbraw/zinc/84/21/94/475842194.db2.gz FRQHECSAXYUOPR-UHFFFAOYSA-N 0 3 331.376 2.567 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCN(C)CC[C@H]1C ZINC000346770690 475843726 /nfs/dbraw/zinc/84/37/26/475843726.db2.gz OZHWYNJKUZWGLQ-GFCCVEGCSA-N 0 3 336.392 2.551 20 5 EFBDHN Cc1ncc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)c(=O)[n-]1 ZINC000346786528 475859864 /nfs/dbraw/zinc/85/98/64/475859864.db2.gz DDIANSVKKOWWRD-HNNXBMFYSA-N 0 3 328.372 2.510 20 5 EFBDHN C[C@H](NC(=O)N1CCN(C2CCCC2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000297765039 475878646 /nfs/dbraw/zinc/87/86/46/475878646.db2.gz VYPZVPKOHRYBSC-AWEZNQCLSA-N 0 3 346.431 2.926 20 5 EFBDHN CC(C)N1CCC[C@H](NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])C1 ZINC000346888713 475940216 /nfs/dbraw/zinc/94/02/16/475940216.db2.gz BRINGLJDXGGSLI-AWEZNQCLSA-N 0 3 333.432 2.861 20 5 EFBDHN COc1cc(C[NH2+]CCC2C[C@H](C)O[C@@H](C)C2)c([N+](=O)[O-])cc1[O-] ZINC000338477649 475941511 /nfs/dbraw/zinc/94/15/11/475941511.db2.gz OAJOSALDCYCCEC-RYUDHWBXSA-N 0 3 338.404 2.992 20 5 EFBDHN O=C(N[C@H]1CCN(CC2CCCC2)C1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000362060937 475969827 /nfs/dbraw/zinc/96/98/27/475969827.db2.gz QTKCYQILCRTSLQ-HNNXBMFYSA-N 0 3 335.379 2.728 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)CN2CCCCCC2)c1 ZINC000338539270 475994502 /nfs/dbraw/zinc/99/45/02/475994502.db2.gz FYIBEHZSVIHZKY-CQSZACIVSA-N 0 3 349.431 2.988 20 5 EFBDHN CN(C[C@H]1CCCN(C)C1)C(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000340384636 476000718 /nfs/dbraw/zinc/00/07/18/476000718.db2.gz AYTKMWVGKNCMJW-AWEZNQCLSA-N 0 3 333.432 2.673 20 5 EFBDHN O=[N+]([O-])c1cccc(CNCCNc2ccc(-c3ccccc3)nn2)c1 ZINC000340447705 476040593 /nfs/dbraw/zinc/04/05/93/476040593.db2.gz YFMAWMSWTLEIPY-UHFFFAOYSA-N 0 3 349.394 2.675 20 5 EFBDHN CCC(=O)c1ccc(NC[C@@H](C)N2CCN(CC)CC2)c([N+](=O)[O-])c1 ZINC000358942438 476058633 /nfs/dbraw/zinc/05/86/33/476058633.db2.gz BDHCKTDHFZVZLQ-CQSZACIVSA-N 0 3 348.447 2.625 20 5 EFBDHN CC[C@@H](NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CCOCC1 ZINC000343431021 476059007 /nfs/dbraw/zinc/05/90/07/476059007.db2.gz QZKHLDYKVKPRPB-OAHLLOKOSA-N 0 3 346.387 2.940 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@@H]2CCO[C@]3(CCSC3)C2)c(F)c1 ZINC000350311730 476129658 /nfs/dbraw/zinc/12/96/58/476129658.db2.gz KCRIGXBFNJGKDO-IUODEOHRSA-N 0 3 326.393 2.878 20 5 EFBDHN CN1CCN(CCOc2cccc([N+](=O)[O-])c2)Cc2ccccc21 ZINC000340650598 476180870 /nfs/dbraw/zinc/18/08/70/476180870.db2.gz KHJCMIATNKASFH-UHFFFAOYSA-N 0 3 327.384 2.926 20 5 EFBDHN O=C(Nc1cc(F)cc([N+](=O)[O-])c1)N1CC[C@H](N2CCCCC2)C1 ZINC000347255204 476209302 /nfs/dbraw/zinc/20/93/02/476209302.db2.gz FJVQNUQYHYLOAA-AWEZNQCLSA-N 0 3 336.367 2.826 20 5 EFBDHN C[C@@H](CN1CCC[C@H](C)C1)NC(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000347295677 476238778 /nfs/dbraw/zinc/23/87/78/476238778.db2.gz YSYFCZQBIYQJHE-RYUDHWBXSA-N 0 3 338.383 2.976 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN(C[C@H](C)O)C1CCCCC1 ZINC000303968268 476254052 /nfs/dbraw/zinc/25/40/52/476254052.db2.gz AMEJMBREEAPGKK-AWEZNQCLSA-N 0 3 349.431 2.857 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN(C[C@@H](C)O)C1CCCCC1 ZINC000303968270 476254368 /nfs/dbraw/zinc/25/43/68/476254368.db2.gz AMEJMBREEAPGKK-CQSZACIVSA-N 0 3 349.431 2.857 20 5 EFBDHN CCOc1ccc([C@@H](C)N[C@@H]2CCc3c[nH]nc3C2)cc1[N+](=O)[O-] ZINC000360059897 476287957 /nfs/dbraw/zinc/28/79/57/476287957.db2.gz RALJXCUOBPWOPO-BXUZGUMPSA-N 0 3 330.388 2.925 20 5 EFBDHN O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2NCc2cnn3ccccc23)n1 ZINC000353864435 476305747 /nfs/dbraw/zinc/30/57/47/476305747.db2.gz IZMZKMVHDGKHIK-GOEBONIOSA-N 0 3 340.387 2.713 20 5 EFBDHN CN(C)[C@@H](CNc1ncnc2cccc([N+](=O)[O-])c21)c1ccccc1 ZINC000357336420 476336366 /nfs/dbraw/zinc/33/63/66/476336366.db2.gz MDLJDAUGRURDMK-INIZCTEOSA-N 0 3 337.383 2.675 20 5 EFBDHN O=[N+]([O-])c1ccc(NCCCN2CCN(c3ccncc3)CC2)cc1 ZINC000353959554 476337510 /nfs/dbraw/zinc/33/75/10/476337510.db2.gz GFSQKXKPXXPCRJ-UHFFFAOYSA-N 0 3 341.415 2.614 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CN3CCC(OCCO)CC3)o2)cc1 ZINC000354034272 476381577 /nfs/dbraw/zinc/38/15/77/476381577.db2.gz PYEMCMCNKMHRCR-UHFFFAOYSA-N 0 3 346.383 2.828 20 5 EFBDHN CNc1c(C(=O)NC[C@H]2CCCCN2CC(C)C)cccc1[N+](=O)[O-] ZINC000360951891 476498505 /nfs/dbraw/zinc/49/85/05/476498505.db2.gz UIVSVTNGYDYSPP-CQSZACIVSA-N 0 3 348.447 2.877 20 5 EFBDHN CCN(CC)CCO[C@@H]1CCN(c2cc([N+](=O)[O-])ccc2C(C)=O)C1 ZINC000360983152 476524062 /nfs/dbraw/zinc/52/40/62/476524062.db2.gz DOQYKESXWWEFOR-MRXNPFEDSA-N 0 3 349.431 2.735 20 5 EFBDHN CCn1c(C)nc([N+](=O)[O-])c1NCCN(C)Cc1ccc(F)cc1 ZINC000361000935 476535244 /nfs/dbraw/zinc/53/52/44/476535244.db2.gz CPQBWVNFMSKEOO-UHFFFAOYSA-N 0 3 335.383 2.803 20 5 EFBDHN COc1ncccc1CCNc1cc(C)nc2ccc([N+](=O)[O-])cc21 ZINC000357774643 476595015 /nfs/dbraw/zinc/59/50/15/476595015.db2.gz LMGPSCUMHNOQTK-UHFFFAOYSA-N 0 3 338.367 2.932 20 5 EFBDHN CCc1ccc(C(=O)N2CCC[C@H](N3CCCC3)C2)cc1[N+](=O)[O-] ZINC000369938742 476596307 /nfs/dbraw/zinc/59/63/07/476596307.db2.gz WJCHBKJVTQAHGN-INIZCTEOSA-N 0 3 331.416 2.858 20 5 EFBDHN CCc1ccc(C(=O)N2CCC[C@@H](N3CCCC3)C2)cc1[N+](=O)[O-] ZINC000369938743 476596893 /nfs/dbraw/zinc/59/68/93/476596893.db2.gz WJCHBKJVTQAHGN-MRXNPFEDSA-N 0 3 331.416 2.858 20 5 EFBDHN C[C@H](C(=O)N1CCCC12CCN(C)CC2)c1ccc([N+](=O)[O-])cc1F ZINC000374968015 476614738 /nfs/dbraw/zinc/61/47/38/476614738.db2.gz GTADEHPFBMUTDD-ZDUSSCGKSA-N 0 3 349.406 2.924 20 5 EFBDHN CNc1c(C(=O)Nc2ccc(CN(C)C)cc2)cccc1[N+](=O)[O-] ZINC000361125579 476617819 /nfs/dbraw/zinc/61/78/19/476617819.db2.gz XPARTHLXDKFEPH-UHFFFAOYSA-N 0 3 328.372 2.950 20 5 EFBDHN Cc1ccccc1[C@@H]([C@H](C)NC(=O)c1cc([N+](=O)[O-])c[nH]1)N(C)C ZINC000354379652 476622464 /nfs/dbraw/zinc/62/24/64/476622464.db2.gz BVXLRQXJTYRZHN-BLLLJJGKSA-N 0 3 330.388 2.653 20 5 EFBDHN C[C@@H](NCCC(=O)Nc1ccccc1[N+](=O)[O-])c1cncc(F)c1 ZINC000361136798 476628636 /nfs/dbraw/zinc/62/86/36/476628636.db2.gz SDVAOWDHJQLUSL-LLVKDONJSA-N 0 3 332.335 2.808 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CCC[C@H](C[C@H]3CCOC3)C2)c1 ZINC000375010965 476633617 /nfs/dbraw/zinc/63/36/17/476633617.db2.gz DDMPQMMGRIHSJY-IIDMSEBBSA-N 0 3 334.416 2.767 20 5 EFBDHN CNc1c(C(=O)NC[C@@H](C)N2CCCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000361144937 476634008 /nfs/dbraw/zinc/63/40/08/476634008.db2.gz MJLBFHSCHVJBPX-CHWSQXEVSA-N 0 3 334.420 2.629 20 5 EFBDHN COc1ccc(C2CCN(CCn3cc([N+](=O)[O-])cn3)CC2)cc1 ZINC000363305783 476644433 /nfs/dbraw/zinc/64/44/33/476644433.db2.gz DFUCOAFVVLNBGP-UHFFFAOYSA-N 0 3 330.388 2.680 20 5 EFBDHN Cn1ccnc1[C@H]1CCCN(CCOc2ccccc2[N+](=O)[O-])C1 ZINC000370063046 476653722 /nfs/dbraw/zinc/65/37/22/476653722.db2.gz OEOINPQUVZCSMT-AWEZNQCLSA-N 0 3 330.388 2.587 20 5 EFBDHN C[C@@H]1CN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@H](C)N1C ZINC000354436810 476662087 /nfs/dbraw/zinc/66/20/87/476662087.db2.gz CWRWABAWJRRVLJ-ZIAGYGMSSA-N 0 3 343.431 2.520 20 5 EFBDHN CN1CCC2(CCCN2C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000370203262 476697573 /nfs/dbraw/zinc/69/75/73/476697573.db2.gz FQRNMIMUEJIIJE-UHFFFAOYSA-N 0 3 337.807 2.949 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCOCC2(CCC2)C1 ZINC000375185566 476707892 /nfs/dbraw/zinc/70/78/92/476707892.db2.gz AJPANZBXJUSDTO-UHFFFAOYSA-N 0 3 347.415 2.734 20 5 EFBDHN C[C@H](O)CN(Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CCCCC1 ZINC000444612290 476726197 /nfs/dbraw/zinc/72/61/97/476726197.db2.gz SYWLVEGQFRKSMY-LBPRGKRZSA-N 0 3 332.404 2.987 20 5 EFBDHN CCO[C@@H]1CCCC[C@H]1NCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000452032066 476783304 /nfs/dbraw/zinc/78/33/04/476783304.db2.gz BZGOVYNQEAUHFH-GDBMZVCRSA-N 0 3 335.404 2.779 20 5 EFBDHN Cc1n[nH]cc1C1CCN(C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000375387583 476809291 /nfs/dbraw/zinc/80/92/91/476809291.db2.gz OHAVOGZZYCNAGB-KRWDZBQOSA-N 0 3 330.388 2.539 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)NCCN1CCCC1(C)C ZINC000457058956 476852326 /nfs/dbraw/zinc/85/23/26/476852326.db2.gz QMBDEKCZYHXKPC-UHFFFAOYSA-N 0 3 335.404 2.598 20 5 EFBDHN COc1cc(C(=O)NC(C)(C)CN2CCCC2)cc([N+](=O)[O-])c1C ZINC000457061723 476853665 /nfs/dbraw/zinc/85/36/65/476853665.db2.gz YYSXFZQCAVSKAG-UHFFFAOYSA-N 0 3 335.404 2.516 20 5 EFBDHN COc1ccc(C[C@@H](C)NCc2ccc(OC)c([N+](=O)[O-])c2)cn1 ZINC000414079608 476867694 /nfs/dbraw/zinc/86/76/94/476867694.db2.gz SCSVLKVYJXPIJR-GFCCVEGCSA-N 0 3 331.372 2.728 20 5 EFBDHN CC(C)(C(=O)NCc1ccc([N+](=O)[O-])cc1)[C@@H](N)c1ccccc1 ZINC000422965830 476870718 /nfs/dbraw/zinc/87/07/18/476870718.db2.gz PVNWUYJCSQEFQG-INIZCTEOSA-N 0 3 327.384 2.937 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)N(C)[C@@H]1CCN(C(C)C)C1 ZINC000457095762 476871867 /nfs/dbraw/zinc/87/18/67/476871867.db2.gz QEYLLGLCVHCAME-CYBMUJFWSA-N 0 3 335.404 2.548 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)N(C)[C@H]1CCN(C(C)C)C1 ZINC000457095763 476872080 /nfs/dbraw/zinc/87/20/80/476872080.db2.gz QEYLLGLCVHCAME-ZDUSSCGKSA-N 0 3 335.404 2.548 20 5 EFBDHN CC(C)(C(=O)NCc1ccccc1[N+](=O)[O-])[C@@H](N)c1ccccc1 ZINC000422972238 476872258 /nfs/dbraw/zinc/87/22/58/476872258.db2.gz ZWXVJYHZBNAMKQ-INIZCTEOSA-N 0 3 327.384 2.937 20 5 EFBDHN CC(C)(C(=O)NCc1ccccc1[N+](=O)[O-])[C@H](N)c1ccccc1 ZINC000422972240 476872629 /nfs/dbraw/zinc/87/26/29/476872629.db2.gz ZWXVJYHZBNAMKQ-MRXNPFEDSA-N 0 3 327.384 2.937 20 5 EFBDHN CC(C)(CCN[C@@H]1CCCc2ccc([N+](=O)[O-])cc21)S(C)(=O)=O ZINC000414272191 476877641 /nfs/dbraw/zinc/87/76/41/476877641.db2.gz XRFJIXLRUAEXHA-OAHLLOKOSA-N 0 3 340.445 2.775 20 5 EFBDHN CC(C)N1CC[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000457137161 476897088 /nfs/dbraw/zinc/89/70/88/476897088.db2.gz XBMMJBICOPGMOS-LBPRGKRZSA-N 0 3 325.796 2.803 20 5 EFBDHN Cc1cc(NC(=O)NC[C@H]2NCCc3ccccc32)ccc1[N+](=O)[O-] ZINC000415418712 476922714 /nfs/dbraw/zinc/92/27/14/476922714.db2.gz PDKLNRKVAIHRAV-MRXNPFEDSA-N 0 3 340.383 2.912 20 5 EFBDHN Cc1cc(NC(=O)NC[C@@H]2NCCc3ccccc32)ccc1[N+](=O)[O-] ZINC000415418711 476922817 /nfs/dbraw/zinc/92/28/17/476922817.db2.gz PDKLNRKVAIHRAV-INIZCTEOSA-N 0 3 340.383 2.912 20 5 EFBDHN C[C@@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)[C@@H](C)CN1 ZINC000415429151 476925082 /nfs/dbraw/zinc/92/50/82/476925082.db2.gz AXLSQKPKLJHGCA-BDAKNGLRSA-N 0 3 346.309 2.828 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](CC(C)C)CN1CCCC1 ZINC000452343548 476925269 /nfs/dbraw/zinc/92/52/69/476925269.db2.gz LJNNMUYRFGBXPA-AWEZNQCLSA-N 0 3 349.431 2.844 20 5 EFBDHN C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCNCc2ccccc21 ZINC000430928771 476938874 /nfs/dbraw/zinc/93/88/74/476938874.db2.gz MIIQTZNEWZOPJR-CYBMUJFWSA-N 0 3 340.383 2.532 20 5 EFBDHN COC(=O)[C@](C)(CNCc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000447059541 476945916 /nfs/dbraw/zinc/94/59/16/476945916.db2.gz LKSHIISBUDKMJT-GOSISDBHSA-N 0 3 346.358 2.954 20 5 EFBDHN COC(=O)[C@](C)(CNCc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000447071824 476950479 /nfs/dbraw/zinc/95/04/79/476950479.db2.gz CROMZSWOIWLMLY-GOSISDBHSA-N 0 3 346.358 2.954 20 5 EFBDHN CC(C)(C(=O)NCCc1ccccc1[N+](=O)[O-])[C@H](N)c1ccccc1 ZINC000423226990 476968606 /nfs/dbraw/zinc/96/86/06/476968606.db2.gz TVLMYYATBYZBII-QGZVFWFLSA-N 0 3 341.411 2.980 20 5 EFBDHN COc1c(C(=O)N(C)C(C)(C)CN2CCCC2)cccc1[N+](=O)[O-] ZINC000416097769 477018472 /nfs/dbraw/zinc/01/84/72/477018472.db2.gz GBFFYWKHCAKGKJ-UHFFFAOYSA-N 0 3 335.404 2.550 20 5 EFBDHN CCC[C@H](C)C(=O)NCCNc1cc(C)nc2ccc([N+](=O)[O-])cc21 ZINC000431493038 477038950 /nfs/dbraw/zinc/03/89/50/477038950.db2.gz ABCRLCGKCIDXQB-LBPRGKRZSA-N 0 3 344.415 2.838 20 5 EFBDHN C[C@H](NC[C@H]1CNCCO1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423514496 477055955 /nfs/dbraw/zinc/05/59/55/477055955.db2.gz DDBCEFXGOSMHMQ-QWHCGFSZSA-N 0 3 347.440 2.962 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1NCC1=CCN(C)CC1 ZINC000447818974 477064994 /nfs/dbraw/zinc/06/49/94/477064994.db2.gz ZQUHORZWXAZSCR-UHFFFAOYSA-N 0 3 339.779 2.709 20 5 EFBDHN O=[N+]([O-])c1cccc(CNC[C@H]2CC[C@@H](c3nc(C4CC4)no3)O2)c1 ZINC000431678825 477073311 /nfs/dbraw/zinc/07/33/11/477073311.db2.gz MUJOZVYDGZNXCX-CABCVRRESA-N 0 3 344.371 2.865 20 5 EFBDHN Cc1c(CN2CC[C@H](N3CCN(C(C)C)CC3)C2)cccc1[N+](=O)[O-] ZINC000375906811 477075443 /nfs/dbraw/zinc/07/54/43/477075443.db2.gz QEKZPYVYMBAIJG-SFHVURJKSA-N 0 3 346.475 2.504 20 5 EFBDHN Cc1cc(OCC(=O)N[C@@H](C)CN2CCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000431834363 477103475 /nfs/dbraw/zinc/10/34/75/477103475.db2.gz RFCJERZFUANXLS-HIFRSBDPSA-N 0 3 349.431 2.519 20 5 EFBDHN O=[N+]([O-])c1ccc2oc(CN3CC[C@@H](C4CCOCC4)C3)nc2c1 ZINC000371065451 477107036 /nfs/dbraw/zinc/10/70/36/477107036.db2.gz OZKGROFHOHGXBL-CYBMUJFWSA-N 0 3 331.372 2.985 20 5 EFBDHN Cc1cc(OCC(=O)NC[C@@H](C)N2CCC(C)CC2)ccc1[N+](=O)[O-] ZINC000431864715 477112129 /nfs/dbraw/zinc/11/21/29/477112129.db2.gz YBFOKMAARLOCFX-OAHLLOKOSA-N 0 3 349.431 2.519 20 5 EFBDHN CN(C)C1(CNC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000416304058 477113938 /nfs/dbraw/zinc/11/39/38/477113938.db2.gz SUJCZXPABUGFHU-UHFFFAOYSA-N 0 3 346.412 2.542 20 5 EFBDHN CS[C@@H]1CN(c2ccnc3c2cccc3[N+](=O)[O-])C[C@@H]1N(C)C ZINC000432331678 477195941 /nfs/dbraw/zinc/19/59/41/477195941.db2.gz PIFSQGDPFOFLCF-LSDHHAIUSA-N 0 3 332.429 2.625 20 5 EFBDHN CCN1CCN([C@H](C)CNc2ccnc3c2cccc3[N+](=O)[O-])CC1 ZINC000432338027 477198622 /nfs/dbraw/zinc/19/86/22/477198622.db2.gz VTAPIXYKSOBHBH-CQSZACIVSA-N 0 3 343.431 2.581 20 5 EFBDHN CCC[C@H](NCCN1C[C@H]2CC[C@@H](C1)O2)c1cccc([N+](=O)[O-])c1 ZINC000453359696 477212009 /nfs/dbraw/zinc/21/20/09/477212009.db2.gz UQIYTEBPZRRMJX-KSZLIROESA-N 0 3 333.432 2.889 20 5 EFBDHN CCO[C@@H]1COC[C@H]1N[C@@H](CC)CSc1ccccc1[N+](=O)[O-] ZINC000453376487 477218114 /nfs/dbraw/zinc/21/81/14/477218114.db2.gz XHVFSMWGBKOAOV-GZBFAFLISA-N 0 3 340.445 2.859 20 5 EFBDHN CCc1ccccc1[C@@H](N)CNC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000423958573 477233946 /nfs/dbraw/zinc/23/39/46/477233946.db2.gz DRLARDMWECTUQP-SFHVURJKSA-N 0 3 341.411 2.906 20 5 EFBDHN COC(=O)c1cc(C)nc(N[C@@H]2CCN(C3CCCC3)C2)c1[N+](=O)[O-] ZINC000376219165 477234433 /nfs/dbraw/zinc/23/44/33/477234433.db2.gz MQHRVSOLARZSCY-GFCCVEGCSA-N 0 3 348.403 2.514 20 5 EFBDHN COc1cc(CNC[C@H]2CCOC(C)(C)C2)c([N+](=O)[O-])cc1OC ZINC000453588183 477243255 /nfs/dbraw/zinc/24/32/55/477243255.db2.gz YNJHWBHFCOHYHM-LBPRGKRZSA-N 0 3 338.404 2.907 20 5 EFBDHN CCc1ccccc1[C@@H](N)CNC(=O)c1cc(C)cc([N+](=O)[O-])c1 ZINC000423984667 477245726 /nfs/dbraw/zinc/24/57/26/477245726.db2.gz UPBSEWUBIPCABD-KRWDZBQOSA-N 0 3 327.384 2.895 20 5 EFBDHN CCc1ccccc1[C@H](N)CNC(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000423989132 477248763 /nfs/dbraw/zinc/24/87/63/477248763.db2.gz YGGGDKNAKYVHST-MRXNPFEDSA-N 0 3 327.384 2.895 20 5 EFBDHN Cc1c(CN2CCC[C@@H]2C[C@H](O)c2cnn(C)c2)cccc1[N+](=O)[O-] ZINC000371333728 477250164 /nfs/dbraw/zinc/25/01/64/477250164.db2.gz BLMYACGLPVOVDG-AEFFLSMTSA-N 0 3 344.415 2.725 20 5 EFBDHN CN(C/C=C/c1ccccc1[N+](=O)[O-])CCCNC(=O)C1CCC1 ZINC000432787698 477265388 /nfs/dbraw/zinc/26/53/88/477265388.db2.gz UOWRBLOXQWFACJ-BJMVGYQFSA-N 0 3 331.416 2.846 20 5 EFBDHN CN1C[C@@H]2CCCN(C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)[C@@H]2C1 ZINC000424117795 477298609 /nfs/dbraw/zinc/29/86/09/477298609.db2.gz ZHJQLRBORVPRBU-IINYFYTJSA-N 0 3 338.795 2.806 20 5 EFBDHN CN1CCC2(CCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CC1 ZINC000371412059 477301624 /nfs/dbraw/zinc/30/16/24/477301624.db2.gz DGSUUZBLVSFURF-VMPITWQZSA-N 0 3 329.400 2.695 20 5 EFBDHN CN(C)CCN(Cc1ccsc1)C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000458207122 477319572 /nfs/dbraw/zinc/31/95/72/477319572.db2.gz VTTXAQSDFYONLB-UHFFFAOYSA-N 0 3 347.440 2.789 20 5 EFBDHN Cn1cc(CN2CCC3(CCO3)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000367092428 477341004 /nfs/dbraw/zinc/34/10/04/477341004.db2.gz OKCNQTFSMYMIBN-UHFFFAOYSA-N 0 3 342.399 2.750 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000448953975 477356992 /nfs/dbraw/zinc/35/69/92/477356992.db2.gz ITNXNHJQOCAPCE-MRXNPFEDSA-N 0 3 347.415 2.548 20 5 EFBDHN CO[C@](C)([C@@H](C)NCC(=O)Nc1c(C)cccc1[N+](=O)[O-])C1CC1 ZINC000411965452 477398307 /nfs/dbraw/zinc/39/83/07/477398307.db2.gz FKCJEIKDEOZQRH-SJKOYZFVSA-N 0 3 335.404 2.635 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])NCc1ccc(S(C)(=O)=O)cc1 ZINC000449103352 477440961 /nfs/dbraw/zinc/44/09/61/477440961.db2.gz PSWBTAYKBJZYJZ-CYBMUJFWSA-N 0 3 348.424 2.719 20 5 EFBDHN CCO[C@@H]1C[C@@](CO)(NC/C=C\c2ccccc2[N+](=O)[O-])C1(C)C ZINC000436384558 477473530 /nfs/dbraw/zinc/47/35/30/477473530.db2.gz GMWCLIUQZVIRAL-JNTIUJHMSA-N 0 3 334.416 2.764 20 5 EFBDHN C[C@H](CNCc1ccc([N+](=O)[O-])cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000449218344 477492540 /nfs/dbraw/zinc/49/25/40/477492540.db2.gz HNBOWIPXSQIDHR-CYBMUJFWSA-N 0 3 348.424 2.892 20 5 EFBDHN COc1ccc(NC(=O)N2CC[C@@]3(C2)CCCN(C)C3)cc1[N+](=O)[O-] ZINC000455093543 477497116 /nfs/dbraw/zinc/49/71/16/477497116.db2.gz CGLCTSAGCWQVOP-KRWDZBQOSA-N 0 3 348.403 2.553 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])NCC(=O)N1Cc2ccccc2C1 ZINC000449292537 477529747 /nfs/dbraw/zinc/52/97/47/477529747.db2.gz DGDRJKFUFQANIP-CQSZACIVSA-N 0 3 339.395 2.658 20 5 EFBDHN CNC(=O)C[C@@H](N[C@H](C)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000449303319 477534413 /nfs/dbraw/zinc/53/44/13/477534413.db2.gz XVJXLWJGYUJGMA-RHSMWYFYSA-N 0 3 341.411 2.993 20 5 EFBDHN CN(C)[C@]1(CNc2nccc3ccc([N+](=O)[O-])cc32)CCSC1 ZINC000413168904 477551651 /nfs/dbraw/zinc/55/16/51/477551651.db2.gz KHIIJAQWDVYKID-INIZCTEOSA-N 0 3 332.429 2.992 20 5 EFBDHN CN(C)CCN(Cc1cccc(F)c1)c1ncc([N+](=O)[O-])cc1F ZINC000413186545 477561552 /nfs/dbraw/zinc/56/15/52/477561552.db2.gz BXCLCGAUIZTTHS-UHFFFAOYSA-N 0 3 336.342 2.836 20 5 EFBDHN CN1C[C@@H]2CCCN(C(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3F)[C@@H]2C1 ZINC000425066052 477627237 /nfs/dbraw/zinc/62/72/37/477627237.db2.gz NBHYURJSVDQFJK-BLLLJJGKSA-N 0 3 349.406 2.564 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H]2CN(C)C[C@H]21 ZINC000425065054 477627304 /nfs/dbraw/zinc/62/73/04/477627304.db2.gz JVWCRMBVPXGXKJ-SOLBZPMBSA-N 0 3 345.443 2.716 20 5 EFBDHN C[C@H]1CN(c2ncc([N+](=O)[O-])cc2C(F)(F)F)CCN(C2CC2)C1 ZINC000413322859 477628496 /nfs/dbraw/zinc/62/84/96/477628496.db2.gz HOPAOSAMSXVYCP-SNVBAGLBSA-N 0 3 344.337 2.929 20 5 EFBDHN O=C(NC[C@@H]1NCCc2ccccc21)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000377075970 477629145 /nfs/dbraw/zinc/62/91/45/477629145.db2.gz DSMJPTNJKBICAJ-HNNXBMFYSA-N 0 3 345.786 2.865 20 5 EFBDHN C[C@@H]1CN(C)[C@@H](C)CN1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425419755 477682096 /nfs/dbraw/zinc/68/20/96/477682096.db2.gz LKFXXEFYJFWYNN-WDEREUQCSA-N 0 3 342.237 2.882 20 5 EFBDHN CN(CCN1CCC(n2ccc([N+](=O)[O-])n2)CC1)Cc1ccccc1 ZINC000450883059 477748368 /nfs/dbraw/zinc/74/83/68/477748368.db2.gz OZFSBBSNZIWZRU-UHFFFAOYSA-N 0 3 343.431 2.560 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCN1CCNC[C@H]1c1ccccc1 ZINC000420422345 477756728 /nfs/dbraw/zinc/75/67/28/477756728.db2.gz ZHGYAJYMPMNWFD-KRWDZBQOSA-N 0 3 327.384 2.620 20 5 EFBDHN CC[C@@H]1CCCCN1CCNC(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000426898992 477757791 /nfs/dbraw/zinc/75/77/91/477757791.db2.gz XYGWLFXUTUYKCG-CYBMUJFWSA-N 0 3 335.404 2.598 20 5 EFBDHN C[C@@H]1CN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)CCN(C2CC2)C1 ZINC000493823613 477843660 /nfs/dbraw/zinc/84/36/60/477843660.db2.gz NVTYYPBNMFDSRQ-DFGFTWQDSA-N 0 3 329.400 2.551 20 5 EFBDHN CN(C)CCc1ccccc1NC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000438565142 477866106 /nfs/dbraw/zinc/86/61/06/477866106.db2.gz BPFXUXISUHRRDN-UHFFFAOYSA-N 0 3 346.362 2.673 20 5 EFBDHN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)C[C@H]1CCCN1C ZINC000421001722 477890909 /nfs/dbraw/zinc/89/09/09/477890909.db2.gz LTMJRXZUTSGXLM-IUODEOHRSA-N 0 3 345.403 2.732 20 5 EFBDHN CC(C)N(C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H](C)c1ccsc1 ZINC000421009656 477895618 /nfs/dbraw/zinc/89/56/18/477895618.db2.gz NHXRRDFMIGZNHE-IUODEOHRSA-N 0 3 338.433 2.685 20 5 EFBDHN CN(Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C[C@@H]1CCCN1C ZINC000421011095 477898443 /nfs/dbraw/zinc/89/84/43/477898443.db2.gz RUWGFMBLPTXOBV-INIZCTEOSA-N 0 3 330.388 2.776 20 5 EFBDHN Cc1c(CC(=O)NC[C@@H](C)N2CCCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000438903071 477903642 /nfs/dbraw/zinc/90/36/42/477903642.db2.gz PQWZGTJPVIHERJ-UONOGXRCSA-N 0 3 333.432 2.825 20 5 EFBDHN CC[C@@]1(C(C)C)C[C@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000516276845 477918314 /nfs/dbraw/zinc/91/83/14/477918314.db2.gz OCUPQCUHTNCSBM-CVEARBPZSA-N 0 3 340.445 2.783 20 5 EFBDHN O=[N+]([O-])c1ccccc1CNC[C@@]1(CO)C[C@H]1c1ccc(F)cc1 ZINC000428533363 477922074 /nfs/dbraw/zinc/92/20/74/477922074.db2.gz GXDSZEFHRFVDDF-FUHWJXTLSA-N 0 3 330.359 2.990 20 5 EFBDHN O=[N+]([O-])c1cccc(CNC[C@]2(CO)C[C@H]2c2ccc(F)cc2)c1 ZINC000428542747 477925608 /nfs/dbraw/zinc/92/56/08/477925608.db2.gz YFNKFXPMMMOIOL-ROUUACIJSA-N 0 3 330.359 2.990 20 5 EFBDHN Cc1ccc([C@@H](CNc2cccc(C(N)=O)c2[N+](=O)[O-])N(C)C)cc1 ZINC000439162536 477939278 /nfs/dbraw/zinc/93/92/78/477939278.db2.gz QCNBUSKTWVXTOL-MRXNPFEDSA-N 0 3 342.399 2.717 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@H](CO)Cc1ccco1 ZINC000532675233 477969349 /nfs/dbraw/zinc/96/93/49/477969349.db2.gz BKEZIBZRQATHDU-CYBMUJFWSA-N 0 3 334.372 2.527 20 5 EFBDHN CC[C@@H]1CN(CCN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)CCO1 ZINC000494459333 477991313 /nfs/dbraw/zinc/99/13/13/477991313.db2.gz XHNRJDPZJYMKRE-AEFFLSMTSA-N 0 3 333.432 2.673 20 5 EFBDHN C[C@]1(NC(=O)c2ccccc2[N+](=O)[O-])CCN(Cc2ccccc2)C1 ZINC000516870712 478002374 /nfs/dbraw/zinc/00/23/74/478002374.db2.gz LDYIJLVMIIZKES-IBGZPJMESA-N 0 3 339.395 2.989 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CNC[C@@H](O)[C@@H](C)c1ccccc1 ZINC000516921936 478012464 /nfs/dbraw/zinc/01/24/64/478012464.db2.gz XTTWTWPLTGORTC-SUMWQHHRSA-N 0 3 330.384 2.858 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@H]1CCC12CCCC2 ZINC000451451861 478024148 /nfs/dbraw/zinc/02/41/48/478024148.db2.gz BNMFFNBIYSWPAL-HNNXBMFYSA-N 0 3 333.388 2.854 20 5 EFBDHN C[C@@H]1C[C@H]1N1CCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@@H](C)C1 ZINC000428999581 478030288 /nfs/dbraw/zinc/03/02/88/478030288.db2.gz VDSPKHHVCBKGDJ-XJKCOSOUSA-N 0 3 344.415 2.898 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN[C@@H]1[C@@H]2CCCO[C@@H]2C1(C)C ZINC000451474150 478036732 /nfs/dbraw/zinc/03/67/32/478036732.db2.gz ADSFIHMYGJUBFZ-VUCTXSBTSA-N 0 3 347.415 2.635 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN[C@@H]1[C@@H]2CCCO[C@H]2C1(C)C ZINC000451474148 478036946 /nfs/dbraw/zinc/03/69/46/478036946.db2.gz ADSFIHMYGJUBFZ-JCURWCKSSA-N 0 3 347.415 2.635 20 5 EFBDHN CCO[C@@H]1C[C@@H](NCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C12CCC2 ZINC000451481509 478041330 /nfs/dbraw/zinc/04/13/30/478041330.db2.gz RHHGYGYSEZBQRY-HZPDHXFCSA-N 0 3 347.415 2.779 20 5 EFBDHN CCO[C@@H]1C[C@H](N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C12CCC2 ZINC000451480796 478041668 /nfs/dbraw/zinc/04/16/68/478041668.db2.gz QBXGOWBIEZCPHQ-VBNZEHGJSA-N 0 3 347.415 2.859 20 5 EFBDHN CO[C@]1(C)C[C@@H](NCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1(C)C ZINC000451483476 478043480 /nfs/dbraw/zinc/04/34/80/478043480.db2.gz FGXDDPWQKZVRAU-RHSMWYFYSA-N 0 3 335.404 2.635 20 5 EFBDHN CO[C@@H]1C[C@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1(C)C ZINC000451506337 478056884 /nfs/dbraw/zinc/05/68/84/478056884.db2.gz RYFMUUPXCWLTAD-QWHCGFSZSA-N 0 3 341.795 2.590 20 5 EFBDHN CO[C@H]1C[C@@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1(C)C ZINC000451506334 478057508 /nfs/dbraw/zinc/05/75/08/478057508.db2.gz RYFMUUPXCWLTAD-OLZOCXBDSA-N 0 3 341.795 2.590 20 5 EFBDHN CC(C)OCC[C@@H](O)CN1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451543193 478078184 /nfs/dbraw/zinc/07/81/84/478078184.db2.gz BGGMGNQEUSWRSW-SJLPKXTDSA-N 0 3 336.432 2.950 20 5 EFBDHN O=[N+]([O-])c1ccc([C@H]2CCCN(CCN3C[C@H]4CC[C@@H](C3)O4)C2)cc1 ZINC000451545409 478080508 /nfs/dbraw/zinc/08/05/08/478080508.db2.gz HCOUEMSYLGUXJD-YTQUADARSA-N 0 3 345.443 2.637 20 5 EFBDHN CC(C)COC[C@H](O)CN1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548750 478084069 /nfs/dbraw/zinc/08/40/69/478084069.db2.gz OGSSWXHSXGVOCC-SJLPKXTDSA-N 0 3 336.432 2.808 20 5 EFBDHN CC(C)(NC[C@@H](O)COCc1ccco1)c1ccccc1[N+](=O)[O-] ZINC000429243195 478087481 /nfs/dbraw/zinc/08/74/81/478087481.db2.gz CFPGYACHGQDFDJ-CYBMUJFWSA-N 0 3 334.372 2.590 20 5 EFBDHN CCOc1ccc(NC(=O)CN[C@H]2CCC[C@@H]3C[C@@H]32)c([N+](=O)[O-])c1 ZINC000459793979 478095720 /nfs/dbraw/zinc/09/57/20/478095720.db2.gz VVULAHQGAHEDJU-XBFCOCLRSA-N 0 3 333.388 2.710 20 5 EFBDHN CCOc1ccc(NC(=O)CN[C@@H]2CCC[C@@H]3C[C@@H]32)c([N+](=O)[O-])c1 ZINC000459793978 478095816 /nfs/dbraw/zinc/09/58/16/478095816.db2.gz VVULAHQGAHEDJU-KWCYVHTRSA-N 0 3 333.388 2.710 20 5 EFBDHN Cc1c(NC(=O)CCN2CCN(C)[C@H](C(C)C)C2)cccc1[N+](=O)[O-] ZINC000488038650 478110237 /nfs/dbraw/zinc/11/02/37/478110237.db2.gz HTGLGOLBCRQAAF-KRWDZBQOSA-N 0 3 348.447 2.504 20 5 EFBDHN O=[N+]([O-])c1cc(F)c(CN[C@@H]([C@H](CO)C2CC2)C2CC2)c(F)c1 ZINC000451593586 478114086 /nfs/dbraw/zinc/11/40/86/478114086.db2.gz CWKQBEOPNOWMRA-CZUORRHYSA-N 0 3 326.343 2.760 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)NCCN1CC[C@H](C)C1 ZINC000534279543 478135015 /nfs/dbraw/zinc/13/50/15/478135015.db2.gz SBMWDARZBZQNRF-LBPRGKRZSA-N 0 3 337.445 2.778 20 5 EFBDHN Cn1cc([C@H]2CN(CCOc3cccc([N+](=O)[O-])c3)CC2(C)C)cn1 ZINC000518062734 478142404 /nfs/dbraw/zinc/14/24/04/478142404.db2.gz HWTSTQHPNFXTAB-QGZVFWFLSA-N 0 3 344.415 2.833 20 5 EFBDHN CCC(=O)c1ccc(NCCN2CCN(C)C(C)(C)C2)c([N+](=O)[O-])c1 ZINC000440648627 478145261 /nfs/dbraw/zinc/14/52/61/478145261.db2.gz JTODJGGPWVRJGB-UHFFFAOYSA-N 0 3 348.447 2.625 20 5 EFBDHN Cc1cccc2c1CN(C[C@H](O)COc1ccccc1[N+](=O)[O-])CC2 ZINC000429584920 478159374 /nfs/dbraw/zinc/15/93/74/478159374.db2.gz HKUILMKVZKQLNR-INIZCTEOSA-N 0 3 342.395 2.701 20 5 EFBDHN Cc1ccccc1[C@H](CO)NCCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000518334062 478159760 /nfs/dbraw/zinc/15/97/60/478159760.db2.gz XREFTOJBZPSFJP-KRWDZBQOSA-N 0 3 343.383 2.555 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCN[C@]2(CO)CCCc3ccccc32)c1 ZINC000440823966 478167244 /nfs/dbraw/zinc/16/72/44/478167244.db2.gz XDINKCNGRXABJT-IBGZPJMESA-N 0 3 342.395 2.787 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](C)N1CCCC1 ZINC000535004185 478183780 /nfs/dbraw/zinc/18/37/80/478183780.db2.gz FKBQFZDSCBKCGS-LBPRGKRZSA-N 0 3 337.445 2.921 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc3c2CCNC3)c1 ZINC000518756480 478188244 /nfs/dbraw/zinc/18/82/44/478188244.db2.gz NQQDQGYXWPMCOL-UHFFFAOYSA-N 0 3 341.367 2.892 20 5 EFBDHN CCOC(=O)[C@@H]1CCC[C@@H]1NCc1ccc([N+](=O)[O-])c(OCC)c1 ZINC000451785172 478202506 /nfs/dbraw/zinc/20/25/06/478202506.db2.gz OTJYYJHAJNJYNA-KGLIPLIRSA-N 0 3 336.388 2.815 20 5 EFBDHN CN(C)C[C@@H]1CCCCN1C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000519086571 478209070 /nfs/dbraw/zinc/20/90/70/478209070.db2.gz BDMKPAJSRKYIAG-LBPRGKRZSA-N 0 3 325.796 2.805 20 5 EFBDHN CN(C)CCN(C(=O)NCCc1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000536232375 478244795 /nfs/dbraw/zinc/24/47/95/478244795.db2.gz LBVTYSYXFOGKBV-UHFFFAOYSA-N 0 3 348.447 2.653 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1CNC[C@@H]1CCOC3(CCC3)C1)OCCO2 ZINC000590658328 478277304 /nfs/dbraw/zinc/27/73/04/478277304.db2.gz DCRLYJSXSHTFGR-CYBMUJFWSA-N 0 3 348.399 2.805 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1CNC[C@H]1CCOC3(CCC3)C1)OCCO2 ZINC000590658348 478277328 /nfs/dbraw/zinc/27/73/28/478277328.db2.gz DCRLYJSXSHTFGR-ZDUSSCGKSA-N 0 3 348.399 2.805 20 5 EFBDHN CCC(C)(C)N1CCN(C(=O)NCc2ccccc2[N+](=O)[O-])CC1 ZINC000594214653 478277826 /nfs/dbraw/zinc/27/78/26/478277826.db2.gz NPUUPOCAFFIIFH-UHFFFAOYSA-N 0 3 334.420 2.611 20 5 EFBDHN CCC(C)(C)N1CCN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000594216762 478279032 /nfs/dbraw/zinc/27/90/32/478279032.db2.gz MMPHVHMBQYPMNJ-UHFFFAOYSA-N 0 3 348.447 2.653 20 5 EFBDHN CC[C@@H](NCC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)C(C)(C)C ZINC000537291353 478295253 /nfs/dbraw/zinc/29/52/53/478295253.db2.gz OIEGPOOYFQTVPP-CQSZACIVSA-N 0 3 337.376 2.676 20 5 EFBDHN C[C@H]1CN(Cc2ccccc2)CCN(c2cccnc2[N+](=O)[O-])C1 ZINC000590723253 478307114 /nfs/dbraw/zinc/30/71/14/478307114.db2.gz CZDFRXVYFKEFEG-HNNXBMFYSA-N 0 3 326.400 2.948 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1CCCN2CCCC[C@H]12 ZINC000594281052 478317340 /nfs/dbraw/zinc/31/73/40/478317340.db2.gz BDLRWTFUCSAYCO-DOTOQJQBSA-N 0 3 346.431 2.753 20 5 EFBDHN O=C1CCCN1CCCN1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000562716819 478328456 /nfs/dbraw/zinc/32/84/56/478328456.db2.gz ZESRRRSEAZTVJA-INIZCTEOSA-N 0 3 331.416 2.787 20 5 EFBDHN CCN(C[C@@H]1CCCN1CC)C(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000570306747 478333016 /nfs/dbraw/zinc/33/30/16/478333016.db2.gz VFGNVPZIJJFJBN-INIZCTEOSA-N 0 3 333.432 2.779 20 5 EFBDHN CCC(C)(C)N1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000594389152 478356662 /nfs/dbraw/zinc/35/66/62/478356662.db2.gz FWXPZERHOINDGD-UHFFFAOYSA-N 0 3 333.432 2.779 20 5 EFBDHN C[C@H](C(=O)NC[C@H](C)N1CCC[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000570505424 478373802 /nfs/dbraw/zinc/37/38/02/478373802.db2.gz DOWKEOSHQPAUET-ILXRZTDVSA-N 0 3 333.432 2.935 20 5 EFBDHN C[C@H](CNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)N1CCC[C@@H](C)C1 ZINC000570505425 478374921 /nfs/dbraw/zinc/37/49/21/478374921.db2.gz DOWKEOSHQPAUET-KFWWJZLASA-N 0 3 333.432 2.935 20 5 EFBDHN C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1nnc([C@H]2CCCO2)[n-]1 ZINC000594514459 478421310 /nfs/dbraw/zinc/42/13/10/478421310.db2.gz YFKWYUXQHXDJGZ-IUODEOHRSA-N 0 3 345.403 2.675 20 5 EFBDHN O=C1NCCC[C@@H]1CNCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000590971656 478423235 /nfs/dbraw/zinc/42/32/35/478423235.db2.gz CXQLCBZKAXISGE-GFCCVEGCSA-N 0 3 345.424 2.939 20 5 EFBDHN O=C(CCNC/C=C\c1ccccc1[N+](=O)[O-])Nc1ccccn1 ZINC000539709571 478427572 /nfs/dbraw/zinc/42/75/72/478427572.db2.gz CYRGZPFUMPOXOD-ALCCZGGFSA-N 0 3 326.356 2.621 20 5 EFBDHN O=C1[C@@H](NCCc2ccc([N+](=O)[O-])cc2)CCN1C1CCCCC1 ZINC000600591886 478431642 /nfs/dbraw/zinc/43/16/42/478431642.db2.gz PPZUEQJBCIOVDR-KRWDZBQOSA-N 0 3 331.416 2.661 20 5 EFBDHN C[C@H](N[C@@H]1CCCN2CCCC[C@@H]12)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000594554163 478434857 /nfs/dbraw/zinc/43/48/57/478434857.db2.gz OPIXAJONSAGRPU-XKQJLSEDSA-N 0 3 346.431 2.528 20 5 EFBDHN C[C@H](N[C@@H]1CCCN2CCCC[C@@H]12)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000594554157 478434987 /nfs/dbraw/zinc/43/49/87/478434987.db2.gz OFIGWQQKDJUMSN-XKQJLSEDSA-N 0 3 346.431 2.528 20 5 EFBDHN C[C@@H](C(=O)N1CC[C@]2(C1)CCCN(C)C2)c1cccc([N+](=O)[O-])c1 ZINC000570750927 478435693 /nfs/dbraw/zinc/43/56/93/478435693.db2.gz XXFVGBOVVNOQKV-RDTXWAMCSA-N 0 3 331.416 2.643 20 5 EFBDHN O=C1[C@H](N2CC[C@H](C3CCC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000591062984 478446808 /nfs/dbraw/zinc/44/68/08/478446808.db2.gz DSZANTDWTBOAMK-WMLDXEAASA-N 0 3 329.400 2.822 20 5 EFBDHN CC[C@H](CN1CCCC1)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000591063140 478447168 /nfs/dbraw/zinc/44/71/68/478447168.db2.gz ZKLWSSPCXURSON-HYVNUMGLSA-N 0 3 331.416 2.689 20 5 EFBDHN CCC(C)(C)N1CCN(c2ncnc3sc([N+](=O)[O-])cc32)CC1 ZINC000594592334 478452077 /nfs/dbraw/zinc/45/20/77/478452077.db2.gz VGOSCRZYSCPFIO-UHFFFAOYSA-N 0 3 335.433 2.910 20 5 EFBDHN CN1CC[C@]2(C1)CCCN(C(=O)c1c[nH]c3cc([N+](=O)[O-])ccc13)C2 ZINC000597716947 478476985 /nfs/dbraw/zinc/47/69/85/478476985.db2.gz UFNYIQPURNXPFB-SFHVURJKSA-N 0 3 342.399 2.634 20 5 EFBDHN CC(C)(C)N1CCCN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)CC1 ZINC000491290323 478499911 /nfs/dbraw/zinc/49/99/11/478499911.db2.gz CDCJERBUOSFKDL-YFHOEESVSA-N 0 3 331.416 2.941 20 5 EFBDHN Cc1cc(C)cc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000594716273 478510438 /nfs/dbraw/zinc/51/04/38/478510438.db2.gz NVWAROSLYYGUCV-QGZVFWFLSA-N 0 3 330.384 2.741 20 5 EFBDHN C[C@@H]1NCCO[C@H]1c1ccc(-c2cc([N+](=O)[O-])ccc2CO)cc1 ZINC000600781472 478517250 /nfs/dbraw/zinc/51/72/50/478517250.db2.gz CKEXEDVFIQDBQV-KPZWWZAWSA-N 0 3 328.368 2.804 20 5 EFBDHN COc1ccc(OCCN[C@@H](CO)c2ccccc2C)c([N+](=O)[O-])c1 ZINC000541053124 478533050 /nfs/dbraw/zinc/53/30/50/478533050.db2.gz FCPLUSMPKDPJQG-INIZCTEOSA-N 0 3 346.383 2.614 20 5 EFBDHN CC(C)(C)[C@H]1CCN(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000541393080 478555104 /nfs/dbraw/zinc/55/51/04/478555104.db2.gz MFPYJNFESHFOCV-AWEZNQCLSA-N 0 3 331.416 2.852 20 5 EFBDHN CC(C)(C)N1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000597923736 478577526 /nfs/dbraw/zinc/57/75/26/478577526.db2.gz OVGDYAOSAXHJCZ-CWRNSKLLSA-N 0 3 331.416 2.687 20 5 EFBDHN CC(C)(C)N1CC[C@@H](NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC000597925790 478578915 /nfs/dbraw/zinc/57/89/15/478578915.db2.gz RFONRUUSSIUOFG-GFCCVEGCSA-N 0 3 330.388 2.679 20 5 EFBDHN CC(C)(C)N1CC[C@H](NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000597924863 478580053 /nfs/dbraw/zinc/58/00/53/478580053.db2.gz TXOUFQGSQGARDR-LBPRGKRZSA-N 0 3 325.796 2.851 20 5 EFBDHN COc1ccc2c(c1)OC[C@@H](NCCOc1ccc([N+](=O)[O-])cc1)C2 ZINC000571394412 478586600 /nfs/dbraw/zinc/58/66/00/478586600.db2.gz ROCRYZZABRBSIO-AWEZNQCLSA-N 0 3 344.367 2.576 20 5 EFBDHN Cn1nc(C(F)(F)F)cc1CNCCOc1ccc([N+](=O)[O-])cc1 ZINC000594928442 478591138 /nfs/dbraw/zinc/59/11/38/478591138.db2.gz YYUYBSVBFIFCIZ-UHFFFAOYSA-N 0 3 344.293 2.516 20 5 EFBDHN COc1cc(CN[C@H]2CCN(C(C)(C)C)C2)c([N+](=O)[O-])cc1OC ZINC000594956585 478604369 /nfs/dbraw/zinc/60/43/69/478604369.db2.gz LPJHAHRINBLINZ-ZDUSSCGKSA-N 0 3 337.420 2.574 20 5 EFBDHN CC1(C)CNCCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000591678401 478605040 /nfs/dbraw/zinc/60/50/40/478605040.db2.gz SVXSOAGPBYJWPV-UHFFFAOYSA-N 0 3 346.412 2.542 20 5 EFBDHN C[C@H](O)[C@H]1CCCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000541890335 478607895 /nfs/dbraw/zinc/60/78/95/478607895.db2.gz RCZZXPIKCKCHRN-ZFWWWQNUSA-N 0 3 344.415 2.588 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCN(CC3Cc4ccccc4C3)CC2)cn1 ZINC000563655593 478611857 /nfs/dbraw/zinc/61/18/57/478611857.db2.gz IHXQIIKPLREOFN-UHFFFAOYSA-N 0 3 338.411 2.527 20 5 EFBDHN C[C@@H]1CCCN(C(C)(C)CNC(=O)c2c(F)cccc2[N+](=O)[O-])C1 ZINC000601010116 478613106 /nfs/dbraw/zinc/61/31/06/478613106.db2.gz JTYQDKKLBPLMHU-GFCCVEGCSA-N 0 3 337.395 2.974 20 5 EFBDHN CCOc1ccc(OC[C@H](O)CNCc2cccc([N+](=O)[O-])c2)cc1 ZINC000591728949 478614422 /nfs/dbraw/zinc/61/44/22/478614422.db2.gz DWMHNLPJAYIPAJ-MRXNPFEDSA-N 0 3 346.383 2.523 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN[C@@H]1CCc2ccc(F)cc21 ZINC000571516012 478614977 /nfs/dbraw/zinc/61/49/77/478614977.db2.gz GVHUGURDMKAXIP-GOEBONIOSA-N 0 3 346.358 2.751 20 5 EFBDHN CCC[C@@H](NC[C@@H](O)COc1cccc([N+](=O)[O-])c1)c1ccccn1 ZINC000591734504 478616095 /nfs/dbraw/zinc/61/60/95/478616095.db2.gz HPFGAFUNRSYEFN-NVXWUHKLSA-N 0 3 345.399 2.861 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@H]2CSc3ccccc32)c1 ZINC000591740790 478617077 /nfs/dbraw/zinc/61/70/77/478617077.db2.gz HTXLWMIIOLBGLC-CJNGLKHVSA-N 0 3 346.408 2.771 20 5 EFBDHN C[C@]1(c2ccccc2)C[C@@H]1NC[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000591744293 478618088 /nfs/dbraw/zinc/61/80/88/478618088.db2.gz PEKQPWDWWJYOGS-AYOQOUSVSA-N 0 3 342.395 2.654 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCCc1cccc(C(N)=O)c1 ZINC000595014408 478629202 /nfs/dbraw/zinc/62/92/02/478629202.db2.gz PHJPLYKZMXLGFQ-GFCCVEGCSA-N 0 3 343.383 2.596 20 5 EFBDHN C[C@H](CN1CCC[C@@H](C)C1)NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000582580521 478632559 /nfs/dbraw/zinc/63/25/59/478632559.db2.gz LCGBUWULTMWGNJ-RBSFLKMASA-N 0 3 333.432 2.935 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@H]1CCO[C@]2(CCOC2)C1 ZINC000595028553 478635214 /nfs/dbraw/zinc/63/52/14/478635214.db2.gz UTEKANYDXYMMRR-GDZNZVCISA-N 0 3 336.388 2.592 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)N[C@@H]1CCN(c2ccccn2)C1 ZINC000595035193 478637490 /nfs/dbraw/zinc/63/74/90/478637490.db2.gz HPGCHYAXBIGFSO-ZIAGYGMSSA-N 0 3 342.399 2.928 20 5 EFBDHN CCCN1C[C@H](CN[C@H](C)c2ccc([N+](=O)[O-])cc2OC)CC1=O ZINC000595044435 478638860 /nfs/dbraw/zinc/63/88/60/478638860.db2.gz MSMUGMPMAHQNMO-OLZOCXBDSA-N 0 3 335.404 2.513 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@@H]1CCCN(C(C)=O)C1 ZINC000595046708 478639919 /nfs/dbraw/zinc/63/99/19/478639919.db2.gz CUWPEYXJCRAPHM-OCCSQVGLSA-N 0 3 335.404 2.513 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@H]1CC[C@H](C(N)=O)CC1 ZINC000595044924 478639978 /nfs/dbraw/zinc/63/99/78/478639978.db2.gz PELICKQBNXIACM-AVGNSLFASA-N 0 3 335.404 2.546 20 5 EFBDHN CCn1cc(CN[C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])nn1 ZINC000595068320 478648784 /nfs/dbraw/zinc/64/87/84/478648784.db2.gz JRFJKWZJKNGGPU-BBRMVZONSA-N 0 3 329.404 2.707 20 5 EFBDHN CCN(C[C@@H]1CCCN1CC)C(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000563947457 478672038 /nfs/dbraw/zinc/67/20/38/478672038.db2.gz RDMCEZIXILGDBF-AWEZNQCLSA-N 0 3 335.404 2.550 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C/CNC[C@@H](n1cncn1)C(F)(F)F ZINC000601144181 478684909 /nfs/dbraw/zinc/68/49/09/478684909.db2.gz FYTKTCOBJQMFOE-MASHWEEQSA-N 0 3 341.293 2.593 20 5 EFBDHN O=C(CCOc1ccccc1[N+](=O)[O-])Nc1cccc2c1CCNC2 ZINC000582840484 478699096 /nfs/dbraw/zinc/69/90/96/478699096.db2.gz SKFYAEBULVUCIS-UHFFFAOYSA-N 0 3 341.367 2.648 20 5 EFBDHN Cc1cccc2c1CC[C@H]2NC[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000582840404 478699721 /nfs/dbraw/zinc/69/97/21/478699721.db2.gz VZOHXJCNQVWAIO-HNAYVOBHSA-N 0 3 342.395 2.920 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCN(C2CCCCC2)C1 ZINC000598220495 478711691 /nfs/dbraw/zinc/71/16/91/478711691.db2.gz QAOQOQANAVHFDX-ZDUSSCGKSA-N 0 3 347.415 2.740 20 5 EFBDHN C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1CNc1cc[n-]c(=O)c1[N+](=O)[O-] ZINC000601211049 478725464 /nfs/dbraw/zinc/72/54/64/478725464.db2.gz VRHJJUQSCDPTTC-UKRRQHHQSA-N 0 3 342.399 2.875 20 5 EFBDHN C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNc1cc[n-]c(=O)c1[N+](=O)[O-] ZINC000601211049 478725473 /nfs/dbraw/zinc/72/54/73/478725473.db2.gz VRHJJUQSCDPTTC-UKRRQHHQSA-N 0 3 342.399 2.875 20 5 EFBDHN Cc1noc(CN2CC[C@H](C)N(Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000595333570 478734173 /nfs/dbraw/zinc/73/41/73/478734173.db2.gz KMBQKFLPLDMTSQ-AWEZNQCLSA-N 0 3 344.415 2.988 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N(CC)C[C@@H]2CCCN2CC)c1 ZINC000572069789 478742491 /nfs/dbraw/zinc/74/24/91/478742491.db2.gz ZBPPKIFIWYPNDN-AWEZNQCLSA-N 0 3 349.431 2.940 20 5 EFBDHN CCCN1CC[C@@H](NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC000598341390 478775249 /nfs/dbraw/zinc/77/52/49/478775249.db2.gz ALYQHNSTNCWKNJ-LLVKDONJSA-N 0 3 345.321 2.828 20 5 EFBDHN C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@H]1C(F)(F)F ZINC000601306114 478776187 /nfs/dbraw/zinc/77/61/87/478776187.db2.gz APZKTPAHHFCSHR-GGZOMVNGSA-N 0 3 331.294 2.852 20 5 EFBDHN CCCN1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)C1 ZINC000598343007 478776279 /nfs/dbraw/zinc/77/62/79/478776279.db2.gz RGWOQEQRZJPXON-CQSZACIVSA-N 0 3 335.404 2.596 20 5 EFBDHN CS[C@@H]1CN(Cc2ccc(F)cc2[N+](=O)[O-])C[C@H]1N1CCCC1 ZINC000595433926 478779561 /nfs/dbraw/zinc/77/95/61/478779561.db2.gz WWYIIPNUAFYZHK-HZPDHXFCSA-N 0 3 339.436 2.746 20 5 EFBDHN CC(C)N(Cc1ccccn1)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000544071647 478807467 /nfs/dbraw/zinc/80/74/67/478807467.db2.gz JWVFBJBDCRTRBP-INIZCTEOSA-N 0 3 345.399 2.640 20 5 EFBDHN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC2(C[C@@H]1C)CCOCC2 ZINC000592181488 478814969 /nfs/dbraw/zinc/81/49/69/478814969.db2.gz FNHPTRKTFSSLPR-UONOGXRCSA-N 0 3 347.415 2.813 20 5 EFBDHN Cc1noc(CN2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)c1[N+](=O)[O-] ZINC000595493552 478819141 /nfs/dbraw/zinc/81/91/41/478819141.db2.gz SHQGAQJULHJKNV-BZUAXINKSA-N 0 3 343.383 2.896 20 5 EFBDHN C[C@@H]1CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC2(CCCC2)O1 ZINC000592193404 478819749 /nfs/dbraw/zinc/81/97/49/478819749.db2.gz MLRWOYKRDLDQRL-CQSZACIVSA-N 0 3 347.415 2.957 20 5 EFBDHN C[C@@H]1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CC2(CCCC2)O1 ZINC000592196704 478822198 /nfs/dbraw/zinc/82/21/98/478822198.db2.gz XDSZVSUDRSVJEZ-CQSZACIVSA-N 0 3 347.415 2.957 20 5 EFBDHN CCCN(CCN1CCCC1)C(=O)NCc1cccc([N+](=O)[O-])c1C ZINC000503127545 478837163 /nfs/dbraw/zinc/83/71/63/478837163.db2.gz WEQZWZNKCQBVHB-UHFFFAOYSA-N 0 3 348.447 2.921 20 5 EFBDHN CCN1CCCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)C1 ZINC000595535407 478839188 /nfs/dbraw/zinc/83/91/88/478839188.db2.gz OEPBGSORGSYHQA-CYBMUJFWSA-N 0 3 345.403 2.561 20 5 EFBDHN CC(C)[C@H]1CN(C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)CCN1 ZINC000592244341 478839216 /nfs/dbraw/zinc/83/92/16/478839216.db2.gz AZGXORUHPSAPDE-IUODEOHRSA-N 0 3 337.445 2.532 20 5 EFBDHN CO[C@@H]1COC[C@H]1NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000592374884 478872373 /nfs/dbraw/zinc/87/23/73/478872373.db2.gz OCGFPZZQMSQRCL-UKRRQHHQSA-N 0 3 334.397 2.827 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN[C@@H](C(C)C)C1 ZINC000598569217 478900745 /nfs/dbraw/zinc/90/07/45/478900745.db2.gz BTFLRUJTTPZQNU-DOTOQJQBSA-N 0 3 333.432 2.620 20 5 EFBDHN COc1cc(CN(C)C)ccc1NC(=O)c1csc([N+](=O)[O-])c1 ZINC000601620782 478911111 /nfs/dbraw/zinc/91/11/11/478911111.db2.gz LBXZIPHBKJYPAA-UHFFFAOYSA-N 0 3 335.385 2.979 20 5 EFBDHN O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2N[C@H](CCO)c2ccco2)n1 ZINC000583673724 478911956 /nfs/dbraw/zinc/91/19/56/478911956.db2.gz STRJMUFWILCLFP-BFHYXJOUSA-N 0 3 334.376 2.581 20 5 EFBDHN C[C@H](N[C@H]1CSC[C@H]1C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000507263516 478912006 /nfs/dbraw/zinc/91/20/06/478912006.db2.gz BMIOUJVRVRVCNZ-ZDMBXUJBSA-N 0 3 343.836 2.916 20 5 EFBDHN C[C@@H](C1CCN(C)CC1)N(C)C(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000492315160 478925868 /nfs/dbraw/zinc/92/58/68/478925868.db2.gz AENHOUKUKOTDGM-PIZKADEWSA-N 0 3 331.416 2.797 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1CN1CCC[C@@H]1[C@@H]1CCCOC1)OCCO2 ZINC000592516971 478926265 /nfs/dbraw/zinc/92/62/65/478926265.db2.gz LYARJYOUMJQMQL-UKRRQHHQSA-N 0 3 348.399 2.757 20 5 EFBDHN C[C@H](C1CCN(C)CC1)N(C)C(=O)/C=C\c1cccc([N+](=O)[O-])c1 ZINC000492320399 478927862 /nfs/dbraw/zinc/92/78/62/478927862.db2.gz OUBGDKALKLLBRD-WBTMPAOCSA-N 0 3 331.416 2.797 20 5 EFBDHN CC(C)Oc1nc(N2CCN([C@@H]3C[C@@H]3C)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000565227076 478956729 /nfs/dbraw/zinc/95/67/29/478956729.db2.gz VAFUGCGZJJJMOX-OFQRWUPVSA-N 0 3 348.447 2.944 20 5 EFBDHN CCOc1ccccc1CNC[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000583929472 478972904 /nfs/dbraw/zinc/97/29/04/478972904.db2.gz LRGIGYFYHDPBIP-INIZCTEOSA-N 0 3 346.383 2.523 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN(C)CC1=CCCOC1 ZINC000595753010 478976252 /nfs/dbraw/zinc/97/62/52/478976252.db2.gz OESWRDHEXJEVIR-UHFFFAOYSA-N 0 3 333.388 2.510 20 5 EFBDHN C[C@@H](NC(=O)N1CC[C@]2(C1)CCCN(C)C2)c1cccc([N+](=O)[O-])c1 ZINC000583979102 478984203 /nfs/dbraw/zinc/98/42/03/478984203.db2.gz MFYZDHYWZMKKMR-RDTXWAMCSA-N 0 3 346.431 2.783 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C/CN1CCC[C@@H](N2CCOCC2)CC1 ZINC000565373405 478992184 /nfs/dbraw/zinc/99/21/84/478992184.db2.gz VBCZCESZNTWYMC-HNSSHINMSA-N 0 3 345.443 2.795 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@H](CN2CCCC2=O)C1 ZINC000595828123 479020160 /nfs/dbraw/zinc/02/01/60/479020160.db2.gz HZUQBVWUQHXEGJ-GJZGRUSLSA-N 0 3 331.416 2.909 20 5 EFBDHN Cc1ccc(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1F ZINC000584194853 479047492 /nfs/dbraw/zinc/04/74/92/479047492.db2.gz BWRVAZBVFQMCFC-CQSZACIVSA-N 0 3 334.347 2.572 20 5 EFBDHN CCCN(C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)[C@@H]1CCN(C)C1 ZINC000592832707 479064543 /nfs/dbraw/zinc/06/45/43/479064543.db2.gz VLBVEZSVMLGFNW-CYBMUJFWSA-N 0 3 330.388 2.632 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1[C@@H]2CC[C@H]1CCN(C)C2 ZINC000584241702 479066412 /nfs/dbraw/zinc/06/64/12/479066412.db2.gz SAAQCAIUWLHXDC-XYJFISCASA-N 0 3 345.443 2.859 20 5 EFBDHN CCCN(C(=O)CCCNc1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(C)C1 ZINC000592833221 479066450 /nfs/dbraw/zinc/06/64/50/479066450.db2.gz WTEDXGWNCJUQTP-QGZVFWFLSA-N 0 3 348.447 2.730 20 5 EFBDHN CC(C)(NC(=O)c1cccc2c1CNC2)c1ccc([N+](=O)[O-])cc1 ZINC000595958135 479081272 /nfs/dbraw/zinc/08/12/72/479081272.db2.gz JMMLQLNHPMAVAB-UHFFFAOYSA-N 0 3 325.368 2.863 20 5 EFBDHN COc1cc(CNCCn2cc([N+](=O)[O-])cn2)cc(C(F)(F)F)c1 ZINC000598967210 479106834 /nfs/dbraw/zinc/10/68/34/479106834.db2.gz FYHMYDXPYFUYPH-UHFFFAOYSA-N 0 3 344.293 2.609 20 5 EFBDHN CC(C)N1CC[C@H](N(C)C(=O)/C=C/c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000493671822 479108239 /nfs/dbraw/zinc/10/82/39/479108239.db2.gz COWHIXGLVNLLHB-ZKKXHLJNSA-N 0 3 335.379 2.688 20 5 EFBDHN COC(=O)COc1ccc(CN[C@@H]2CC23CCCCC3)cc1[N+](=O)[O-] ZINC000598983148 479113772 /nfs/dbraw/zinc/11/37/72/479113772.db2.gz CBODDMVNTHBQHH-MRXNPFEDSA-N 0 3 348.399 2.959 20 5 EFBDHN CCN1CCN(CCNc2ccc(C(F)F)cc2[N+](=O)[O-])CC1 ZINC000596075076 479123416 /nfs/dbraw/zinc/12/34/16/479123416.db2.gz YMKZMCAIEIEVQI-UHFFFAOYSA-N 0 3 328.363 2.582 20 5 EFBDHN O=[N+]([O-])c1cccc(CNCC[C@@H](O)COCc2ccccc2)c1 ZINC000599024064 479130977 /nfs/dbraw/zinc/13/09/77/479130977.db2.gz YJVHFBNCIUBLER-GOSISDBHSA-N 0 3 330.384 2.652 20 5 EFBDHN C[C@H](CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-])N1CCCC[C@@H]1C ZINC000593027963 479132560 /nfs/dbraw/zinc/13/25/60/479132560.db2.gz HKNQPTMBXOHRAC-QWHCGFSZSA-N 0 3 337.395 2.656 20 5 EFBDHN CC1CC[NH+](C[C@H]2CCCN(c3cc[n-]c(=O)c3[N+](=O)[O-])C2)CC1 ZINC000596097195 479136384 /nfs/dbraw/zinc/13/63/84/479136384.db2.gz FYORIGYCHUDFRZ-CQSZACIVSA-N 0 3 334.420 2.644 20 5 EFBDHN O=c1[n-]ccc(NC[C@H]2CC[N@H+](CCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000596106387 479142438 /nfs/dbraw/zinc/14/24/38/479142438.db2.gz AFBBVDDIBHILEL-OAHLLOKOSA-N 0 3 342.399 2.672 20 5 EFBDHN O=c1[n-]ccc(NC[C@H]2CC[N@@H+](CCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000596106387 479142446 /nfs/dbraw/zinc/14/24/46/479142446.db2.gz AFBBVDDIBHILEL-OAHLLOKOSA-N 0 3 342.399 2.672 20 5 EFBDHN CC(C)O[C@@H]1CCCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000593054883 479146227 /nfs/dbraw/zinc/14/62/27/479146227.db2.gz HLGDEVDWWIVQBS-MRXNPFEDSA-N 0 3 335.404 2.813 20 5 EFBDHN Cc1ncccc1CN[C@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000599074490 479151212 /nfs/dbraw/zinc/15/12/12/479151212.db2.gz SSMYNDOJMWZAPQ-GFCCVEGCSA-N 0 3 328.372 2.805 20 5 EFBDHN C[C@H](N[C@@H]1CCO[C@H]1c1ccc(=O)[nH]c1)c1ccc([N+](=O)[O-])cc1 ZINC000599073541 479151438 /nfs/dbraw/zinc/15/14/38/479151438.db2.gz JDUGIWJRZGQLQR-CXMBCZLWSA-N 0 3 329.356 2.876 20 5 EFBDHN C[C@@H](c1ccccc1)N1CCC(Nc2ccc(N)c([N+](=O)[O-])n2)CC1 ZINC000596132858 479156243 /nfs/dbraw/zinc/15/62/43/479156243.db2.gz RUPQKNAOARAOOC-ZDUSSCGKSA-N 0 3 341.415 2.631 20 5 EFBDHN CN1CCC[C@@H](CNc2ccc(N)c([N+](=O)[O-])n2)[C@H]1c1cccs1 ZINC000596146071 479163122 /nfs/dbraw/zinc/16/31/22/479163122.db2.gz KWYKLXKQXUUEFL-NHYWBVRUSA-N 0 3 347.444 2.550 20 5 EFBDHN C[C@@H]1CN(c2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)C[C@H](C)N1 ZINC000599110310 479164979 /nfs/dbraw/zinc/16/49/79/479164979.db2.gz PTTDGRMZNKJRPB-OKILXGFUSA-N 0 3 342.399 2.755 20 5 EFBDHN CN1CCN(CCc2ccc([N+](=O)[O-])cc2)[C@@H](Cc2ccccc2)C1 ZINC000593088588 479165282 /nfs/dbraw/zinc/16/52/82/479165282.db2.gz IBLZEVNMVQXINS-FQEVSTJZSA-N 0 3 339.439 2.996 20 5 EFBDHN CS[C@@H]1CN(c2cc(C)sc2[N+](=O)[O-])C[C@H]1N1CCCC1 ZINC000596195861 479191590 /nfs/dbraw/zinc/19/15/90/479191590.db2.gz PEERCRARTFJUKQ-CHWSQXEVSA-N 0 3 327.475 2.981 20 5 EFBDHN C[C@@H](Nc1ccc([N+](=O)[O-])c(C(N)=O)c1)[C@H](c1ccccc1)N(C)C ZINC000596216735 479205038 /nfs/dbraw/zinc/20/50/38/479205038.db2.gz LKKNWEYFCFSWER-SJKOYZFVSA-N 0 3 342.399 2.797 20 5 EFBDHN C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1Nc1cc[n-]c(=O)c1[N+](=O)[O-] ZINC000596217293 479206170 /nfs/dbraw/zinc/20/61/70/479206170.db2.gz BWHDDYYDBGLTOV-IUODEOHRSA-N 0 3 328.372 2.628 20 5 EFBDHN C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1Nc1cc[n-]c(=O)c1[N+](=O)[O-] ZINC000596217293 479206173 /nfs/dbraw/zinc/20/61/73/479206173.db2.gz BWHDDYYDBGLTOV-IUODEOHRSA-N 0 3 328.372 2.628 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN(C)CCOC(C)(C)C ZINC000610859786 479212846 /nfs/dbraw/zinc/21/28/46/479212846.db2.gz MGWIRIREQWUAAJ-UHFFFAOYSA-N 0 3 337.420 2.979 20 5 EFBDHN CC(C)C[C@@H](CN1CCCC1)NC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000574374091 479273210 /nfs/dbraw/zinc/27/32/10/479273210.db2.gz UAFOSTNHVBCWGK-INIZCTEOSA-N 0 3 348.447 2.905 20 5 EFBDHN C[C@@H]1CN(c2ncc([N+](=O)[O-])cn2)[C@H](C)[C@H](C)N1Cc1ccccc1 ZINC000585090417 479278434 /nfs/dbraw/zinc/27/84/34/479278434.db2.gz LUZLHCKTXNGPAX-QLFBSQMISA-N 0 3 341.415 2.873 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CN2CC(Cc3ccccc3)C2)c1 ZINC000611177953 479301888 /nfs/dbraw/zinc/30/18/88/479301888.db2.gz HGYJCGXYMRHBAS-GOSISDBHSA-N 0 3 342.395 2.509 20 5 EFBDHN CCCN(CCn1cc([N+](=O)[O-])ccc1=O)Cc1ccc(OC)cc1 ZINC000611185028 479306163 /nfs/dbraw/zinc/30/61/63/479306163.db2.gz LMONZXUXQXOQFV-UHFFFAOYSA-N 0 3 345.399 2.677 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC(N2CCOCC2)CC1 ZINC000599473162 479307864 /nfs/dbraw/zinc/30/78/64/479307864.db2.gz YTOVNAXJDIMQOT-HNNXBMFYSA-N 0 3 333.432 2.761 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])n1cc(CCN2CCCCC2)nn1 ZINC000603220370 479309263 /nfs/dbraw/zinc/30/92/63/479309263.db2.gz UERGNNLHTVUSQG-CQSZACIVSA-N 0 3 329.404 2.824 20 5 EFBDHN C[C@H](CN1CCC(C)CC1)Nc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000596487588 479314696 /nfs/dbraw/zinc/31/46/96/479314696.db2.gz IICKTNWVBWMCQC-GFCCVEGCSA-N 0 3 345.403 2.776 20 5 EFBDHN C[C@@H]1CN(C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@@H](C)C1(F)F ZINC000599511847 479317881 /nfs/dbraw/zinc/31/78/81/479317881.db2.gz BYXNIOVYEBYQFN-BZPMIXESSA-N 0 3 344.358 2.558 20 5 EFBDHN C[C@@H]1CN(C[C@H](O)COc2ccccc2[N+](=O)[O-])C[C@@H](C)C1(F)F ZINC000599514186 479318744 /nfs/dbraw/zinc/31/87/44/479318744.db2.gz DZXICRSCZBEJQM-UPJWGTAASA-N 0 3 344.358 2.558 20 5 EFBDHN Cc1c(CNC(=O)N(C)CCN2CCCCC2)cccc1[N+](=O)[O-] ZINC000593396467 479324378 /nfs/dbraw/zinc/32/43/78/479324378.db2.gz ACXMNBKERBYLHC-UHFFFAOYSA-N 0 3 334.420 2.531 20 5 EFBDHN C[C@@H](CN1CCC[C@H](C)C1)NC(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000593419318 479333438 /nfs/dbraw/zinc/33/34/38/479333438.db2.gz FKLZBYLQFUZMGS-STQMWFEESA-N 0 3 337.395 2.513 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1CN1CC[C@@H](C3CCOCC3)C1)OCCO2 ZINC000611274860 479333918 /nfs/dbraw/zinc/33/39/18/479333918.db2.gz YJAWPNGPOFKVCH-CQSZACIVSA-N 0 3 348.399 2.615 20 5 EFBDHN CC(C)CC[C@@H](N)C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000602458782 479344569 /nfs/dbraw/zinc/34/45/69/479344569.db2.gz OZZTZQGBVOLKFP-QGZVFWFLSA-N 0 3 349.431 2.728 20 5 EFBDHN CC(C)CC[C@H](N)C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000602458581 479344640 /nfs/dbraw/zinc/34/46/40/479344640.db2.gz OZZTZQGBVOLKFP-KRWDZBQOSA-N 0 3 349.431 2.728 20 5 EFBDHN Cc1nn(CCN(C)Cc2ccc(F)cc2)c2ncc([N+](=O)[O-])cc12 ZINC000603326172 479346918 /nfs/dbraw/zinc/34/69/18/479346918.db2.gz MEAXNSUXGWQOON-UHFFFAOYSA-N 0 3 343.362 2.919 20 5 EFBDHN O=[N+]([O-])c1cc(F)c(CN2CCN(c3ccncc3)CC2)c(F)c1 ZINC000586766505 479348114 /nfs/dbraw/zinc/34/81/14/479348114.db2.gz XMRQHJPPNSCIOU-UHFFFAOYSA-N 0 3 334.326 2.590 20 5 EFBDHN CCOCCN(CCn1ccc([N+](=O)[O-])n1)[C@H]1CCc2ccccc21 ZINC000599625484 479358873 /nfs/dbraw/zinc/35/88/73/479358873.db2.gz MCGTYVASJMHEMA-KRWDZBQOSA-N 0 3 344.415 2.817 20 5 EFBDHN CCc1ccc(C(=O)NC[C@@H]2CCCCN2C2CC2)cc1[N+](=O)[O-] ZINC000574856286 479359994 /nfs/dbraw/zinc/35/99/94/479359994.db2.gz BOLBMWLWLIOEBE-INIZCTEOSA-N 0 3 331.416 2.904 20 5 EFBDHN CN(CCN1CCCCC1)c1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC000593515272 479372448 /nfs/dbraw/zinc/37/24/48/479372448.db2.gz FCOOOIKXUHBTJI-UHFFFAOYSA-N 0 3 332.326 2.931 20 5 EFBDHN O=C(CCCNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NC1CC1 ZINC000602514061 479376693 /nfs/dbraw/zinc/37/66/93/479376693.db2.gz KXFSWNIWLKRVAT-UHFFFAOYSA-N 0 3 345.321 2.762 20 5 EFBDHN C[C@H](CNCc1nc2cc([N+](=O)[O-])ccc2o1)N1CCC(C)CC1 ZINC000602523447 479380461 /nfs/dbraw/zinc/38/04/61/479380461.db2.gz CPMYNTLANDJSLT-CYBMUJFWSA-N 0 3 332.404 2.946 20 5 EFBDHN COc1ccc([C@@H]2CCCN2CCn2c(C)ncc2[N+](=O)[O-])cc1 ZINC000611442805 479381338 /nfs/dbraw/zinc/38/13/38/479381338.db2.gz DHVUHSLYUURYFJ-INIZCTEOSA-N 0 3 330.388 2.945 20 5 EFBDHN COc1cc(N2CCN(C)[C@H](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000588053689 479388359 /nfs/dbraw/zinc/38/83/59/479388359.db2.gz ZIDXQARGXDVMBK-QGZVFWFLSA-N 0 3 341.411 2.967 20 5 EFBDHN COC[C@@H](C)N(CCn1ccc([N+](=O)[O-])n1)[C@@H]1CCc2ccccc21 ZINC000599683261 479388864 /nfs/dbraw/zinc/38/88/64/479388864.db2.gz PTEIKXWCQRFFEO-RHSMWYFYSA-N 0 3 344.415 2.816 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1CN1CCC[C@H]1C1CCOCC1)OCCO2 ZINC000611479703 479389615 /nfs/dbraw/zinc/38/96/15/479389615.db2.gz SVQOSIKHYFUNIO-HNNXBMFYSA-N 0 3 348.399 2.757 20 5 EFBDHN Cc1noc(C)c1[C@@H](C)NC1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602555134 479395899 /nfs/dbraw/zinc/39/58/99/479395899.db2.gz OSMULLTZLYMXIC-LLVKDONJSA-N 0 3 345.403 2.914 20 5 EFBDHN Cc1nc(CNC2CCN(c3ccc([N+](=O)[O-])nc3)CC2)sc1C ZINC000602556990 479395977 /nfs/dbraw/zinc/39/59/77/479395977.db2.gz ICVZYAQKYIYMAV-UHFFFAOYSA-N 0 3 347.444 2.822 20 5 EFBDHN CCc1cnc(CNC2CCN(c3ccc([N+](=O)[O-])nc3)CC2)s1 ZINC000602559399 479396313 /nfs/dbraw/zinc/39/63/13/479396313.db2.gz IGWNRAYYZQUXFA-UHFFFAOYSA-N 0 3 347.444 2.767 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN[C@@H]1CCc2c[nH]nc2C1 ZINC000602566494 479400806 /nfs/dbraw/zinc/40/08/06/479400806.db2.gz DOQOVDPNSFOQRI-GFCCVEGCSA-N 0 3 340.305 2.984 20 5 EFBDHN C[C@H](CC[S@@](C)=O)NCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602569273 479402243 /nfs/dbraw/zinc/40/22/43/479402243.db2.gz OQKNLSLGCYRIDN-PVBMHHQDSA-N 0 3 338.351 2.860 20 5 EFBDHN CN1CC=C(CNCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602580604 479408634 /nfs/dbraw/zinc/40/86/34/479408634.db2.gz FPTHBRMCWHGWDV-UHFFFAOYSA-N 0 3 329.322 2.965 20 5 EFBDHN O=C(CCN[C@H]1CCc2c1cccc2[N+](=O)[O-])N1CCCCCC1 ZINC000575136751 479410718 /nfs/dbraw/zinc/41/07/18/479410718.db2.gz JLYSRUGNNNEDSE-INIZCTEOSA-N 0 3 331.416 2.964 20 5 EFBDHN C[C@@H]1CCN(CCNCc2cc(Br)c([N+](=O)[O-])s2)C1 ZINC000602592315 479413144 /nfs/dbraw/zinc/41/31/44/479413144.db2.gz COJORFFERGSXQB-SECBINFHSA-N 0 3 348.266 2.850 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)ccc1CCNCc1cc2c(cn1)OCCO2 ZINC000602598102 479417747 /nfs/dbraw/zinc/41/77/47/479417747.db2.gz BEVFNAMQOFWOJQ-UHFFFAOYSA-N 0 3 349.774 2.747 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CNCC[C@]3(O)CCCOC3)o2)cc1 ZINC000593690988 479424353 /nfs/dbraw/zinc/42/43/53/479424353.db2.gz GQTCXONQAVULQH-GOSISDBHSA-N 0 3 346.383 2.876 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN[C@H]1CCn2ccnc2C1 ZINC000602621674 479428975 /nfs/dbraw/zinc/42/89/75/479428975.db2.gz ISNOBYVEZQMJSZ-LBPRGKRZSA-N 0 3 340.305 2.915 20 5 EFBDHN CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)c1ccsc1[N+](=O)[O-] ZINC000614533690 479438177 /nfs/dbraw/zinc/43/81/77/479438177.db2.gz DMYRTCYTOXGMIR-KRWDZBQOSA-N 0 3 347.440 2.730 20 5 EFBDHN CCOC1CC(O)(CNCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602636538 479440102 /nfs/dbraw/zinc/44/01/02/479440102.db2.gz IIZIAFJBKBZPAS-UHFFFAOYSA-N 0 3 348.321 2.633 20 5 EFBDHN CO[C@H](CNCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@@H]1CCOC1 ZINC000602641476 479442856 /nfs/dbraw/zinc/44/28/56/479442856.db2.gz SCFBGFRBQQLJGK-BXUZGUMPSA-N 0 3 348.321 2.755 20 5 EFBDHN CCn1c(C)nc([N+](=O)[O-])c1N1CC[C@@H](N(C)Cc2ccccc2)C1 ZINC000588821878 479444306 /nfs/dbraw/zinc/44/43/06/479444306.db2.gz OMIRVPUDKAAAEG-MRXNPFEDSA-N 0 3 343.431 2.830 20 5 EFBDHN CC[C@@H]1CN(C)CCCN1C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000588821389 479444643 /nfs/dbraw/zinc/44/46/43/479444643.db2.gz FQEMCDJAXZLYKD-CYBMUJFWSA-N 0 3 325.796 2.805 20 5 EFBDHN O=[N+]([O-])c1ccc2ncnc(N3CC[C@H](N4CCCCC4)C3)c2c1 ZINC000611706372 479451400 /nfs/dbraw/zinc/45/14/00/479451400.db2.gz JIVGLXQNEUFTTK-AWEZNQCLSA-N 0 3 327.388 2.603 20 5 EFBDHN CN(C)C1(CNCc2cc(Br)c([N+](=O)[O-])s2)CC1 ZINC000602695323 479482922 /nfs/dbraw/zinc/48/29/22/479482922.db2.gz MIRLWMKUZOGKBC-UHFFFAOYSA-N 0 3 334.239 2.603 20 5 EFBDHN Cc1c(CN[C@@H]([C@@H]2CCCO2)C2(CO)CCC2)cccc1[N+](=O)[O-] ZINC000602668366 479462970 /nfs/dbraw/zinc/46/29/70/479462970.db2.gz WOXKTJDKAUWICO-IRXDYDNUSA-N 0 3 334.416 2.703 20 5 EFBDHN CO[C@@H]1COCC[C@@H]1CNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602674864 479469350 /nfs/dbraw/zinc/46/93/50/479469350.db2.gz GXMBPGMRWUUUFN-BXUZGUMPSA-N 0 3 348.321 2.755 20 5 EFBDHN CN(C)CC(C)(C)NCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602688952 479476610 /nfs/dbraw/zinc/47/66/10/479476610.db2.gz UHFLCVZZNMXNRP-UHFFFAOYSA-N 0 3 336.255 2.849 20 5 EFBDHN CN(Cc1cc(Br)c([N+](=O)[O-])s1)C[C@H]1CCCN1C ZINC000602701082 479487616 /nfs/dbraw/zinc/48/76/16/479487616.db2.gz ZWHYXYPSTJPZGJ-SECBINFHSA-N 0 3 348.266 2.945 20 5 EFBDHN CC[C@@H](CN1CCCC1)NC(=O)Nc1ccc(OC)c([N+](=O)[O-])c1 ZINC000611824590 479493718 /nfs/dbraw/zinc/49/37/18/479493718.db2.gz ROCCHGUPNFKPQR-LBPRGKRZSA-N 0 3 336.392 2.599 20 5 EFBDHN CN(CCN1CCCCC1)C(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000593884532 479496467 /nfs/dbraw/zinc/49/64/67/479496467.db2.gz XVRVHEQPLSCPPB-UHFFFAOYSA-N 0 3 333.432 2.817 20 5 EFBDHN CN(CCN1CCCCC1)C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000593883479 479496555 /nfs/dbraw/zinc/49/65/55/479496555.db2.gz NKKKERGMJXDWET-UHFFFAOYSA-N 0 3 348.447 2.731 20 5 EFBDHN CCCN1CC[C@@H](NCc2cc(Br)c([N+](=O)[O-])s2)C1 ZINC000602713387 479497252 /nfs/dbraw/zinc/49/72/52/479497252.db2.gz MIGDPBOEGRSIQO-SECBINFHSA-N 0 3 348.266 2.993 20 5 EFBDHN CN(CCN1CCCCC1)C(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000593883612 479497360 /nfs/dbraw/zinc/49/73/60/479497360.db2.gz QUBNAHOOSGZXJO-UHFFFAOYSA-N 0 3 325.796 2.806 20 5 EFBDHN CN(CCN1CCCCC1)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000593884921 479497428 /nfs/dbraw/zinc/49/74/28/479497428.db2.gz YCDHTCXVBQEXAK-UHFFFAOYSA-N 0 3 325.796 2.806 20 5 EFBDHN O=C([C@@H]1CCN(C/C=C\c2ccccc2[N+](=O)[O-])C1)N1CCCC1 ZINC000589205473 479497702 /nfs/dbraw/zinc/49/77/02/479497702.db2.gz SCNIJEPIRZNGCQ-GMNBZTITSA-N 0 3 329.400 2.552 20 5 EFBDHN O=[N+]([O-])c1sc(CNC[C@@H](CO)CC2CC2)cc1Br ZINC000602718209 479500630 /nfs/dbraw/zinc/50/06/30/479500630.db2.gz QWLCIKPAXWIZLI-VIFPVBQESA-N 0 3 349.250 2.917 20 5 EFBDHN Cc1c(CN2CCC[C@@H]2CN2C[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000604467069 479520853 /nfs/dbraw/zinc/52/08/53/479520853.db2.gz VPQNELZEAKLEOA-RVKKMQEKSA-N 0 3 347.459 2.977 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN1CCC[C@H]1Cc1ccc(F)cc1 ZINC000602766874 479537370 /nfs/dbraw/zinc/53/73/70/479537370.db2.gz GDNPKFVDMWUCGS-INIZCTEOSA-N 0 3 332.379 2.946 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN1CCC(COc2ccccc2)CC1 ZINC000602765554 479537854 /nfs/dbraw/zinc/53/78/54/479537854.db2.gz VGNSEITXCOMLDV-UHFFFAOYSA-N 0 3 344.415 2.891 20 5 EFBDHN COc1ccccc1[C@@H]1CCCN1CCn1c(C)ncc1[N+](=O)[O-] ZINC000602771426 479541043 /nfs/dbraw/zinc/54/10/43/479541043.db2.gz ACGKIOMDTRZJII-HNNXBMFYSA-N 0 3 330.388 2.945 20 5 EFBDHN CCC(C)(C)N1CCN([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000594020678 479552185 /nfs/dbraw/zinc/55/21/85/479552185.db2.gz KWKULJPMLPKUNX-CQSZACIVSA-N 0 3 348.447 2.728 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CN[C@@H]1CCc2ccccc21 ZINC000612028259 479554283 /nfs/dbraw/zinc/55/42/83/479554283.db2.gz YCPFAMYBCNRGHL-GDBMZVCRSA-N 0 3 328.368 2.612 20 5 EFBDHN CN(C)CCN(c1ncnc2ccc([N+](=O)[O-])cc21)C1CCCC1 ZINC000589692373 479561640 /nfs/dbraw/zinc/56/16/40/479561640.db2.gz PBEZATDXLSVTSM-UHFFFAOYSA-N 0 3 329.404 2.849 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN[C@@H](C)c1ccc(-n2cccn2)cc1 ZINC000602808101 479567616 /nfs/dbraw/zinc/56/76/16/479567616.db2.gz XDOGELIVGGRNQH-ZDUSSCGKSA-N 0 3 340.387 2.636 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN[C@H](C)c1cccc(-n2cccn2)c1 ZINC000602808760 479568086 /nfs/dbraw/zinc/56/80/86/479568086.db2.gz ZAJKXNPISAVJDG-CYBMUJFWSA-N 0 3 340.387 2.636 20 5 EFBDHN CC[C@](C)(O)CN(CCn1c(C)ncc1[N+](=O)[O-])Cc1ccccc1 ZINC000602819017 479572794 /nfs/dbraw/zinc/57/27/94/479572794.db2.gz YEBVMAYCRAUUFA-SFHVURJKSA-N 0 3 346.431 2.763 20 5 EFBDHN COC[C@@H](NCCn1c(C)ncc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000602817995 479573156 /nfs/dbraw/zinc/57/31/56/479573156.db2.gz MUGJAHCKKMPWOK-CQSZACIVSA-N 0 3 338.795 2.730 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@@H]1CC[C@@](O)(C(F)(F)F)C1 ZINC000589938049 479584142 /nfs/dbraw/zinc/58/41/42/479584142.db2.gz BLWVIPYSCVQWDY-RISCZKNCSA-N 0 3 348.321 2.929 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCN1CCCN(c2ccncc2)CC1 ZINC000602848017 479592210 /nfs/dbraw/zinc/59/22/10/479592210.db2.gz XSJZNUDLROTETO-UHFFFAOYSA-N 0 3 342.399 2.581 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC[C@@H]2NC(=O)CC[C@H]2C1 ZINC000597207180 479621176 /nfs/dbraw/zinc/62/11/76/479621176.db2.gz SQEKZLZVZHPGEV-AHIVSBDTSA-N 0 3 329.400 2.599 20 5 EFBDHN CCN(CCOc1ccccc1OC)CCn1c(C)ncc1[N+](=O)[O-] ZINC000602904738 479622667 /nfs/dbraw/zinc/62/26/67/479622667.db2.gz LBHSTCKTPSDDKZ-UHFFFAOYSA-N 0 3 348.403 2.509 20 5 EFBDHN O=C(CSc1ccccc1[N+](=O)[O-])N[C@@H]1CCCN2CCCC[C@@H]12 ZINC000594196152 479626867 /nfs/dbraw/zinc/62/68/67/479626867.db2.gz LBVTWOWHLLUBPO-KGLIPLIRSA-N 0 3 349.456 2.820 20 5 EFBDHN CCOc1ccc(C(=O)N[C@@H]2CCCN3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC000594201736 479630155 /nfs/dbraw/zinc/63/01/55/479630155.db2.gz QOIFEEXYDVHFAX-HUUCEWRRSA-N 0 3 347.415 2.740 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC[C@@H](CN2CCCC2=O)C1 ZINC000597228823 479631614 /nfs/dbraw/zinc/63/16/14/479631614.db2.gz OZDWPRTYMDKJPQ-IUYQLWOBSA-N 0 3 343.427 2.942 20 5 EFBDHN CC[C@](C)(NCCn1cc([N+](=O)[O-])ccc1=O)c1ccc(F)cc1 ZINC000602922689 479633199 /nfs/dbraw/zinc/63/31/99/479633199.db2.gz BTGIVBUIMPLDGW-KRWDZBQOSA-N 0 3 333.363 2.811 20 5 EFBDHN CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1(CO)CCOCC1 ZINC000597252259 479645262 /nfs/dbraw/zinc/64/52/62/479645262.db2.gz QAEQHBJFUJPMDD-UHFFFAOYSA-N 0 3 346.383 2.828 20 5 EFBDHN C[C@@H]1[C@H](N(C)C)CCN1C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000615303166 479651990 /nfs/dbraw/zinc/65/19/90/479651990.db2.gz GGEZNBMHAWKDNJ-BFUOFWGJSA-N 0 3 349.434 2.846 20 5 EFBDHN CCN(C[C@@H]1CCCN1CC)C(=O)c1cc([N+](=O)[O-])ccc1OC ZINC000579043964 479653682 /nfs/dbraw/zinc/65/36/82/479653682.db2.gz SHJWNXUCKOWRGH-AWEZNQCLSA-N 0 3 335.404 2.550 20 5 EFBDHN CC(C)(C(=O)NCc1cccc([N+](=O)[O-])c1)[C@@H](N)c1ccccc1 ZINC000579108489 479661318 /nfs/dbraw/zinc/66/13/18/479661318.db2.gz SJDBTSJRWSSPCY-INIZCTEOSA-N 0 3 327.384 2.937 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H](N2CCOCC2)CC1 ZINC000590601425 479667163 /nfs/dbraw/zinc/66/71/63/479667163.db2.gz WJHSMIZCXOXGLU-HZPDHXFCSA-N 0 3 333.432 2.843 20 5 EFBDHN CCO[C@@H]1C[C@H](NC/C=C\c2ccccc2[N+](=O)[O-])[C@@]12CCCO2 ZINC000612691921 479733491 /nfs/dbraw/zinc/73/34/91/479733491.db2.gz UFDQREVPNDGJAU-AWRCXPFVSA-N 0 3 332.400 2.924 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCN([C@@H]2CCC[C@@H]2O)CC1 ZINC000615835570 479766077 /nfs/dbraw/zinc/76/60/77/479766077.db2.gz RRLQGHDRIDFZAR-IWCZSELASA-N 0 3 345.443 2.529 20 5 EFBDHN COc1cc(C[NH2+]C[C@H](c2ccnn2C)C(C)C)c([N+](=O)[O-])cc1[O-] ZINC000615943155 479788602 /nfs/dbraw/zinc/78/86/02/479788602.db2.gz IEMBCGNULLKZRH-ZDUSSCGKSA-N 0 3 348.403 2.572 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)ccc1N1CCCN(C[C@@H]2CCCO2)CC1 ZINC000615941693 479789471 /nfs/dbraw/zinc/78/94/71/479789471.db2.gz IWSZLVSJGICODW-AWEZNQCLSA-N 0 3 339.823 2.939 20 5 EFBDHN Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000619525363 479818934 /nfs/dbraw/zinc/81/89/34/479818934.db2.gz DJIKLUZGAQAUQN-KRWDZBQOSA-N 0 3 342.399 2.500 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1CN[C@H](CO)[C@H](C)c1ccccc1 ZINC000619532016 479821354 /nfs/dbraw/zinc/82/13/54/479821354.db2.gz XNRXCWQQFCJRAM-CXAGYDPISA-N 0 3 330.384 2.858 20 5 EFBDHN CC[C@@H]1CN(C)CCCN1C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000619578696 479834412 /nfs/dbraw/zinc/83/44/12/479834412.db2.gz NJAQBNUBFZAYCS-GFCCVEGCSA-N 0 3 325.796 2.805 20 5 EFBDHN NC(=O)C1(c2ccccc2)CCN(Cc2ccccc2[N+](=O)[O-])CC1 ZINC000609672627 480195114 /nfs/dbraw/zinc/19/51/14/480195114.db2.gz NLSDCJNBAFCWEI-UHFFFAOYSA-N 0 3 339.395 2.614 20 5 EFBDHN CC(C)(C(=O)N1CC[C@@H](N2CCCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000610063363 480232523 /nfs/dbraw/zinc/23/25/23/480232523.db2.gz RADAKCFBQWYJIB-MRXNPFEDSA-N 0 3 331.416 2.569 20 5 EFBDHN CC(C)(C(=O)N1CC[C@H](N2CCCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000610063362 480233477 /nfs/dbraw/zinc/23/34/77/480233477.db2.gz RADAKCFBQWYJIB-INIZCTEOSA-N 0 3 331.416 2.569 20 5 EFBDHN Cn1cnc([N+](=O)[O-])c1N[C@H](CN1CCCCC1)c1ccccc1 ZINC000610279218 480269369 /nfs/dbraw/zinc/26/93/69/480269369.db2.gz AMKXOVWHXXLIMJ-OAHLLOKOSA-N 0 3 329.404 2.967 20 5 EFBDHN COc1cccc(CN(CCn2cc([N+](=O)[O-])cn2)CC(C)C)c1 ZINC000610447516 480308155 /nfs/dbraw/zinc/30/81/55/480308155.db2.gz CDRXKHPAXKIZNB-UHFFFAOYSA-N 0 3 332.404 2.958 20 5 EFBDHN COc1ccc(-c2ccc(CNCC3(CO)CC3)o2)c([N+](=O)[O-])c1 ZINC000610468042 480313196 /nfs/dbraw/zinc/31/31/96/480313196.db2.gz OKEMFXCHMLXMRC-UHFFFAOYSA-N 0 3 332.356 2.726 20 5 EFBDHN CC(C)(NCCOc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1 ZINC000610662792 480357616 /nfs/dbraw/zinc/35/76/16/480357616.db2.gz XOTFAAVPSZUNPK-UHFFFAOYSA-N 0 3 343.383 2.981 20 5 EFBDHN CC1(C)CCCN(CCNCc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC000618198591 480565248 /nfs/dbraw/zinc/56/52/48/480565248.db2.gz GXUIBXWORQMCQA-UHFFFAOYSA-N 0 3 349.431 2.578 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN3CC[C@@H](N4CCCCC4)C3)nc2c1 ZINC000618280677 480603197 /nfs/dbraw/zinc/60/31/97/480603197.db2.gz PYIJQGXMEMJAOM-CQSZACIVSA-N 0 3 329.404 2.531 20 5 EFBDHN C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N)[C@H](c1ccccc1)N(C)C ZINC000189825739 533747547 /nfs/dbraw/zinc/74/75/47/533747547.db2.gz MBOAAYTWDSWUPT-YVEFUNNKSA-N 0 3 342.399 2.598 20 5 EFBDHN COc1ccc(NC(=O)CCN[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000181785129 534069331 /nfs/dbraw/zinc/06/93/31/534069331.db2.gz ATDDPMDDGTZPLE-LBPRGKRZSA-N 0 3 344.371 2.678 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](c2ccccc2)N(C)C)c1 ZINC000152042612 534319118 /nfs/dbraw/zinc/31/91/18/534319118.db2.gz HCSXREVBSDHUNP-QGZVFWFLSA-N 0 3 327.384 2.936 20 5 EFBDHN CC(C)(C)N1C[C@H](N[C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1=O ZINC000090177808 518721714 /nfs/dbraw/zinc/72/17/14/518721714.db2.gz RSDAIHHNGZHDGS-HZPDHXFCSA-N 0 3 345.443 2.905 20 5 EFBDHN CC(C)CO[C@@H]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000119873755 519760465 /nfs/dbraw/zinc/76/04/65/519760465.db2.gz TXJJYVQVOSTPCJ-MRXNPFEDSA-N 0 3 335.404 2.670 20 5 EFBDHN CCN(CC)Cc1cccc(NC(=O)c2cc([N+](=O)[O-])cnc2N)c1 ZINC000180523567 520756869 /nfs/dbraw/zinc/75/68/69/520756869.db2.gz CYGIYVCJLCXCTF-UHFFFAOYSA-N 0 3 343.387 2.666 20 5 EFBDHN CN(C)C(=O)[C@@H](NCCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000194408042 524009390 /nfs/dbraw/zinc/00/93/90/524009390.db2.gz WNSRRVOXNFIVLB-KRWDZBQOSA-N 0 3 327.384 2.556 20 5 EFBDHN COc1ccc(CN[C@H](C)CO)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000067223885 524089042 /nfs/dbraw/zinc/08/90/42/524089042.db2.gz NCTXRGWMXFSPNW-CYBMUJFWSA-N 0 3 346.383 2.653 20 5 EFBDHN Cc1cc(C(=O)N[C@@H](C)CN2C[C@H](C)C[C@H](C)C2)cc([N+](=O)[O-])c1 ZINC000195694654 524118440 /nfs/dbraw/zinc/11/84/40/524118440.db2.gz JHBFITYYKBRIAO-ZNMIVQPWSA-N 0 3 333.432 2.999 20 5 EFBDHN C[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000182071922 524300912 /nfs/dbraw/zinc/30/09/12/524300912.db2.gz DSOOWXCOZDVFSJ-CQSZACIVSA-N 0 3 327.384 2.845 20 5 EFBDHN C[C@H](CN1CCC[C@H](C)C1)NC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000120653640 524342477 /nfs/dbraw/zinc/34/24/77/524342477.db2.gz TYACZWGSRMVEPM-LSDHHAIUSA-N 0 3 348.447 2.557 20 5 EFBDHN C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000120743617 524557935 /nfs/dbraw/zinc/55/79/35/524557935.db2.gz ABJRHMVHGSZDGH-HZMBPMFUSA-N 0 3 325.796 2.660 20 5 EFBDHN C[C@@H](CN(C)Cc1ccccc1)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000182103924 524574001 /nfs/dbraw/zinc/57/40/01/524574001.db2.gz PMLUAKMJQJWAMB-AWEZNQCLSA-N 0 3 327.384 2.845 20 5 EFBDHN C[C@@H](NC(=O)N1CC[C@@H](N2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000066186118 525175569 /nfs/dbraw/zinc/17/55/69/525175569.db2.gz CVOPWZZWFSIVKD-CZUORRHYSA-N 0 3 332.404 2.536 20 5 EFBDHN C[S@@](=O)C[C@@H](NCCOc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000183131025 525366548 /nfs/dbraw/zinc/36/65/48/525366548.db2.gz HNJSKUFDXQXAKN-MZNJEOGPSA-N 0 3 348.424 2.683 20 5 EFBDHN Cc1c(NC(=O)[C@H](C)N(C)C[C@H]2CCCOC2)cccc1[N+](=O)[O-] ZINC000245497996 525855530 /nfs/dbraw/zinc/85/55/30/525855530.db2.gz VEVJFDITGJVZDK-UONOGXRCSA-N 0 3 335.404 2.589 20 5 EFBDHN Cc1ccc(C(=O)NCCN[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000120917805 526167853 /nfs/dbraw/zinc/16/78/53/526167853.db2.gz FTDRUVZMNVCKQE-CQSZACIVSA-N 0 3 327.384 2.984 20 5 EFBDHN CC(C)(C)OC(=O)NC[C@H](NCc1ccccc1[N+](=O)[O-])C1CC1 ZINC000153835148 526472377 /nfs/dbraw/zinc/47/23/77/526472377.db2.gz FQBXDEZMDYCSQO-AWEZNQCLSA-N 0 3 335.404 2.988 20 5 EFBDHN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCC[C@H](N2CCCC2)C1 ZINC000136979366 526574893 /nfs/dbraw/zinc/57/48/93/526574893.db2.gz LMYSUPPYTZHYPM-LBPRGKRZSA-N 0 3 337.807 2.949 20 5 EFBDHN O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CCC[C@H](N2CCCC2)C1 ZINC000077510557 526610977 /nfs/dbraw/zinc/61/09/77/526610977.db2.gz ZINRFIURHAVYCI-ZDUSSCGKSA-N 0 3 337.807 2.949 20 5 EFBDHN CN1CC[C@@H]2[C@H](CCCN2C(=O)Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC000351621079 536474436 /nfs/dbraw/zinc/47/44/36/536474436.db2.gz PSOKAHACLQENSD-IAQYHMDHSA-N 0 3 336.367 2.682 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CN2CCC[C@H]2c2ccncc2)c1 ZINC000245718309 527391484 /nfs/dbraw/zinc/39/14/84/527391484.db2.gz QQVGLHMLDOWVIC-WMZOPIPTSA-N 0 3 343.383 2.567 20 5 EFBDHN CCO[C@H]1C[C@H](NCc2ccc(C(N)=O)cc2[N+](=O)[O-])C1(CC)CC ZINC000187042286 528143067 /nfs/dbraw/zinc/14/30/67/528143067.db2.gz XGSANIMJTKYWJF-HOTGVXAUSA-N 0 3 349.431 2.767 20 5 EFBDHN CCOc1ccc([C@H](C)NCCCO[C@H]2CCOC2)cc1[N+](=O)[O-] ZINC000154220457 528606175 /nfs/dbraw/zinc/60/61/75/528606175.db2.gz WPHVRXRDUJTXGI-ZFWWWQNUSA-N 0 3 338.404 2.840 20 5 EFBDHN CCOc1ccc([C@H](C)NCCC(=O)N[C@H](C)CC)cc1[N+](=O)[O-] ZINC000153244421 528606240 /nfs/dbraw/zinc/60/62/40/528606240.db2.gz KRYOYYOYWNSIOK-OLZOCXBDSA-N 0 3 337.420 2.949 20 5 EFBDHN CCOC(=O)CCCN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174242765 528697276 /nfs/dbraw/zinc/69/72/76/528697276.db2.gz UMPKUGGCHBNWQI-UHFFFAOYSA-N 0 3 336.388 2.781 20 5 EFBDHN CCCn1ccnc1CCCN(C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000191520289 528862572 /nfs/dbraw/zinc/86/25/72/528862572.db2.gz IKWBUMHXKLZPPM-QGZVFWFLSA-N 0 3 346.431 2.799 20 5 EFBDHN CC(C)N(CCNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)C(C)C ZINC000189563419 528906834 /nfs/dbraw/zinc/90/68/34/528906834.db2.gz BKDIWPCTVMJCKE-UHFFFAOYSA-N 0 3 343.449 2.529 20 5 EFBDHN CC[C@@H](O)[C@@H]1CCCCN1CCOc1ccc(OC)cc1[N+](=O)[O-] ZINC000173778698 529236269 /nfs/dbraw/zinc/23/62/69/529236269.db2.gz YQLLWGQLCFSILZ-GOEBONIOSA-N 0 3 338.404 2.608 20 5 EFBDHN CC[C@@H](c1ccncc1)N(C)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000130157582 529260266 /nfs/dbraw/zinc/26/02/66/529260266.db2.gz LKCUHNIOPXXCAN-WMZOPIPTSA-N 0 3 345.399 2.813 20 5 EFBDHN CC(C)Oc1cc(C(=O)N2CC[C@H]3CCN(C)C[C@H]32)ccc1[N+](=O)[O-] ZINC000412248101 534946300 /nfs/dbraw/zinc/94/63/00/534946300.db2.gz KUASJZUTFBWFEH-CZUORRHYSA-N 0 3 347.415 2.548 20 5 EFBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1C[C@@H]2CC[C@H](O)C[C@@H]2C1 ZINC000412036383 535021789 /nfs/dbraw/zinc/02/17/89/535021789.db2.gz FTPMHONWHIOBDT-VBQJREDUSA-N 0 3 334.416 2.975 20 5 EFBDHN CC[C@@H](C)N[C@H](CNC(=O)Cc1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000359530687 535605217 /nfs/dbraw/zinc/60/52/17/535605217.db2.gz DKNJSTASPUCXTB-CZUORRHYSA-N 0 3 345.399 2.976 20 5 EFBDHN CCOC[C@@H](O)CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000344575772 535675748 /nfs/dbraw/zinc/67/57/48/535675748.db2.gz CACQHXSFWRDZFO-AWEZNQCLSA-N 0 3 336.413 2.810 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)C[C@@H]1CCCN1C ZINC000421710679 535771764 /nfs/dbraw/zinc/77/17/64/535771764.db2.gz LVBALALEBUWPBN-RDJZCZTQSA-N 0 3 333.432 2.716 20 5 EFBDHN CCOC(=O)N1CC[C@H](N[C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000193300155 535782172 /nfs/dbraw/zinc/78/21/72/535782172.db2.gz UOTUNZATNUSQRL-BBRMVZONSA-N 0 3 333.388 2.793 20 5 EFBDHN CC[C@@H]1CCC[C@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000349660567 535822076 /nfs/dbraw/zinc/82/20/76/535822076.db2.gz CNPXUGPNXDHHLF-KGLIPLIRSA-N 0 3 340.445 2.927 20 5 EFBDHN CN(C)CCN(C(=O)c1cc(F)cc([N+](=O)[O-])c1)c1ccccc1 ZINC000344217234 535846472 /nfs/dbraw/zinc/84/64/72/535846472.db2.gz QPQZGYBCQJYAMD-UHFFFAOYSA-N 0 3 331.347 2.942 20 5 EFBDHN CN(C)CCN(Cc1ccccn1)Cc1ccc([N+](=O)[O-])cc1F ZINC000349293873 535865796 /nfs/dbraw/zinc/86/57/96/535865796.db2.gz GNUKUAUFUOCOSZ-UHFFFAOYSA-N 0 3 332.379 2.693 20 5 EFBDHN CN(C)Cc1cccc(CNC(=O)c2cc(F)cc([N+](=O)[O-])c2)c1 ZINC000344207438 536034097 /nfs/dbraw/zinc/03/40/97/536034097.db2.gz GQUUXUIZNQMKQK-UHFFFAOYSA-N 0 3 331.347 2.726 20 5 EFBDHN CN(C)Cc1cccc(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])c1 ZINC000266257672 536037075 /nfs/dbraw/zinc/03/70/75/536037075.db2.gz LMIVMLVKFCGNPE-UHFFFAOYSA-N 0 3 342.399 2.731 20 5 EFBDHN COc1c(C(=O)NCc2cccc(CN(C)C)c2)cccc1[N+](=O)[O-] ZINC000354114843 536846141 /nfs/dbraw/zinc/84/61/41/536846141.db2.gz MYDLUKPPXGVNCM-UHFFFAOYSA-N 0 3 343.383 2.595 20 5 EFBDHN CCN(CC)C(=O)CN[C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000753940640 575363617 /nfs/dbraw/zinc/36/36/17/575363617.db2.gz UUMKYWJPJVLLFY-GOEBONIOSA-N 0 3 333.432 2.764 20 5 EFBDHN O=[N+]([O-])c1ccc([C@H](O)CNCCOc2ccc(Cl)cc2)cc1 ZINC000754251881 575411178 /nfs/dbraw/zinc/41/11/78/575411178.db2.gz XULUPLJODPHDCT-MRXNPFEDSA-N 0 3 336.775 2.950 20 5 EFBDHN CC(C)[C@@H](CN(C)C)NC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000754361539 575424978 /nfs/dbraw/zinc/42/49/78/575424978.db2.gz IIARBAJHFDRCQG-XHDPSFHLSA-N 0 3 325.384 2.540 20 5 EFBDHN CC[C@H](NCC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])[C@H]1CCCO1 ZINC000754520735 575446342 /nfs/dbraw/zinc/44/63/42/575446342.db2.gz WDUUZBFQQGTLCG-SMDDNHRTSA-N 0 3 341.795 2.734 20 5 EFBDHN CC[C@@H](C(=O)NCc1cc([N+](=O)[O-])ccc1Cl)N(CC)CC ZINC000756998379 575809414 /nfs/dbraw/zinc/80/94/14/575809414.db2.gz LEHZVZPTKKMNHV-AWEZNQCLSA-N 0 3 327.812 2.985 20 5 EFBDHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000757795330 575853132 /nfs/dbraw/zinc/85/31/32/575853132.db2.gz KXZMNGFCWGPOSJ-NOZJJQNGSA-N 0 3 338.795 2.852 20 5 EFBDHN Cc1nn(CN2CC[C@@H](C3CCOCC3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761292740 576141514 /nfs/dbraw/zinc/14/15/14/576141514.db2.gz MSMDFTPGDZPANW-OAHLLOKOSA-N 0 3 344.415 2.959 20 5 EFBDHN CS(=O)(=O)[C@H]1CCC[C@H](NCc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000761525436 576174466 /nfs/dbraw/zinc/17/44/66/576174466.db2.gz JZZPKGXIFCFKDW-RYUDHWBXSA-N 0 3 346.836 2.694 20 5 EFBDHN CN1CCC(NC(=S)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)CC1 ZINC000763306206 576371930 /nfs/dbraw/zinc/37/19/30/576371930.db2.gz SBBCSEOHSCELRT-UHFFFAOYSA-N 0 3 348.472 2.528 20 5 EFBDHN C[C@H](C[C@H](O)c1ccco1)NCc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000763523894 576380028 /nfs/dbraw/zinc/38/00/28/576380028.db2.gz KANIVDYSCZVFHO-RISCZKNCSA-N 0 3 348.355 2.561 20 5 EFBDHN Cc1nn(CN(C)CCC2CCOCC2)c2ccc([N+](=O)[O-])cc12 ZINC000765074467 577003897 /nfs/dbraw/zinc/00/38/97/577003897.db2.gz RJUGPWVVPYKMCI-UHFFFAOYSA-N 0 3 332.404 2.959 20 5 EFBDHN C[C@@H](NC[C@H](O)COc1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000765289193 577027824 /nfs/dbraw/zinc/02/78/24/577027824.db2.gz MVKIVDOEWIVNJT-WBMJQRKESA-N 0 3 334.347 2.824 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(N[C@@H]2CCN(C)[C@@H](C)C2)cc1Cl ZINC000765508845 577048708 /nfs/dbraw/zinc/04/87/08/577048708.db2.gz LDCWEKXVSSKNNW-VHSXEESVSA-N 0 3 341.795 2.929 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](CN(C)C)C(C)C ZINC000765517231 577049896 /nfs/dbraw/zinc/04/98/96/577049896.db2.gz WBWXFHDDIGJNHT-RDJZCZTQSA-N 0 3 335.448 2.866 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1CCCCN1C1CC1 ZINC000765663271 577063760 /nfs/dbraw/zinc/06/37/60/577063760.db2.gz NMDJTTDMJJQORC-CQSZACIVSA-N 0 3 348.403 2.742 20 5 EFBDHN CCc1cc(CNC2CCN(c3ccc([N+](=O)[O-])cc3)CC2)[nH]n1 ZINC000766004048 577097652 /nfs/dbraw/zinc/09/76/52/577097652.db2.gz RDCPMXHIZHZPCZ-UHFFFAOYSA-N 0 3 329.404 2.639 20 5 EFBDHN CC(C)(C)N1CCCN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)CC1 ZINC000725789533 577225700 /nfs/dbraw/zinc/22/57/00/577225700.db2.gz IYXSOTOHRXOLAK-UHFFFAOYSA-N 0 3 346.431 2.790 20 5 EFBDHN CCCCCCN(C)CC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000769602763 577374577 /nfs/dbraw/zinc/37/45/77/577374577.db2.gz HVTQUFUWBBHKHW-UHFFFAOYSA-N 0 3 347.419 2.599 20 5 EFBDHN O=C(NCCN1CCCCC1)Nc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000770018719 577397956 /nfs/dbraw/zinc/39/79/56/577397956.db2.gz ZLKIKGMSHGQLPT-UHFFFAOYSA-N 0 3 326.784 2.856 20 5 EFBDHN O=[N+]([O-])c1ccc([C@@H](O)CN2CC[C@]3(C2)OCc2ccccc23)cc1 ZINC000770689222 581126026 /nfs/dbraw/zinc/12/60/26/581126026.db2.gz PMVDYDYDYOAZIX-RBUKOAKNSA-N 0 3 340.379 2.760 20 5 EFBDHN CCc1nnc([C@@H](C)[NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)[n-]1 ZINC000773136179 581399947 /nfs/dbraw/zinc/39/99/47/581399947.db2.gz GLLKLYBMYUFVLD-GFCCVEGCSA-N 0 3 344.419 2.595 20 5 EFBDHN O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2NCc2ccc([N+](=O)[O-])cc2)n1 ZINC000774232465 581487753 /nfs/dbraw/zinc/48/77/53/581487753.db2.gz YTKXSFHCKHWKLA-LSDHHAIUSA-N 0 3 345.359 2.973 20 5 EFBDHN CC(C)(C)N1C[C@@H](CNCc2cc([N+](=O)[O-])ccc2Cl)CC1=O ZINC000850395542 1250463127 /nfs/dbraw/zinc/46/31/27/1250463127.db2.gz ALICQWQYBXPLLU-LLVKDONJSA-N 0 3 339.823 2.985 20 5 EFBDHN Cc1nc(SCC(C)C)sc1CC(=O)OCC(C)[N+](=O)[O-] ZINC000851035767 1250765843 /nfs/dbraw/zinc/76/58/43/1250765843.db2.gz AKTCRRGUKRKRIE-VIFPVBQESA-N 0 3 332.447 2.951 20 5 EFBDHN CCCn1nccc1C(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000851108067 1250802023 /nfs/dbraw/zinc/80/20/23/1250802023.db2.gz IZDKCOZHJDXWII-ABAIWWIYSA-N 0 3 335.335 2.996 20 5 EFBDHN CC([C@@H](OC(=O)c1cnc2n1CCC2)c1ccccc1F)[N+](=O)[O-] ZINC000851108874 1250806549 /nfs/dbraw/zinc/80/65/49/1250806549.db2.gz QMGHSQBVBDWZMP-ZUZCIYMTSA-N 0 3 333.319 2.532 20 5 EFBDHN CN(Cc1ccc(Br)c([N+](=O)[O-])c1)C[C@H](O)C1CC1 ZINC000708550639 1259765767 /nfs/dbraw/zinc/76/57/67/1259765767.db2.gz KLZPXGKUTUDSIT-ZDUSSCGKSA-N 0 3 329.194 2.560 20 5 EFBDHN CN1CC[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC000923314177 1261446966 /nfs/dbraw/zinc/44/69/66/1261446966.db2.gz RNVMPDZEZOTNQW-WDEREUQCSA-N 0 3 341.770 2.696 20 5 EFBDHN CC1(C)CCN(CCNC(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000890082424 1261464528 /nfs/dbraw/zinc/46/45/28/1261464528.db2.gz WSYBMLCWXZKFRO-UHFFFAOYSA-N 0 3 337.445 2.535 20 5 EFBDHN COc1ccc(-c2ccc(CN[C@H]3COC[C@H]3C)o2)c([N+](=O)[O-])c1 ZINC000922642912 1266505174 /nfs/dbraw/zinc/50/51/74/1266505174.db2.gz IVTWYUUPLFIYNF-ABAIWWIYSA-N 0 3 332.356 2.988 20 5 EFBDHN CCN(C[C@@H]1CCOC1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000738082232 1268321026 /nfs/dbraw/zinc/32/10/26/1268321026.db2.gz PKSCGBCFVOLHHQ-AWEZNQCLSA-N 0 3 330.388 2.774 20 5 EFBDHN Cc1ncc2c(n1)CC[C@@H](NCc1cc(Cl)ccc1[N+](=O)[O-])C2 ZINC000740001062 1268787974 /nfs/dbraw/zinc/78/79/74/1268787974.db2.gz DMBJUERKPXVLTN-CQSZACIVSA-N 0 3 332.791 2.994 20 5 EFBDHN Cc1ncc2c(n1)CC[C@H](NCc1cc(Cl)ccc1[N+](=O)[O-])C2 ZINC000740001061 1268787986 /nfs/dbraw/zinc/78/79/86/1268787986.db2.gz DMBJUERKPXVLTN-AWEZNQCLSA-N 0 3 332.791 2.994 20 5 EFBDHN Cc1ccoc1C(=O)NC[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001086028955 1269586107 /nfs/dbraw/zinc/58/61/07/1269586107.db2.gz MSYHYTBAGZGYMO-OTVXOJSOSA-N 0 3 343.383 2.794 20 5 EFBDHN O=C(NC[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1)C1CC=CC1 ZINC001086048825 1269675555 /nfs/dbraw/zinc/67/55/55/1269675555.db2.gz UEVXAEZMBWBHQV-AKAXFMLLSA-N 0 3 329.400 2.545 20 5 EFBDHN Cc1ccc(C(=O)NC[C@H]2C[C@H](NCc3ccccc3[N+](=O)[O-])C2)o1 ZINC001086303303 1270907925 /nfs/dbraw/zinc/90/79/25/1270907925.db2.gz YOAXUVBEJHZRNU-CTYIDZIISA-N 0 3 343.383 2.794 20 5 EFBDHN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NC[C@@H]1N(C)CCCC1(C)C ZINC000843873759 1278608551 /nfs/dbraw/zinc/60/85/51/1278608551.db2.gz SCGJNTRUQFOWLD-AWEZNQCLSA-N 0 3 337.395 2.893 20 5 EFBDHN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N1CCN(C2CCC2)C[C@H](C)C1 ZINC000843892853 1278640391 /nfs/dbraw/zinc/64/03/91/1278640391.db2.gz HPVKAGBJQKPPKI-LBPRGKRZSA-N 0 3 349.406 2.989 20 5 EFBDHN CN(C)Cc1ccccc1NC(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC000745843775 1271641261 /nfs/dbraw/zinc/64/12/61/1271641261.db2.gz RKZRPHORCPXITQ-UHFFFAOYSA-N 0 3 347.346 2.813 20 5 EFBDHN C[C@@H](NC[C@@H](O)COc1cccc(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000746049933 1271744891 /nfs/dbraw/zinc/74/48/91/1271744891.db2.gz YHAKMGHNCUFSST-MLGOLLRUSA-N 0 3 334.347 2.824 20 5 EFBDHN CN1CCN(Cc2cccc([N+](=O)[O-])c2Br)CC1(C)C ZINC000234316916 1272095942 /nfs/dbraw/zinc/09/59/42/1272095942.db2.gz HXDAKUFLHRKBBZ-UHFFFAOYSA-N 0 3 342.237 2.883 20 5 EFBDHN O=C(N[C@H]1CC[C@H](NCc2csc([N+](=O)[O-])c2)CC1)c1cc[nH]c1 ZINC001034650133 1272437780 /nfs/dbraw/zinc/43/77/80/1272437780.db2.gz BJFOZDNSCAXEOW-HDJSIYSDSA-N 0 3 348.428 2.815 20 5 EFBDHN O=[N+]([O-])C[C@@H]1CC[C@@H](N2CCN(c3nsc4ccccc43)CC2)C1 ZINC001169010655 1272583446 /nfs/dbraw/zinc/58/34/46/1272583446.db2.gz FGMOSTOCFCORQV-ZIAGYGMSSA-N 0 3 346.456 2.864 20 5 EFBDHN O=[N+]([O-])C[C@H]1CC[C@H](N2CCN(Cc3ccccc3Cl)CC2)C1 ZINC001169028417 1272591472 /nfs/dbraw/zinc/59/14/72/1272591472.db2.gz RYEJZPHRRUPMCI-HOCLYGCPSA-N 0 3 337.851 2.903 20 5 EFBDHN CC[C@@H]1CN(C(=O)OC(C)(C)C)CCN1[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169033231 1272597414 /nfs/dbraw/zinc/59/74/14/1272597414.db2.gz BLVFFQGSEAYJDF-RRFJBIMHSA-N 0 3 341.452 2.763 20 5 EFBDHN CC[C@H]1CN(C(=O)OC(C)(C)C)CCN1[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169035494 1272598889 /nfs/dbraw/zinc/59/88/89/1272598889.db2.gz BLVFFQGSEAYJDF-SOUVJXGZSA-N 0 3 341.452 2.763 20 5 EFBDHN CC[C@H]1CN(C(=O)OC(C)(C)C)CCN1[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169035491 1272599022 /nfs/dbraw/zinc/59/90/22/1272599022.db2.gz BLVFFQGSEAYJDF-ILXRZTDVSA-N 0 3 341.452 2.763 20 5 EFBDHN CC(C)(C)OC(=O)N1CCN([C@H]2CC[C@H](C[N+](=O)[O-])C2)CC12CC2 ZINC001169036448 1272600376 /nfs/dbraw/zinc/60/03/76/1272600376.db2.gz OLWSKCASRLIRTP-KBPBESRZSA-N 0 3 339.436 2.517 20 5 EFBDHN O=[N+]([O-])C[C@H]1CC[C@H](N2CCN(c3nccc4ccccc43)CC2)C1 ZINC001169038002 1272605563 /nfs/dbraw/zinc/60/55/63/1272605563.db2.gz UZQNFJNFJIMXPR-RDJZCZTQSA-N 0 3 340.427 2.802 20 5 EFBDHN O=[N+]([O-])C[C@@H]1CC[C@H](N2CCN(c3nccc4ccccc43)CC2)C1 ZINC001169038003 1272606603 /nfs/dbraw/zinc/60/66/03/1272606603.db2.gz UZQNFJNFJIMXPR-WBVHZDCISA-N 0 3 340.427 2.802 20 5 EFBDHN CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H]1CN2[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169041601 1272612852 /nfs/dbraw/zinc/61/28/52/1272612852.db2.gz BLEHFJISZGPSGN-KBXIAJHMSA-N 0 3 339.436 2.516 20 5 EFBDHN C[C@@H]1CN(C(=O)OC(C)(C)C)[C@@H](C)CN1[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169017540 1272616690 /nfs/dbraw/zinc/61/66/90/1272616690.db2.gz AKSLWYWRZGGDBS-LXTVHRRPSA-N 0 3 341.452 2.762 20 5 EFBDHN O=[N+]([O-])C[C@H]1CC[C@@H](N2CCN(Cc3c(F)cccc3F)CC2)C1 ZINC001169050486 1272628307 /nfs/dbraw/zinc/62/83/07/1272628307.db2.gz ZVHDGZCATHDUCE-UONOGXRCSA-N 0 3 339.386 2.528 20 5 EFBDHN Cc1cc(-n2ccc([C@@H](C)N)n2)c([N+](=O)[O-])cc1Br ZINC001169235269 1272742056 /nfs/dbraw/zinc/74/20/56/1272742056.db2.gz UWNHKSMQVRCSGD-MRVPVSSYSA-N 0 3 325.166 2.871 20 5 EFBDHN CC1CCN(CC(=O)N(C)CCCNc2ccccc2[N+](=O)[O-])CC1 ZINC001109498819 1274354678 /nfs/dbraw/zinc/35/46/78/1274354678.db2.gz RDCCWTXKAWWTPW-UHFFFAOYSA-N 0 3 348.447 2.587 20 5 EFBDHN CCn1cc(CN(C[C@H](O)c2cccc([N+](=O)[O-])c2)C(C)C)cn1 ZINC000844417102 1278965616 /nfs/dbraw/zinc/96/56/16/1278965616.db2.gz JVCXUOLUMUITPU-KRWDZBQOSA-N 0 3 332.404 2.755 20 5 EFBDHN CC(=Cc1cccc([N+](=O)[O-])c1)CN1CCC2(CNC(=O)O2)CC1 ZINC000787418732 1275769432 /nfs/dbraw/zinc/76/94/32/1275769432.db2.gz QNBZYWJLLMLRSS-LCYFTJDESA-N 0 3 331.372 2.573 20 5 EFBDHN COc1ccc(C[C@@H](C)N(C)c2nc(CN)ccc2C)c([N+](=O)[O-])c1 ZINC001170294599 1278978723 /nfs/dbraw/zinc/97/87/23/1278978723.db2.gz BSGVJKFNFYGIDY-CYBMUJFWSA-N 0 3 344.415 2.833 20 5 EFBDHN CN1CCC[C@H]2CN(c3nc(Cl)c(Cl)cc3[N+](=O)[O-])C[C@@H]21 ZINC001157265270 1275859792 /nfs/dbraw/zinc/85/97/92/1275859792.db2.gz IKOVYZXZWQTZJE-KWQFWETISA-N 0 3 331.203 2.827 20 5 EFBDHN COc1ccc(CN[C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])nc1 ZINC001170312984 1279008555 /nfs/dbraw/zinc/00/85/55/1279008555.db2.gz HODFPMVFTORRLQ-LBPRGKRZSA-N 0 3 331.372 2.728 20 5 EFBDHN COc1ccc(C[C@H](C)NCc2cnc(Cl)cn2)c([N+](=O)[O-])c1 ZINC001170325809 1279017829 /nfs/dbraw/zinc/01/78/29/1279017829.db2.gz AEMITIPMWVHZEW-JTQLQIEISA-N 0 3 336.779 2.768 20 5 EFBDHN COc1ccc(C[C@@H](C)NCc2cnc(Cl)cn2)c([N+](=O)[O-])c1 ZINC001170325811 1279018000 /nfs/dbraw/zinc/01/80/00/1279018000.db2.gz AEMITIPMWVHZEW-SNVBAGLBSA-N 0 3 336.779 2.768 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CNCCO[C@H]2CCOC2)o1 ZINC000922939491 1276365519 /nfs/dbraw/zinc/36/55/19/1276365519.db2.gz PTCLSGMMIHYVDL-AWEZNQCLSA-N 0 3 332.356 2.750 20 5 EFBDHN CCN(CC)c1ccc(CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000818962690 1276551565 /nfs/dbraw/zinc/55/15/65/1276551565.db2.gz VKGCBJHMIHJFGF-QGZVFWFLSA-N 0 3 344.415 2.659 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CCOc3ccc(F)cc32)c1 ZINC000819048653 1276581559 /nfs/dbraw/zinc/58/15/59/1276581559.db2.gz OEPNFPFMYHBXNH-HOTGVXAUSA-N 0 3 332.331 2.881 20 5 EFBDHN CC(C)Oc1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)ccn1 ZINC000819186114 1276664673 /nfs/dbraw/zinc/66/46/73/1276664673.db2.gz PISDQUMOPOWPOO-INIZCTEOSA-N 0 3 331.372 2.600 20 5 EFBDHN CCCCn1cc(CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c(C)n1 ZINC000819204824 1276676911 /nfs/dbraw/zinc/67/69/11/1276676911.db2.gz FNGVBRVIGRCLDM-KRWDZBQOSA-N 0 3 332.404 2.723 20 5 EFBDHN COc1ccnc(CN[C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])c1 ZINC001170306725 1279029239 /nfs/dbraw/zinc/02/92/39/1279029239.db2.gz AWWVSFNJFGIFFF-GFCCVEGCSA-N 0 3 331.372 2.728 20 5 EFBDHN C[C@@H]1CN(C(=O)[C@@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)CCN(C2CC2)C1 ZINC000820874912 1277354581 /nfs/dbraw/zinc/35/45/81/1277354581.db2.gz VASLPZIQHSDXLY-MORSLUCNSA-N 0 3 343.427 2.641 20 5 EFBDHN Cc1cc(Cl)c(C(=O)N2[C@@H]3CC[C@H]2CCN(C)C3)cc1[N+](=O)[O-] ZINC000923265499 1277413583 /nfs/dbraw/zinc/41/35/83/1277413583.db2.gz KIASDACJBMLPFG-NWDGAFQWSA-N 0 3 337.807 2.865 20 5 EFBDHN CN1CCCC(C)(C)[C@H]1CNC(=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000791118251 1277953115 /nfs/dbraw/zinc/95/31/15/1277953115.db2.gz WSXUVZNDCDLTLF-CQSZACIVSA-N 0 3 341.358 2.723 20 5 EFBDHN Cc1ccc(NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)c(CN(C)C)c1 ZINC000791364920 1278071331 /nfs/dbraw/zinc/07/13/31/1278071331.db2.gz XTBPXZDLNMKXOP-UHFFFAOYSA-N 0 3 346.362 2.938 20 5 EFBDHN COc1ccc(C[C@@H](C)N2CCC3(CCOC3=O)CC2)c([N+](=O)[O-])c1 ZINC001170351433 1279057053 /nfs/dbraw/zinc/05/70/53/1279057053.db2.gz CFGWMSRXTFZSNA-CYBMUJFWSA-N 0 3 348.399 2.564 20 5 EFBDHN C[C@H](c1ccccc1)[C@H](CO)NCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792878747 1279233428 /nfs/dbraw/zinc/23/34/28/1279233428.db2.gz ZULMYCPBPHIGDO-WBMJQRKESA-N 0 3 345.355 2.757 20 5 EFBDHN Cc1nn(C)c(C)c1CC(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845872271 1279900376 /nfs/dbraw/zinc/90/03/76/1279900376.db2.gz FTEJGSRVFVYDIJ-YVEFUNNKSA-N 0 3 349.362 2.668 20 5 EFBDHN Cc1nn(C)c(C)c1CC(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845872269 1279900432 /nfs/dbraw/zinc/90/04/32/1279900432.db2.gz FTEJGSRVFVYDIJ-SJCJKPOMSA-N 0 3 349.362 2.668 20 5 EFBDHN CC([C@@H](OC(=O)/C=C/c1cnn(C)c1)c1ccccc1F)[N+](=O)[O-] ZINC000845872298 1279900572 /nfs/dbraw/zinc/90/05/72/1279900572.db2.gz GCWCHFIAMFJMSC-RVDACILISA-N 0 3 333.319 2.522 20 5 EFBDHN CC(=O)c1cc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])n(C)c1 ZINC000845872901 1279900716 /nfs/dbraw/zinc/90/07/16/1279900716.db2.gz QQSPMPQCWPLFDH-MGPLVRAMSA-N 0 3 348.330 2.930 20 5 EFBDHN CC([C@@H](OC(=O)CC1CCOCC1)c1ccccc1F)[N+](=O)[O-] ZINC000845875935 1279901693 /nfs/dbraw/zinc/90/16/93/1279901693.db2.gz MBXXMNALMOFSCQ-MEDUHNTESA-N 0 3 325.336 2.892 20 5 EFBDHN CC([C@H](OC(=O)c1ccnc(N(C)C)c1)c1ccccc1F)[N+](=O)[O-] ZINC000845874615 1279901742 /nfs/dbraw/zinc/90/17/42/1279901742.db2.gz ICJIVEPKCMYXDM-ZBEGNZNMSA-N 0 3 347.346 2.850 20 5 EFBDHN CC([C@H](OC(=O)c1cc(C2CC2)n(C)n1)c1ccccc1F)[N+](=O)[O-] ZINC000845875923 1279901759 /nfs/dbraw/zinc/90/17/59/1279901759.db2.gz LYQPTAGEZYFYIP-HWPZZCPQSA-N 0 3 347.346 3.000 20 5 EFBDHN Cc1cc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])cc(=O)[nH]1 ZINC000845873999 1279901852 /nfs/dbraw/zinc/90/18/52/1279901852.db2.gz FTPIVLZANCWOBP-BMIGLBTASA-N 0 3 334.303 2.798 20 5 EFBDHN Cc1ccc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])c(=O)[nH]1 ZINC000845873968 1279901925 /nfs/dbraw/zinc/90/19/25/1279901925.db2.gz GEDFPKLAYVZMJW-YGRLFVJLSA-N 0 3 334.303 2.798 20 5 EFBDHN COc1ccc(CC(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])nc1 ZINC000845877138 1279903118 /nfs/dbraw/zinc/90/31/18/1279903118.db2.gz FBCQOGATXIVKJJ-PIGZYNQJSA-N 0 3 348.330 2.722 20 5 EFBDHN CCn1cc(CC(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])cn1 ZINC000845876992 1279903509 /nfs/dbraw/zinc/90/35/09/1279903509.db2.gz CUBXCTDLPUDMCO-BDJLRTHQSA-N 0 3 335.335 2.534 20 5 EFBDHN CCOC1CC(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])C1 ZINC000845880014 1279904661 /nfs/dbraw/zinc/90/46/61/1279904661.db2.gz JXEWPDWTBFUAIU-QZLRTXKQSA-N 0 3 325.336 2.890 20 5 EFBDHN COc1cccnc1CC(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845881462 1279904946 /nfs/dbraw/zinc/90/49/46/1279904946.db2.gz KVZYAHWRJMWCKI-APPDUMDISA-N 0 3 348.330 2.722 20 5 EFBDHN COc1cccnc1CC(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845881463 1279905172 /nfs/dbraw/zinc/90/51/72/1279905172.db2.gz KVZYAHWRJMWCKI-DIFFPNOSSA-N 0 3 348.330 2.722 20 5 EFBDHN CC([C@H](OC(=O)c1cnc2n1CCCC2)c1ccccc1F)[N+](=O)[O-] ZINC000845883276 1279906366 /nfs/dbraw/zinc/90/63/66/1279906366.db2.gz RJDQLBYMLRGIMZ-ZBEGNZNMSA-N 0 3 347.346 2.922 20 5 EFBDHN CCN1C[C@H](CNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1=O ZINC000846097705 1280031557 /nfs/dbraw/zinc/03/15/57/1280031557.db2.gz UIQJWHWZEBGSEI-VIFPVBQESA-N 0 3 346.214 2.860 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H](C)CN1CCCC1=O ZINC000872024326 1287404264 /nfs/dbraw/zinc/40/42/64/1287404264.db2.gz QGGHDZGVHLUTNA-VXGBXAGGSA-N 0 3 337.445 2.978 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1NC1CCN(CC(F)(F)F)CC1)CNC2 ZINC001170446020 1280138806 /nfs/dbraw/zinc/13/88/06/1280138806.db2.gz PHZQHMPTZDRVNL-UHFFFAOYSA-N 0 3 344.337 2.637 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H](C)CN1CCOCC1 ZINC000872021368 1287402760 /nfs/dbraw/zinc/40/27/60/1287402760.db2.gz CGZVKUROHOGFJP-CHWSQXEVSA-N 0 3 339.461 2.688 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C)CN1CCCC1=O ZINC000872024325 1287403696 /nfs/dbraw/zinc/40/36/96/1287403696.db2.gz QGGHDZGVHLUTNA-RYUDHWBXSA-N 0 3 337.445 2.978 20 5 EFBDHN COCCN(C)CCN[C@@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872030617 1287405872 /nfs/dbraw/zinc/40/58/72/1287405872.db2.gz ITKULTRSXZQTMD-LBPRGKRZSA-N 0 3 327.450 2.546 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H](O)C1CCOCC1 ZINC000872046959 1287411006 /nfs/dbraw/zinc/41/10/06/1287411006.db2.gz AFGCFJMWCFOLPM-IAQYHMDHSA-N 0 3 340.445 2.755 20 5 EFBDHN CNC(=O)[C@@H]1CCC[C@H]1N[C@@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872054489 1287413477 /nfs/dbraw/zinc/41/34/77/1287413477.db2.gz XGPMFIKJTRAOBS-ZKYQVNSYSA-N 0 3 337.445 2.882 20 5 EFBDHN CNC(=O)[C@@H]1CCC[C@@H]1N[C@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872054487 1287413488 /nfs/dbraw/zinc/41/34/88/1287413488.db2.gz XGPMFIKJTRAOBS-QKCSRTOESA-N 0 3 337.445 2.882 20 5 EFBDHN CCCN(C)CC(=O)NC[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(C)c2)C1 ZINC001091358892 1280429172 /nfs/dbraw/zinc/42/91/72/1280429172.db2.gz OUGINSXCMXFRHZ-FZNQNYSPSA-N 0 3 348.447 2.552 20 5 EFBDHN COC(=O)[C@]12CN(Cc3ccc([N+](=O)[O-])c(F)c3)C[C@H]1CCCC2 ZINC000847016763 1280705315 /nfs/dbraw/zinc/70/53/15/1280705315.db2.gz FGNHUFSRQFEPSF-CXAGYDPISA-N 0 3 336.363 2.899 20 5 EFBDHN O=C(NCCNCc1cccc([N+](=O)[O-])c1)c1cc2sccc2[nH]1 ZINC001146600119 1280947837 /nfs/dbraw/zinc/94/78/37/1280947837.db2.gz PXIOGMWDJORKLU-UHFFFAOYSA-N 0 3 344.396 2.657 20 5 EFBDHN Cc1nc(C)c(C(=O)NCCCNCc2ccccc2[N+](=O)[O-])s1 ZINC001175583708 1287476417 /nfs/dbraw/zinc/47/64/17/1287476417.db2.gz ABVBNGAMGVIXKA-UHFFFAOYSA-N 0 3 348.428 2.578 20 5 EFBDHN CCc1ccc(F)cc1C(=O)NCCNCc1ccc([N+](=O)[O-])cc1 ZINC001130814415 1281201700 /nfs/dbraw/zinc/20/17/00/1281201700.db2.gz MFFSRFZYFZJMBH-UHFFFAOYSA-N 0 3 345.374 2.816 20 5 EFBDHN CCc1oc(C(=O)NCCNCc2cccc([N+](=O)[O-])c2)cc1C ZINC001147583352 1281212450 /nfs/dbraw/zinc/21/24/50/1281212450.db2.gz CLJVNZLHAONFOF-UHFFFAOYSA-N 0 3 331.372 2.578 20 5 EFBDHN CCc1cc(C(=O)NCCNCc2ccc([N+](=O)[O-])cc2)oc1CC ZINC001147987746 1281392650 /nfs/dbraw/zinc/39/26/50/1281392650.db2.gz UXTJIWXOZXTNGJ-UHFFFAOYSA-N 0 3 345.399 2.832 20 5 EFBDHN Cc1cc(F)c(C(=O)NCCNCc2ccc([N+](=O)[O-])cc2)c(F)c1 ZINC001131120246 1281485471 /nfs/dbraw/zinc/48/54/71/1281485471.db2.gz JGIXCRFKVMCFSK-UHFFFAOYSA-N 0 3 349.337 2.701 20 5 EFBDHN Cc1cccc(CCC(=O)NCCNCc2ccc([N+](=O)[O-])cc2)c1 ZINC001131969509 1282690863 /nfs/dbraw/zinc/69/08/63/1282690863.db2.gz LPLMOCLFIOGINE-UHFFFAOYSA-N 0 3 341.411 2.742 20 5 EFBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN[C@@H](CO)C1CCOCC1 ZINC000809974143 1282694763 /nfs/dbraw/zinc/69/47/63/1282694763.db2.gz NSJBIKTYNZLDBG-ZDUSSCGKSA-N 0 3 349.214 2.779 20 5 EFBDHN O=C(NC1CC1)OC[C@@H]1CCCCN1CCc1ccc([N+](=O)[O-])cc1 ZINC000810039062 1282802101 /nfs/dbraw/zinc/80/21/01/1282802101.db2.gz PIYKMADUWTZZOH-KRWDZBQOSA-N 0 3 347.415 2.880 20 5 EFBDHN C[C@@H](NC[C@H](O)c1c(F)cccc1F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815594637 1287622855 /nfs/dbraw/zinc/62/28/55/1287622855.db2.gz UYJSTYUMRWMZRK-PSLIRLAXSA-N 0 3 337.326 2.839 20 5 EFBDHN Cc1cc(F)cc(C)c1C(=O)NCCNCc1cccc([N+](=O)[O-])c1 ZINC001132236240 1283194535 /nfs/dbraw/zinc/19/45/35/1283194535.db2.gz BOAOBZAFWHMXMK-UHFFFAOYSA-N 0 3 345.374 2.870 20 5 EFBDHN Cc1cc(NCCNC(=O)C(C)(C)N2CCCCC2)ccc1[N+](=O)[O-] ZINC001093889098 1284599542 /nfs/dbraw/zinc/59/95/42/1284599542.db2.gz RYJTWYYXZHINPW-UHFFFAOYSA-N 0 3 348.447 2.696 20 5 EFBDHN Cc1ccc(NCCNC(=O)C(C)(C)N2CCCCC2)c([N+](=O)[O-])c1 ZINC001093889249 1284600754 /nfs/dbraw/zinc/60/07/54/1284600754.db2.gz VUAWFLXOVQPXJX-UHFFFAOYSA-N 0 3 348.447 2.696 20 5 EFBDHN O=C(NCCCNCc1csc([N+](=O)[O-])c1)C(C1CC1)C1CC1 ZINC001170652324 1284788899 /nfs/dbraw/zinc/78/88/99/1284788899.db2.gz JNVVLAXTVSMHFX-UHFFFAOYSA-N 0 3 337.445 2.688 20 5 EFBDHN CC(C)n1cccc1C(=O)NCCCNCc1ccccc1[N+](=O)[O-] ZINC001176207895 1287744693 /nfs/dbraw/zinc/74/46/93/1287744693.db2.gz JJSUEKITTKEHMM-UHFFFAOYSA-N 0 3 344.415 2.887 20 5 EFBDHN Cc1cc(C(=O)NCCNCc2ccc([N+](=O)[O-])cc2)ccc1F ZINC001133156944 1284889450 /nfs/dbraw/zinc/88/94/50/1284889450.db2.gz ATNWZWSADBRISO-UHFFFAOYSA-N 0 3 331.347 2.562 20 5 EFBDHN C[C@H]1CCN(Cc2ccccc2)C[C@@H]1Nc1ncc([N+](=O)[O-])cn1 ZINC000716203867 1285172175 /nfs/dbraw/zinc/17/21/75/1285172175.db2.gz LVFNPNAASVGEFK-BBRMVZONSA-N 0 3 327.388 2.707 20 5 EFBDHN COc1ccc([N+](=O)[O-])nc1-n1c(-c2ccccc2)cnc1[C@H](C)N ZINC001170680645 1285243408 /nfs/dbraw/zinc/24/34/08/1285243408.db2.gz DEZVOBYOFAZNNR-NSHDSACASA-N 0 3 339.355 2.871 20 5 EFBDHN Cc1ccc(-n2ccnc2SCC(=O)OCC(C)[N+](=O)[O-])cc1C ZINC000813100133 1285652442 /nfs/dbraw/zinc/65/24/42/1285652442.db2.gz NLKDGTDEDIHCON-CYBMUJFWSA-N 0 3 349.412 2.790 20 5 EFBDHN CC(COC(=O)c1ccccc1NC(=O)c1cccs1)[N+](=O)[O-] ZINC000813103220 1285653409 /nfs/dbraw/zinc/65/34/09/1285653409.db2.gz ZAKPKVSGQPTRAH-SNVBAGLBSA-N 0 3 334.353 2.822 20 5 EFBDHN CC(COC(=O)c1ccc(F)c(NC(=O)OC(C)(C)C)c1)[N+](=O)[O-] ZINC000813102893 1285654046 /nfs/dbraw/zinc/65/40/46/1285654046.db2.gz LBCDFVFWFMRPSC-VIFPVBQESA-N 0 3 342.323 2.995 20 5 EFBDHN CC(COC(=O)c1cccc(-c2noc(C(F)(F)F)n2)c1)[N+](=O)[O-] ZINC000813104655 1285654658 /nfs/dbraw/zinc/65/46/58/1285654658.db2.gz PNPIBOZCQISIDV-ZETCQYMHSA-N 0 3 345.233 2.577 20 5 EFBDHN Cc1ccc(-n2nc(C(=O)OCC(C)[N+](=O)[O-])c3c2CCC3)c(C)c1 ZINC000813102120 1285655108 /nfs/dbraw/zinc/65/51/08/1285655108.db2.gz NWPUZEBGQDHPOH-ZDUSSCGKSA-N 0 3 343.383 2.800 20 5 EFBDHN CC(COC(=O)c1ccccc1NC(=O)c1cccs1)[N+](=O)[O-] ZINC000813103218 1285655143 /nfs/dbraw/zinc/65/51/43/1285655143.db2.gz ZAKPKVSGQPTRAH-JTQLQIEISA-N 0 3 334.353 2.822 20 5 EFBDHN CC(COC(=O)c1ccc(F)c(NC(=O)OC(C)(C)C)c1)[N+](=O)[O-] ZINC000813102892 1285655211 /nfs/dbraw/zinc/65/52/11/1285655211.db2.gz LBCDFVFWFMRPSC-SECBINFHSA-N 0 3 342.323 2.995 20 5 EFBDHN CC(COC(=O)CCc1nnc(-c2ccc(Cl)cc2)o1)[N+](=O)[O-] ZINC000813102344 1285655266 /nfs/dbraw/zinc/65/52/66/1285655266.db2.gz DUONHUQHMTTYPL-VIFPVBQESA-N 0 3 339.735 2.531 20 5 EFBDHN Cc1cc(C(=O)OCC(C)[N+](=O)[O-])nc(-c2ccc(Cl)cc2)n1 ZINC000813108022 1285678446 /nfs/dbraw/zinc/67/84/46/1285678446.db2.gz TZFGATGVMLRZHJ-JTQLQIEISA-N 0 3 335.747 2.927 20 5 EFBDHN CC(COC(=O)c1ccccc1N(C)C(=O)c1cccs1)[N+](=O)[O-] ZINC000813107301 1285680234 /nfs/dbraw/zinc/68/02/34/1285680234.db2.gz OVEOXKXPCWHBMB-LLVKDONJSA-N 0 3 348.380 2.847 20 5 EFBDHN CSc1ncc(C(=O)OCC(C)[N+](=O)[O-])n1-c1ccc(F)cc1 ZINC000813108170 1285680661 /nfs/dbraw/zinc/68/06/61/1285680661.db2.gz BOFGMIRMEOULBS-SECBINFHSA-N 0 3 339.348 2.555 20 5 EFBDHN CCc1c(C)nn(-c2cccc(C(=O)OCC(C)[N+](=O)[O-])c2)c1C ZINC000813112004 1285682396 /nfs/dbraw/zinc/68/23/96/1285682396.db2.gz YIFQMEGVEZNHMR-NSHDSACASA-N 0 3 331.372 2.874 20 5 EFBDHN CC(COC(=O)c1cccc(NC(=O)c2cccs2)c1)[N+](=O)[O-] ZINC000813109194 1285682687 /nfs/dbraw/zinc/68/26/87/1285682687.db2.gz PIZMKLIHRFHPMC-SNVBAGLBSA-N 0 3 334.353 2.822 20 5 EFBDHN CC(COC(=O)c1ccccc1NC(=O)c1ccsc1)[N+](=O)[O-] ZINC000813109414 1285682734 /nfs/dbraw/zinc/68/27/34/1285682734.db2.gz RZEAATGTUPKRBV-SNVBAGLBSA-N 0 3 334.353 2.822 20 5 EFBDHN CC(COC(=O)c1cncc(-c2ccc3c(c2)CCO3)c1)[N+](=O)[O-] ZINC000813110405 1285682808 /nfs/dbraw/zinc/68/28/08/1285682808.db2.gz ZUUDSRFUCZNLFO-NSHDSACASA-N 0 3 328.324 2.506 20 5 EFBDHN CC(COC(=O)c1cccc(C(=O)N(C)c2ccccc2)c1)[N+](=O)[O-] ZINC000813111073 1285683242 /nfs/dbraw/zinc/68/32/42/1285683242.db2.gz BYVXWVMPYFYHKP-CYBMUJFWSA-N 0 3 342.351 2.785 20 5 EFBDHN CC(COC(=O)c1ccc(CNC(=O)c2cccs2)cc1)[N+](=O)[O-] ZINC000813113240 1285683364 /nfs/dbraw/zinc/68/33/64/1285683364.db2.gz ORNQBODXWZVXJX-NSHDSACASA-N 0 3 348.380 2.500 20 5 EFBDHN COc1ccc2nc(C3CC3)cc(C(=O)OCC(C)[N+](=O)[O-])c2c1 ZINC000813114198 1285685047 /nfs/dbraw/zinc/68/50/47/1285685047.db2.gz NFPPNPXBFVXYIL-SNVBAGLBSA-N 0 3 330.340 2.943 20 5 EFBDHN COc1ccccc1Nc1ncccc1C(=O)OCC(C)[N+](=O)[O-] ZINC000813114372 1285685759 /nfs/dbraw/zinc/68/57/59/1285685759.db2.gz QUAADJAHDDGIMH-NSHDSACASA-N 0 3 331.328 2.656 20 5 EFBDHN COc1ccsc1C(=O)NCCCNCc1ccccc1[N+](=O)[O-] ZINC001171770008 1285777036 /nfs/dbraw/zinc/77/70/36/1285777036.db2.gz JOLIXKOABKDASJ-UHFFFAOYSA-N 0 3 349.412 2.575 20 5 EFBDHN CCN1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2SC)[C@@H](C)C1 ZINC000822569165 1289035253 /nfs/dbraw/zinc/03/52/53/1289035253.db2.gz PRVQQJXBPZXVKL-LBPRGKRZSA-N 0 3 337.445 2.873 20 5 EFBDHN Cc1ccc(C(=O)NCCCNCc2ccccc2[N+](=O)[O-])cc1 ZINC001171878886 1285909111 /nfs/dbraw/zinc/90/91/11/1285909111.db2.gz BAGXSUNDIXXUMD-UHFFFAOYSA-N 0 3 327.384 2.813 20 5 EFBDHN Cc1nnsc1CNC1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000813883205 1286170138 /nfs/dbraw/zinc/17/01/38/1286170138.db2.gz AAMZAGJDMGIMSN-UHFFFAOYSA-N 0 3 333.417 2.513 20 5 EFBDHN NC(=O)[C@H](N[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccccc1 ZINC001172908829 1286311319 /nfs/dbraw/zinc/31/13/19/1286311319.db2.gz ZPIPPRYIFRMTCR-FUHWJXTLSA-N 0 3 339.395 2.658 20 5 EFBDHN Cc1nc2c(n1[C@H]1CCc3ccc([N+](=O)[O-])cc3CC1)CNCC2 ZINC001172921003 1286328734 /nfs/dbraw/zinc/32/87/34/1286328734.db2.gz NTNYUOLRCHPGSY-HNNXBMFYSA-N 0 3 326.400 2.866 20 5 EFBDHN C[C@@H](CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)N1CCCCC1 ZINC000822663176 1289068859 /nfs/dbraw/zinc/06/88/59/1289068859.db2.gz MSLBOOJXRFGAMT-AWEZNQCLSA-N 0 3 347.415 2.548 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)NCc2cccnc2F)c1F ZINC001173175606 1286451612 /nfs/dbraw/zinc/45/16/12/1286451612.db2.gz DQZRIVYFHTVQHY-SNVBAGLBSA-N 0 3 337.326 2.997 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)NCc2ccncc2F)c1F ZINC001173175130 1286451714 /nfs/dbraw/zinc/45/17/14/1286451714.db2.gz AHAXUKJCNQVTIU-SNVBAGLBSA-N 0 3 337.326 2.997 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)NCc2cc(C)nn2C)c1F ZINC001173180059 1286454963 /nfs/dbraw/zinc/45/49/63/1286454963.db2.gz SNJNHQKKNUWYST-JTQLQIEISA-N 0 3 336.367 2.505 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)NCc2cccc(F)n2)c1F ZINC001173183641 1286456100 /nfs/dbraw/zinc/45/61/00/1286456100.db2.gz COSZUZCEUHTERX-SNVBAGLBSA-N 0 3 337.326 2.997 20 5 EFBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N(C)CCNC(=O)OC(C)(C)C ZINC001173224467 1286478411 /nfs/dbraw/zinc/47/84/11/1286478411.db2.gz GFQFWCMYIBNYMB-ZDUSSCGKSA-N 0 3 337.420 2.982 20 5 EFBDHN COc1ccccc1[C@@H](CO)N[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173227501 1286482454 /nfs/dbraw/zinc/48/24/54/1286482454.db2.gz GJZPKAYXMQZLBA-SUMWQHHRSA-N 0 3 330.384 2.858 20 5 EFBDHN C[C@@H](N[C@@H](C)Cc1ccc([N+](=O)[O-])cc1)c1nnc2ccccn21 ZINC001173210319 1286485421 /nfs/dbraw/zinc/48/54/21/1286485421.db2.gz ITGYMFZNVBEODT-QWHCGFSZSA-N 0 3 325.372 2.919 20 5 EFBDHN Cc1ccc(F)c(C(=O)NCCNCc2cccc([N+](=O)[O-])c2)c1 ZINC001134357208 1286588873 /nfs/dbraw/zinc/58/88/73/1286588873.db2.gz UUISJSYFJFIBFN-UHFFFAOYSA-N 0 3 331.347 2.562 20 5 EFBDHN CCCN(C)CC(=O)N1CCC(Nc2ccc(C)cc2[N+](=O)[O-])CC1 ZINC001095233737 1286721857 /nfs/dbraw/zinc/72/18/57/1286721857.db2.gz OJYKZYFPUMQLND-UHFFFAOYSA-N 0 3 348.447 2.648 20 5 EFBDHN C[C@@H]1CCCN(CCNC(=O)c2cccc([N+](=O)[O-])c2Cl)C1 ZINC000816874159 1288308238 /nfs/dbraw/zinc/30/82/38/1288308238.db2.gz WQMGKBLBTMLGIF-LLVKDONJSA-N 0 3 325.796 2.710 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NC[C@H]1CCCCN1C1CC1 ZINC000822458209 1288996613 /nfs/dbraw/zinc/99/66/13/1288996613.db2.gz GIWLFQLCHNHIAQ-OAHLLOKOSA-N 0 3 331.416 2.958 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1N[C@H]1CCc3ccc(O)cc3C1)CNC2 ZINC001171034165 1289463890 /nfs/dbraw/zinc/46/38/90/1289463890.db2.gz YPXLPYBONGTOHE-HNNXBMFYSA-N 0 3 325.368 2.873 20 5 EFBDHN CC(C)(C)CCN1CCN(C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)CC1 ZINC000824003179 1289498088 /nfs/dbraw/zinc/49/80/88/1289498088.db2.gz RMXZEBCGINLHRJ-UHFFFAOYSA-N 0 3 349.435 2.763 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1CNCCNC(=O)c1ccc(F)cc1 ZINC000873023077 1289525399 /nfs/dbraw/zinc/52/53/99/1289525399.db2.gz ZWJRWTAFHKZCLU-UHFFFAOYSA-N 0 3 345.374 2.870 20 5 EFBDHN Cc1c(NC(=O)NC[C@H]2Cc3ccccc3CN2)cccc1[N+](=O)[O-] ZINC000873299064 1289712729 /nfs/dbraw/zinc/71/27/29/1289712729.db2.gz IMCPKAQWRVZYHC-OAHLLOKOSA-N 0 3 340.383 2.739 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1C(=O)Nc1ccc2c(c1)CNCCO2 ZINC000876853849 1291048836 /nfs/dbraw/zinc/04/88/36/1291048836.db2.gz ARBSAIVONHXAEV-UHFFFAOYSA-N 0 3 341.367 2.946 20 5 EFBDHN Cc1ccc(NC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)c(CN(C)C)c1 ZINC000825921471 1291070005 /nfs/dbraw/zinc/07/00/05/1291070005.db2.gz VTOOPJXQWOSITP-QGZVFWFLSA-N 0 3 343.383 2.637 20 5 EFBDHN O=[N+]([O-])c1sc(CN[C@@H](CCO)C2CC2)cc1Br ZINC000877058737 1291121038 /nfs/dbraw/zinc/12/10/38/1291121038.db2.gz FWDLLCZJUCGEAC-JTQLQIEISA-N 0 3 335.223 2.669 20 5 EFBDHN Nc1ccnc(NC[C@H](c2ccccc2)N2CCCC2)c1[N+](=O)[O-] ZINC001166888521 1312861070 /nfs/dbraw/zinc/86/10/70/1312861070.db2.gz JRCHTQFUUXIAAE-OAHLLOKOSA-N 0 3 327.388 2.821 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN1CCCC[C@@H]1[C@@H](O)c1ccccc1 ZINC000878223709 1291565592 /nfs/dbraw/zinc/56/55/92/1291565592.db2.gz RCZXKARWMOETCG-AEFFLSMTSA-N 0 3 344.415 2.688 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN1CCCC[C@H]1[C@H](O)c1ccccc1 ZINC000878223711 1291565850 /nfs/dbraw/zinc/56/58/50/1291565850.db2.gz RCZXKARWMOETCG-FUHWJXTLSA-N 0 3 344.415 2.688 20 5 EFBDHN CCN(CC)CC(=O)N[C@H]1C[C@H](CNc2ccc([N+](=O)[O-])c(C)c2)C1 ZINC001114773575 1291902149 /nfs/dbraw/zinc/90/21/49/1291902149.db2.gz UHNJWIGNYFEVRO-KOMQPUFPSA-N 0 3 348.447 2.552 20 5 EFBDHN CS(=O)(=O)CCCCCNCc1cc(Cl)ccc1[N+](=O)[O-] ZINC000775374991 1292115938 /nfs/dbraw/zinc/11/59/38/1292115938.db2.gz PQMKZKDJSRXEJN-UHFFFAOYSA-N 0 3 334.825 2.553 20 5 EFBDHN COc1ccc([C@H]2CN(Cc3ccccc3[N+](=O)[O-])CCN2)cc1 ZINC000879517004 1292165771 /nfs/dbraw/zinc/16/57/71/1292165771.db2.gz BUUFIWAZNQJESJ-QGZVFWFLSA-N 0 3 327.384 2.750 20 5 EFBDHN COc1ccc([C@@H]2CN(Cc3c(F)cccc3[N+](=O)[O-])CCN2)cc1 ZINC000879522438 1292170733 /nfs/dbraw/zinc/17/07/33/1292170733.db2.gz XNECJTNOQXKCKP-KRWDZBQOSA-N 0 3 345.374 2.889 20 5 EFBDHN Cc1ccc(Cn2cc(CNC3CCCCC3)nn2)cc1[N+](=O)[O-] ZINC000881213240 1292788861 /nfs/dbraw/zinc/78/88/61/1292788861.db2.gz YQBYCTZQBDBHRI-UHFFFAOYSA-N 0 3 329.404 2.965 20 5 EFBDHN Cc1c(CNCc2ccc(N3CCNC3=O)cc2)cccc1[N+](=O)[O-] ZINC000883280741 1293530818 /nfs/dbraw/zinc/53/08/18/1293530818.db2.gz MLXGRTILZFOQHT-UHFFFAOYSA-N 0 3 340.383 2.723 20 5 EFBDHN C[N@H+](CCCNC(=O)c1ccccc1[O-])Cc1ccc([N+](=O)[O-])cc1 ZINC001234099328 1313056698 /nfs/dbraw/zinc/05/66/98/1313056698.db2.gz DVOCNAAYRRVSDL-UHFFFAOYSA-N 0 3 343.383 2.552 20 5 EFBDHN C[N@@H+](CCCNC(=O)c1ccccc1[O-])Cc1ccc([N+](=O)[O-])cc1 ZINC001234099328 1313056700 /nfs/dbraw/zinc/05/67/00/1313056700.db2.gz DVOCNAAYRRVSDL-UHFFFAOYSA-N 0 3 343.383 2.552 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H](CO)C[C@@H]2CCCO2)o1 ZINC000886229336 1294775666 /nfs/dbraw/zinc/77/56/66/1294775666.db2.gz OFIWIKVRDPXOLK-KBPBESRZSA-N 0 3 346.383 2.874 20 5 EFBDHN Cc1ncsc1C(=O)NCCCN(C)Cc1ccc([N+](=O)[O-])cc1 ZINC001234362237 1313114154 /nfs/dbraw/zinc/11/41/54/1313114154.db2.gz ZROFFZVQNGKKLS-UHFFFAOYSA-N 0 3 348.428 2.612 20 5 EFBDHN CCN1CCN(Cc2ccc(Br)c([N+](=O)[O-])c2)C[C@H]1C ZINC000252707056 1295317888 /nfs/dbraw/zinc/31/78/88/1295317888.db2.gz VYPJTISECDJQDW-LLVKDONJSA-N 0 3 342.237 2.883 20 5 EFBDHN C[C@@H]1[C@H](C)N(Cc2ccc(Br)c([N+](=O)[O-])c2)CCN1C ZINC000775984567 1295571203 /nfs/dbraw/zinc/57/12/03/1295571203.db2.gz GXPULRSHJXABQH-MNOVXSKESA-N 0 3 342.237 2.882 20 5 EFBDHN Cc1cccc(OCCN(C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000776279819 1297355895 /nfs/dbraw/zinc/35/58/95/1297355895.db2.gz YCAQRSZWQURNNQ-GOSISDBHSA-N 0 3 330.384 2.947 20 5 EFBDHN CC(C)N1CCC[C@@H]1C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000935006612 1297598870 /nfs/dbraw/zinc/59/88/70/1297598870.db2.gz ORNQRUIYHKAVLV-QGZVFWFLSA-N 0 3 331.416 2.959 20 5 EFBDHN COCCN(Cc1cccs1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776574195 1299604025 /nfs/dbraw/zinc/60/40/25/1299604025.db2.gz FARRIABUKFARHO-INIZCTEOSA-N 0 3 336.413 2.838 20 5 EFBDHN Cc1n[nH]c(C)c1[C@H]1CCCN1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776601919 1299731169 /nfs/dbraw/zinc/73/11/69/1299731169.db2.gz NNCXOUJNBYZCSK-CVEARBPZSA-N 0 3 330.388 2.805 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CN2CCC([C@@H]3CCCCO3)CC2)c1 ZINC000852593344 1299775378 /nfs/dbraw/zinc/77/53/78/1299775378.db2.gz FHWVELXVYOOMAX-ROUUACIJSA-N 0 3 334.416 2.909 20 5 EFBDHN CC(C)CO[C@@H](C)C(=N)NOCc1c(F)cc([N+](=O)[O-])cc1F ZINC000853672665 1300223943 /nfs/dbraw/zinc/22/39/43/1300223943.db2.gz JFIUBBUHPRDUBC-VIFPVBQESA-N 0 3 331.319 2.933 20 5 EFBDHN Nc1ccc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000854496331 1300593222 /nfs/dbraw/zinc/59/32/22/1300593222.db2.gz JTYYQEIMEYQDGD-UWVGGRQHSA-N 0 3 347.293 2.863 20 5 EFBDHN Cc1cc([N+](=O)[O-])c(F)c(C(=O)N[C@H]2CCN(C(C)(C)C)C2)c1F ZINC000855286564 1300888193 /nfs/dbraw/zinc/88/81/93/1300888193.db2.gz TVOLBBKUBGQLFJ-JTQLQIEISA-N 0 3 341.358 2.784 20 5 EFBDHN CC1(C(=O)NC2CC3(CC(NCc4csc([N+](=O)[O-])c4)C3)C2)CC1 ZINC000963844597 1301369354 /nfs/dbraw/zinc/36/93/54/1301369354.db2.gz CCEJUXLIYLVRLD-UHFFFAOYSA-N 0 3 349.456 2.973 20 5 EFBDHN C[C@H](CN(C)CCc1ccc([N+](=O)[O-])cc1)NC(=O)OC(C)(C)C ZINC000860096121 1301698373 /nfs/dbraw/zinc/69/83/73/1301698373.db2.gz UPCOYSNTMFRWQT-CYBMUJFWSA-N 0 3 337.420 2.982 20 5 EFBDHN CCO[C@H](C(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-])C1CC1 ZINC000860854848 1301942475 /nfs/dbraw/zinc/94/24/75/1301942475.db2.gz KPEZVZFDEKODEO-VQISRLSMSA-N 0 3 325.336 2.890 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCN(C[C@H]3CCOC3)CC2)c(C(F)F)c1 ZINC000865592651 1303325291 /nfs/dbraw/zinc/32/52/91/1303325291.db2.gz WXZZSKHFHDTJIG-GFCCVEGCSA-N 0 3 341.358 2.691 20 5 EFBDHN CCC(C)(C)N1CCN(c2cc(F)c([N+](=O)[O-])cc2CO)CC1 ZINC000865917017 1303453499 /nfs/dbraw/zinc/45/34/99/1303453499.db2.gz XKJVKBUMEKUNBV-UHFFFAOYSA-N 0 3 325.384 2.537 20 5 EFBDHN CC(COC(=O)[C@@H]1[C@@H]2Cc3ccc(Br)cc3[C@@H]21)[N+](=O)[O-] ZINC000870378005 1305291538 /nfs/dbraw/zinc/29/15/38/1305291538.db2.gz TZVSOLZLDQXSLF-WXVIEYFRSA-N 0 3 340.173 2.543 20 5 EFBDHN Cc1nccc([C@@H]2CCCN(C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)n1 ZINC000749687420 1311037455 /nfs/dbraw/zinc/03/74/55/1311037455.db2.gz JQSOTFGHYSYLIY-CRAIPNDOSA-N 0 3 342.399 2.606 20 5 EFBDHN CC(C)CC(=O)NCC1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001222269264 1311108030 /nfs/dbraw/zinc/10/80/30/1311108030.db2.gz FQTZOVMIXKXYGQ-UHFFFAOYSA-N 0 3 333.432 2.969 20 5 EFBDHN Cc1cc(CN(C)C)cc(NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)c1 ZINC000801932545 1311119026 /nfs/dbraw/zinc/11/90/26/1311119026.db2.gz OYZZXKWWVPBCQA-UHFFFAOYSA-N 0 3 346.362 2.938 20 5 EFBDHN COC(=O)[C@@H]1CNCCN1Cc1c2ccccc2cc2ccccc21 ZINC001222413870 1311127724 /nfs/dbraw/zinc/12/77/24/1311127724.db2.gz FEOXCBGUOUIRNY-FQEVSTJZSA-N 0 3 334.419 2.940 20 5 EFBDHN CC1(C(=O)NCC2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC001223265159 1311234238 /nfs/dbraw/zinc/23/42/38/1311234238.db2.gz BFEPWMKAOHOTLX-UHFFFAOYSA-N 0 3 331.416 2.723 20 5 EFBDHN O=[N+]([O-])c1cc([O-])cc(Nc2cccnc2OCC2CC[NH2+]CC2)c1 ZINC001159295191 1311488524 /nfs/dbraw/zinc/48/85/24/1311488524.db2.gz LOPBOKKDDQNJAJ-UHFFFAOYSA-N 0 3 344.371 2.817 20 5 EFBDHN C[C@@H](Nc1cc2ccc(Cl)nc2cc1[N+](=O)[O-])[C@@H]1CNCCO1 ZINC001159500657 1311527812 /nfs/dbraw/zinc/52/78/12/1311527812.db2.gz FHNQLYVJVZFBJW-OTYXRUKQSA-N 0 3 336.779 2.585 20 5 EFBDHN C[C@H](Nc1cc(Cl)nc2ccc([N+](=O)[O-])cc21)[C@H]1CNCCO1 ZINC001159503758 1311528570 /nfs/dbraw/zinc/52/85/70/1311528570.db2.gz ZDTWDJNOZGBQNG-LKFCYVNXSA-N 0 3 336.779 2.585 20 5 EFBDHN O=C(NCCCNCc1csc([N+](=O)[O-])c1)c1[nH]ccc1C1CC1 ZINC001159614709 1311552660 /nfs/dbraw/zinc/55/26/60/1311552660.db2.gz IVMARCRTEMLYII-UHFFFAOYSA-N 0 3 348.428 2.772 20 5 EFBDHN CC(C)(CC(F)F)C(=O)NCCCNCc1csc([N+](=O)[O-])c1 ZINC001159691439 1311566750 /nfs/dbraw/zinc/56/67/50/1311566750.db2.gz VRVIXBBYNOBVMA-UHFFFAOYSA-N 0 3 349.403 2.934 20 5 EFBDHN O=[N+]([O-])c1cc(Br)cnc1OC1CCN(C2CC2)CC1 ZINC001225747456 1311571849 /nfs/dbraw/zinc/57/18/49/1311571849.db2.gz MIAOXZOOXLKURN-UHFFFAOYSA-N 0 3 342.193 2.758 20 5 EFBDHN COC(=O)Cc1ccc(O[C@H]2CCCN(C(C)C)C2)c([N+](=O)[O-])c1 ZINC001226216275 1311631578 /nfs/dbraw/zinc/63/15/78/1311631578.db2.gz HGOQCKHNQOSPKT-AWEZNQCLSA-N 0 3 336.388 2.562 20 5 EFBDHN COc1cc(Br)c(OC2CCN(C)CC2)c([N+](=O)[O-])c1 ZINC001226283891 1311641990 /nfs/dbraw/zinc/64/19/90/1311641990.db2.gz ZHQDZJNTDGWVGF-UHFFFAOYSA-N 0 3 345.193 2.839 20 5 EFBDHN COc1cc(O[C@H]2CCN(Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC001226577344 1311691356 /nfs/dbraw/zinc/69/13/56/1311691356.db2.gz YXPUGUNRUDJKJW-AWEZNQCLSA-N 0 3 329.356 2.652 20 5 EFBDHN COc1cc(O[C@H]2CN(Cc3ccccc3)C[C@@H]2C)ncc1[N+](=O)[O-] ZINC001226578509 1311691643 /nfs/dbraw/zinc/69/16/43/1311691643.db2.gz HONPIQSNRHCZIO-GUYCJALGSA-N 0 3 343.383 2.898 20 5 EFBDHN NCc1cc(-c2ccncc2)nn1-c1ccc2ccc([N+](=O)[O-])cc2n1 ZINC001160338323 1311693539 /nfs/dbraw/zinc/69/35/39/1311693539.db2.gz WVZQLBNBRVKYCU-UHFFFAOYSA-N 0 3 346.350 2.849 20 5 EFBDHN NCc1ccc(Nc2ccc(-c3ccc(F)c([N+](=O)[O-])c3)nn2)cn1 ZINC001160406216 1311703968 /nfs/dbraw/zinc/70/39/68/1311703968.db2.gz SWZSWJZYRGMRFS-UHFFFAOYSA-N 0 3 340.318 2.788 20 5 EFBDHN CC(C)C[C@@H]1CN(C)CCN1Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000902541611 1311853412 /nfs/dbraw/zinc/85/34/12/1311853412.db2.gz IGZJDVAHNJNKKB-MRXNPFEDSA-N 0 3 331.420 2.564 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)CC[C@H]1Oc1ncncc1[N+](=O)[O-] ZINC001228655075 1311976484 /nfs/dbraw/zinc/97/64/84/1311976484.db2.gz PGZVDJRBNJQXTP-CZUORRHYSA-N 0 3 328.372 2.674 20 5 EFBDHN O=[N+]([O-])c1ccc(O[C@H]2CN3CCC2CC3)cc1Br ZINC001229086280 1312045707 /nfs/dbraw/zinc/04/57/07/1312045707.db2.gz OMTRKACVYUVVAN-ZDUSSCGKSA-N 0 3 327.178 2.830 20 5 EFBDHN CC(=O)Nc1cc(O[C@@H]2CCCN(C)CC2)c(C(C)=O)cc1[N+](=O)[O-] ZINC001229131778 1312051806 /nfs/dbraw/zinc/05/18/06/1312051806.db2.gz YWJAUDLYQLBSDZ-CYBMUJFWSA-N 0 3 349.387 2.619 20 5 EFBDHN O=C(C1=CCCC1)N1C[C@H]2CN(Cc3ccc([N+](=O)[O-])cc3)C[C@H]2C1 ZINC001048762750 1312114413 /nfs/dbraw/zinc/11/44/13/1312114413.db2.gz LORQDKPWWFCPLJ-CALCHBBNSA-N 0 3 341.411 2.595 20 5 EFBDHN CC(=O)N(CCNCc1cccc([N+](=O)[O-])c1)CCc1ccccc1 ZINC001162639241 1312141224 /nfs/dbraw/zinc/14/12/24/1312141224.db2.gz RPQMWIDPJXFGDF-UHFFFAOYSA-N 0 3 341.411 2.776 20 5 EFBDHN COC(=O)c1cc(OC2CCN(C3CC3)CC2)c(F)cc1[N+](=O)[O-] ZINC001229943967 1312162771 /nfs/dbraw/zinc/16/27/71/1312162771.db2.gz WEDSAZNYFIQXMK-UHFFFAOYSA-N 0 3 338.335 2.526 20 5 EFBDHN Cc1cnc(C(=O)NCCCNCc2ccccc2[N+](=O)[O-])c(C)c1 ZINC001162970090 1312214680 /nfs/dbraw/zinc/21/46/80/1312214680.db2.gz IZWHZXMNHFWTGO-UHFFFAOYSA-N 0 3 342.399 2.516 20 5 EFBDHN CCN(CC)CCNC(=N)Nc1nc(Cl)c(Cl)cc1[N+](=O)[O-] ZINC001163123144 1312245803 /nfs/dbraw/zinc/24/58/03/1312245803.db2.gz ZBMSZIHKGPZKDM-UHFFFAOYSA-N 0 3 349.222 2.575 20 5 EFBDHN CC(F)(F)C(=O)NCCC1(CNCc2csc([N+](=O)[O-])c2)CC1 ZINC001163143091 1312250201 /nfs/dbraw/zinc/25/02/01/1312250201.db2.gz NNIZGSFLHZTZPS-UHFFFAOYSA-N 0 3 347.387 2.688 20 5 EFBDHN CC(=O)Cc1c(F)c(O[C@@H]2C[C@H]3CC[C@@H](C2)N3C)ccc1[N+](=O)[O-] ZINC001230794811 1312345927 /nfs/dbraw/zinc/34/59/27/1312345927.db2.gz VVYBLLVATQZGQJ-CLLJXQQHSA-N 0 3 336.363 2.869 20 5 EFBDHN O=C(/C=C\C1CC1)NCCC1(CNCc2ccccc2[N+](=O)[O-])CC1 ZINC001163941097 1312411912 /nfs/dbraw/zinc/41/19/12/1312411912.db2.gz XSJDFTIRABOTHL-FPLPWBNLSA-N 0 3 343.427 2.937 20 5 EFBDHN Cc1cc(CN)nn1-c1cc(C)c(Br)cc1[N+](=O)[O-] ZINC001163985875 1312420684 /nfs/dbraw/zinc/42/06/84/1312420684.db2.gz HXNDETLIDFKTBW-UHFFFAOYSA-N 0 3 325.166 2.619 20 5 EFBDHN CN1CCC(Oc2c([N+](=O)[O-])cc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC001231234098 1312459871 /nfs/dbraw/zinc/45/98/71/1312459871.db2.gz LDVPZOBFZJMFAK-UHFFFAOYSA-N 0 3 349.265 2.995 20 5 EFBDHN O=[N+]([O-])c1ccc2nc(Cl)cc(-n3cnc4c3CNCC4)c2c1 ZINC001164316971 1312491429 /nfs/dbraw/zinc/49/14/29/1312491429.db2.gz SSDFNKOWCSXKGW-UHFFFAOYSA-N 0 3 329.747 2.628 20 5 EFBDHN O=[N+]([O-])c1cc(F)cnc1N1C[C@H]2CCN(Cc3ccccc3)[C@@H]2C1 ZINC001165089964 1312565846 /nfs/dbraw/zinc/56/58/46/1312565846.db2.gz WLFPZEPVKUJSKY-RHSMWYFYSA-N 0 3 342.374 2.840 20 5 EFBDHN CCc1cc(N2CC(C)(N(C)C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001165121704 1312572293 /nfs/dbraw/zinc/57/22/93/1312572293.db2.gz XMRDAZXJTOKLIA-UHFFFAOYSA-N 0 3 341.415 2.755 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)[C@@H](C)CN1c1ccc([N+](=O)[O-])c(N)n1 ZINC001165202998 1312585296 /nfs/dbraw/zinc/58/52/96/1312585296.db2.gz QYAYBLILXQGLHM-UONOGXRCSA-N 0 3 341.415 2.671 20 5 EFBDHN O=C(NCCCNCc1csc([N+](=O)[O-])c1)c1cc[nH]c1C1CC1 ZINC001165221325 1312589883 /nfs/dbraw/zinc/58/98/83/1312589883.db2.gz LOJRVWBJMDEFPC-UHFFFAOYSA-N 0 3 348.428 2.772 20 5 EFBDHN O=C(NCCCNCc1ccccc1[N+](=O)[O-])c1cc[nH]c1C1CC1 ZINC001165221250 1312589974 /nfs/dbraw/zinc/58/99/74/1312589974.db2.gz GJOBGRRIJSYDAV-UHFFFAOYSA-N 0 3 342.399 2.710 20 5 EFBDHN CC1(C)CC(C(=O)N[C@H]2C[C@H](NCc3ccccc3[N+](=O)[O-])C2)C1 ZINC001020123019 1314621125 /nfs/dbraw/zinc/62/11/25/1314621125.db2.gz APOHJWSRWUXCQQ-SHTZXODSSA-N 0 3 331.416 2.768 20 5 EFBDHN Cc1coc(C)c1C(=O)N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001020124356 1314621858 /nfs/dbraw/zinc/62/18/58/1314621858.db2.gz JYFCAKDAXQKYRS-SHTZXODSSA-N 0 3 343.383 2.855 20 5 EFBDHN N[C@]1(C(F)(F)F)CCN([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001246572987 1314650350 /nfs/dbraw/zinc/65/03/50/1314650350.db2.gz VNWIKKJXXPAHSA-DZGCQCFKSA-N 0 3 343.349 2.808 20 5 EFBDHN CC(C)(C)N1CCN(Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC001318267701 1328542411 /nfs/dbraw/zinc/54/24/11/1328542411.db2.gz NDSGWYPYPKOXOI-UHFFFAOYSA-N 0 3 343.431 2.832 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1-c1nc(-c2ccc3c(n2)CCNC3)no1 ZINC001215374701 1314826478 /nfs/dbraw/zinc/82/64/78/1314826478.db2.gz XODCLVAZXGZPQK-UHFFFAOYSA-N 0 3 337.339 2.661 20 5 EFBDHN CNCc1cccc(-n2c3ccccc3nc3cc(N)c(=O)cc2-3)c1F ZINC001216226041 1314929690 /nfs/dbraw/zinc/92/96/90/1314929690.db2.gz JRZQFCQQVFVQCH-UHFFFAOYSA-N 0 3 348.381 2.931 20 5 EFBDHN Cc1ccc(-c2nc(-c3ccc4c(n3)CCNC4)no2)c([N+](=O)[O-])c1 ZINC001216831650 1315013049 /nfs/dbraw/zinc/01/30/49/1315013049.db2.gz WCKRNACOQOFNRF-UHFFFAOYSA-N 0 3 337.339 2.661 20 5 EFBDHN Cc1cc(Br)c(O[C@H]2CCNC[C@H]2F)cc1[N+](=O)[O-] ZINC001218068682 1315142178 /nfs/dbraw/zinc/14/21/78/1315142178.db2.gz FPDBRMQBWWLSHH-KOLCDFICSA-N 0 3 333.157 2.745 20 5 EFBDHN COC(=O)c1ccc(O[C@@H]2CNCc3ccccc32)cc1[N+](=O)[O-] ZINC001218491600 1315204838 /nfs/dbraw/zinc/20/48/38/1315204838.db2.gz VLMHMRHTJHGFOH-MRXNPFEDSA-N 0 3 328.324 2.605 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCC(N3CCCCC34COC4)CC2)cc1 ZINC001254478612 1315708037 /nfs/dbraw/zinc/70/80/37/1315708037.db2.gz HZCBCICNUIQBGN-UHFFFAOYSA-N 0 3 331.416 2.819 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCC(N3CCOCC34CCC4)CC2)cc1 ZINC001254479473 1315708458 /nfs/dbraw/zinc/70/84/58/1315708458.db2.gz APKPLXVOHBRHLG-UHFFFAOYSA-N 0 3 331.416 2.819 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])NC1CN(C(=O)OC(C)(C)C)C1 ZINC001254532250 1315720030 /nfs/dbraw/zinc/72/00/30/1315720030.db2.gz LZXTWRGBZVWRIN-GFCCVEGCSA-N 0 3 335.404 2.735 20 5 EFBDHN Cc1cnc(O[C@H]2CCN([C@H](C)Cc3ccccc3[N+](=O)[O-])C2)nc1 ZINC001254569831 1315725147 /nfs/dbraw/zinc/72/51/47/1315725147.db2.gz LFQCPOIIWRHRMD-ZBFHGGJFSA-N 0 3 342.399 2.778 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N1CCC[C@@H](Oc2cnccn2)C1 ZINC001254569092 1315725468 /nfs/dbraw/zinc/72/54/68/1315725468.db2.gz HTGKSGBHCDTQCK-GDBMZVCRSA-N 0 3 342.399 2.859 20 5 EFBDHN COC(=O)c1ccccc1CN[C@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254573024 1315726031 /nfs/dbraw/zinc/72/60/31/1315726031.db2.gz VNRCAXDZBZRJGG-HNNXBMFYSA-N 0 3 326.352 2.638 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@H](NCc1ccnc(OC3CCC3)n1)C2 ZINC001254585233 1315727711 /nfs/dbraw/zinc/72/77/11/1315727711.db2.gz BZUWZPHMNXYVNR-OAHLLOKOSA-N 0 3 340.383 2.573 20 5 EFBDHN COc1cccc2c1OC[C@@H]2N[C@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254587905 1315727855 /nfs/dbraw/zinc/72/78/55/1315727855.db2.gz CEORYQAWWZEDFF-BBRMVZONSA-N 0 3 326.352 2.794 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@H](NCc1cn(CC(F)(F)F)cn1)C2 ZINC001254586490 1315727860 /nfs/dbraw/zinc/72/78/60/1315727860.db2.gz KJLOQIPFKWWXCF-GFCCVEGCSA-N 0 3 340.305 2.611 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@@H](NCc1cc(OC3CCC3)ncn1)C2 ZINC001254588318 1315727983 /nfs/dbraw/zinc/72/79/83/1315727983.db2.gz XWZHSHMQGWGTGN-AWEZNQCLSA-N 0 3 340.383 2.573 20 5 EFBDHN CN(CCNC(=O)OC(C)(C)C)[C@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254597350 1315729163 /nfs/dbraw/zinc/72/91/63/1315729163.db2.gz HRTWXSHPGAUTEN-HNNXBMFYSA-N 0 3 335.404 2.519 20 5 EFBDHN CN(CCN(C)[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1)C(=O)OC(C)(C)C ZINC001254596425 1315729226 /nfs/dbraw/zinc/72/92/26/1315729226.db2.gz DNXJAKYJXBXIIJ-MRXNPFEDSA-N 0 3 349.431 2.861 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@H](N1CC[C@H](N3CCCCC3)[C@@H](F)C1)C2 ZINC001254610563 1315731046 /nfs/dbraw/zinc/73/10/46/1315731046.db2.gz NMNBDFFDQPXVLR-QYZOEREBSA-N 0 3 347.434 2.960 20 5 EFBDHN Cc1cccnc1O[C@H]1CCN([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254612060 1315731827 /nfs/dbraw/zinc/73/18/27/1315731827.db2.gz USWGDGNGRAFCKW-ROUUACIJSA-N 0 3 339.395 2.919 20 5 EFBDHN CC([C@H](OC(=O)COC(F)(F)F)c1ccccc1F)[N+](=O)[O-] ZINC001263534897 1316548561 /nfs/dbraw/zinc/54/85/61/1316548561.db2.gz LUPGDCJULQKGDW-CPCISQLKSA-N 0 3 325.214 2.612 20 5 EFBDHN CS[C@@H]1CC[C@H](N(C)Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C1 ZINC001319404373 1328873923 /nfs/dbraw/zinc/87/39/23/1328873923.db2.gz NGSRCEXEUGVIKP-WCQYABFASA-N 0 3 335.433 2.821 20 5 EFBDHN C[C@H](NCCN1C(=O)COc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC001320025901 1329058467 /nfs/dbraw/zinc/05/84/67/1329058467.db2.gz JGMZLRWJKJVGAP-ZDUSSCGKSA-N 0 3 341.367 2.671 20 5 EFBDHN CCCN1CCCC[C@H]1C(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC001322418698 1329457296 /nfs/dbraw/zinc/45/72/96/1329457296.db2.gz YCMBKWRBOPXOFL-KRWDZBQOSA-N 0 3 333.432 2.860 20 5 EFBDHN COC(=O)[C@@H]1CCC[C@H]1NCc1cc([N+](=O)[O-])ccc1OC(C)C ZINC001320947218 1329323103 /nfs/dbraw/zinc/32/31/03/1329323103.db2.gz TWYZUHZWMWYDJJ-HUUCEWRRSA-N 0 3 336.388 2.813 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1CCN(C(C)(C)C)CC1 ZINC001322678931 1329479033 /nfs/dbraw/zinc/47/90/33/1329479033.db2.gz WHUILIYYQGTNOK-UHFFFAOYSA-N 0 3 335.404 2.610 20 5 EFBDHN CC(C)(CCC(=O)N(CCN1CCCC1)c1ccccc1)[N+](=O)[O-] ZINC001324702383 1329652625 /nfs/dbraw/zinc/65/26/25/1329652625.db2.gz KBSXXJFPLSUFSW-UHFFFAOYSA-N 0 3 333.432 2.951 20 5 EFBDHN CN1CCN(Cn2c3cc([N+](=O)[O-])ccc3oc2=S)CC1(C)C ZINC001333313364 1331114182 /nfs/dbraw/zinc/11/41/82/1331114182.db2.gz NBOAHUVHIBXHAV-UHFFFAOYSA-N 0 3 336.417 2.855 20 5 EFBDHN C[C@@H](NCc1c(Br)cccc1[N+](=O)[O-])[C@@H]1CCOC1 ZINC001335780562 1331402022 /nfs/dbraw/zinc/40/20/22/1331402022.db2.gz KUBKNKPMEGHEBC-NXEZZACHSA-N 0 3 329.194 2.872 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]C[C@H]2[C@@H]3c4ccccc4C[C@H]23)c1[N+](=O)[O-] ZINC001336747939 1331499395 /nfs/dbraw/zinc/49/93/95/1331499395.db2.gz PGIWPSHGSISIEG-BFYDXBDKSA-N 0 3 340.379 2.985 20 5 EFBDHN Cc1cccnc1[C@@H](C)NCCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC001338436768 1331707737 /nfs/dbraw/zinc/70/77/37/1331707737.db2.gz QYUHASYIBHCWFS-CYBMUJFWSA-N 0 3 328.372 2.978 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cnc2c(c1)CNCC2 ZINC001340129184 1332143411 /nfs/dbraw/zinc/14/34/11/1332143411.db2.gz SNMCDPDTQYHEFH-UHFFFAOYSA-N 0 3 344.396 2.610 20 5 EFBDHN CO[C@@H]1CCC[C@@H]1C(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC001345207367 1332521739 /nfs/dbraw/zinc/52/17/39/1332521739.db2.gz KLRYWEIGVAVEPW-FATJJJSSSA-N 0 3 325.336 2.890 20 5 EFBDHN CC([C@H](OC(=O)c1c2c(nn1C)CCC2)c1ccccc1F)[N+](=O)[O-] ZINC001345207384 1332522158 /nfs/dbraw/zinc/52/21/58/1332522158.db2.gz KTIFKXUFTXDGQA-QFYYESIMSA-N 0 3 347.346 2.611 20 5 EFBDHN CN1CCCC[C@@H]1CNC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001346435633 1332640184 /nfs/dbraw/zinc/64/01/84/1332640184.db2.gz MNJSSQOSRDKJGU-QGZVFWFLSA-N 0 3 346.431 2.753 20 5 EFBDHN COc1ncccc1C(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC001348939658 1332886749 /nfs/dbraw/zinc/88/67/49/1332886749.db2.gz LISLPWCBZZBHEA-YGRLFVJLSA-N 0 3 334.303 2.793 20 5 EFBDHN CC(C)[C@H](CCO)NCc1cc([N+](=O)[O-])ccc1Br ZINC001351289368 1333206647 /nfs/dbraw/zinc/20/66/47/1333206647.db2.gz SOHQJGXIUXCOMJ-ZDUSSCGKSA-N 0 3 331.210 2.854 20 5 EFBDHN O=C(N[C@@H]1CCCN2CCCC[C@H]12)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000847254010 1333447271 /nfs/dbraw/zinc/44/72/71/1333447271.db2.gz CHTWNNCEYVIEMF-ZIAGYGMSSA-N 0 3 339.342 2.620 20 5 EFBDHN Cc1cc(F)cc(C(=O)N[C@H]2CCCN3CCCC[C@H]23)c1[N+](=O)[O-] ZINC000847254953 1333448965 /nfs/dbraw/zinc/44/89/65/1333448965.db2.gz HZTWLDQYMGIMHV-LSDHHAIUSA-N 0 3 335.379 2.789 20 5 EFBDHN Cc1cc(F)cc(C(=O)N[C@@H]2CCCN3CCCC[C@@H]23)c1[N+](=O)[O-] ZINC000847254947 1333449257 /nfs/dbraw/zinc/44/92/57/1333449257.db2.gz HZTWLDQYMGIMHV-CABCVRRESA-N 0 3 335.379 2.789 20 5 EFBDHN O=C(CCNCc1ccc([N+](=O)[O-])cc1)Nc1ccccc1[N+](=O)[O-] ZINC001353229653 1334033072 /nfs/dbraw/zinc/03/30/72/1334033072.db2.gz BMUSSDOWPIFHII-UHFFFAOYSA-N 0 3 344.327 2.621 20 5 EFBDHN CN(C)C[C@@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC001353274481 1334059418 /nfs/dbraw/zinc/05/94/18/1334059418.db2.gz UCHQKZALFUBIOR-QZTJIDSGSA-N 0 3 347.390 2.660 20 5 EFBDHN CCC(C)(C)N1CCN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)CC1 ZINC000848300743 1334598771 /nfs/dbraw/zinc/59/87/71/1334598771.db2.gz BEVYMVTYQLEVLL-YFHOEESVSA-N 0 3 331.416 2.941 20 5 EFBDHN CC(C)[C@@H]1CN(C)CCN1Cn1cc(-c2ccccc2[N+](=O)[O-])cn1 ZINC000848479531 1334737477 /nfs/dbraw/zinc/73/74/77/1334737477.db2.gz DMHYXQGOGLXPNA-SFHVURJKSA-N 0 3 343.431 2.688 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1cnn(CN2CC[C@@H]([C@H]3CCOC3)C2)c1 ZINC000848482912 1334739977 /nfs/dbraw/zinc/73/99/77/1334739977.db2.gz VAJAYYHOOMYPSX-CABCVRRESA-N 0 3 342.399 2.774 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2NC[C@@H](O)COc1cccc(F)c1 ZINC000848524267 1334772883 /nfs/dbraw/zinc/77/28/83/1334772883.db2.gz RMYCMBCSIFSVKL-CXAGYDPISA-N 0 3 346.358 2.751 20 5 EFBDHN CCC(C)(C)N1CCN(c2ccc(CC(=O)OC)cc2[N+](=O)[O-])CC1 ZINC000848760510 1334878972 /nfs/dbraw/zinc/87/89/72/1334878972.db2.gz FVQARDYUAZCCTR-UHFFFAOYSA-N 0 3 349.431 2.621 20 5 EFBDHN O=[N+]([O-])c1ccc(S(=O)(=O)CCN[C@H]2CC23CCCCC3)cc1 ZINC001356609501 1335062508 /nfs/dbraw/zinc/06/25/08/1335062508.db2.gz PIEMNQIOXBJWQL-HNNXBMFYSA-N 0 3 338.429 2.681 20 5 EFBDHN Cc1nn(CN(C)CCC2CCOCC2)c2cc([N+](=O)[O-])ccc12 ZINC000121255060 712932871 /nfs/dbraw/zinc/93/28/71/712932871.db2.gz UFOBLSFGHDHHKR-UHFFFAOYSA-N 0 3 332.404 2.959 20 5 EFBDHN O=C(N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1)C1CC2(CC2)C1 ZINC001020569954 713217937 /nfs/dbraw/zinc/21/79/37/713217937.db2.gz QQHOIIXHUZCRLL-SHTZXODSSA-N 0 3 329.400 2.522 20 5 EFBDHN COc1c(O)ccc(CN[C@H]2C[C@H](OC(C)C)C2(C)C)c1[N+](=O)[O-] ZINC000893624016 717903390 /nfs/dbraw/zinc/90/33/90/717903390.db2.gz LLRYATAVXGYASC-KBPBESRZSA-N 0 3 338.404 2.991 20 5 EFBDHN COc1c([O-])ccc(C[NH2+][C@H]2C[C@H](OC(C)C)C2(C)C)c1[N+](=O)[O-] ZINC000893624016 717903396 /nfs/dbraw/zinc/90/33/96/717903396.db2.gz LLRYATAVXGYASC-KBPBESRZSA-N 0 3 338.404 2.991 20 5 EFBDHN CC(COC(=O)Cc1c[nH]c2cccc(Br)c12)[N+](=O)[O-] ZINC000813106487 713530246 /nfs/dbraw/zinc/53/02/46/713530246.db2.gz DFDGZQZMOGWFEL-MRVPVSSYSA-N 0 3 341.161 2.681 20 5 EFBDHN O=C(CC1CCCC1)N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001021791139 714479779 /nfs/dbraw/zinc/47/97/79/714479779.db2.gz YWEGEHUIAGVTTC-IYBDPMFKSA-N 0 3 331.416 2.912 20 5 EFBDHN CCN1CCN(Cc2ccc(Br)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000157813983 714524368 /nfs/dbraw/zinc/52/43/68/714524368.db2.gz VYPJTISECDJQDW-NSHDSACASA-N 0 3 342.237 2.883 20 5 EFBDHN Cc1coc(C)c1C(=O)N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001022039768 714682901 /nfs/dbraw/zinc/68/29/01/714682901.db2.gz JYFCAKDAXQKYRS-GASCZTMLSA-N 0 3 343.383 2.855 20 5 EFBDHN COc1ccc([C@@H](CNc2c([N+](=O)[O-])cnn2C)N2CCCC2)cc1 ZINC000891475553 714775669 /nfs/dbraw/zinc/77/56/69/714775669.db2.gz HXNNDYBOAMEWKK-OAHLLOKOSA-N 0 3 345.403 2.586 20 5 EFBDHN COc1cccc([C@H](CNc2ncc([N+](=O)[O-])cc2OC)N(C)C)c1 ZINC000891502410 714789119 /nfs/dbraw/zinc/78/91/19/714789119.db2.gz WLCPESFVNAAKOP-HNNXBMFYSA-N 0 3 346.387 2.722 20 5 EFBDHN O=C(N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1)C1(F)CCCC1 ZINC001022334929 715020150 /nfs/dbraw/zinc/02/01/50/715020150.db2.gz ZOLREYMUNWFKFG-OKILXGFUSA-N 0 3 335.379 2.614 20 5 EFBDHN C[C@@H](Cc1cccnc1)NCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000934236371 715274298 /nfs/dbraw/zinc/27/42/98/715274298.db2.gz NZWVITRNUUAIJB-NSHDSACASA-N 0 3 348.790 2.803 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CN(C2CC2)C[C@H]1C ZINC000934574378 715685442 /nfs/dbraw/zinc/68/54/42/715685442.db2.gz GIHRQOHATVUPAF-YGRLFVJLSA-N 0 3 335.429 2.529 20 5 EFBDHN COc1cccc(CC[NH2+]Cc2ccc([O-])c(OC)c2[N+](=O)[O-])c1 ZINC000892599364 718325797 /nfs/dbraw/zinc/32/57/97/718325797.db2.gz KMGCENVQJQJKLD-UHFFFAOYSA-N 0 3 332.356 2.650 20 5 EFBDHN COc1c(O)ccc(CN[C@H](C)COc2ccccc2)c1[N+](=O)[O-] ZINC000892693273 718738246 /nfs/dbraw/zinc/73/82/46/718738246.db2.gz GLSJVGCATUPUSK-GFCCVEGCSA-N 0 3 332.356 2.866 20 5 EFBDHN CCO[C@@H]1C[C@H](NCc2ccc(O)c(OC)c2[N+](=O)[O-])C12CCC2 ZINC000892958526 719345892 /nfs/dbraw/zinc/34/58/92/719345892.db2.gz BRHZLEZICDBCHH-UONOGXRCSA-N 0 3 336.388 2.746 20 5 EFBDHN CCO[C@@H]1C[C@H]([NH2+]Cc2ccc([O-])c(OC)c2[N+](=O)[O-])C12CCC2 ZINC000892958526 719345893 /nfs/dbraw/zinc/34/58/93/719345893.db2.gz BRHZLEZICDBCHH-UONOGXRCSA-N 0 3 336.388 2.746 20 5 EFBDHN COc1c([O-])ccc(C[NH2+][C@@H]2[C@H]3CCCO[C@H]3C2(C)C)c1[N+](=O)[O-] ZINC000893092693 719624985 /nfs/dbraw/zinc/62/49/85/719624985.db2.gz MVRJQMHWTIENOH-HFBAOOFYSA-N 0 3 336.388 2.602 20 5 EFBDHN CC(C)Oc1ccc([C@H](CNc2c([N+](=O)[O-])cnn2C)N(C)C)cc1 ZINC000893865046 720130525 /nfs/dbraw/zinc/13/05/25/720130525.db2.gz FKUMUVILKHCNJB-HNNXBMFYSA-N 0 3 347.419 2.830 20 5 EFBDHN COc1c([O-])ccc(C[NH2+][C@@H]2CCO[C@@H](C(C)(C)C)C2)c1[N+](=O)[O-] ZINC000893256283 720282354 /nfs/dbraw/zinc/28/23/54/720282354.db2.gz OWBHEBKKUFMRMP-TZMCWYRMSA-N 0 3 338.404 2.992 20 5 EFBDHN COc1c([O-])ccc(C[N@@H+]2CCC[C@@H]2C2CCOCC2)c1[N+](=O)[O-] ZINC000893317148 720588139 /nfs/dbraw/zinc/58/81/39/720588139.db2.gz KDVQUCDMXZPOOW-CQSZACIVSA-N 0 3 336.388 2.700 20 5 EFBDHN COc1c([O-])ccc(C[N@H+]2CCC[C@@H]2C2CCOCC2)c1[N+](=O)[O-] ZINC000893317148 720588142 /nfs/dbraw/zinc/58/81/42/720588142.db2.gz KDVQUCDMXZPOOW-CQSZACIVSA-N 0 3 336.388 2.700 20 5 EFBDHN COc1c([O-])ccc(C[NH2+][C@H]2CCO[C@@H](CC(C)C)C2)c1[N+](=O)[O-] ZINC000893320725 720607454 /nfs/dbraw/zinc/60/74/54/720607454.db2.gz UIHDWJGMGCTDKV-KBPBESRZSA-N 0 3 338.404 2.992 20 5 EFBDHN O=[N+]([O-])c1ccc2oc(=S)n(CN3CCN(CC4CC4)CC3)c2c1 ZINC000124211179 721415652 /nfs/dbraw/zinc/41/56/52/721415652.db2.gz BZFTYSCBOVNMDS-UHFFFAOYSA-N 0 3 348.428 2.857 20 5 EFBDHN O=C(N[C@H]1C[C@H](CNCc2csc([N+](=O)[O-])c2)C1)c1ccco1 ZINC000983028355 721769958 /nfs/dbraw/zinc/76/99/58/721769958.db2.gz GVYBFGNGXGUETP-UMSPYCQHSA-N 0 3 335.385 2.548 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]CCC2C[C@H](C)O[C@@H](C)C2)c1[N+](=O)[O-] ZINC000894275202 721882985 /nfs/dbraw/zinc/88/29/85/721882985.db2.gz QIDHKHDOCAUHTQ-RYUDHWBXSA-N 0 3 338.404 2.992 20 5 EFBDHN Cn1c2ccccc2c(N[C@@H]2CCN(C(C)(C)C)C2)c([N+](=O)[O-])c1=O ZINC000894488750 722753341 /nfs/dbraw/zinc/75/33/41/722753341.db2.gz HXCQPWIDKUNOTP-GFCCVEGCSA-N 0 3 344.415 2.731 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CNC[C@@H]3COCO3)o2)c(Cl)c1 ZINC000894872453 722930081 /nfs/dbraw/zinc/93/00/81/722930081.db2.gz JFICVOPHRJIIRI-GFCCVEGCSA-N 0 3 338.747 2.971 20 5 EFBDHN CSc1ccc(C(=O)NC[C@@H](C)N2CCCCC2)cc1[N+](=O)[O-] ZINC000917836948 728793584 /nfs/dbraw/zinc/79/35/84/728793584.db2.gz DEQOMEPPQFCPPJ-GFCCVEGCSA-N 0 3 337.445 2.921 20 5 EFBDHN O=[N+]([O-])c1cnc(N[C@@H]2[C@H]3CN(Cc4ccccc4)C[C@H]32)c(F)c1 ZINC000895187314 723845898 /nfs/dbraw/zinc/84/58/98/723845898.db2.gz QTUXWDDRXOKANN-FOLVSLTJSA-N 0 3 328.347 2.671 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C1CCN(C(=O)C2CC=CC2)CC1 ZINC000985351873 724158560 /nfs/dbraw/zinc/15/85/60/724158560.db2.gz JYSKKSANJNUWPC-UHFFFAOYSA-N 0 3 343.427 2.984 20 5 EFBDHN C[C@H](CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CCCCC1 ZINC000918703324 728912012 /nfs/dbraw/zinc/91/20/12/728912012.db2.gz BDMPISLYKZBKGF-GFCCVEGCSA-N 0 3 330.388 2.680 20 5 EFBDHN CCN1CCCN(C(=O)c2c(Cl)cccc2[N+](=O)[O-])[C@H](C)C1 ZINC000910284216 727427234 /nfs/dbraw/zinc/42/72/34/727427234.db2.gz OKPKEXFWTYLJPW-LLVKDONJSA-N 0 3 325.796 2.805 20 5 EFBDHN COc1ccc(CNC[C@H](O)c2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000917416757 727805289 /nfs/dbraw/zinc/80/52/89/727805289.db2.gz MPLQKBIFLAJXEA-HNNXBMFYSA-N 0 3 338.310 2.705 20 5 EFBDHN O=C(Cc1ccoc1)N1CCC(NCc2csc([N+](=O)[O-])c2)CC1 ZINC000991605205 728144805 /nfs/dbraw/zinc/14/48/05/728144805.db2.gz SZOMQJFHPRHRAQ-UHFFFAOYSA-N 0 3 349.412 2.573 20 5 EFBDHN C[C@@H](CNC(=O)OC(C)(C)C)N(C)CCc1ccc([N+](=O)[O-])cc1 ZINC000171956417 728560130 /nfs/dbraw/zinc/56/01/30/728560130.db2.gz XHPIZJIQQWIKIW-ZDUSSCGKSA-N 0 3 337.420 2.982 20 5 EFBDHN COc1ccccc1C[C@@](C)(CO)NCc1ccc(F)cc1[N+](=O)[O-] ZINC000931601438 1126135610 /nfs/dbraw/zinc/13/56/10/1126135610.db2.gz OPKJGGFNWRUNMR-SFHVURJKSA-N 0 3 348.374 2.826 20 5 EFBDHN CC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)[C@@H](CC)CN1 ZINC001573721130 1087883398 /nfs/dbraw/zinc/88/33/98/1087883398.db2.gz XJFHUIWGDRZLFM-QWRGUYRKSA-N 0 3 325.796 2.851 20 5 EFBDHN Cc1cc(NC(=O)NC[C@@H]2NCCc3ccccc32)cc([N+](=O)[O-])c1 ZINC001579631266 1090646959 /nfs/dbraw/zinc/64/69/59/1090646959.db2.gz LEMTXEZZBKXYBY-KRWDZBQOSA-N 0 3 340.383 2.912 20 5 EFBDHN O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1cccc2c1CNC2 ZINC001580564701 1090951363 /nfs/dbraw/zinc/95/13/63/1090951363.db2.gz GWRWPKMVLTYVNR-UHFFFAOYSA-N 0 3 329.381 2.929 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN[C@H]1CNCCC1(F)F ZINC001580874864 1091031215 /nfs/dbraw/zinc/03/12/15/1091031215.db2.gz MMCVVVWEABDUHR-NSHDSACASA-N 0 3 339.264 2.700 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1NCc1cc(Br)no1)CNC2 ZINC001167498851 1092387250 /nfs/dbraw/zinc/38/72/50/1092387250.db2.gz RNBPKWWWPCGLSA-UHFFFAOYSA-N 0 3 339.149 2.561 20 5 EFBDHN CCCC[N@H+](C)C[C@H](C)Nc1cc(C)c([N+](=O)[O-])cc1-c1nnn[n-]1 ZINC001590600219 1093509322 /nfs/dbraw/zinc/50/93/22/1093509322.db2.gz BQUYYPJRAXJDDV-LBPRGKRZSA-N 0 3 347.423 2.616 20 5 EFBDHN CCCC[N@@H+](C)C[C@H](C)Nc1cc(C)c([N+](=O)[O-])cc1-c1nnn[n-]1 ZINC001590600219 1093509331 /nfs/dbraw/zinc/50/93/31/1093509331.db2.gz BQUYYPJRAXJDDV-LBPRGKRZSA-N 0 3 347.423 2.616 20 5 EFBDHN CCCC[N@H+](C)C[C@H](C)Nc1cc(C)c([N+](=O)[O-])cc1-c1nn[n-]n1 ZINC001590600219 1093509339 /nfs/dbraw/zinc/50/93/39/1093509339.db2.gz BQUYYPJRAXJDDV-LBPRGKRZSA-N 0 3 347.423 2.616 20 5 EFBDHN CCCC[N@@H+](C)C[C@H](C)Nc1cc(C)c([N+](=O)[O-])cc1-c1nn[n-]n1 ZINC001590600219 1093509347 /nfs/dbraw/zinc/50/93/47/1093509347.db2.gz BQUYYPJRAXJDDV-LBPRGKRZSA-N 0 3 347.423 2.616 20 5 EFBDHN Cc1cc(NCC[NH+](C(C)C)C(C)C)c(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001592048424 1093966721 /nfs/dbraw/zinc/96/67/21/1093966721.db2.gz BBZHAZNWORXQBI-UHFFFAOYSA-N 0 3 347.423 2.614 20 5 EFBDHN Cc1cc(NCC[NH+](C(C)C)C(C)C)c(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001592048424 1093966724 /nfs/dbraw/zinc/96/67/24/1093966724.db2.gz BBZHAZNWORXQBI-UHFFFAOYSA-N 0 3 347.423 2.614 20 5 EFBDHN Cc1cc(Br)cc([N+](=O)[O-])c1O[C@H]1CCNC[C@@H]1F ZINC001218071413 1095532656 /nfs/dbraw/zinc/53/26/56/1095532656.db2.gz PJYDUJACJAAWPU-ONGXEEELSA-N 0 3 333.157 2.745 20 5 EFBDHN CC1(C)CCCC[C@H]1[NH2+]Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001603777496 1096623697 /nfs/dbraw/zinc/62/36/97/1096623697.db2.gz CFXCQQYUDICORV-CQSZACIVSA-N 0 3 330.392 2.833 20 5 EFBDHN CC1(C)CCCC[C@H]1[NH2+]Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001603777496 1096623700 /nfs/dbraw/zinc/62/37/00/1096623700.db2.gz CFXCQQYUDICORV-CQSZACIVSA-N 0 3 330.392 2.833 20 5 EFBDHN C[C@@H]1CCCC[C@H]1[N@H+](C)Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001603891559 1096661475 /nfs/dbraw/zinc/66/14/75/1096661475.db2.gz STQDPUBYFYCEGQ-BXUZGUMPSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001603891559 1096661477 /nfs/dbraw/zinc/66/14/77/1096661477.db2.gz STQDPUBYFYCEGQ-BXUZGUMPSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCCC[C@H]1[N@H+](C)Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001603891559 1096661482 /nfs/dbraw/zinc/66/14/82/1096661482.db2.gz STQDPUBYFYCEGQ-BXUZGUMPSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001603891559 1096661486 /nfs/dbraw/zinc/66/14/86/1096661486.db2.gz STQDPUBYFYCEGQ-BXUZGUMPSA-N 0 3 330.392 2.785 20 5 EFBDHN CC[C@H]([NH2+]Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])[C@H]1CC1(C)C ZINC001604061199 1096714908 /nfs/dbraw/zinc/71/49/08/1096714908.db2.gz KRYORILXIVPNSW-OLZOCXBDSA-N 0 3 330.392 2.689 20 5 EFBDHN CC[C@H]([NH2+]Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])[C@H]1CC1(C)C ZINC001604061199 1096714911 /nfs/dbraw/zinc/71/49/11/1096714911.db2.gz KRYORILXIVPNSW-OLZOCXBDSA-N 0 3 330.392 2.689 20 5 EFBDHN CC[NH+](CC)CCC[C@@H](C)Nc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001604284271 1096794887 /nfs/dbraw/zinc/79/48/87/1096794887.db2.gz DAOZDARRNNNPPY-GFCCVEGCSA-N 0 3 347.423 2.697 20 5 EFBDHN CC[NH+](CC)CCC[C@@H](C)Nc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001604284271 1096794895 /nfs/dbraw/zinc/79/48/95/1096794895.db2.gz DAOZDARRNNNPPY-GFCCVEGCSA-N 0 3 347.423 2.697 20 5 EFBDHN O=[N+]([O-])c1c([O-])ccnc1OC1CC[NH+](CCc2ccccc2)CC1 ZINC001225664927 1098003943 /nfs/dbraw/zinc/00/39/43/1098003943.db2.gz ULZPFLGTTFNHBL-UHFFFAOYSA-N 0 3 343.383 2.781 20 5 EFBDHN CC[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001609199813 1098196994 /nfs/dbraw/zinc/19/69/94/1098196994.db2.gz GLTYCMZJXJDEOM-RISCZKNCSA-N 0 3 330.392 2.833 20 5 EFBDHN CC[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001609199813 1098196998 /nfs/dbraw/zinc/19/69/98/1098196998.db2.gz GLTYCMZJXJDEOM-RISCZKNCSA-N 0 3 330.392 2.833 20 5 EFBDHN CCC[C@@H]1CCC[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001609206532 1098200020 /nfs/dbraw/zinc/20/00/20/1098200020.db2.gz CLRDHFCTJZJCKA-GFCCVEGCSA-N 0 3 330.392 2.787 20 5 EFBDHN CCC[C@@H]1CCC[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001609206532 1098200025 /nfs/dbraw/zinc/20/00/25/1098200025.db2.gz CLRDHFCTJZJCKA-GFCCVEGCSA-N 0 3 330.392 2.787 20 5 EFBDHN CCC[C@@H]1CCC[N@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001609206532 1098200029 /nfs/dbraw/zinc/20/00/29/1098200029.db2.gz CLRDHFCTJZJCKA-GFCCVEGCSA-N 0 3 330.392 2.787 20 5 EFBDHN CCC[C@@H]1CCC[N@@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001609206532 1098200033 /nfs/dbraw/zinc/20/00/33/1098200033.db2.gz CLRDHFCTJZJCKA-GFCCVEGCSA-N 0 3 330.392 2.787 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[NH+]1CCCCCCCC1 ZINC001609599858 1098394607 /nfs/dbraw/zinc/39/46/07/1098394607.db2.gz FBWULRCYAADQRK-UHFFFAOYSA-N 0 3 330.392 2.931 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1C[NH+]1CCCCCCCC1 ZINC001609599858 1098394611 /nfs/dbraw/zinc/39/46/11/1098394611.db2.gz FBWULRCYAADQRK-UHFFFAOYSA-N 0 3 330.392 2.931 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[N@@H+]1CCC[C@@H]1C1CCCC1 ZINC001609602642 1098395858 /nfs/dbraw/zinc/39/58/58/1098395858.db2.gz AVHJEILOWTWAPB-OAHLLOKOSA-N 0 3 342.403 2.930 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[N@H+]1CCC[C@@H]1C1CCCC1 ZINC001609602642 1098395862 /nfs/dbraw/zinc/39/58/62/1098395862.db2.gz AVHJEILOWTWAPB-OAHLLOKOSA-N 0 3 342.403 2.930 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[N@@H+]1CCC[C@@H]1C1CCCC1 ZINC001609602642 1098395870 /nfs/dbraw/zinc/39/58/70/1098395870.db2.gz AVHJEILOWTWAPB-OAHLLOKOSA-N 0 3 342.403 2.930 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[N@H+]1CCC[C@@H]1C1CCCC1 ZINC001609602642 1098395874 /nfs/dbraw/zinc/39/58/74/1098395874.db2.gz AVHJEILOWTWAPB-OAHLLOKOSA-N 0 3 342.403 2.930 20 5 EFBDHN CN1CC2(C1)CCN(C(=O)c1ccnc3c1ccc1cccnc13)CC2 ZINC001270442101 1099092644 /nfs/dbraw/zinc/09/26/44/1099092644.db2.gz SHXHPYVTZZJVQC-UHFFFAOYSA-N 0 3 346.434 2.951 20 5 EFBDHN CC(C)[C@@H]1N(C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC12CCOCC2 ZINC000840776258 1101670883 /nfs/dbraw/zinc/67/08/83/1101670883.db2.gz HWMWMTPCUAWCHJ-SJORKVTESA-N 0 3 334.416 2.765 20 5 EFBDHN O=C(CCCC(F)(F)F)NCCCNCc1ccccc1[N+](=O)[O-] ZINC001167252583 1102151736 /nfs/dbraw/zinc/15/17/36/1102151736.db2.gz OKHPSCLEZUQCSM-UHFFFAOYSA-N 0 3 347.337 2.923 20 5 EFBDHN COC(=O)N1CCC[C@H](NCc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000783609588 1102691602 /nfs/dbraw/zinc/69/16/02/1102691602.db2.gz ZREMSGGLLMOMQO-NSHDSACASA-N 0 3 327.768 2.569 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCOc3c(F)cccc32)c1 ZINC000905642341 1103458205 /nfs/dbraw/zinc/45/82/05/1103458205.db2.gz AIWFSUQVPLZNIW-HZPDHXFCSA-N 0 3 332.331 2.881 20 5 EFBDHN CSCC[C@@H](Nc1cc2c(cc1[N+](=O)[O-])CNC2)C(C)(C)O ZINC001168212785 1104537329 /nfs/dbraw/zinc/53/73/29/1104537329.db2.gz JLIUAMGSBMIOHY-CQSZACIVSA-N 0 3 325.434 2.503 20 5 EFBDHN CN(C)Cc1ccc(-c2noc(-c3ccc(N)c([N+](=O)[O-])c3)n2)cc1 ZINC000904622302 1108047132 /nfs/dbraw/zinc/04/71/32/1108047132.db2.gz GVQAKZUZFXIQHM-UHFFFAOYSA-N 0 3 339.355 2.956 20 5 EFBDHN CN(C)Cc1ccc(-c2noc(-c3cc([N+](=O)[O-])ccc3N)n2)cc1 ZINC000904623397 1108047923 /nfs/dbraw/zinc/04/79/23/1108047923.db2.gz CJCYJWBCGFMEDK-UHFFFAOYSA-N 0 3 339.355 2.956 20 5 EFBDHN O=[N+]([O-])CCNCC1(c2cccc(C(F)(F)F)c2)CCOCC1 ZINC000899873790 1109530148 /nfs/dbraw/zinc/53/01/48/1109530148.db2.gz UNOLVVNYKAKZFH-UHFFFAOYSA-N 0 3 332.322 2.620 20 5 EFBDHN CC(C)N(C)CC(=O)N1CCC(C)(Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC001112352974 1111215762 /nfs/dbraw/zinc/21/57/62/1111215762.db2.gz LESGNSBOVWWUHQ-UHFFFAOYSA-N 0 3 348.447 2.728 20 5 EFBDHN C[C@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000055749944 214340467 /nfs/dbraw/zinc/34/04/67/214340467.db2.gz XFZANVFTLJAGIJ-JHJVBQTASA-N 0 3 337.395 2.830 20 5 EFBDHN CNC(=O)CCN(C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000179408300 529856889 /nfs/dbraw/zinc/85/68/89/529856889.db2.gz PGISZLBGJAJSIA-UHFFFAOYSA-N 0 3 333.413 2.891 20 5 EFBDHN CN(Cc1ccccc1)CC(C)(C)NC(=O)c1ccc([N+](=O)[O-])o1 ZINC000133139205 529999857 /nfs/dbraw/zinc/99/98/57/529999857.db2.gz QKHHZNNZENZYAQ-UHFFFAOYSA-N 0 3 331.372 2.828 20 5 EFBDHN CCCC(=O)NC[C@H]1CCCN(CCOc2ccccc2[N+](=O)[O-])C1 ZINC000101912114 219171948 /nfs/dbraw/zinc/17/19/48/219171948.db2.gz QXYCVMFKLBYDRT-OAHLLOKOSA-N 0 3 349.431 2.602 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CNC2(c3cccc(F)c3)CC2)c1 ZINC000179692348 233329161 /nfs/dbraw/zinc/32/91/61/233329161.db2.gz NWNXBANLVDZHDJ-MRXNPFEDSA-N 0 3 346.358 2.753 20 5 EFBDHN Cc1cc(C(=O)NC[C@H](c2ccccc2)N(C)C)c(N)c([N+](=O)[O-])c1 ZINC000068509957 215313796 /nfs/dbraw/zinc/31/37/96/215313796.db2.gz WAJAREQMSDLHTN-MRXNPFEDSA-N 0 3 342.399 2.518 20 5 EFBDHN COc1cc(CN(C)CCOc2cccc([N+](=O)[O-])c2)ccc1O ZINC000104195182 219359936 /nfs/dbraw/zinc/35/99/36/219359936.db2.gz ZJKZEVIVJJIZAD-UHFFFAOYSA-N 0 3 332.356 2.820 20 5 EFBDHN Cc1c([C@@H](C)NCCC(=O)Nc2cccc([N+](=O)[O-])c2C)cnn1C ZINC000183330129 235010978 /nfs/dbraw/zinc/01/09/78/235010978.db2.gz IYRKXAWZEBSQKL-GFCCVEGCSA-N 0 3 345.403 2.625 20 5 EFBDHN COC[C@H](N[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)C1CC1 ZINC000183473781 235098594 /nfs/dbraw/zinc/09/85/94/235098594.db2.gz WRYBFYPZYLCKIQ-XPTSAGLGSA-N 0 3 341.795 2.590 20 5 EFBDHN C[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CCN1C ZINC000341286077 291068384 /nfs/dbraw/zinc/06/83/84/291068384.db2.gz PYIDGYURCKGHFT-ZFWWWQNUSA-N 0 3 326.400 2.973 20 5 EFBDHN C[C@@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000246434998 295934587 /nfs/dbraw/zinc/93/45/87/295934587.db2.gz DAJIIBXEGKLXQP-UPJWGTAASA-N 0 3 337.395 2.830 20 5 EFBDHN C[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2Cl)CCN1CC(C)(C)O ZINC000189903699 237381813 /nfs/dbraw/zinc/38/18/13/237381813.db2.gz RTXOJGDZWBDCET-GFCCVEGCSA-N 0 3 341.839 2.525 20 5 EFBDHN CCN1CCC(n2nccc2NC(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000073024985 216341703 /nfs/dbraw/zinc/34/17/03/216341703.db2.gz YDYCHSAPSVUMBZ-UHFFFAOYSA-N 0 3 343.387 2.700 20 5 EFBDHN O=C(C1CCN(C2CC2)CC1)N1CCCc2c([N+](=O)[O-])cccc21 ZINC000192779832 283758211 /nfs/dbraw/zinc/75/82/11/283758211.db2.gz NXBCVSNOVXWBBH-UHFFFAOYSA-N 0 3 329.400 2.748 20 5 EFBDHN C[C@H]1[C@H](NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)CCCN1C ZINC000345740979 291308000 /nfs/dbraw/zinc/30/80/00/291308000.db2.gz HXTQSOYNRIATNU-XJKSGUPXSA-N 0 3 346.431 2.752 20 5 EFBDHN C[C@H](N[C@@H]1CC(C)(C)OC1(C)C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000132407209 223327665 /nfs/dbraw/zinc/32/76/65/223327665.db2.gz CZQAMVXLNLSVBQ-SMDDNHRTSA-N 0 3 335.404 2.858 20 5 EFBDHN COc1cccc(C(=O)NCCN[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000193197587 240091117 /nfs/dbraw/zinc/09/11/17/240091117.db2.gz PTSSXNLNBPGJDQ-CYBMUJFWSA-N 0 3 343.383 2.684 20 5 EFBDHN C[C@H](CNc1ncc([N+](=O)[O-])cc1Br)N(C)C1CC1 ZINC000226357440 242101299 /nfs/dbraw/zinc/10/12/99/242101299.db2.gz LDEQWMZPTHKCCG-MRVPVSSYSA-N 0 3 329.198 2.647 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCN2C[C@H](O)C[C@H]2c2ccccc2)cc1 ZINC000411934056 243034007 /nfs/dbraw/zinc/03/40/07/243034007.db2.gz HCHDPELRGZOEAZ-AEFFLSMTSA-N 0 3 328.368 2.782 20 5 EFBDHN CC(C)N1C[C@@H](C)[C@H](NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000246737106 243305529 /nfs/dbraw/zinc/30/55/29/243305529.db2.gz AVCSVBALQNRZQN-BDJLRTHQSA-N 0 3 330.388 2.535 20 5 EFBDHN CS[C@H]1CN(c2ccc([N+](=O)[O-])c3ncccc32)C[C@H]1N(C)C ZINC000413211922 243543907 /nfs/dbraw/zinc/54/39/07/243543907.db2.gz QLZHUTPCUXSSCQ-CABCVRRESA-N 0 3 332.429 2.625 20 5 EFBDHN C[C@@H]1CC[C@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000248524411 243580610 /nfs/dbraw/zinc/58/06/10/243580610.db2.gz TUWVYDRLGKFGAL-WWGRRREGSA-N 0 3 340.445 2.783 20 5 EFBDHN CN(C)C(=O)[C@@H]1CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000414497234 244197546 /nfs/dbraw/zinc/19/75/46/244197546.db2.gz JWVOKOJPLINHHB-CQSZACIVSA-N 0 3 343.383 2.765 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CNCCC(C)(C)S(C)(=O)=O ZINC000414515758 244205010 /nfs/dbraw/zinc/20/50/10/244205010.db2.gz MUQMRRVVIIXAJP-RAXLEYEMSA-N 0 3 340.445 2.801 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2ccc(CN[C@H](CO)[C@@H]3CCCOC3)o2)c1 ZINC000414562892 244237390 /nfs/dbraw/zinc/23/73/90/244237390.db2.gz UCGJPIMTHCXAKF-RHSMWYFYSA-N 0 3 346.383 2.732 20 5 EFBDHN C[C@H](NC(=O)NCc1ccc2c(c1)CNC2)c1cccc([N+](=O)[O-])c1 ZINC000417128856 245034996 /nfs/dbraw/zinc/03/49/96/245034996.db2.gz JLFKEVDKMFJVCO-LBPRGKRZSA-N 0 3 340.383 2.758 20 5 EFBDHN COC(=O)[C@@](C)(CNCc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000447071825 284222634 /nfs/dbraw/zinc/22/26/34/284222634.db2.gz CROMZSWOIWLMLY-SFHVURJKSA-N 0 3 346.358 2.954 20 5 EFBDHN COC(=O)COc1ccc(CN2C[C@H](C)[C@@H](C)[C@@H]2C)cc1[N+](=O)[O-] ZINC000418121922 245112938 /nfs/dbraw/zinc/11/29/38/245112938.db2.gz JFEXONKATDNOEC-XQQFMLRXSA-N 0 3 336.388 2.623 20 5 EFBDHN CC[C@@H](NCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])[C@H]1CC1(C)C ZINC000419321812 245379320 /nfs/dbraw/zinc/37/93/20/245379320.db2.gz ROTOPSFQKIBKRO-CHWSQXEVSA-N 0 3 335.404 2.956 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCCN2CCC[C@H]2[C@H](O)C(F)(F)F)cc1 ZINC000111231943 220116779 /nfs/dbraw/zinc/11/67/79/220116779.db2.gz CALYOCMJOBBPPS-KBPBESRZSA-N 0 3 348.321 2.751 20 5 EFBDHN COc1cc(CN(C)CCOc2ccccc2[N+](=O)[O-])ccc1O ZINC000080846630 217336300 /nfs/dbraw/zinc/33/63/00/217336300.db2.gz AARNVGNEFDCZQM-UHFFFAOYSA-N 0 3 332.356 2.820 20 5 EFBDHN CN(C[C@@H]1CCCN1C)C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000421701422 246068489 /nfs/dbraw/zinc/06/84/89/246068489.db2.gz HNKYYZNQJXKPEW-NSHDSACASA-N 0 3 345.321 2.780 20 5 EFBDHN COCC(C)(C)N1CCN(c2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000425281621 247029120 /nfs/dbraw/zinc/02/91/20/247029120.db2.gz PTTJLXFUNQTLHY-UHFFFAOYSA-N 0 3 344.415 2.690 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)CN1CCCCCC1 ZINC000427064448 247313544 /nfs/dbraw/zinc/31/35/44/247313544.db2.gz LREXZIWEJQSDDJ-CYBMUJFWSA-N 0 3 335.404 2.598 20 5 EFBDHN CC(C)[C@H]1N(C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC12CCC2 ZINC000427179955 247325976 /nfs/dbraw/zinc/32/59/76/247325976.db2.gz WSRYNNQVBWYQGV-DOTOQJQBSA-N 0 3 334.416 2.845 20 5 EFBDHN COCCN(CCOc1cccc([N+](=O)[O-])c1)[C@H]1CCCSC1 ZINC000433193204 248026634 /nfs/dbraw/zinc/02/66/34/248026634.db2.gz JAIQHDWBPCSCKG-HNNXBMFYSA-N 0 3 340.445 2.818 20 5 EFBDHN COCCN(CCOc1ccccc1[N+](=O)[O-])[C@@H]1CCCSC1 ZINC000433201527 248028272 /nfs/dbraw/zinc/02/82/72/248028272.db2.gz WVJRZXUUHBYNEA-CQSZACIVSA-N 0 3 340.445 2.818 20 5 EFBDHN C[C@@H](NC(=O)NC[C@@H]1CCCCN1C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000433566143 248072093 /nfs/dbraw/zinc/07/20/93/248072093.db2.gz YJHNFAVZKYAXNH-DYVFJYSZSA-N 0 3 346.431 2.972 20 5 EFBDHN C[C@H]1C[C@@H](N(C)C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CCN1C ZINC000266098126 248095093 /nfs/dbraw/zinc/09/50/93/248095093.db2.gz RAEXTHWQRRYQKW-AAEUAGOBSA-N 0 3 330.388 2.631 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NC[C@H]1CCCCN1C1CC1 ZINC000433953726 248106744 /nfs/dbraw/zinc/10/67/44/248106744.db2.gz LWBHPKAPEDOUSC-MRXNPFEDSA-N 0 3 346.431 2.753 20 5 EFBDHN O=[N+]([O-])c1ccc(NCc2ccccc2CN2CCC(O)CC2)nc1 ZINC000266283494 248223197 /nfs/dbraw/zinc/22/31/97/248223197.db2.gz UWSFRNCPDGBZDW-UHFFFAOYSA-N 0 3 342.399 2.559 20 5 EFBDHN O=C(c1cccc(Cl)c1[N+](=O)[O-])N1CC[C@H](N2CCCCC2)C1 ZINC000267361269 296250458 /nfs/dbraw/zinc/25/04/58/296250458.db2.gz HBBWDGRBCJTATF-LBPRGKRZSA-N 0 3 337.807 2.949 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H](C(=O)NCC2CC2)C1 ZINC000266553970 248358436 /nfs/dbraw/zinc/35/84/36/248358436.db2.gz VIMBEPJXHXIJSP-UKRRQHHQSA-N 0 3 331.416 2.894 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C/CN1CCC[C@@H](Cn2ccnn2)C1 ZINC000092069820 218114600 /nfs/dbraw/zinc/11/46/00/218114600.db2.gz KYYHAVVYMPWDRU-NFBGWVBBSA-N 0 3 327.388 2.612 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1 ZINC000092429308 218141614 /nfs/dbraw/zinc/14/16/14/218141614.db2.gz MHQGYWPXCLXAHE-TZMCWYRMSA-N 0 3 331.416 2.875 20 5 EFBDHN CNC(=O)[C@@H]1CCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000093360818 218218198 /nfs/dbraw/zinc/21/81/98/218218198.db2.gz PQOWVCCCIQPCRH-CYBMUJFWSA-N 0 3 343.383 2.813 20 5 EFBDHN CNC(=O)CCCN(C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000093717722 218243964 /nfs/dbraw/zinc/24/39/64/218243964.db2.gz UQFJWGGXHHYZHE-UHFFFAOYSA-N 0 3 331.372 2.813 20 5 EFBDHN CCOC(=O)C[C@@](C)(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(C)C ZINC000444677383 250328954 /nfs/dbraw/zinc/32/89/54/250328954.db2.gz UEAYIMDFCDHRHL-QGZVFWFLSA-N 0 3 348.403 2.929 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N(C)CC1CCN(C)CC1 ZINC000094119683 218265737 /nfs/dbraw/zinc/26/57/37/218265737.db2.gz VVBQIZLQFQTQNA-UHFFFAOYSA-N 0 3 333.432 2.934 20 5 EFBDHN CCc1nn(C)c(NC[C@H](c2ccco2)N(CC)CC)c1[N+](=O)[O-] ZINC000094151003 218266360 /nfs/dbraw/zinc/26/63/60/218266360.db2.gz CHLZACACDQXXHU-CYBMUJFWSA-N 0 3 335.408 2.979 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@]2(CCO)CCOC2)s1 ZINC000447065343 250538063 /nfs/dbraw/zinc/53/80/63/250538063.db2.gz HEGDDXSCFSPFGA-QGZVFWFLSA-N 0 3 348.424 2.954 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC2(CCN(C)C2=O)CC1 ZINC000447089535 250542668 /nfs/dbraw/zinc/54/26/68/250542668.db2.gz WXCLCQRBSNAEOQ-QINSGFPZSA-N 0 3 343.427 2.942 20 5 EFBDHN C[C@@H](CN1CCCCC1)Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000267202933 250829171 /nfs/dbraw/zinc/82/91/71/250829171.db2.gz JSENYUZNWDGNLR-ZDUSSCGKSA-N 0 3 346.431 2.773 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)c1ccc([N+](=O)[O-])o1 ZINC000267413254 251036600 /nfs/dbraw/zinc/03/66/00/251036600.db2.gz KTATXFZBCUAJKS-UKRRQHHQSA-N 0 3 343.383 2.828 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@@H]([C@@H](CO)C1CC1)C1CC1 ZINC000449510830 251047501 /nfs/dbraw/zinc/04/75/01/251047501.db2.gz QQEDSODEQUUZOF-FUHWJXTLSA-N 0 3 334.416 2.880 20 5 EFBDHN CN1CC[C@@H]2CN(Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C[C@@H]21 ZINC000449517964 251051190 /nfs/dbraw/zinc/05/11/90/251051190.db2.gz LTTJMGCMOPTLQS-PBHICJAKSA-N 0 3 327.384 2.991 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN1CC[C@@H]2C[C@H](O)CC[C@@H]2C1 ZINC000449559452 251065614 /nfs/dbraw/zinc/06/56/14/251065614.db2.gz YIPVKBDJKVXZGZ-CKEIUWERSA-N 0 3 334.416 2.976 20 5 EFBDHN CNC(=O)C[C@H](C)NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000449599033 251078648 /nfs/dbraw/zinc/07/86/48/251078648.db2.gz FBMGHABELJEFOW-NSHDSACASA-N 0 3 333.413 2.938 20 5 EFBDHN COC[C@]1(CO)CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000449693672 251120627 /nfs/dbraw/zinc/12/06/27/251120627.db2.gz FBUUFXXISLSQEH-GOSISDBHSA-N 0 3 346.383 2.686 20 5 EFBDHN COC(=O)[C@H]1CN(Cc2ccc([N+](=O)[O-])cc2)C[C@H]1c1ccccc1 ZINC000449757316 251143182 /nfs/dbraw/zinc/14/31/82/251143182.db2.gz SDNSXOFQOUDOPV-ROUUACIJSA-N 0 3 340.379 2.983 20 5 EFBDHN CCO[C@@H]1CCCC[C@H]1NCc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000449760159 251144832 /nfs/dbraw/zinc/14/48/32/251144832.db2.gz MGMSONZVXTXCBU-HZPDHXFCSA-N 0 3 336.388 2.899 20 5 EFBDHN Cc1nc(NCC2CCN(Cc3cccs3)CC2)ncc1[N+](=O)[O-] ZINC000450284960 251329319 /nfs/dbraw/zinc/32/93/19/251329319.db2.gz DGSRIGKRYNPBLM-UHFFFAOYSA-N 0 3 347.444 2.501 20 5 EFBDHN C[C@H](O)C[C@@H]1CCCN1[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000152925869 224033226 /nfs/dbraw/zinc/03/32/26/224033226.db2.gz PCOSQFACMHWONQ-HUBLWGQQSA-N 0 3 346.387 2.941 20 5 EFBDHN Cc1cccc(OC[C@@H](O)CN[C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000268853580 252301556 /nfs/dbraw/zinc/30/15/56/252301556.db2.gz QIBKITBDHMNJSG-PBHICJAKSA-N 0 3 330.384 2.994 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N(C)CC2(N(C)C)CCC2)c1 ZINC000188070062 533009365 /nfs/dbraw/zinc/00/93/65/533009365.db2.gz YFTZUVLZVHSWJG-UHFFFAOYSA-N 0 3 337.445 2.873 20 5 EFBDHN CCN(C)CCNc1ccc(I)cc1[N+](=O)[O-] ZINC000097347875 219013360 /nfs/dbraw/zinc/01/33/60/219013360.db2.gz NMVHXLTZCKNCIH-UHFFFAOYSA-N 0 3 349.172 2.563 20 5 EFBDHN COC[C@H](N[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)C1CC1 ZINC000183473796 533098693 /nfs/dbraw/zinc/09/86/93/533098693.db2.gz WRYBFYPZYLCKIQ-OTYXRUKQSA-N 0 3 341.795 2.590 20 5 EFBDHN COC(=O)C1(CNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000188673589 533214779 /nfs/dbraw/zinc/21/47/79/533214779.db2.gz GGNUJZZBVWEMHG-UHFFFAOYSA-N 0 3 330.340 2.898 20 5 EFBDHN CO[C@@H]1C[C@H](N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C12CCC2 ZINC000459777443 255932358 /nfs/dbraw/zinc/93/23/58/255932358.db2.gz VWTQVCNEXVPCTO-VBNZEHGJSA-N 0 3 347.415 2.777 20 5 EFBDHN CC(C)CO[C@H]1CCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000119541959 221343959 /nfs/dbraw/zinc/34/39/59/221343959.db2.gz DJZOTRODKGQNHD-AWEZNQCLSA-N 0 3 335.404 2.670 20 5 EFBDHN CC(C)CO[C@@H]1CCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000119541794 221344430 /nfs/dbraw/zinc/34/44/30/221344430.db2.gz DJZOTRODKGQNHD-CQSZACIVSA-N 0 3 335.404 2.670 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN(C)[C@@H](C)CN1CCOCC1 ZINC000435056645 533383260 /nfs/dbraw/zinc/38/32/60/533383260.db2.gz NAUGUSUIENBJQG-QZFKAFNDSA-N 0 3 333.432 2.651 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CNCc1ccc(C(N)=O)cc1 ZINC000344841158 533384343 /nfs/dbraw/zinc/38/43/43/533384343.db2.gz GIUTVCCGLHPOLI-LCYFTJDESA-N 0 3 325.368 2.887 20 5 EFBDHN C[C@@H](NCCn1ccc([N+](=O)[O-])n1)c1ccc(Br)cc1 ZINC000181107454 533407583 /nfs/dbraw/zinc/40/75/83/533407583.db2.gz ORMIZAVCYFBULX-SNVBAGLBSA-N 0 3 339.193 2.905 20 5 EFBDHN C[C@@H]1CCCC[C@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000129244795 533616598 /nfs/dbraw/zinc/61/65/98/533616598.db2.gz MWYKRKLPWCODJW-IUODEOHRSA-N 0 3 326.418 2.537 20 5 EFBDHN CC1CCN(CCNC(=O)CSc2ccc([N+](=O)[O-])cc2)CC1 ZINC000054779831 141354115 /nfs/dbraw/zinc/35/41/15/141354115.db2.gz VGBADDIRJCYBAL-UHFFFAOYSA-N 0 3 337.445 2.535 20 5 EFBDHN O=C(C1CCC1)N(CCCNCc1csc([N+](=O)[O-])c1)C1CC1 ZINC000343498919 142008184 /nfs/dbraw/zinc/00/81/84/142008184.db2.gz CCTZNWAGCOXLJS-UHFFFAOYSA-N 0 3 337.445 2.927 20 5 EFBDHN CCCN(CCN1CCCCCC1)C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000344429991 142015139 /nfs/dbraw/zinc/01/51/39/142015139.db2.gz CGLUKZFOMMQARW-UHFFFAOYSA-N 0 3 349.435 2.532 20 5 EFBDHN C[C@H]1C[C@H]1N1CCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000346151576 142155657 /nfs/dbraw/zinc/15/56/57/142155657.db2.gz ZEVFWSMVBNRACT-SLEUVZQESA-N 0 3 335.379 2.536 20 5 EFBDHN C[C@H]1C[C@H]1N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)C[C@@H](C)C1 ZINC000346187834 142163979 /nfs/dbraw/zinc/16/39/79/142163979.db2.gz OISSCBWYDDTKEQ-MQIPJXDCSA-N 0 3 335.379 2.536 20 5 EFBDHN CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)CN(C)C ZINC000346213703 142168700 /nfs/dbraw/zinc/16/87/00/142168700.db2.gz YTDSAPGQCVQXDS-LLVKDONJSA-N 0 3 325.434 2.777 20 5 EFBDHN Cc1cc(C(=O)N2CCN([C@@H]3C[C@H]3C)C[C@H](C)C2)cc([N+](=O)[O-])c1 ZINC000346242189 142174928 /nfs/dbraw/zinc/17/49/28/142174928.db2.gz RTSLTGMXTNXODY-JJRVBVJISA-N 0 3 331.416 2.706 20 5 EFBDHN CCN(CCN1CCCCCC1)C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000346304427 142186480 /nfs/dbraw/zinc/18/64/80/142186480.db2.gz WHEXBHKRDGXHNY-UHFFFAOYSA-N 0 3 349.431 2.698 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000347776214 142270011 /nfs/dbraw/zinc/27/00/11/142270011.db2.gz LCPPDXHZJAECQJ-AWEZNQCLSA-N 0 3 331.372 2.945 20 5 EFBDHN CC(C)N1CCC[C@H](NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000347945975 142297896 /nfs/dbraw/zinc/29/78/96/142297896.db2.gz FFGBJDBOJQMJKK-HNNXBMFYSA-N 0 3 346.431 2.772 20 5 EFBDHN C[C@@H](NC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F)C1=CCN(C)CC1 ZINC000347987138 142304676 /nfs/dbraw/zinc/30/46/76/142304676.db2.gz BAHUSWIZYDIZKE-VXGBXAGGSA-N 0 3 335.379 2.604 20 5 EFBDHN CN(C)CCOc1ccccc1C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000348016403 142309080 /nfs/dbraw/zinc/30/90/80/142309080.db2.gz QSXLMGNYSCWRJF-UHFFFAOYSA-N 0 3 347.346 2.927 20 5 EFBDHN CCO[C@H]1C[C@H](N(C)CCn2cc([N+](=O)[O-])cn2)C12CCCCC2 ZINC000350039515 142393781 /nfs/dbraw/zinc/39/37/81/142393781.db2.gz IDMSNYCSDGSMHP-HOTGVXAUSA-N 0 3 336.436 2.851 20 5 EFBDHN COC1CCN(C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC000341313714 145031312 /nfs/dbraw/zinc/03/13/12/145031312.db2.gz ZZZNQBUXLAWUTC-UHFFFAOYSA-N 0 3 349.431 2.522 20 5 EFBDHN C[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)N(C)C ZINC000355113012 146866843 /nfs/dbraw/zinc/86/68/43/146866843.db2.gz IYYOZHDHRNRDHA-MRVPVSSYSA-N 0 3 334.298 2.685 20 5 EFBDHN COc1ccc(CNC[C@@](C)(CO)c2ccccc2)cc1[N+](=O)[O-] ZINC000342228137 145084059 /nfs/dbraw/zinc/08/40/59/145084059.db2.gz PXBIYUWFEGQMOC-SFHVURJKSA-N 0 3 330.384 2.643 20 5 EFBDHN O=[N+]([O-])c1cccc(F)c1NC[C@]1(O)CCN(Cc2ccccc2)C1 ZINC000342369546 145110096 /nfs/dbraw/zinc/11/00/96/145110096.db2.gz GUYHWVSDTIJNJQ-GOSISDBHSA-N 0 3 345.374 2.783 20 5 EFBDHN CC1CCC(CNCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000342367086 145110208 /nfs/dbraw/zinc/11/02/08/145110208.db2.gz XOGADKGKNVZFJG-UHFFFAOYSA-N 0 3 340.445 2.784 20 5 EFBDHN C[C@@H]1[C@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CCCN1C ZINC000342650347 145165981 /nfs/dbraw/zinc/16/59/81/145165981.db2.gz HQUFVXWWYJVUGJ-QMTHXVAHSA-N 0 3 340.811 2.530 20 5 EFBDHN CCCN(CCN1CCCCC1)C(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000342790643 145193520 /nfs/dbraw/zinc/19/35/20/145193520.db2.gz DHMDEEJKZADYLE-UHFFFAOYSA-N 0 3 349.431 2.942 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN1CC[C@H]1Cc1ccccc1 ZINC000343563511 145239626 /nfs/dbraw/zinc/23/96/26/145239626.db2.gz ZMSCVGHZUXCLPN-IRXDYDNUSA-N 0 3 342.395 2.652 20 5 EFBDHN CC(C)NC(=O)c1ccc(N[C@H]2CCCN(C)[C@@H]2C)c([N+](=O)[O-])c1 ZINC000343588249 145246262 /nfs/dbraw/zinc/24/62/62/145246262.db2.gz FOSYGWSHBJKNPC-OCCSQVGLSA-N 0 3 334.420 2.628 20 5 EFBDHN CC(C)NC(=O)c1ccc(N[C@@H]2CCCN(C)[C@H]2C)c([N+](=O)[O-])c1 ZINC000343588246 145246431 /nfs/dbraw/zinc/24/64/31/145246431.db2.gz FOSYGWSHBJKNPC-GXTWGEPZSA-N 0 3 334.420 2.628 20 5 EFBDHN C[C@@H]1[C@H](Nc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)CCCN1C ZINC000343610184 145251903 /nfs/dbraw/zinc/25/19/03/145251903.db2.gz STSKYMHKJUPXOF-CZUORRHYSA-N 0 3 346.431 2.725 20 5 EFBDHN C[C@@H]1[C@@H](Nc2ncc(Br)cc2[N+](=O)[O-])CCCN1C ZINC000343614390 145252709 /nfs/dbraw/zinc/25/27/09/145252709.db2.gz YFEDLUSPTMIOFQ-SCZZXKLOSA-N 0 3 329.198 2.647 20 5 EFBDHN C[C@H](NCc1ccncc1OCCN(C)C)c1cccc([N+](=O)[O-])c1 ZINC000344010039 145344263 /nfs/dbraw/zinc/34/42/63/145344263.db2.gz ZYLQNUWWSVIQCT-AWEZNQCLSA-N 0 3 344.415 2.781 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@@H]1CCC[C@@H]1OC(F)F ZINC000348535225 145966680 /nfs/dbraw/zinc/96/66/80/145966680.db2.gz QMBIAGUGJAMPAR-YPMHNXCESA-N 0 3 343.330 2.592 20 5 EFBDHN CN(C)C1(CN(C)C(=O)C(C)(C)c2ccccc2[N+](=O)[O-])CCC1 ZINC000349077649 146048100 /nfs/dbraw/zinc/04/81/00/146048100.db2.gz NEAIZCMOYAQBNQ-UHFFFAOYSA-N 0 3 333.432 2.815 20 5 EFBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])N[C@H]1CCCN(C)C1=O ZINC000349201480 146065586 /nfs/dbraw/zinc/06/55/86/146065586.db2.gz LANLXKBYJZENNW-STQMWFEESA-N 0 3 337.445 2.676 20 5 EFBDHN CCOc1ncccc1CN[C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000351505113 146133290 /nfs/dbraw/zinc/13/32/90/146133290.db2.gz ZPPSOLISPKKWTF-GJZGRUSLSA-N 0 3 345.403 2.859 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1CNCCn1cc(Br)cn1 ZINC000353064782 146389308 /nfs/dbraw/zinc/38/93/08/146389308.db2.gz RJBGVHDAJCYYTB-UHFFFAOYSA-N 0 3 339.193 2.652 20 5 EFBDHN CC[C@H]1CCCCN1Cc1ccc(OCC(=O)OC)c([N+](=O)[O-])c1 ZINC000355584865 147004331 /nfs/dbraw/zinc/00/43/31/147004331.db2.gz PUENTVFHZORQPA-AWEZNQCLSA-N 0 3 336.388 2.911 20 5 EFBDHN O=[N+]([O-])c1ccccc1NC[C@]1(O)CCN(Cc2ccccc2)C1 ZINC000355711968 147041623 /nfs/dbraw/zinc/04/16/23/147041623.db2.gz AGKYDTSFVIBCLI-GOSISDBHSA-N 0 3 327.384 2.644 20 5 EFBDHN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCN(C)C1CC1 ZINC000356387007 147231226 /nfs/dbraw/zinc/23/12/26/147231226.db2.gz GQOAEQBGHGFKMC-UHFFFAOYSA-N 0 3 337.445 2.921 20 5 EFBDHN C[C@H](C(=O)N(C)CCc1ccccc1[N+](=O)[O-])N1[C@H](C)CC[C@H]1C ZINC000359128277 148003273 /nfs/dbraw/zinc/00/32/73/148003273.db2.gz HIXCDBDUUTXIMA-RBSFLKMASA-N 0 3 333.432 2.857 20 5 EFBDHN CC[C@H](C)N[C@@H](CNC(=O)Cc1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000359530684 148111705 /nfs/dbraw/zinc/11/17/05/148111705.db2.gz DKNJSTASPUCXTB-BBRMVZONSA-N 0 3 345.399 2.976 20 5 EFBDHN CO[C@]1(CNCc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCOC1 ZINC000359645324 148149841 /nfs/dbraw/zinc/14/98/41/148149841.db2.gz LMUALIALUVHCTE-KRWDZBQOSA-N 0 3 332.356 2.750 20 5 EFBDHN CN(C)[C@@]1(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)CCSC1 ZINC000359681720 148161469 /nfs/dbraw/zinc/16/14/69/148161469.db2.gz USPMSEPQVREFSW-MRXNPFEDSA-N 0 3 349.412 2.508 20 5 EFBDHN CN(C)C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000359794906 148191138 /nfs/dbraw/zinc/19/11/38/148191138.db2.gz OZPHWNHQPPDLTI-MRXNPFEDSA-N 0 3 331.347 2.767 20 5 EFBDHN Cc1cc(NCCCN2CCCO[C@H](C)C2)c(F)cc1[N+](=O)[O-] ZINC000360070647 148264722 /nfs/dbraw/zinc/26/47/22/148264722.db2.gz IJWDYTTWLQSDHV-CYBMUJFWSA-N 0 3 325.384 2.955 20 5 EFBDHN CS[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1N(C)C ZINC000360200389 148297254 /nfs/dbraw/zinc/29/72/54/148297254.db2.gz RDEDECWGPAVTMM-UONOGXRCSA-N 0 3 329.853 2.726 20 5 EFBDHN CCOc1ccc(C(=O)N2CCC[C@@H](N3CCCC3)C2)cc1[N+](=O)[O-] ZINC000364480503 149163399 /nfs/dbraw/zinc/16/33/99/149163399.db2.gz WBJHMJLPGCXVPY-OAHLLOKOSA-N 0 3 347.415 2.694 20 5 EFBDHN Cc1ccc([C@@]2(C)CCN(CCn3cc([N+](=O)[O-])ccc3=O)C2)cc1 ZINC000364848826 149258007 /nfs/dbraw/zinc/25/80/07/149258007.db2.gz QZJOXUKXAJELJD-IBGZPJMESA-N 0 3 341.411 2.729 20 5 EFBDHN COc1cc(C(=O)N2CCC[C@@H](N3CCCC3)C2)cc([N+](=O)[O-])c1C ZINC000365155802 149332385 /nfs/dbraw/zinc/33/23/85/149332385.db2.gz LPHQLSFRWAQDSV-OAHLLOKOSA-N 0 3 347.415 2.612 20 5 EFBDHN COc1cccc(CC2CCN(CCn3cc([N+](=O)[O-])cn3)CC2)c1 ZINC000368175234 150057204 /nfs/dbraw/zinc/05/72/04/150057204.db2.gz VNYASGLNQYWBPL-UHFFFAOYSA-N 0 3 344.415 2.755 20 5 EFBDHN O=C(N[C@@H]1[C@H]2CN(Cc3ccccc3)C[C@H]21)c1csc([N+](=O)[O-])c1 ZINC000372025952 150933367 /nfs/dbraw/zinc/93/33/67/150933367.db2.gz NSMPUVKYWOVLDN-FOLVSLTJSA-N 0 3 343.408 2.517 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@H](N2CCCC2)C1 ZINC000374072921 151279991 /nfs/dbraw/zinc/27/99/91/151279991.db2.gz VCCNYNWLGHPNAC-CQSZACIVSA-N 0 3 348.403 2.696 20 5 EFBDHN O=C1CC[C@H](N[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C2(CCC2)N1 ZINC000374808882 151416006 /nfs/dbraw/zinc/41/60/06/151416006.db2.gz OJJVLKBOUMERQX-CVEARBPZSA-N 0 3 329.400 2.763 20 5 EFBDHN CC[C@@H](N[C@H]1CCN(c2cnn(C)c2)C1)c1cccc([N+](=O)[O-])c1 ZINC000378170439 152024711 /nfs/dbraw/zinc/02/47/11/152024711.db2.gz SCOKGWWOOAAOQC-WMLDXEAASA-N 0 3 329.404 2.648 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@@H](N2CCOCC2)[C@@H]1C ZINC000352018180 292296565 /nfs/dbraw/zinc/29/65/65/292296565.db2.gz OHFVKDHSXBHEMY-RLFYNMQTSA-N 0 3 333.432 2.759 20 5 EFBDHN C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000158407972 225009595 /nfs/dbraw/zinc/00/95/95/225009595.db2.gz MTDMHWYZGZSXCH-MFKMUULPSA-N 0 3 325.796 2.660 20 5 EFBDHN NC(=O)CC1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000159754872 225272969 /nfs/dbraw/zinc/27/29/69/225272969.db2.gz KWXXMEGZIYTXTI-UHFFFAOYSA-N 0 3 343.383 2.942 20 5 EFBDHN CC[C@@H]1CCCCN1CCNC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000122968674 222191298 /nfs/dbraw/zinc/19/12/98/222191298.db2.gz KNPWHVJHQZFODZ-MRXNPFEDSA-N 0 3 333.432 2.826 20 5 EFBDHN COc1cccc(NCCCCN2C[C@@H](C)O[C@@H](C)C2)c1[N+](=O)[O-] ZINC000185543578 265044536 /nfs/dbraw/zinc/04/45/36/265044536.db2.gz KMWQBRKKIRXYLE-OKILXGFUSA-N 0 3 337.420 2.905 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@@H](CO)Cc1ccccc1C ZINC000188925115 265163763 /nfs/dbraw/zinc/16/37/63/265163763.db2.gz HANXVXGDRJDPCO-QGZVFWFLSA-N 0 3 344.411 2.995 20 5 EFBDHN COc1cc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1C ZINC000193983895 265355263 /nfs/dbraw/zinc/35/52/63/265355263.db2.gz UIXDQOIDJMJQNA-HNNXBMFYSA-N 0 3 342.399 2.993 20 5 EFBDHN CCc1nn(C)c(N[C@@H]2CCN(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000271307675 265942993 /nfs/dbraw/zinc/94/29/93/265942993.db2.gz RYSAPMKDPJTSPS-CQSZACIVSA-N 0 3 329.404 2.577 20 5 EFBDHN COc1cc(CN[C@@H]2CCO[C@H](C(C)C)C2)c([N+](=O)[O-])cc1OC ZINC000271535670 266002835 /nfs/dbraw/zinc/00/28/35/266002835.db2.gz OURYBBPPYSTCIT-HIFRSBDPSA-N 0 3 338.404 2.905 20 5 EFBDHN COc1cc(CN[C@@H]2CCO[C@@H](C(C)C)C2)c([N+](=O)[O-])cc1OC ZINC000271535673 266003046 /nfs/dbraw/zinc/00/30/46/266003046.db2.gz OURYBBPPYSTCIT-UKRRQHHQSA-N 0 3 338.404 2.905 20 5 EFBDHN CC(C)C[C@H](CN(C)C)NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000087134070 272993852 /nfs/dbraw/zinc/99/38/52/272993852.db2.gz UWJHWUBHEIWXBO-MRXNPFEDSA-N 0 3 348.447 2.639 20 5 EFBDHN COc1cc(C[NH2+][C@@H]2CCO[C@@H](CC(C)C)C2)c([N+](=O)[O-])cc1[O-] ZINC000272045920 266135375 /nfs/dbraw/zinc/13/53/75/266135375.db2.gz WXJWPWBQXDUEPX-KGLIPLIRSA-N 0 3 338.404 2.992 20 5 EFBDHN C[C@@H](C1CCN(C)CC1)N(C)C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000272126890 266162487 /nfs/dbraw/zinc/16/24/87/266162487.db2.gz ATLSZTDWGVHFSE-LBPRGKRZSA-N 0 3 344.415 2.878 20 5 EFBDHN C[C@@H](C1CCN(C)CC1)N(C)C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000272168164 266175523 /nfs/dbraw/zinc/17/55/23/266175523.db2.gz IVHAFYPPFIBGET-LBPRGKRZSA-N 0 3 344.415 2.878 20 5 EFBDHN CN1CC[C@@H]2CCN(c3ccc(Br)cc3[N+](=O)[O-])[C@@H]2C1 ZINC000272223824 266195291 /nfs/dbraw/zinc/19/52/91/266195291.db2.gz SLXUDYJHAYITEU-QMTHXVAHSA-N 0 3 340.221 2.888 20 5 EFBDHN CC[C@H](NCc1ccc(OC)c([N+](=O)[O-])c1)C1(C(=O)OC)CCC1 ZINC000272608080 266324510 /nfs/dbraw/zinc/32/45/10/266324510.db2.gz YURPTJWYMYAFNK-HNNXBMFYSA-N 0 3 336.388 2.815 20 5 EFBDHN C[C@@H](NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1)C1=CCN(C)CC1 ZINC000272625245 266329406 /nfs/dbraw/zinc/32/94/06/266329406.db2.gz APBNCEUGRHAWHK-CYBMUJFWSA-N 0 3 331.416 2.639 20 5 EFBDHN CC[C@H](NC(=O)N1CC[C@@H]2CCN(C)C[C@H]21)c1cccc([N+](=O)[O-])c1 ZINC000272633262 266334248 /nfs/dbraw/zinc/33/42/48/266334248.db2.gz XFWVLGAIWPVNDR-RRQGHBQHSA-N 0 3 346.431 2.782 20 5 EFBDHN C[C@@H](NC(=O)CCCNc1ccc([N+](=O)[O-])cc1)C1=CCN(C)CC1 ZINC000272656199 266342262 /nfs/dbraw/zinc/34/22/62/266342262.db2.gz BFXFPBOFWAJLIJ-CQSZACIVSA-N 0 3 346.431 2.554 20 5 EFBDHN COc1ccc(NC(=O)N2CC[C@H](N3CCCCC3)C2)cc1[N+](=O)[O-] ZINC000272817831 266390082 /nfs/dbraw/zinc/39/00/82/266390082.db2.gz KOLCHUPPKFNHDS-AWEZNQCLSA-N 0 3 348.403 2.696 20 5 EFBDHN CCN1CCC[C@@H]1CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000273915145 266578295 /nfs/dbraw/zinc/57/82/95/266578295.db2.gz DPOINICJCUCLIA-CYBMUJFWSA-N 0 3 337.395 2.612 20 5 EFBDHN C[C@@H](CCN1CCN(C)CC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000274520712 266666047 /nfs/dbraw/zinc/66/60/47/266666047.db2.gz WOCXFONYUXYVOC-LBPRGKRZSA-N 0 3 326.828 2.686 20 5 EFBDHN O=[N+]([O-])c1cccnc1NC[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000276933774 267080728 /nfs/dbraw/zinc/08/07/28/267080728.db2.gz ACTCBDUTOZDCOL-MRXNPFEDSA-N 0 3 342.399 2.693 20 5 EFBDHN CCNC(=O)C1(CN[C@@H](C)c2ccc(OCC)c([N+](=O)[O-])c2)CCC1 ZINC000277116262 267116884 /nfs/dbraw/zinc/11/68/84/267116884.db2.gz IJERKXKQODEKMB-ZDUSSCGKSA-N 0 3 349.431 2.951 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)N(CC(C)C)C1CCN(C)CC1 ZINC000277255321 267140422 /nfs/dbraw/zinc/14/04/22/267140422.db2.gz ZTJHBRQCINISNH-UHFFFAOYSA-N 0 3 349.431 2.796 20 5 EFBDHN O=C(NC[C@@H]1CCCCN1C1CC1)c1ccc([N+](=O)[O-])cc1Cl ZINC000277434471 267179916 /nfs/dbraw/zinc/17/99/16/267179916.db2.gz DYGZTMZSEXJEHL-ZDUSSCGKSA-N 0 3 337.807 2.995 20 5 EFBDHN O=C(/C=C/c1ccccc1[N+](=O)[O-])NC[C@@H]1CCCCN1C1CC1 ZINC000277583992 267204634 /nfs/dbraw/zinc/20/46/34/267204634.db2.gz RSFFZBOTEFPFDN-KXKDPZRNSA-N 0 3 329.400 2.741 20 5 EFBDHN O=[N+]([O-])c1ccc(CCN2CCC[C@H]([C@H](O)C(F)(F)F)C2)cc1 ZINC000277856234 267280616 /nfs/dbraw/zinc/28/06/16/267280616.db2.gz TVUSMWFVWVMRDN-JSGCOSHPSA-N 0 3 332.322 2.773 20 5 EFBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])NCCNC(=O)C(C)C ZINC000271137551 273100987 /nfs/dbraw/zinc/10/09/87/273100987.db2.gz NNFDIDNRZNIAOM-ZDUSSCGKSA-N 0 3 339.461 2.827 20 5 EFBDHN CC(C)O[C@H]1C[C@@H](NCC(=O)Nc2ccccc2[N+](=O)[O-])C1(C)C ZINC000274308303 273131526 /nfs/dbraw/zinc/13/15/26/273131526.db2.gz SSBZUCNVKAIXIV-CABCVRRESA-N 0 3 335.404 2.715 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)NCc1cccc(CN(C)C)c1 ZINC000277156167 273149220 /nfs/dbraw/zinc/14/92/20/273149220.db2.gz WXTUSMFPQSXLJI-UHFFFAOYSA-N 0 3 343.383 2.595 20 5 EFBDHN COc1cc(CNC[C@@H]2CCCCN2C2CC2)c([N+](=O)[O-])cc1OC ZINC000277505860 273158799 /nfs/dbraw/zinc/15/87/99/273158799.db2.gz QDRJMBWXSPXFJS-HNNXBMFYSA-N 0 3 349.431 2.719 20 5 EFBDHN C[C@H](CN1CCCC1=O)N[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000278989620 273163744 /nfs/dbraw/zinc/16/37/44/273163744.db2.gz DSRBRFWIRSNIEX-WBMJQRKESA-N 0 3 331.416 2.918 20 5 EFBDHN CCC(=O)N1CC[C@H](N[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000279058422 273171789 /nfs/dbraw/zinc/17/17/89/273171789.db2.gz KPLYRTZNXIFBST-LRDDRELGSA-N 0 3 331.416 2.918 20 5 EFBDHN CC1(C)C[C@@H](NCC2(C(N)=O)CCCC2)c2cc([N+](=O)[O-])ccc21 ZINC000279084964 273174941 /nfs/dbraw/zinc/17/49/41/273174941.db2.gz MZGRJLDUPLZTQP-OAHLLOKOSA-N 0 3 331.416 2.953 20 5 EFBDHN C[C@H](CN1CCOCC1)N[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000279156073 273182906 /nfs/dbraw/zinc/18/29/06/273182906.db2.gz TTYGUQGONQMEJX-CXAGYDPISA-N 0 3 333.432 2.628 20 5 EFBDHN CC1(C)C[C@@H](NC[C@@H](O)C2CCOCC2)c2cc([N+](=O)[O-])ccc21 ZINC000279212909 273189167 /nfs/dbraw/zinc/18/91/67/273189167.db2.gz YJVIOEBPJRVYAJ-IAGOWNOFSA-N 0 3 334.416 2.694 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2nc(CN[C@H]3CCC[C@H]3CCO)co2)cc1 ZINC000279254118 273193642 /nfs/dbraw/zinc/19/36/42/273193642.db2.gz LKZAIKIDHZRHPG-LRDDRELGSA-N 0 3 331.372 2.891 20 5 EFBDHN C[C@@H](CNC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N(C)C1CC1 ZINC000280733577 273360945 /nfs/dbraw/zinc/36/09/45/273360945.db2.gz VNTYZPPCHAALQV-VIFPVBQESA-N 0 3 343.786 2.529 20 5 EFBDHN COC[C@@H](CO)N[C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000280935536 273383094 /nfs/dbraw/zinc/38/30/94/273383094.db2.gz IMBIKNBBUHFASJ-NWDGAFQWSA-N 0 3 336.413 2.981 20 5 EFBDHN CN(C)C1(CNc2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)CCCC1 ZINC000281025467 273392989 /nfs/dbraw/zinc/39/29/89/273392989.db2.gz SRNCQCDLXWUZFY-UHFFFAOYSA-N 0 3 331.376 2.530 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)NCCN1CCCC[C@H]1CC ZINC000281034148 273393835 /nfs/dbraw/zinc/39/38/35/273393835.db2.gz VSUPJAYCAHEHDH-CQSZACIVSA-N 0 3 349.431 2.988 20 5 EFBDHN CNC(=O)[C@]1(C)CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000281045841 273394887 /nfs/dbraw/zinc/39/48/87/273394887.db2.gz HGYIPOLBGXKPKG-GOSISDBHSA-N 0 3 343.383 2.813 20 5 EFBDHN CC(C)N1C[C@H](N[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1=O ZINC000433280895 273538305 /nfs/dbraw/zinc/53/83/05/273538305.db2.gz GIXAEPOPNSPNEA-WBMJQRKESA-N 0 3 331.416 2.916 20 5 EFBDHN CN(C)CC(C)(C)NC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000411104478 273794057 /nfs/dbraw/zinc/79/40/57/273794057.db2.gz YBMVEPYPAFECHU-UHFFFAOYSA-N 0 3 333.310 2.684 20 5 EFBDHN COc1cccc([C@@H](O)CN[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000284100760 273797316 /nfs/dbraw/zinc/79/73/16/273797316.db2.gz MUKYKKWYLOZJFY-GTNSWQLSSA-N 0 3 331.372 2.570 20 5 EFBDHN CCO[C@@H]1C[C@H](N[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)[C@]12CCCO2 ZINC000284897738 273904019 /nfs/dbraw/zinc/90/40/19/273904019.db2.gz CDAGXGOVMNMILS-GLZXHMCRSA-N 0 3 335.404 2.554 20 5 EFBDHN C[C@H](N[C@@H]1CCCN(C(=O)N2CCCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000285142076 273949151 /nfs/dbraw/zinc/94/91/51/273949151.db2.gz OSNVQJFRAFZTJX-GOEBONIOSA-N 0 3 346.431 2.926 20 5 EFBDHN Cc1ccc(CNCCn2cc(Br)cn2)cc1[N+](=O)[O-] ZINC000285488596 274009928 /nfs/dbraw/zinc/00/99/28/274009928.db2.gz MCEBTOWNZDPPKL-UHFFFAOYSA-N 0 3 339.193 2.652 20 5 EFBDHN COC1([C@H](C)NCc2ccc(Cl)cc2[N+](=O)[O-])CCOCC1 ZINC000421022605 274015577 /nfs/dbraw/zinc/01/55/77/274015577.db2.gz AKLLMMMCQUDIRL-NSHDSACASA-N 0 3 328.796 2.922 20 5 EFBDHN COc1ccc(OCCN2CCSCC[C@H]2C)c([N+](=O)[O-])c1 ZINC000285966730 274108462 /nfs/dbraw/zinc/10/84/62/274108462.db2.gz DNFWSXOSSLXTLO-GFCCVEGCSA-N 0 3 326.418 2.810 20 5 EFBDHN CCCN(CCN1CCCCC1)C(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000286182165 274148932 /nfs/dbraw/zinc/14/89/32/274148932.db2.gz KZUNSYGZSJCZNV-UHFFFAOYSA-N 0 3 349.431 2.942 20 5 EFBDHN CCCN(CCN1CCCCC1)C(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000286346719 274182652 /nfs/dbraw/zinc/18/26/52/274182652.db2.gz WGMXIPUNDKWSPP-UHFFFAOYSA-N 0 3 334.420 2.515 20 5 EFBDHN C[C@@H](CN1CCC[C@H](C)C1)NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000342889752 274218516 /nfs/dbraw/zinc/21/85/16/274218516.db2.gz ZMEMNAVJDVGIEJ-STQMWFEESA-N 0 3 344.415 2.926 20 5 EFBDHN COc1cc(C(=O)N2CC[C@@H](N3CCCC3)[C@@H]2C)cc([N+](=O)[O-])c1C ZINC000287086727 274338554 /nfs/dbraw/zinc/33/85/54/274338554.db2.gz KSGMKTASSUAAIZ-DZGCQCFKSA-N 0 3 347.415 2.611 20 5 EFBDHN CS[C@H]1CN(c2c(F)cccc2[N+](=O)[O-])C[C@H]1N1CCCC1 ZINC000287107545 274344317 /nfs/dbraw/zinc/34/43/17/274344317.db2.gz ZLOBGVCQSWODIC-KGLIPLIRSA-N 0 3 325.409 2.750 20 5 EFBDHN C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000288218983 274550509 /nfs/dbraw/zinc/55/05/09/274550509.db2.gz DPNXOGWEDFTWIW-RHSMWYFYSA-N 0 3 345.443 2.958 20 5 EFBDHN C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000288564636 274619196 /nfs/dbraw/zinc/61/91/96/274619196.db2.gz WKTIYMYXCIBRBI-NWDGAFQWSA-N 0 3 337.807 2.947 20 5 EFBDHN CCCCO[C@@H]1C[C@@H](NCc2ccc(C(N)=O)cc2[N+](=O)[O-])C1(C)C ZINC000289352279 274745720 /nfs/dbraw/zinc/74/57/20/274745720.db2.gz NDFMCODRHCVWTQ-HZPDHXFCSA-N 0 3 349.431 2.767 20 5 EFBDHN Cc1ccc([C@@H](CNCc2ccccc2[N+](=O)[O-])N2CCOCC2)o1 ZINC000073052232 274756761 /nfs/dbraw/zinc/75/67/61/274756761.db2.gz PCZFOIKSIFGHJF-QGZVFWFLSA-N 0 3 345.399 2.659 20 5 EFBDHN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N1CC[C@@H](N2CCCCC2)C1 ZINC000264575940 274967529 /nfs/dbraw/zinc/96/75/29/274967529.db2.gz INUMWBIUOQZDGF-RCMYXZNBSA-N 0 3 329.400 2.695 20 5 EFBDHN O=C1CCc2cc([N+](=O)[O-])c(N3CC[C@H](N4CCCCC4)C3)cc2N1 ZINC000264543377 275018436 /nfs/dbraw/zinc/01/84/36/275018436.db2.gz BCZWMNPNJVDVJM-AWEZNQCLSA-N 0 3 344.415 2.544 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCN(CCO)[C@H]2CCc3ccccc32)c1 ZINC000114467063 275039625 /nfs/dbraw/zinc/03/96/25/275039625.db2.gz CGXQOPFNZVVBBD-IBGZPJMESA-N 0 3 342.395 2.955 20 5 EFBDHN C/C(=C/c1ccccc1)CN[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000192684695 275399036 /nfs/dbraw/zinc/39/90/36/275399036.db2.gz LSTAWHMHTDVCGO-CIMVEIJJSA-N 0 3 342.395 2.682 20 5 EFBDHN CCN(CCN1CCCCCC1)C(=O)c1cccc([N+](=O)[O-])c1N ZINC000346324637 276124837 /nfs/dbraw/zinc/12/48/37/276124837.db2.gz ACKGMUHBIMYXPJ-UHFFFAOYSA-N 0 3 334.420 2.515 20 5 EFBDHN CNC(=O)[C@@H]1CCC[C@H]1N[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433281436 277244192 /nfs/dbraw/zinc/24/41/92/277244192.db2.gz JECWGOYSLXSMST-WQVCFCJDSA-N 0 3 331.416 2.822 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H](C)CN1CCCCC1 ZINC000123130724 277390021 /nfs/dbraw/zinc/39/00/21/277390021.db2.gz MSRLKFCYZYHUSL-GFCCVEGCSA-N 0 3 336.392 2.599 20 5 EFBDHN CC(C)c1ccc(CN[C@H](C)CCN2CCOCC2)cc1[N+](=O)[O-] ZINC000076898005 278037486 /nfs/dbraw/zinc/03/74/86/278037486.db2.gz NSYQSYZEDOTYFD-OAHLLOKOSA-N 0 3 335.448 2.919 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CCN(C(C)C)C2)c1 ZINC000457106027 278174891 /nfs/dbraw/zinc/17/48/91/278174891.db2.gz CTQDCYFLEKTQJL-GFCCVEGCSA-N 0 3 337.445 2.871 20 5 EFBDHN C[C@H](CNC(=O)NCCc1ccccc1[N+](=O)[O-])N1CCC[C@@H](C)C1 ZINC000340940348 278202607 /nfs/dbraw/zinc/20/26/07/278202607.db2.gz RBCPWAWBLIOMOC-HUUCEWRRSA-N 0 3 348.447 2.557 20 5 EFBDHN C[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1)N(C)Cc1ccccc1 ZINC000110349774 278270210 /nfs/dbraw/zinc/27/02/10/278270210.db2.gz GDFBJHOQXVHNRN-HNNXBMFYSA-N 0 3 341.411 2.774 20 5 EFBDHN C[C@@H]1CN(CC2CCN(c3cc(N)ccc3[N+](=O)[O-])CC2)C[C@@H](C)O1 ZINC000192788867 278744467 /nfs/dbraw/zinc/74/44/67/278744467.db2.gz KYLFOYJGBCIWDS-ZIAGYGMSSA-N 0 3 348.447 2.503 20 5 EFBDHN C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000370636277 278899560 /nfs/dbraw/zinc/89/95/60/278899560.db2.gz SJHAMXRBVKHXDC-DGCLKSJQSA-N 0 3 337.807 2.947 20 5 EFBDHN Cc1nn(C)c(NC[C@H](c2cccs2)N2CCCC2)c1[N+](=O)[O-] ZINC000265221166 279200825 /nfs/dbraw/zinc/20/08/25/279200825.db2.gz GJJFGEZODGEIKB-GFCCVEGCSA-N 0 3 335.433 2.947 20 5 EFBDHN C[C@H](C(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1)N1[C@H](C)CC[C@@H]1C ZINC000359628197 279201585 /nfs/dbraw/zinc/20/15/85/279201585.db2.gz ZHKIGKWWAPPYPY-HZSPNIEDSA-N 0 3 347.415 2.577 20 5 EFBDHN CCO[C@@H]1COCC[C@H]1NCc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339089996 279797326 /nfs/dbraw/zinc/79/73/26/279797326.db2.gz FHKYAANKFBKKJN-ZIAGYGMSSA-N 0 3 348.321 2.897 20 5 EFBDHN CCOc1ncccc1CN[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000351505112 279985918 /nfs/dbraw/zinc/98/59/18/279985918.db2.gz ZPPSOLISPKKWTF-CABCVRRESA-N 0 3 345.403 2.859 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1C(=O)N1CCN([C@@H]2C[C@@H]2C)C[C@@H](C)C1 ZINC000346257711 281257074 /nfs/dbraw/zinc/25/70/74/281257074.db2.gz HBZMVHMCJIPUJO-IVMMDQJWSA-N 0 3 331.416 2.706 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H](C)CN1C[C@H](C)C[C@H](C)C1 ZINC000194484721 281258437 /nfs/dbraw/zinc/25/84/37/281258437.db2.gz IJCKOFFLEZHQRO-VNHYZAJKSA-N 0 3 333.432 2.999 20 5 EFBDHN CN1C[C@@H]2CCCN(c3cc(C(F)(F)F)ncc3[N+](=O)[O-])[C@@H]2C1 ZINC000425277365 290280909 /nfs/dbraw/zinc/28/09/09/290280909.db2.gz CRZZXPSECOPSLE-JOYOIKCWSA-N 0 3 330.310 2.539 20 5 EFBDHN CN(C)C[C@H]1CCCCN1C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000129381223 293132481 /nfs/dbraw/zinc/13/24/81/293132481.db2.gz NDYJHEOUMAVMMF-OAHLLOKOSA-N 0 3 344.415 2.561 20 5 EFBDHN C[C@@H]1C[C@@H](NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)CN1C1CC1 ZINC000130368395 293163278 /nfs/dbraw/zinc/16/32/78/293163278.db2.gz FPDADWFUYDDANY-TZMCWYRMSA-N 0 3 346.431 2.754 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](C)N(C)C1CC1 ZINC000132324938 293223937 /nfs/dbraw/zinc/22/39/37/293223937.db2.gz MILFLDMESFWNGG-NSHDSACASA-N 0 3 337.445 2.919 20 5 EFBDHN CCC[C@H](NC[C@H]1CC[C@@H](C(=O)N(C)C)O1)c1cccc([N+](=O)[O-])c1 ZINC000246041491 293651338 /nfs/dbraw/zinc/65/13/38/293651338.db2.gz NYIHFTOFASGZJN-IKGGRYGDSA-N 0 3 349.431 2.661 20 5 EFBDHN O=C([C@H]1CCN(C/C=C/c2ccccc2[N+](=O)[O-])C1)N1CCCC1 ZINC000290557508 294119577 /nfs/dbraw/zinc/11/95/77/294119577.db2.gz SCNIJEPIRZNGCQ-YERXGYGTSA-N 0 3 329.400 2.552 20 5 EFBDHN Cn1c(C(=O)N[C@H](CN2CCCC2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000345299384 294151477 /nfs/dbraw/zinc/15/14/77/294151477.db2.gz INPLLBWGZIMZMG-OAHLLOKOSA-N 0 3 342.399 2.500 20 5 EFBDHN CCCN(CC)C[C@@H](C)Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000290701090 294161756 /nfs/dbraw/zinc/16/17/56/294161756.db2.gz KPNZLFHAQRMHGM-GFCCVEGCSA-N 0 3 343.449 2.531 20 5 EFBDHN C[C@@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H](c1ccccc1)N(C)C ZINC000290920374 294220578 /nfs/dbraw/zinc/22/05/78/294220578.db2.gz IFQKSFFSSLQBDH-PXAZEXFGSA-N 0 3 342.399 2.797 20 5 EFBDHN COc1cc(CN[C@H](C2CC2)C(C)(C)CO)c([N+](=O)[O-])cc1F ZINC000293241528 294918333 /nfs/dbraw/zinc/91/83/33/294918333.db2.gz YZAXRTTUHCWJSF-OAHLLOKOSA-N 0 3 326.368 2.629 20 5 EFBDHN COc1cc(C(=O)N2CCN(C3CCC3)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000293720017 295035778 /nfs/dbraw/zinc/03/57/78/295035778.db2.gz PKRVEPGSAIDUNC-ZDUSSCGKSA-N 0 3 347.415 2.550 20 5 EFBDHN CCNC(=O)c1ccc(CN[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000293801288 295052743 /nfs/dbraw/zinc/05/27/43/295052743.db2.gz RDUAJEHETKXYST-LBPRGKRZSA-N 0 3 342.399 2.778 20 5 EFBDHN C[C@H](NC[C@]1(CO)C[C@@H]1c1ccccc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294016160 295098420 /nfs/dbraw/zinc/09/84/20/295098420.db2.gz DNUIYTRUNQZZPE-CRFBAAHOSA-N 0 3 341.411 2.994 20 5 EFBDHN CN1CCC[C@@]2(CCN(C(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000294190246 295125297 /nfs/dbraw/zinc/12/52/97/295125297.db2.gz PLUHURGOMNMOHX-LJQANCHMSA-N 0 3 345.443 2.817 20 5 EFBDHN CN1CCC[C@]2(CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])C2)C1 ZINC000294215255 295129324 /nfs/dbraw/zinc/12/93/24/295129324.db2.gz QTQCZRMTUQDEAS-DVBCCOPCSA-N 0 3 329.400 2.552 20 5 EFBDHN CC(C)(CCC(=O)N[C@H]1CCCN(Cc2ccccc2)C1)[N+](=O)[O-] ZINC000294329722 295148562 /nfs/dbraw/zinc/14/85/62/295148562.db2.gz DUCYGBMMTFUIDE-INIZCTEOSA-N 0 3 333.432 2.603 20 5 EFBDHN CC(C)(CCC(=O)NC[C@H](c1cccs1)N1CCCC1)[N+](=O)[O-] ZINC000294491255 295175281 /nfs/dbraw/zinc/17/52/81/295175281.db2.gz RJQQZNTVSHIUDT-CYBMUJFWSA-N 0 3 339.461 2.837 20 5 EFBDHN CN(C)[C@@H]1CCCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC000294733777 295217306 /nfs/dbraw/zinc/21/73/06/295217306.db2.gz XMKFNOJVHWUCJP-LLVKDONJSA-N 0 3 345.321 2.780 20 5 EFBDHN CN(C)[C@H]1CCCN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC000294733778 295217333 /nfs/dbraw/zinc/21/73/33/295217333.db2.gz XMKFNOJVHWUCJP-NSHDSACASA-N 0 3 345.321 2.780 20 5 EFBDHN CN(C(=O)CCC(C)(C)[N+](=O)[O-])[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000294794876 295228999 /nfs/dbraw/zinc/22/89/99/295228999.db2.gz BCBYZMMTXSPKAY-QGZVFWFLSA-N 0 3 347.459 2.945 20 5 EFBDHN Cc1nc(N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)ncc1[N+](=O)[O-] ZINC000294939233 295248581 /nfs/dbraw/zinc/24/85/81/295248581.db2.gz JOKLWZUOESBHAP-SWLSCSKDSA-N 0 3 327.388 2.626 20 5 EFBDHN CN(C(=O)CCC(C)(C)[N+](=O)[O-])C1CCN(Cc2ccccc2)CC1 ZINC000294995823 295255607 /nfs/dbraw/zinc/25/56/07/295255607.db2.gz VEAZODJPRNUTGT-UHFFFAOYSA-N 0 3 347.459 2.945 20 5 EFBDHN C[C@@H]1C[C@H](NC(=O)CCC(C)(C)[N+](=O)[O-])CCN1Cc1ccccc1 ZINC000295010727 295257310 /nfs/dbraw/zinc/25/73/10/295257310.db2.gz CRTMIEORZWNWAC-NVXWUHKLSA-N 0 3 347.459 2.991 20 5 EFBDHN CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2NCc1ccc([N+](=O)[O-])cc1 ZINC000295048595 295261636 /nfs/dbraw/zinc/26/16/36/295261636.db2.gz FMWIWOIVAJZHPX-FICVDOATSA-N 0 3 333.388 2.550 20 5 EFBDHN COC[C@@]1(C)CCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000295105672 295269057 /nfs/dbraw/zinc/26/90/57/295269057.db2.gz KXXYOBBLLDYMRG-SFHVURJKSA-N 0 3 344.415 2.854 20 5 EFBDHN COc1ccc2c(c1)ncc([N+](=O)[O-])c2NCC1=CCN(C)CC1 ZINC000295119123 295270207 /nfs/dbraw/zinc/27/02/07/295270207.db2.gz WNSCYQICZLBAMM-UHFFFAOYSA-N 0 3 328.372 2.825 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCC(CF)CC1 ZINC000295191479 295280238 /nfs/dbraw/zinc/28/02/38/295280238.db2.gz TWCHRJURJYYFFI-UHFFFAOYSA-N 0 3 339.367 2.614 20 5 EFBDHN C[C@H]1CN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CCN(C2CC2)C1 ZINC000295219143 295284029 /nfs/dbraw/zinc/28/40/29/295284029.db2.gz AGWZKMGATMKRHX-GFCCVEGCSA-N 0 3 342.399 2.632 20 5 EFBDHN CC[C@@H](C)N1CCN(Cc2cc(OC)c(OC)cc2[N+](=O)[O-])CC1 ZINC000295239351 295286681 /nfs/dbraw/zinc/28/66/81/295286681.db2.gz OUQONKGQPZCIER-CYBMUJFWSA-N 0 3 337.420 2.528 20 5 EFBDHN C[C@@H]1[C@@H](NC(=O)CCC(C)(C)[N+](=O)[O-])CCN1Cc1ccccc1 ZINC000295412767 295315856 /nfs/dbraw/zinc/31/58/56/295315856.db2.gz UMFHQMSLIOQXIW-ZBFHGGJFSA-N 0 3 333.432 2.601 20 5 EFBDHN CC(C)(C[C@@H]1CCCN(CCc2ccc([N+](=O)[O-])cc2)C1)C(N)=O ZINC000295518524 295334343 /nfs/dbraw/zinc/33/43/43/295334343.db2.gz IHWLIPFZRNSTEN-HNNXBMFYSA-N 0 3 333.432 2.751 20 5 EFBDHN CCOC(=O)c1cc(CNCCc2ccccc2[N+](=O)[O-])[nH]c1C ZINC000295688035 295360855 /nfs/dbraw/zinc/36/08/55/295360855.db2.gz LNJQSTMWHKWACL-UHFFFAOYSA-N 0 3 331.372 2.740 20 5 EFBDHN CN1CCC[C@]2(CCN(C(=O)c3ccc(Cl)c([N+](=O)[O-])c3)C2)C1 ZINC000295691200 295361286 /nfs/dbraw/zinc/36/12/86/295361286.db2.gz WOZABWJRPSZQJX-INIZCTEOSA-N 0 3 337.807 2.806 20 5 EFBDHN C[C@@H]1CN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CCN(C2CC2)C1 ZINC000295697807 295362596 /nfs/dbraw/zinc/36/25/96/295362596.db2.gz NVTYYPBNMFDSRQ-MDDUGHTDSA-N 0 3 329.400 2.551 20 5 EFBDHN Cc1nc(N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)ncc1[N+](=O)[O-] ZINC000295714645 295364691 /nfs/dbraw/zinc/36/46/91/295364691.db2.gz SJVAWVCMFTZLRR-UKRRQHHQSA-N 0 3 327.388 2.768 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)c([N+](=O)[O-])c1 ZINC000295908129 295395235 /nfs/dbraw/zinc/39/52/35/295395235.db2.gz HHGLSPHGRFDDPT-CFVMTHIKSA-N 0 3 333.344 2.550 20 5 EFBDHN C[C@H](NC(=O)NCCN1CCC(C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000296280100 295452002 /nfs/dbraw/zinc/45/20/02/295452002.db2.gz IYHHTIAKSNCCKO-AWEZNQCLSA-N 0 3 334.420 2.687 20 5 EFBDHN Cc1ccccc1[C@H]1CCCN1CCn1cc([N+](=O)[O-])ccc1=O ZINC000159765120 302217164 /nfs/dbraw/zinc/21/71/64/302217164.db2.gz UCYBWAZOEWMVOB-QGZVFWFLSA-N 0 3 327.384 2.902 20 5 EFBDHN CN(C)CC(C)(C)NCc1ccc(Br)cc1[N+](=O)[O-] ZINC000308610643 311227968 /nfs/dbraw/zinc/22/79/68/311227968.db2.gz WXRMMZXFPHNGRP-UHFFFAOYSA-N 0 3 330.226 2.787 20 5 EFBDHN C[C@@H](NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1CCOCC1 ZINC000179875880 310792639 /nfs/dbraw/zinc/79/26/39/310792639.db2.gz ZRJUHHBNTQIGPL-SNVBAGLBSA-N 0 3 341.795 2.591 20 5 EFBDHN CN(C)CC1(NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CCC1 ZINC000298735821 311019125 /nfs/dbraw/zinc/01/91/25/311019125.db2.gz SVKJQDGTRRDNMM-UHFFFAOYSA-N 0 3 345.321 2.828 20 5 EFBDHN CCN(CC)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])[nH]1)c1ccsc1 ZINC000298914400 311034337 /nfs/dbraw/zinc/03/43/37/311034337.db2.gz FNPMWRJDUCYLKE-ZDUSSCGKSA-N 0 3 336.417 2.797 20 5 EFBDHN C[C@@H]1CCCN(CCNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC000299055051 311046187 /nfs/dbraw/zinc/04/61/87/311046187.db2.gz TUNBGDLYXZJSRS-GFCCVEGCSA-N 0 3 330.388 2.538 20 5 EFBDHN CC1CCN(CCNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000299169693 311058455 /nfs/dbraw/zinc/05/84/55/311058455.db2.gz SGOYEBYZTJYDLV-UHFFFAOYSA-N 0 3 325.796 2.710 20 5 EFBDHN CN(C)CCN(CCCc1ccccc1)C(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000299260168 311066579 /nfs/dbraw/zinc/06/65/79/311066579.db2.gz BKXKXFMNTWJMDU-UHFFFAOYSA-N 0 3 344.415 2.560 20 5 EFBDHN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@@H]1CN1CCCC1 ZINC000299524789 311093341 /nfs/dbraw/zinc/09/33/41/311093341.db2.gz LVCNRGXIMFLFII-CYBMUJFWSA-N 0 3 337.807 2.949 20 5 EFBDHN O=C(CCN[C@@H](CCO)c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000299585253 311099636 /nfs/dbraw/zinc/09/96/36/311099636.db2.gz HWWDFCWTBVFQRT-HNNXBMFYSA-N 0 3 343.383 2.637 20 5 EFBDHN C[C@@H](CN1CCCCC1)Nc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000301093089 311118384 /nfs/dbraw/zinc/11/83/84/311118384.db2.gz LVGDLQGDPJCHOJ-NSHDSACASA-N 0 3 331.376 2.530 20 5 EFBDHN CCN1CCN([C@@H](C)CNc2cc(C)c([N+](=O)[O-])cc2Cl)CC1 ZINC000301502083 311141146 /nfs/dbraw/zinc/14/11/46/311141146.db2.gz FIEIEGUGBCJWQS-ZDUSSCGKSA-N 0 3 340.855 2.995 20 5 EFBDHN CCOc1cc(N2CCC(CN3CCOCC3)CC2)ccc1[N+](=O)[O-] ZINC000301532525 311142902 /nfs/dbraw/zinc/14/29/02/311142902.db2.gz PYESHHWUDDWHMG-UHFFFAOYSA-N 0 3 349.431 2.542 20 5 EFBDHN CC1CCN(C[C@H](O)CNc2ccc3cc([N+](=O)[O-])ccc3n2)CC1 ZINC000301547857 311143665 /nfs/dbraw/zinc/14/36/65/311143665.db2.gz PPFHFADMKDYCPP-MRXNPFEDSA-N 0 3 344.415 2.648 20 5 EFBDHN C[C@@H]1CCCN(CCNc2ncc(Br)cc2[N+](=O)[O-])C1 ZINC000301714239 311154402 /nfs/dbraw/zinc/15/44/02/311154402.db2.gz ZGFVKDSMVIJOOD-SNVBAGLBSA-N 0 3 343.225 2.896 20 5 EFBDHN O=[N+]([O-])c1ccc(NC2CCN([C@@H]3CCOC3)CC2)c(Cl)c1 ZINC000301742152 311155855 /nfs/dbraw/zinc/15/58/55/311155855.db2.gz YMHZHHKJEFBSLY-CYBMUJFWSA-N 0 3 325.796 2.913 20 5 EFBDHN Cc1ccc(NC[C@@H]2C[C@H](O)CN2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000301887318 311164906 /nfs/dbraw/zinc/16/49/06/311164906.db2.gz QQLWKKPAHZTKHF-IRXDYDNUSA-N 0 3 341.411 2.951 20 5 EFBDHN Cc1ccc(NC[C@H]2C[C@@H](O)CN2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000301887317 311164936 /nfs/dbraw/zinc/16/49/36/311164936.db2.gz QQLWKKPAHZTKHF-IAGOWNOFSA-N 0 3 341.411 2.951 20 5 EFBDHN Cc1ccc(NC[C@H]2C[C@H](O)CN2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000301887319 311165036 /nfs/dbraw/zinc/16/50/36/311165036.db2.gz QQLWKKPAHZTKHF-SJORKVTESA-N 0 3 341.411 2.951 20 5 EFBDHN COCCN1CCC(Nc2cc(C)nc3c2cccc3[N+](=O)[O-])CC1 ZINC000302034298 311173594 /nfs/dbraw/zinc/17/35/94/311173594.db2.gz UCTYDRSEGCOHRC-UHFFFAOYSA-N 0 3 344.415 2.974 20 5 EFBDHN Cc1cc(N[C@@H](C)[C@@H](C)N2CCOCC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302212664 311185035 /nfs/dbraw/zinc/18/50/35/311185035.db2.gz YYDQZYBDNUARCZ-UONOGXRCSA-N 0 3 344.415 2.973 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN(CCCO)[C@H]2CCCc3ccccc32)c1 ZINC000304736920 311213191 /nfs/dbraw/zinc/21/31/91/311213191.db2.gz AGJMNGBKKZGDBD-SFHVURJKSA-N 0 3 344.415 2.553 20 5 EFBDHN C[C@H](NC(=O)[C@@H]1CNCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000325645746 311243300 /nfs/dbraw/zinc/24/33/00/311243300.db2.gz XJRCYPTUJRREGT-YVEFUNNKSA-N 0 3 325.368 2.659 20 5 EFBDHN C[C@H](NC(=O)[C@H]1CNCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000325645744 311243334 /nfs/dbraw/zinc/24/33/34/311243334.db2.gz XJRCYPTUJRREGT-SJCJKPOMSA-N 0 3 325.368 2.659 20 5 EFBDHN C[C@@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000330596883 311323762 /nfs/dbraw/zinc/32/37/62/311323762.db2.gz VUYYCCVOWSVBCQ-TUAOUCFPSA-N 0 3 325.434 2.753 20 5 EFBDHN CCN1C[C@@H](C)N(CCC(=O)Nc2cccc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000330802507 311335714 /nfs/dbraw/zinc/33/57/14/311335714.db2.gz AUUYQBIZJUHOHC-OKILXGFUSA-N 0 3 348.447 2.646 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCN(C)[C@@H](C)C1 ZINC000330897760 311342330 /nfs/dbraw/zinc/34/23/30/311342330.db2.gz HVBTUVJEXSYZDS-AVGNSLFASA-N 0 3 337.445 2.674 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCN(C)C[C@H]1C(C)C ZINC000331002076 311348107 /nfs/dbraw/zinc/34/81/07/311348107.db2.gz QVOWLZUMQUQXIG-KRWDZBQOSA-N 0 3 348.447 2.504 20 5 EFBDHN Cc1c(NC(=O)CCN2CCN(C)C[C@H]2C(C)C)cccc1[N+](=O)[O-] ZINC000330998977 311348177 /nfs/dbraw/zinc/34/81/77/311348177.db2.gz PRCZUYIQIFHGAO-KRWDZBQOSA-N 0 3 348.447 2.504 20 5 EFBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@H](c2ccnc(N)n2)C1 ZINC000331623392 311398634 /nfs/dbraw/zinc/39/86/34/311398634.db2.gz YCQJIIGNWQXEIU-JSGCOSHPSA-N 0 3 327.388 2.738 20 5 EFBDHN C[C@H](C(=O)N1C[C@@H](N2CCCC2)C[C@@H]1C)c1ccc([N+](=O)[O-])cc1F ZINC000331874265 311429173 /nfs/dbraw/zinc/42/91/73/311429173.db2.gz BWPFCIYXUMUBHR-YDHLFZDLSA-N 0 3 349.406 2.923 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1C[C@H](N2CCCC2)C[C@@H]1C ZINC000332083670 311452303 /nfs/dbraw/zinc/45/23/03/311452303.db2.gz PBAZGGIMQLZDIG-LSDHHAIUSA-N 0 3 331.416 2.910 20 5 EFBDHN CC[C@@H]1C[C@H](CN2CCN(c3ccccc3[N+](=O)[O-])CC2)CCO1 ZINC000332399341 311498979 /nfs/dbraw/zinc/49/89/79/311498979.db2.gz RNAXZFMCLOMHOW-HZPDHXFCSA-N 0 3 333.432 2.922 20 5 EFBDHN CCc1ccccc1[C@H](N)CNCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000415066233 312087126 /nfs/dbraw/zinc/08/71/26/312087126.db2.gz OFEDOLVCXRKBJB-MRXNPFEDSA-N 0 3 329.400 2.955 20 5 EFBDHN CNCc1cccc(NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000415942580 312182356 /nfs/dbraw/zinc/18/23/56/312182356.db2.gz JTQJHUXAPZUUAE-UHFFFAOYSA-N 0 3 340.383 2.904 20 5 EFBDHN COCCN1CC[C@@H](N[C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417304779 312206478 /nfs/dbraw/zinc/20/64/78/312206478.db2.gz FOGGAWCMTZAHIT-CRAIPNDOSA-N 0 3 333.432 2.673 20 5 EFBDHN CNC(=O)[C@@H]1CCC[C@H]1N[C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417309770 312206893 /nfs/dbraw/zinc/20/68/93/312206893.db2.gz KAPOYHLJOYUMAV-DJIMGWMZSA-N 0 3 331.416 2.867 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](NC[C@H]1CN(C3CC3)CCO1)CCCC2 ZINC000417311210 312207330 /nfs/dbraw/zinc/20/73/30/312207330.db2.gz OAELQKGCHJFLKY-PKOBYXMFSA-N 0 3 345.443 2.815 20 5 EFBDHN CC(C)COC[C@H](O)CN[C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417335805 312210719 /nfs/dbraw/zinc/21/07/19/312210719.db2.gz GSIJSWLCDBEXKM-SJLPKXTDSA-N 0 3 336.432 2.985 20 5 EFBDHN C[C@H](CN1CCCC1=O)N[C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417345387 312212183 /nfs/dbraw/zinc/21/21/83/312212183.db2.gz UHQSDYDLTLYDDQ-CXAGYDPISA-N 0 3 331.416 2.963 20 5 EFBDHN CCS(=O)(=O)CCCN[C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417366217 312214920 /nfs/dbraw/zinc/21/49/20/312214920.db2.gz NETMMJGFISCGNX-INIZCTEOSA-N 0 3 340.445 2.777 20 5 EFBDHN CC(C)COC[C@H](O)CN[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433144767 312595958 /nfs/dbraw/zinc/59/59/58/312595958.db2.gz NSOICTFJUDVBCN-PBHICJAKSA-N 0 3 336.432 2.940 20 5 EFBDHN C[C@@H]1COCCN1CCN[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433168291 312597360 /nfs/dbraw/zinc/59/73/60/312597360.db2.gz MGIKHNCTDZULCR-CXAGYDPISA-N 0 3 333.432 2.628 20 5 EFBDHN C[C@@H]1CC[C@@H](CNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)O1 ZINC000453635370 312922480 /nfs/dbraw/zinc/92/24/80/312922480.db2.gz USDPLRAPXISLEK-WBMJQRKESA-N 0 3 330.388 2.652 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@](C)(CO)C1CCCCC1 ZINC000471229324 313140864 /nfs/dbraw/zinc/14/08/64/313140864.db2.gz WVQUPPFBEDOENS-GOSISDBHSA-N 0 3 349.431 2.763 20 5 EFBDHN CC[C@H]1C[C@H](C)CN1Cc1ccc(OCC(=O)OC)c([N+](=O)[O-])c1 ZINC000475703712 313225063 /nfs/dbraw/zinc/22/50/63/313225063.db2.gz YAOGKIZRDZEOEM-JSGCOSHPSA-N 0 3 336.388 2.767 20 5 EFBDHN COc1c(C(=O)NC[C@@H]2CCCCN2CC(C)C)cccc1[N+](=O)[O-] ZINC000476395998 313232931 /nfs/dbraw/zinc/23/29/31/313232931.db2.gz KBJBCEPFLHZWOT-AWEZNQCLSA-N 0 3 349.431 2.844 20 5 EFBDHN CC(C)[C@H]1CN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)CCN1C ZINC000487059138 313361780 /nfs/dbraw/zinc/36/17/80/313361780.db2.gz ISKVRFYNFIMFNS-CYBMUJFWSA-N 0 3 329.347 2.973 20 5 EFBDHN CN(C)Cc1ccccc1C(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000488363629 313477668 /nfs/dbraw/zinc/47/76/68/313477668.db2.gz GGKNSUIPNCSFHC-UHFFFAOYSA-N 0 3 341.411 2.971 20 5 EFBDHN CN(C)CC1(NC(=O)/C=C\c2ccc(Cl)c([N+](=O)[O-])c2)CCC1 ZINC000492617932 314059335 /nfs/dbraw/zinc/05/93/35/314059335.db2.gz NQVKMQLLEGRFGW-ALCCZGGFSA-N 0 3 337.807 2.862 20 5 EFBDHN CCOc1cc(CN(C[C@H](C)C(=O)OC)C2CC2)ccc1[N+](=O)[O-] ZINC000492693960 314088755 /nfs/dbraw/zinc/08/87/55/314088755.db2.gz AUQRBEYJVDCUKI-LBPRGKRZSA-N 0 3 336.388 2.767 20 5 EFBDHN C[C@H]1CN(C(=O)/C=C/c2cccc([N+](=O)[O-])c2)CCN(C2CCC2)C1 ZINC000492803914 314132447 /nfs/dbraw/zinc/13/24/47/314132447.db2.gz WASZIXUZIDILLL-XVJNWHFHSA-N 0 3 343.427 2.941 20 5 EFBDHN C[C@H]1C[C@H]1N1CCN(C(=O)/C=C\c2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000492922255 314178049 /nfs/dbraw/zinc/17/80/49/314178049.db2.gz MXXFZJISGOHCRB-VJONKGRXSA-N 0 3 343.427 2.797 20 5 EFBDHN CC[C@@H](NC(=O)N1CCN(C)CC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000493046049 314222085 /nfs/dbraw/zinc/22/20/85/314222085.db2.gz DBLVTFSQKHBCFP-XJKSGUPXSA-N 0 3 334.420 2.782 20 5 EFBDHN CN1CCC[C@]2(CCN(C(=O)/C=C\c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000493170123 314264663 /nfs/dbraw/zinc/26/46/63/314264663.db2.gz XEIKCOPDEYEYAA-MTIYJEKLSA-N 0 3 329.400 2.552 20 5 EFBDHN C[C@H]1CN(C(=O)/C=C/c2cccc([N+](=O)[O-])c2)CCN(C2CC2)C1 ZINC000493169734 314265040 /nfs/dbraw/zinc/26/50/40/314265040.db2.gz HBVTXHXPIXJMNJ-LHRNQBEKSA-N 0 3 329.400 2.551 20 5 EFBDHN CSC1(CNC(=O)/C=C/c2ccccc2[N+](=O)[O-])CCN(C)CC1 ZINC000493681967 314443203 /nfs/dbraw/zinc/44/32/03/314443203.db2.gz AFMQANRCWRODRM-BQYQJAHWSA-N 0 3 349.456 2.552 20 5 EFBDHN COC(=O)N1CCC[C@H]([C@@H](C)NCc2csc([N+](=O)[O-])c2)C1 ZINC000495479704 314729164 /nfs/dbraw/zinc/72/91/64/314729164.db2.gz JAASHGRJLIHBOM-PWSUYJOCSA-N 0 3 327.406 2.613 20 5 EFBDHN COC(=O)N1CCC[C@H]([C@@H](C)NCc2ccc([N+](=O)[O-])cc2F)C1 ZINC000495567058 314758917 /nfs/dbraw/zinc/75/89/17/314758917.db2.gz SKVTUXPVYSELOY-YPMHNXCESA-N 0 3 339.367 2.690 20 5 EFBDHN COC(=O)N1CCC([C@@H](C)NCc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000496668721 315151262 /nfs/dbraw/zinc/15/12/62/315151262.db2.gz SPLXDQFKCLNIFY-LLVKDONJSA-N 0 3 339.367 2.690 20 5 EFBDHN CCOC(=O)c1cc(N2C[C@@H](C)N(CC)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000497515447 315393393 /nfs/dbraw/zinc/39/33/93/315393393.db2.gz MVUMMAWYAPGXDS-OLZOCXBDSA-N 0 3 335.404 2.690 20 5 EFBDHN C[C@H](C(=O)N(C)[C@@H](C)C1CCN(C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000515115629 315593087 /nfs/dbraw/zinc/59/30/87/315593087.db2.gz ARMHUXXESXBWIG-KBPBESRZSA-N 0 3 333.432 2.887 20 5 EFBDHN CCN(CC)[C@@H](CNC(=O)c1cc([N+](=O)[O-])cn1C)c1ccccc1 ZINC000515176978 315597882 /nfs/dbraw/zinc/59/78/82/315597882.db2.gz BAJQHXUNIJHLTC-KRWDZBQOSA-N 0 3 344.415 2.746 20 5 EFBDHN O=C(CCN[C@H]1COc2ccccc2C1)Nc1ccccc1[N+](=O)[O-] ZINC000519141345 315846500 /nfs/dbraw/zinc/84/65/00/315846500.db2.gz AMIHRBRGNUDPQO-CQSZACIVSA-N 0 3 341.367 2.517 20 5 EFBDHN CNc1ccc(C(=O)N2CCCN(C3CCCC3)CC2)cc1[N+](=O)[O-] ZINC000523392981 316120383 /nfs/dbraw/zinc/12/03/83/316120383.db2.gz KIHGWPXHUSVJTB-UHFFFAOYSA-N 0 3 346.431 2.727 20 5 EFBDHN COC(=O)CCC1CCN(CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000531241435 317239961 /nfs/dbraw/zinc/23/99/61/317239961.db2.gz OYNXIWXBBXUFFV-UHFFFAOYSA-N 0 3 336.388 2.639 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H]1CN(CC(C)C)CCO1 ZINC000531931488 317334026 /nfs/dbraw/zinc/33/40/26/317334026.db2.gz OMUAXRBRAYHNPC-NVXWUHKLSA-N 0 3 335.448 2.911 20 5 EFBDHN CN(C)C[C@H]1CCCCN1C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000534248282 317536631 /nfs/dbraw/zinc/53/66/31/317536631.db2.gz UDNQKOVTHNNNPO-GFCCVEGCSA-N 0 3 330.388 2.632 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCN(C[C@@H]3C[C@H]3c3ccccc3)CC2)cn1 ZINC000535785714 317611439 /nfs/dbraw/zinc/61/14/39/317611439.db2.gz BOOTXQAUDMGIJU-WMZOPIPTSA-N 0 3 338.411 2.916 20 5 EFBDHN CCN(C[C@H]1CCCN1CC)C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000547798283 318043356 /nfs/dbraw/zinc/04/33/56/318043356.db2.gz WSWLJRXNQFMHNK-QGZVFWFLSA-N 0 3 333.432 2.860 20 5 EFBDHN CCN(C[C@@H]1CCCN1CC)C(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000547798153 318043364 /nfs/dbraw/zinc/04/33/64/318043364.db2.gz WYTJHBAKCSWSBP-AWEZNQCLSA-N 0 3 335.404 2.550 20 5 EFBDHN CCN(C[C@H]1CCCN1CC)C(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000548454783 318109847 /nfs/dbraw/zinc/10/98/47/318109847.db2.gz CDIAPHCGADZHJS-GFCCVEGCSA-N 0 3 325.434 2.911 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@@H]2CCc3cc(F)ccc32)c1 ZINC000552030986 318238598 /nfs/dbraw/zinc/23/85/98/318238598.db2.gz ZAXAFDJHFNBOJG-CRAIPNDOSA-N 0 3 346.358 2.751 20 5 EFBDHN CN(CCCN(C)C(=O)c1ccc([N+](=O)[O-])s1)Cc1ccncc1 ZINC000552112212 318243117 /nfs/dbraw/zinc/24/31/17/318243117.db2.gz SDKFUOHSFHFRQH-UHFFFAOYSA-N 0 3 348.428 2.645 20 5 EFBDHN CN(CCCN(C)C(=O)c1cccc([N+](=O)[O-])c1)Cc1ccncc1 ZINC000552112697 318243257 /nfs/dbraw/zinc/24/32/57/318243257.db2.gz PZWYXKVNGHRBJP-UHFFFAOYSA-N 0 3 342.399 2.584 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(C)cc1N[C@H]1C[C@H](C)N(C2CC2)C1 ZINC000553448052 318283672 /nfs/dbraw/zinc/28/36/72/318283672.db2.gz MDPKSOSJPHEFHB-RYUDHWBXSA-N 0 3 333.388 2.727 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(C)cc1N[C@H]1C[C@@H](C)N(C2CC2)C1 ZINC000553448050 318283701 /nfs/dbraw/zinc/28/37/01/318283701.db2.gz MDPKSOSJPHEFHB-NEPJUHHUSA-N 0 3 333.388 2.727 20 5 EFBDHN CCCCN(C)CCNC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000553997152 318298667 /nfs/dbraw/zinc/29/86/67/318298667.db2.gz VBCHPPKGEHIOJC-UHFFFAOYSA-N 0 3 336.436 2.511 20 5 EFBDHN C[C@@H](C(=O)N1CCN([C@H]2C[C@H]2C)C[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000554113788 318301379 /nfs/dbraw/zinc/30/13/79/318301379.db2.gz XKLNIDURGLVNNL-BORJPKMPSA-N 0 3 345.443 2.887 20 5 EFBDHN C[C@@H](C(=O)N1CCN([C@@H]2C[C@@H]2C)C[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000554113790 318301477 /nfs/dbraw/zinc/30/14/77/318301477.db2.gz XKLNIDURGLVNNL-OIPACUDHSA-N 0 3 345.443 2.887 20 5 EFBDHN Cc1ccc(OCCNCCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000554527247 318320949 /nfs/dbraw/zinc/32/09/49/318320949.db2.gz RUDJVWUGHQPZMZ-UHFFFAOYSA-N 0 3 343.383 2.900 20 5 EFBDHN O=[N+]([O-])c1ccn(C2CCN(C[C@@H]3CCC4(CCCC4)O3)CC2)n1 ZINC000558743743 318491039 /nfs/dbraw/zinc/49/10/39/318491039.db2.gz ZTPLCJUIJQTUHD-HNNXBMFYSA-N 0 3 334.420 2.920 20 5 EFBDHN C[C@@H](C(=O)N1CC[C@H](N2CCCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000562300319 318632419 /nfs/dbraw/zinc/63/24/19/318632419.db2.gz KFEWPJKDSSJQKI-PBHICJAKSA-N 0 3 331.416 2.785 20 5 EFBDHN O=C(CCN[C@@H]1CCCc2ccc([N+](=O)[O-])cc21)Nc1ccccn1 ZINC000562592736 318668414 /nfs/dbraw/zinc/66/84/14/318668414.db2.gz VFRMHGUTZCBHLN-MRXNPFEDSA-N 0 3 340.383 2.986 20 5 EFBDHN CC(C)(CNCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C1CCC1 ZINC000564650823 318877632 /nfs/dbraw/zinc/87/76/32/318877632.db2.gz DQBHXIFHRDQGEK-UHFFFAOYSA-N 0 3 340.445 2.784 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@@H]2C[C@H]2c2ccccc2F)c1 ZINC000564652251 318878061 /nfs/dbraw/zinc/87/80/61/318878061.db2.gz WFPQEHQZVWOHNC-QANKJYHBSA-N 0 3 346.358 2.619 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@H]2CCc3ccc(F)cc32)c1 ZINC000564792530 318892094 /nfs/dbraw/zinc/89/20/94/318892094.db2.gz JTGNEGZWEVFIJS-YJBOKZPZSA-N 0 3 346.358 2.751 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](N)Cc3ccccc32)c1 ZINC000566103717 319032750 /nfs/dbraw/zinc/03/27/50/319032750.db2.gz HTJKYQJXJCFLDV-CYBMUJFWSA-N 0 3 341.367 2.524 20 5 EFBDHN CC1(CNCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CCCCC1 ZINC000566112555 319034303 /nfs/dbraw/zinc/03/43/03/319034303.db2.gz PMSISDYFFQMSJS-UHFFFAOYSA-N 0 3 340.445 2.929 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2NC[C@H](O)COc1ccc(F)cc1 ZINC000566476049 319082149 /nfs/dbraw/zinc/08/21/49/319082149.db2.gz SGIZUQFWXPONFO-SUMWQHHRSA-N 0 3 346.358 2.751 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@H]2CCCc3occc32)c1 ZINC000567464491 319174014 /nfs/dbraw/zinc/17/40/14/319174014.db2.gz VRIJEAXNUJEHMH-BBRMVZONSA-N 0 3 332.356 2.595 20 5 EFBDHN CO[C@H](CNCCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000567891843 319222506 /nfs/dbraw/zinc/22/25/06/319222506.db2.gz WJUXOCKWKLJNDF-QGZVFWFLSA-N 0 3 343.383 2.901 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)[C@H]2CNCc3ccccc32)cc1[N+](=O)[O-] ZINC000568390429 319279608 /nfs/dbraw/zinc/27/96/08/319279608.db2.gz MUTRUIITOKUGCE-DYVFJYSZSA-N 0 3 339.395 2.967 20 5 EFBDHN CN(C)c1ccc(CN[C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cn1 ZINC000568589264 319297095 /nfs/dbraw/zinc/29/70/95/319297095.db2.gz CLCNOMZDWUXESN-LSDHHAIUSA-N 0 3 344.419 2.526 20 5 EFBDHN CSc1ccc(OC[C@@H](O)CNCc2cccc([N+](=O)[O-])c2)cc1 ZINC000569095557 319347907 /nfs/dbraw/zinc/34/79/07/319347907.db2.gz SGOWXFAIYIOKQZ-HNNXBMFYSA-N 0 3 348.424 2.846 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCc1ccc(Cl)s1 ZINC000570963805 319530011 /nfs/dbraw/zinc/53/00/11/319530011.db2.gz SKMZSRBLUAJEQZ-JTQLQIEISA-N 0 3 342.804 2.839 20 5 EFBDHN CCn1nc(C)c(CN[C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c1C ZINC000575127162 319927523 /nfs/dbraw/zinc/92/75/23/319927523.db2.gz WCEUNUZBLFWJLI-JKSUJKDBSA-N 0 3 346.435 2.898 20 5 EFBDHN Cc1cc(CNCCC(=O)Nc2ccccc2[N+](=O)[O-])cc(C)n1 ZINC000576576401 320028770 /nfs/dbraw/zinc/02/87/70/320028770.db2.gz AXLUXZBXVDGRCF-UHFFFAOYSA-N 0 3 328.372 2.725 20 5 EFBDHN COc1ccc(CNC[C@H](O)[C@@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000578725746 320232805 /nfs/dbraw/zinc/23/28/05/320232805.db2.gz VWOLWCVFKMEGQE-GUYCJALGSA-N 0 3 330.384 2.858 20 5 EFBDHN Cc1ccc([C@@H](C)NC[C@@H](O)COCc2ccco2)cc1[N+](=O)[O-] ZINC000181840302 323253116 /nfs/dbraw/zinc/25/31/16/323253116.db2.gz PZRHUJJGQSGNLR-UKRRQHHQSA-N 0 3 334.372 2.725 20 5 EFBDHN C[C@H]1Cc2ccccc2CN1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000181912394 323255175 /nfs/dbraw/zinc/25/51/75/323255175.db2.gz MLYFAARCKVCOKM-YOEHRIQHSA-N 0 3 342.395 2.781 20 5 EFBDHN CC(C)[C@H](NCCn1cc([N+](=O)[O-])cn1)c1ccc2c(c1)OCCO2 ZINC000181974010 323258109 /nfs/dbraw/zinc/25/81/09/323258109.db2.gz DARFOOVXTSCBGT-KRWDZBQOSA-N 0 3 346.387 2.549 20 5 EFBDHN COc1ccc([C@H](CCO)NCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000182378658 323280683 /nfs/dbraw/zinc/28/06/83/323280683.db2.gz QMRIUELFKQXLEJ-SFHVURJKSA-N 0 3 346.383 2.696 20 5 EFBDHN CC[C@H](NC[C@@H](O)COc1ccccc1[N+](=O)[O-])c1c(C)noc1C ZINC000182519268 323287373 /nfs/dbraw/zinc/28/73/73/323287373.db2.gz ZLNYUYOJLIITOT-KGLIPLIRSA-N 0 3 349.387 2.680 20 5 EFBDHN CCC[C@H](NC[C@H]1CC[C@H](C(=O)N(C)C)O1)c1cccc([N+](=O)[O-])c1 ZINC000183471466 323336238 /nfs/dbraw/zinc/33/62/38/323336238.db2.gz NYIHFTOFASGZJN-IXDOHACOSA-N 0 3 349.431 2.661 20 5 EFBDHN C[C@@H](C(=O)N1CCCC[C@H]1CN(C)C)c1ccc([N+](=O)[O-])cc1F ZINC000185129976 323384513 /nfs/dbraw/zinc/38/45/13/323384513.db2.gz PHHUUSLIGQEOJX-OCCSQVGLSA-N 0 3 337.395 2.780 20 5 EFBDHN COC(=O)COc1ccc(CN[C@H]2CCC[C@@H](F)C2)cc1[N+](=O)[O-] ZINC000580193535 324118291 /nfs/dbraw/zinc/11/82/91/324118291.db2.gz HHVPVAFVTNKEMX-OLZOCXBDSA-N 0 3 340.351 2.517 20 5 EFBDHN C[C@H]1CN(CCN[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CCO1 ZINC000580390674 324151636 /nfs/dbraw/zinc/15/16/36/324151636.db2.gz WCDMHQCNQSKTAP-SUMWQHHRSA-N 0 3 333.432 2.628 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2ccc(Cl)s2)c1 ZINC000580667397 324209959 /nfs/dbraw/zinc/20/99/59/324209959.db2.gz QKOLLCIRYYMGDB-NSHDSACASA-N 0 3 342.804 2.839 20 5 EFBDHN COc1ccc(CN2C[C@@H](c3cnn(C)c3)C(C)(C)C2)cc1[N+](=O)[O-] ZINC000580782267 324235076 /nfs/dbraw/zinc/23/50/76/324235076.db2.gz BHVGTAQDUQXUJU-HNNXBMFYSA-N 0 3 344.415 2.963 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2N[C@@H](CO)Cc1ccc(F)cc1 ZINC000581200516 324328222 /nfs/dbraw/zinc/32/82/22/324328222.db2.gz QTNHRLDZGWNOFK-RHSMWYFYSA-N 0 3 330.359 2.914 20 5 EFBDHN Cc1ccc(NCCCNC[C@](C)(O)C(F)(F)F)c([N+](=O)[O-])c1 ZINC000581603440 324417636 /nfs/dbraw/zinc/41/76/36/324417636.db2.gz XGBFYKPVBPOFIX-ZDUSSCGKSA-N 0 3 335.326 2.608 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2)CN1Cc1ccccc1 ZINC000137441652 473206694 /nfs/dbraw/zinc/20/66/94/473206694.db2.gz ADMOBDGBBURAIY-WMLDXEAASA-N 0 3 339.395 2.988 20 5 EFBDHN CCN1CCN([C@H](C)CNc2ccc3cc([N+](=O)[O-])ccc3n2)CC1 ZINC000095407766 473198872 /nfs/dbraw/zinc/19/88/72/473198872.db2.gz STSBHYDPFIGNBK-CQSZACIVSA-N 0 3 343.431 2.581 20 5 EFBDHN CCN1CCN(CCCNc2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000112074241 473241032 /nfs/dbraw/zinc/24/10/32/473241032.db2.gz CZLBOAKNYCONEF-UHFFFAOYSA-N 0 3 343.431 2.583 20 5 EFBDHN CCOc1ccc([C@@H](C)N[C@@H]2CCc3nc(C)nn3C2)cc1[N+](=O)[O-] ZINC000095982157 473241806 /nfs/dbraw/zinc/24/18/06/473241806.db2.gz XKQQNPDYCCUQJA-BXUZGUMPSA-N 0 3 345.403 2.559 20 5 EFBDHN CCCCN(C)CCNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000112309485 473255493 /nfs/dbraw/zinc/25/54/93/473255493.db2.gz PKKYZJJFWJSDCX-UHFFFAOYSA-N 0 3 334.420 2.631 20 5 EFBDHN CN[C@@H](CC(C)(C)C)C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000517134366 468072404 /nfs/dbraw/zinc/07/24/04/468072404.db2.gz NGQVHCVXEKYAGV-AWEZNQCLSA-N 0 3 345.403 2.948 20 5 EFBDHN C[C@H](CCc1ccccc1[N+](=O)[O-])N[C@@H](C)C(=O)NCc1ccco1 ZINC000162022464 473295810 /nfs/dbraw/zinc/29/58/10/473295810.db2.gz NTKFTAVOQNKZAJ-KGLIPLIRSA-N 0 3 345.399 2.803 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CN1C1CC1 ZINC000177100490 473306405 /nfs/dbraw/zinc/30/64/05/473306405.db2.gz GFPGHHXJIFDSQC-JQWIXIFHSA-N 0 3 337.807 2.532 20 5 EFBDHN Cc1cc(C(=O)NCCCCN2C[C@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000083026504 473312656 /nfs/dbraw/zinc/31/26/56/473312656.db2.gz DKLOJAGREUQPBM-GJZGRUSLSA-N 0 3 349.431 2.522 20 5 EFBDHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1ccccc1[N+](=O)[O-] ZINC000112820983 473317342 /nfs/dbraw/zinc/31/73/42/473317342.db2.gz DZCCVSTZACPQNV-UHFFFAOYSA-N 0 3 345.374 2.938 20 5 EFBDHN CC1(C)CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CC(C)(C)O1 ZINC000190564532 473321294 /nfs/dbraw/zinc/32/12/94/473321294.db2.gz YCKZKZVITYKGRP-UHFFFAOYSA-N 0 3 335.404 2.813 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2C[C@H](C)N(C3CC3)C2)c1 ZINC000177159241 473320354 /nfs/dbraw/zinc/32/03/54/473320354.db2.gz AYZYIXVBBIJQOT-QWRGUYRKSA-N 0 3 335.429 2.672 20 5 EFBDHN C[C@H](C(=O)N1CCC[C@@H]1CN1CCCC1)c1ccc([N+](=O)[O-])cc1F ZINC000185128869 473338049 /nfs/dbraw/zinc/33/80/49/473338049.db2.gz IPKKPKPLUVNXAX-DZGCQCFKSA-N 0 3 349.406 2.924 20 5 EFBDHN CNC(=O)[C@H]1CCCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000125074754 473352168 /nfs/dbraw/zinc/35/21/68/473352168.db2.gz TYGRYNIAJMYFHU-AWEZNQCLSA-N 0 3 343.383 2.813 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN[C@H]3CCCC34CCOCC4)nc2c1 ZINC000619723141 479866139 /nfs/dbraw/zinc/86/61/39/479866139.db2.gz IHRCZJVDFLGQRK-HNNXBMFYSA-N 0 3 330.388 2.910 20 5 EFBDHN C[C@H](C(=O)N(C)C[C@@H]1CCCN(C)C1)c1ccc([N+](=O)[O-])cc1F ZINC000185246554 473375983 /nfs/dbraw/zinc/37/59/83/473375983.db2.gz JWLAIZVJSCUGDX-QWHCGFSZSA-N 0 3 337.395 2.638 20 5 EFBDHN COc1cc(C(=O)N2CCC[C@@H]2CN2CCCC2)cc([N+](=O)[O-])c1C ZINC000190750022 473382019 /nfs/dbraw/zinc/38/20/19/473382019.db2.gz NOHOINCOTMLZKQ-OAHLLOKOSA-N 0 3 347.415 2.612 20 5 EFBDHN COc1cc(CN[C@@H](C)[C@H]2CCOC2)c([N+](=O)[O-])cc1OC(F)F ZINC000162778762 473382058 /nfs/dbraw/zinc/38/20/58/473382058.db2.gz LAHRIRMRLMVGQM-UWVGGRQHSA-N 0 3 346.330 2.719 20 5 EFBDHN O=C1CC[C@@H]2CN(Cc3ccc([N+](=O)[O-])cc3)CC[C@@H]2N1C1CC1 ZINC000125257422 473383665 /nfs/dbraw/zinc/38/36/65/473383665.db2.gz PORRKLROZJUCOY-PBHICJAKSA-N 0 3 329.400 2.570 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H](N3CCCC3)C2)c1 ZINC000171445285 473389164 /nfs/dbraw/zinc/38/91/64/473389164.db2.gz WCDCYUKVNZKJSC-GFCCVEGCSA-N 0 3 335.429 2.627 20 5 EFBDHN CO[C@H](CN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000338545718 476000154 /nfs/dbraw/zinc/00/01/54/476000154.db2.gz IXMFQDVAKXYRSU-DOTOQJQBSA-N 0 3 342.399 2.864 20 5 EFBDHN Cc1ccccc1C1(NC[C@H](O)COc2ccccc2[N+](=O)[O-])CC1 ZINC000592140091 478791767 /nfs/dbraw/zinc/79/17/67/478791767.db2.gz YZIBOVPFNNGZDZ-HNNXBMFYSA-N 0 3 342.395 2.922 20 5 EFBDHN Cc1ccccc1C1(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1 ZINC000592138533 478792862 /nfs/dbraw/zinc/79/28/62/478792862.db2.gz ZITGVUQWJPYVIH-INIZCTEOSA-N 0 3 342.395 2.922 20 5 EFBDHN O=[N+]([O-])c1ccc(CCNCc2cccnc2OCC(F)F)cc1 ZINC000602578390 479407219 /nfs/dbraw/zinc/40/72/19/479407219.db2.gz FDAFPYIORKNFBV-UHFFFAOYSA-N 0 3 337.326 2.966 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N(C)CCN2CCCCC2)c1 ZINC000593882944 479495109 /nfs/dbraw/zinc/49/51/09/479495109.db2.gz LUWQJZFNOIIUDA-UHFFFAOYSA-N 0 3 349.431 2.616 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C\CN1CCC[C@H](CN2CCOCC2)C1 ZINC000619846038 479896500 /nfs/dbraw/zinc/89/65/00/479896500.db2.gz BQJGZBZXJNBOMS-IMXKFXGHSA-N 0 3 345.443 2.652 20 5 EFBDHN Cc1c(C(=O)N2CCCN(CC3CCC3)CC2)cccc1[N+](=O)[O-] ZINC000619868412 479898359 /nfs/dbraw/zinc/89/83/59/479898359.db2.gz WRXJVUIFUKVQAG-UHFFFAOYSA-N 0 3 331.416 2.851 20 5 EFBDHN Cc1sc(C(=O)N2CCCN(CC3CCC3)CC2)cc1[N+](=O)[O-] ZINC000619868387 479898882 /nfs/dbraw/zinc/89/88/82/479898882.db2.gz BWHSGBFJMOJJMF-UHFFFAOYSA-N 0 3 337.445 2.913 20 5 EFBDHN O=C(NC1CCN(Cc2ccccc2)CC1)c1ccccc1[N+](=O)[O-] ZINC000005603148 471512416 /nfs/dbraw/zinc/51/24/16/471512416.db2.gz LALXQNFBJHJTMT-UHFFFAOYSA-N 0 3 339.395 2.989 20 5 EFBDHN CN(C)Cc1ccc(CNC(=O)/C=C/c2cccc([N+](=O)[O-])c2)cc1 ZINC000008430912 471687903 /nfs/dbraw/zinc/68/79/03/471687903.db2.gz XHRQRCWIZYXBOQ-ZHACJKMWSA-N 0 3 339.395 2.986 20 5 EFBDHN CN(CCCNC(=O)Cc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000009982514 471725338 /nfs/dbraw/zinc/72/53/38/471725338.db2.gz DAWVKAPWQGJUJC-UHFFFAOYSA-N 0 3 341.411 2.776 20 5 EFBDHN CNc1ccc(C(=O)NC[C@H](c2ccccc2)N(C)C)cc1[N+](=O)[O-] ZINC000016599202 471943501 /nfs/dbraw/zinc/94/35/01/471943501.db2.gz KDJVYZOAGXPQPX-QGZVFWFLSA-N 0 3 342.399 2.669 20 5 EFBDHN CN(C)[C@H]1Cc2ccccc2N(C(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000067204141 472004912 /nfs/dbraw/zinc/00/49/12/472004912.db2.gz XVPDKCKNYDWFFJ-INIZCTEOSA-N 0 3 325.368 2.728 20 5 EFBDHN CN(C)[C@@H]1Cc2ccccc2N(C(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000067204139 472005230 /nfs/dbraw/zinc/00/52/30/472005230.db2.gz XVPDKCKNYDWFFJ-MRXNPFEDSA-N 0 3 325.368 2.728 20 5 EFBDHN CN(CCNc1nc2sccn2c1[N+](=O)[O-])Cc1ccccc1 ZINC000053582835 472022262 /nfs/dbraw/zinc/02/22/62/472022262.db2.gz USPYJPMKSKOCHZ-UHFFFAOYSA-N 0 3 331.401 2.848 20 5 EFBDHN CN(C)[C@@H](CNC(=O)Nc1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000024367725 472053075 /nfs/dbraw/zinc/05/30/75/472053075.db2.gz JRBQXAGCXFXYDM-QGZVFWFLSA-N 0 3 342.399 2.889 20 5 EFBDHN CN(CCNC(=O)c1ccc([N+](=O)[O-])cc1F)Cc1ccccc1 ZINC000054281658 472071719 /nfs/dbraw/zinc/07/17/19/472071719.db2.gz DBKKSNMBCCHBDG-UHFFFAOYSA-N 0 3 331.347 2.596 20 5 EFBDHN CNc1ccc(C(=O)NCC(C)(C)N2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000054287072 472074260 /nfs/dbraw/zinc/07/42/60/472074260.db2.gz UKGSSLSYUKHPKP-ZDUSSCGKSA-N 0 3 348.447 2.877 20 5 EFBDHN CCN(CC)[C@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]1)c1ccccc1 ZINC000054374046 472082859 /nfs/dbraw/zinc/08/28/59/472082859.db2.gz AJSTVHNTJDVSFD-MRXNPFEDSA-N 0 3 330.388 2.736 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCN(CC(C)C)CC1 ZINC000041894485 472094356 /nfs/dbraw/zinc/09/43/56/472094356.db2.gz GUXZLRVAFZQRHV-UHFFFAOYSA-N 0 3 348.447 2.505 20 5 EFBDHN CN(CCOc1ccccc1)CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000026222738 472127721 /nfs/dbraw/zinc/12/77/21/472127721.db2.gz VPYZTQZKJKKTDH-UHFFFAOYSA-N 0 3 343.383 2.934 20 5 EFBDHN C[C@@H]1CCC[C@@H](N(C)CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000026473468 472139382 /nfs/dbraw/zinc/13/93/82/472139382.db2.gz HGAOXZYRGDGITK-VXGBXAGGSA-N 0 3 349.387 2.773 20 5 EFBDHN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1CN1CCCCC1 ZINC000068134790 472140259 /nfs/dbraw/zinc/14/02/59/472140259.db2.gz MWQJVOCKUCUZSW-KRWDZBQOSA-N 0 3 331.416 2.614 20 5 EFBDHN CNc1ccc(C(=O)N2CCC[C@H]2CN2CCCCC2)cc1[N+](=O)[O-] ZINC000075506436 472147756 /nfs/dbraw/zinc/14/77/56/472147756.db2.gz MCQOCMGFEMRKLL-HNNXBMFYSA-N 0 3 346.431 2.727 20 5 EFBDHN CN(C)CCN(Cc1cccs1)C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000084251123 472160338 /nfs/dbraw/zinc/16/03/38/472160338.db2.gz CJDZTOTXHMUALB-UHFFFAOYSA-N 0 3 333.413 2.860 20 5 EFBDHN C[C@@H](CN1CCCCC1)NC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000027750507 472193455 /nfs/dbraw/zinc/19/34/55/472193455.db2.gz YRQKHYWTDMRZNC-HNNXBMFYSA-N 0 3 348.447 2.778 20 5 EFBDHN C[C@@H](CNC(=O)CCNc1ccccc1[N+](=O)[O-])N1CCCC[C@@H]1C ZINC000043085575 472197429 /nfs/dbraw/zinc/19/74/29/472197429.db2.gz TZAGZYWOFDKVFN-GJZGRUSLSA-N 0 3 348.447 2.776 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)CN1C[C@@H](C)C[C@H](C)C1 ZINC000055749166 472233114 /nfs/dbraw/zinc/23/31/14/472233114.db2.gz PICYEPLVUWKUCX-MELADBBJSA-N 0 3 349.431 2.700 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)CN1C[C@H](C)C[C@H](C)C1 ZINC000055749165 472233385 /nfs/dbraw/zinc/23/33/85/472233385.db2.gz PICYEPLVUWKUCX-HZSPNIEDSA-N 0 3 349.431 2.700 20 5 EFBDHN C[C@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)c1csc([N+](=O)[O-])c1 ZINC000055749939 472234372 /nfs/dbraw/zinc/23/43/72/472234372.db2.gz YQTWPASNQVPKAI-GRYCIOLGSA-N 0 3 325.434 2.753 20 5 EFBDHN CN(C)[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000043467402 472234975 /nfs/dbraw/zinc/23/49/75/472234975.db2.gz AHOZQIMZRQRCGE-QGZVFWFLSA-N 0 3 342.399 2.889 20 5 EFBDHN CC(C)N1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000068798932 472245406 /nfs/dbraw/zinc/24/54/06/472245406.db2.gz XOYPFHXKEUUTLT-UHFFFAOYSA-N 0 3 325.796 2.805 20 5 EFBDHN CC(C)N1CCCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)CC1 ZINC000068800432 472245636 /nfs/dbraw/zinc/24/56/36/472245636.db2.gz SFQBUNLLAKPJHF-UHFFFAOYSA-N 0 3 337.445 2.630 20 5 EFBDHN CC(C)C[C@@H](CN(C)C)NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000087134069 472309205 /nfs/dbraw/zinc/30/92/05/472309205.db2.gz UWJHWUBHEIWXBO-INIZCTEOSA-N 0 3 348.447 2.639 20 5 EFBDHN Cc1c(C(=O)N(CCN(C)C)Cc2ccco2)cccc1[N+](=O)[O-] ZINC000088230089 472349524 /nfs/dbraw/zinc/34/95/24/472349524.db2.gz RZCIBDZNUVSPBD-UHFFFAOYSA-N 0 3 331.372 2.700 20 5 EFBDHN Cc1nn(C)c(NC[C@H](c2ccccc2)N2CCCC2)c1[N+](=O)[O-] ZINC000076461400 472350780 /nfs/dbraw/zinc/35/07/80/472350780.db2.gz SQXVINOBEMGEMS-OAHLLOKOSA-N 0 3 329.404 2.886 20 5 EFBDHN CN(C)CCN(Cc1ccco1)C(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000088250683 472352390 /nfs/dbraw/zinc/35/23/90/472352390.db2.gz YEMRJOIXMHMQGA-JXMROGBWSA-N 0 3 343.383 2.791 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN(C)CCOCC1CC1 ZINC000088601405 472376049 /nfs/dbraw/zinc/37/60/49/472376049.db2.gz JRVQBYACHPMTTO-UHFFFAOYSA-N 0 3 335.404 2.590 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN(C)CCOCC1CC1 ZINC000088600281 472376454 /nfs/dbraw/zinc/37/64/54/472376454.db2.gz CWGVVTUPUSJVNV-UHFFFAOYSA-N 0 3 335.404 2.590 20 5 EFBDHN O=C(NCCN1CCCCC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000045208930 472382709 /nfs/dbraw/zinc/38/27/09/472382709.db2.gz SULLDFNHARGGSO-UHFFFAOYSA-N 0 3 326.784 2.856 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CN[C@H](CO)[C@@H](C)c1ccccc1 ZINC000613389614 479984287 /nfs/dbraw/zinc/98/42/87/479984287.db2.gz OXGRVPHSWPWODO-SUMWQHHRSA-N 0 3 330.384 2.858 20 5 EFBDHN Cc1c(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)cccc1[N+](=O)[O-] ZINC000057287904 472410065 /nfs/dbraw/zinc/41/00/65/472410065.db2.gz OVBNXDAKEFAGOR-MRXNPFEDSA-N 0 3 341.411 2.806 20 5 EFBDHN Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCCCN1CC(C)C ZINC000154303630 472414124 /nfs/dbraw/zinc/41/41/24/472414124.db2.gz ZSXJUQLEZLRVLB-AWEZNQCLSA-N 0 3 334.420 2.539 20 5 EFBDHN COc1ccc(C(=O)NC[C@@H]2CCCCN2CC(C)C)cc1[N+](=O)[O-] ZINC000154330705 472419354 /nfs/dbraw/zinc/41/93/54/472419354.db2.gz GLXZNSQQAZWEHV-HNNXBMFYSA-N 0 3 349.431 2.844 20 5 EFBDHN CC(C)N1CCCN(C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000069776610 472428708 /nfs/dbraw/zinc/42/87/08/472428708.db2.gz OCMKQAMTTPEZAS-AWEZNQCLSA-N 0 3 334.420 2.782 20 5 EFBDHN O=C(NCCCN1CCc2ccccc2C1)c1ccccc1[N+](=O)[O-] ZINC000032400303 472428879 /nfs/dbraw/zinc/42/88/79/472428879.db2.gz ZCLSTGRYNKBJIR-UHFFFAOYSA-N 0 3 339.395 2.773 20 5 EFBDHN C[C@@H](CNC(=O)NCc1ccccc1[N+](=O)[O-])N1CCC[C@H](C)C1 ZINC000045625286 472435756 /nfs/dbraw/zinc/43/57/56/472435756.db2.gz NVAWJOBVALTHEZ-KBPBESRZSA-N 0 3 334.420 2.514 20 5 EFBDHN C[C@@H](Cn1cc(Br)cn1)NCc1ccc([N+](=O)[O-])cc1 ZINC000089513321 472452004 /nfs/dbraw/zinc/45/20/04/472452004.db2.gz DFRJBIOQRLZBCP-JTQLQIEISA-N 0 3 339.193 2.732 20 5 EFBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@H](CN2CCOCC2)C1 ZINC000069857603 472452562 /nfs/dbraw/zinc/45/25/62/472452562.db2.gz JLWIXUJBZFQBPH-JKSUJKDBSA-N 0 3 333.432 2.700 20 5 EFBDHN CC[C@H](O)CN(Cc1ccccc1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154661357 472458867 /nfs/dbraw/zinc/45/88/67/472458867.db2.gz WSWHSQKJKWLDLH-OALUTQOASA-N 0 3 344.411 2.901 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H](C)N(C)C1CC1 ZINC000057716862 472467222 /nfs/dbraw/zinc/46/72/22/472467222.db2.gz HIIOEDKEJPCANG-RYUDHWBXSA-N 0 3 337.445 2.674 20 5 EFBDHN O=[N+]([O-])c1ccc(NC2CCN([C@@H]3CCOC3)CC2)c2ncccc12 ZINC000089602949 472467488 /nfs/dbraw/zinc/46/74/88/472467488.db2.gz SAQQIJNEHJVHRU-CQSZACIVSA-N 0 3 342.399 2.808 20 5 EFBDHN CCOc1cc(NC2CCN([C@H]3CCOC3)CC2)ccc1[N+](=O)[O-] ZINC000089602846 472467638 /nfs/dbraw/zinc/46/76/38/472467638.db2.gz WEAVWWYWYHIMRD-HNNXBMFYSA-N 0 3 335.404 2.659 20 5 EFBDHN CN(C)Cc1cccc(CNC(=O)Cc2ccccc2[N+](=O)[O-])c1 ZINC000033083791 472495847 /nfs/dbraw/zinc/49/58/47/472495847.db2.gz CSWNMOXDKUQNJR-UHFFFAOYSA-N 0 3 327.384 2.515 20 5 EFBDHN CN(C)CCN(C(=O)COc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000077542786 472550971 /nfs/dbraw/zinc/55/09/71/472550971.db2.gz GVIVQJFEPJFDFE-UHFFFAOYSA-N 0 3 349.431 2.697 20 5 EFBDHN CCOc1ccc(C(=O)NC[C@H](C)N2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000046593533 472574075 /nfs/dbraw/zinc/57/40/75/472574075.db2.gz FDICAPGZAGUNRV-KBPBESRZSA-N 0 3 349.431 2.986 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@H](OCC(C)C)C1 ZINC000119791848 472583785 /nfs/dbraw/zinc/58/37/85/472583785.db2.gz XOFNDIJMTSHDBJ-INIZCTEOSA-N 0 3 349.431 2.979 20 5 EFBDHN CC1(C)CCCC[C@@H]1NCC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000119807009 472585003 /nfs/dbraw/zinc/58/50/03/472585003.db2.gz WMNOVFOKDMYPOR-HNNXBMFYSA-N 0 3 349.387 2.820 20 5 EFBDHN CC1(C)CCCC[C@H]1NCC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000119807149 472585089 /nfs/dbraw/zinc/58/50/89/472585089.db2.gz WMNOVFOKDMYPOR-OAHLLOKOSA-N 0 3 349.387 2.820 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[C@H](OCC(C)C)C1 ZINC000119830845 472587255 /nfs/dbraw/zinc/58/72/55/472587255.db2.gz ACKWFRNKPQNZAF-INIZCTEOSA-N 0 3 349.431 2.979 20 5 EFBDHN O=C(CN1CCC[C@H]1C1CCC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000102926068 472599607 /nfs/dbraw/zinc/59/96/07/472599607.db2.gz RDCCHYJGSQOWKF-INIZCTEOSA-N 0 3 329.400 2.748 20 5 EFBDHN C[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(-n2cnnn2)cc1 ZINC000155814610 472621222 /nfs/dbraw/zinc/62/12/22/472621222.db2.gz BPECKVZBIKQZGS-STQMWFEESA-N 0 3 338.371 2.982 20 5 EFBDHN Cc1nccn1CCCN(C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000130692468 472622305 /nfs/dbraw/zinc/62/23/05/472622305.db2.gz WWZJIYHGQVKLIV-UHFFFAOYSA-N 0 3 329.360 2.763 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1NCCCN1CCC(O)CC1 ZINC000059363440 472625638 /nfs/dbraw/zinc/62/56/38/472625638.db2.gz HOEZHAMUIAIERS-UHFFFAOYSA-N 0 3 347.337 2.872 20 5 EFBDHN C[C@H](CN1CCCCC1)NC(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000071970317 472626964 /nfs/dbraw/zinc/62/69/64/472626964.db2.gz JPZUMZCBIJSSJE-LLVKDONJSA-N 0 3 325.796 2.852 20 5 EFBDHN CCN(CCn1cc([N+](=O)[O-])ccc1=O)[C@@H](C)c1ccc(F)cc1 ZINC000090519104 472628775 /nfs/dbraw/zinc/62/87/75/472628775.db2.gz AFLAFDZSLROCGR-ZDUSSCGKSA-N 0 3 333.363 2.979 20 5 EFBDHN CC[C@H](NC(=O)NC1CCN(C2CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000090519499 472628945 /nfs/dbraw/zinc/62/89/45/472628945.db2.gz CFHSOYZYRKLXBZ-KRWDZBQOSA-N 0 3 346.431 2.972 20 5 EFBDHN C[C@@H](NCCn1cc([N+](=O)[O-])cn1)c1ccccc1OC(F)F ZINC000090538097 472631515 /nfs/dbraw/zinc/63/15/15/472631515.db2.gz NTYINVSODXQPLV-SNVBAGLBSA-N 0 3 326.303 2.744 20 5 EFBDHN CCCN(CCc1cccc(F)c1)CCn1cc([N+](=O)[O-])ccc1=O ZINC000090549235 472634006 /nfs/dbraw/zinc/63/40/06/472634006.db2.gz HDUCUUJXCOFTKW-UHFFFAOYSA-N 0 3 347.390 2.850 20 5 EFBDHN C[C@@H]1[C@@H](c2ccccc2)CCN1CCn1cc([N+](=O)[O-])ccc1=O ZINC000090552052 472634734 /nfs/dbraw/zinc/63/47/34/472634734.db2.gz SSFOZIJYRADJAM-PBHICJAKSA-N 0 3 327.384 2.635 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCN1CCC(c2ccc(F)cc2)CC1 ZINC000090552049 472634983 /nfs/dbraw/zinc/63/49/83/472634983.db2.gz KHAWRJNWTYDMKG-UHFFFAOYSA-N 0 3 345.374 2.775 20 5 EFBDHN CN(C)Cc1cccc(C(=O)NCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000155914489 472638485 /nfs/dbraw/zinc/63/84/85/472638485.db2.gz IXHQIEZHNJQHPV-UHFFFAOYSA-N 0 3 327.384 2.629 20 5 EFBDHN CC[C@H](NC(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000090610776 472642191 /nfs/dbraw/zinc/64/21/91/472642191.db2.gz KPGWMQQSOZCRFE-QEORTHHSSA-N 0 3 346.431 2.970 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CN2CC[C@H](c3ccccc3)C2)c1 ZINC000120191400 472645925 /nfs/dbraw/zinc/64/59/25/472645925.db2.gz CVUHSFRLZYGVBV-WMZOPIPTSA-N 0 3 342.395 2.824 20 5 EFBDHN CC(C)C(=O)NC[C@H]1CCCN(CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000060361106 472647171 /nfs/dbraw/zinc/64/71/71/472647171.db2.gz VSBIVVQLVWQHRQ-MRXNPFEDSA-N 0 3 333.432 2.622 20 5 EFBDHN C[C@@H]1CN(CC2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)C[C@H](C)O1 ZINC000060368423 472648021 /nfs/dbraw/zinc/64/80/21/472648021.db2.gz PVLLLDFUULJZQQ-IYBDPMFKSA-N 0 3 347.459 2.916 20 5 EFBDHN C[C@H]1CN(CC2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)C[C@H](C)O1 ZINC000060368424 472648903 /nfs/dbraw/zinc/64/89/03/472648903.db2.gz PVLLLDFUULJZQQ-HOTGVXAUSA-N 0 3 347.459 2.916 20 5 EFBDHN C[C@H]1C[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])c3cccnc23)CCN1C ZINC000156036719 472658502 /nfs/dbraw/zinc/65/85/02/472658502.db2.gz SBIOYGJSWGXHGL-QWHCGFSZSA-N 0 3 342.399 2.698 20 5 EFBDHN C[C@@H]1CCCN(CCNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000047145543 472660837 /nfs/dbraw/zinc/66/08/37/472660837.db2.gz RQPVWKXKLXRXEI-LLVKDONJSA-N 0 3 325.796 2.710 20 5 EFBDHN CCOC1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000060485111 472661949 /nfs/dbraw/zinc/66/19/49/472661949.db2.gz DUKBWTABPSWYOU-UHFFFAOYSA-N 0 3 335.404 2.733 20 5 EFBDHN Cc1ccc([C@@H](CNc2ncc([N+](=O)[O-])c(N)n2)N2CCCC2)cc1 ZINC000060862622 472681542 /nfs/dbraw/zinc/68/15/42/472681542.db2.gz KCTAOKKPWNCIRN-CQSZACIVSA-N 0 3 342.403 2.524 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN(C[C@@H](C)O)C1CCCCC1 ZINC000104684515 472683331 /nfs/dbraw/zinc/68/33/31/472683331.db2.gz CFWYLRFWQCMTAP-CQSZACIVSA-N 0 3 349.431 2.857 20 5 EFBDHN COc1cc(CNC[C@@H](C)O)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000061011987 472688186 /nfs/dbraw/zinc/68/81/86/472688186.db2.gz LGUKIXFXYCRUBW-CYBMUJFWSA-N 0 3 346.383 2.653 20 5 EFBDHN CN(Cc1ccccc1)C[C@@H](O)COc1c(F)cccc1[N+](=O)[O-] ZINC000613450827 480003783 /nfs/dbraw/zinc/00/37/83/480003783.db2.gz GQZBJGBAASNQHP-CQSZACIVSA-N 0 3 334.347 2.606 20 5 EFBDHN O=C1CCCCN1C1CCN(CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000120458822 472693666 /nfs/dbraw/zinc/69/36/66/472693666.db2.gz FTMWZTAAYRMKQZ-UHFFFAOYSA-N 0 3 331.416 2.614 20 5 EFBDHN C[C@@H]1CC[C@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000120517179 472702732 /nfs/dbraw/zinc/70/27/32/472702732.db2.gz TUWVYDRLGKFGAL-IOASZLSFSA-N 0 3 340.445 2.783 20 5 EFBDHN CN(C)CCN(Cc1ccccc1)C(=O)c1ccc([N+](=O)[O-])s1 ZINC000072729655 472709922 /nfs/dbraw/zinc/70/99/22/472709922.db2.gz JZIPOSMCHULSQU-UHFFFAOYSA-N 0 3 333.413 2.860 20 5 EFBDHN O=[N+]([O-])c1ccc(CCN2CCC(OC[C@@H]3CCOC3)CC2)cc1 ZINC000132179110 472719823 /nfs/dbraw/zinc/71/98/23/472719823.db2.gz OFDBWDHUWOCYDE-MRXNPFEDSA-N 0 3 334.416 2.655 20 5 EFBDHN O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])o1 ZINC000062231591 472732123 /nfs/dbraw/zinc/73/21/23/472732123.db2.gz JPIVJNJDTMVBCA-OAHLLOKOSA-N 0 3 343.383 2.830 20 5 EFBDHN CCN1CCCN(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000105349977 472748088 /nfs/dbraw/zinc/74/80/88/472748088.db2.gz XDIORWIDVATGLL-UHFFFAOYSA-N 0 3 326.784 2.808 20 5 EFBDHN CCN1CCC(N(C)C(=O)c2ccc(SC)c([N+](=O)[O-])c2)CC1 ZINC000105599806 472761583 /nfs/dbraw/zinc/76/15/83/472761583.db2.gz ZPBNHKQXIZRBBN-UHFFFAOYSA-N 0 3 337.445 2.873 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(NCCN(C)C2CC2)cc1Cl ZINC000091459638 472769892 /nfs/dbraw/zinc/76/98/92/472769892.db2.gz QAFUJPSHQWBBDL-UHFFFAOYSA-N 0 3 327.768 2.541 20 5 EFBDHN CN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000157247570 472800908 /nfs/dbraw/zinc/80/09/08/472800908.db2.gz IIWSUUNSSNDXOD-IAQYHMDHSA-N 0 3 337.807 2.805 20 5 EFBDHN CC(C)(C)N1CCCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CC1 ZINC000063725816 472806531 /nfs/dbraw/zinc/80/65/31/472806531.db2.gz CDCJERBUOSFKDL-JXMROGBWSA-N 0 3 331.416 2.941 20 5 EFBDHN COc1ccc(C(=O)N2CCCN(C(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000063726348 472806835 /nfs/dbraw/zinc/80/68/35/472806835.db2.gz LGEJBJQKPBYJSD-UHFFFAOYSA-N 0 3 335.404 2.550 20 5 EFBDHN C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000121149211 472807649 /nfs/dbraw/zinc/80/76/49/472807649.db2.gz KYFPCEHUGADUFJ-GWCFXTLKSA-N 0 3 325.796 2.660 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)N2CCCN(C(C)(C)C)CC2)c1 ZINC000063727653 472807839 /nfs/dbraw/zinc/80/78/39/472807839.db2.gz WNHKTXIPQFJLDG-UHFFFAOYSA-N 0 3 335.404 2.550 20 5 EFBDHN Cc1ccc([C@H](CNc2ccc(C(N)=O)cc2[N+](=O)[O-])N(C)C)cc1 ZINC000064114272 472834661 /nfs/dbraw/zinc/83/46/61/472834661.db2.gz VTVJGFJLUJOJIR-KRWDZBQOSA-N 0 3 342.399 2.717 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CC[C@H]2CC[C@@H](C1)N2C ZINC000091991192 472838922 /nfs/dbraw/zinc/83/89/22/472838922.db2.gz LBIJRZGYCXMAJF-CABCVRRESA-N 0 3 331.416 2.829 20 5 EFBDHN C[C@@H](CN1CCC[C@H](C)C1)NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000064311959 472842587 /nfs/dbraw/zinc/84/25/87/472842587.db2.gz MCXJMPQONAQNKZ-STQMWFEESA-N 0 3 344.415 2.926 20 5 EFBDHN CCN1CCN(CCNc2c(Cl)cc([N+](=O)[O-])cc2Cl)CC1 ZINC000121382006 472844048 /nfs/dbraw/zinc/84/40/48/472844048.db2.gz CTNOLKYTZYPNHA-UHFFFAOYSA-N 0 3 347.246 2.951 20 5 EFBDHN COC[C@H](NCc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000121424043 472848984 /nfs/dbraw/zinc/84/89/84/472848984.db2.gz YHPDYYUGMCBBRX-NSHDSACASA-N 0 3 346.330 2.719 20 5 EFBDHN Cc1c(CC(=O)NCc2ccc(CN(C)C)cc2)cccc1[N+](=O)[O-] ZINC000157991509 472881184 /nfs/dbraw/zinc/88/11/84/472881184.db2.gz VLBYSFDBYURCES-UHFFFAOYSA-N 0 3 341.411 2.824 20 5 EFBDHN Cc1cc(NC[C@H](O)CN2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000079872509 472935247 /nfs/dbraw/zinc/93/52/47/472935247.db2.gz XZSUEAGLKOQFLQ-SFHVURJKSA-N 0 3 341.411 2.734 20 5 EFBDHN NC(=O)C1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000158603746 472951689 /nfs/dbraw/zinc/95/16/89/472951689.db2.gz BJCHAEPAKJAROV-UHFFFAOYSA-N 0 3 329.356 2.552 20 5 EFBDHN CC(C)CN(CCN(C)C)C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000080045798 472966199 /nfs/dbraw/zinc/96/61/99/472966199.db2.gz JBAXEOFVWXCSFV-AWEZNQCLSA-N 0 3 336.436 2.885 20 5 EFBDHN CCN(CCNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000080109603 472978123 /nfs/dbraw/zinc/97/81/23/472978123.db2.gz AEONAGJOXCBTNO-UHFFFAOYSA-N 0 3 334.420 2.613 20 5 EFBDHN CCc1nn(C)c(NC[C@@H](c2ccc(F)cc2)N(C)C)c1[N+](=O)[O-] ZINC000092828973 472994276 /nfs/dbraw/zinc/99/42/76/472994276.db2.gz GUIXZWJLTNSFDY-AWEZNQCLSA-N 0 3 335.383 2.745 20 5 EFBDHN CCN(CC)Cc1cccc(NC(=O)Cn2cc([N+](=O)[O-])nc2C)c1 ZINC000065725857 473002920 /nfs/dbraw/zinc/00/29/20/473002920.db2.gz YOYQNZZSCAYGHO-UHFFFAOYSA-N 0 3 345.403 2.580 20 5 EFBDHN CCCCNC(=O)[C@@H]1CCCN(CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000051058585 473023967 /nfs/dbraw/zinc/02/39/67/473023967.db2.gz MPOWCNXOVMIRTB-OAHLLOKOSA-N 0 3 349.431 2.602 20 5 EFBDHN CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000065931784 473028840 /nfs/dbraw/zinc/02/88/40/473028840.db2.gz UUOWCGBVUCRJFM-UHFFFAOYSA-N 0 3 345.374 2.938 20 5 EFBDHN O=C(CN1CC[C@@H]2CCCC[C@@H]21)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000159577911 473041618 /nfs/dbraw/zinc/04/16/18/473041618.db2.gz UKPSQPLFVSDNOI-BBRMVZONSA-N 0 3 329.400 2.748 20 5 EFBDHN CN(CCc1ccc([N+](=O)[O-])cc1)C[C@@H]1COc2ccccc2O1 ZINC000051505618 473053329 /nfs/dbraw/zinc/05/33/29/473053329.db2.gz KVSOQHPNCHFYTC-MRXNPFEDSA-N 0 3 328.368 2.909 20 5 EFBDHN Cc1cc(NCc2ccccc2OCCN(C)C)ncc1[N+](=O)[O-] ZINC000080599996 473053839 /nfs/dbraw/zinc/05/38/39/473053839.db2.gz KLWKWYNNAUCNQD-UHFFFAOYSA-N 0 3 330.388 2.851 20 5 EFBDHN CC1CCN(CCNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CC1 ZINC000052160316 473088139 /nfs/dbraw/zinc/08/81/39/473088139.db2.gz INDBNZFIUNRVRX-UHFFFAOYSA-N 0 3 346.431 2.631 20 5 EFBDHN C[C@@H]1C[C@H](N(C)C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CCN1C ZINC000135655083 473103971 /nfs/dbraw/zinc/10/39/71/473103971.db2.gz IVGAUQYVYJMNMA-TZMCWYRMSA-N 0 3 344.415 2.560 20 5 EFBDHN CN(Cc1ccccc1)[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000081121136 473149772 /nfs/dbraw/zinc/14/97/72/473149772.db2.gz WQCXGJQCNKBDCV-GOSISDBHSA-N 0 3 339.395 2.941 20 5 EFBDHN O=C1C[C@@H](c2ccccc2)N(CCc2ccc([N+](=O)[O-])cc2)CCN1 ZINC000052835590 473153119 /nfs/dbraw/zinc/15/31/19/473153119.db2.gz IKCIIVWJMRTRDU-SFHVURJKSA-N 0 3 339.395 2.701 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC1CCN(C2CC2)CC1 ZINC000093910308 473162086 /nfs/dbraw/zinc/16/20/86/473162086.db2.gz WVDVGXOMOJBKMN-UHFFFAOYSA-N 0 3 331.416 2.877 20 5 EFBDHN COCCN(Cc1ccccc1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136809150 473177278 /nfs/dbraw/zinc/17/72/78/473177278.db2.gz HMDCFOFZUWWRRL-SFHVURJKSA-N 0 3 330.384 2.777 20 5 EFBDHN COc1ccc(OCCN(C)C[C@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000136819512 473177853 /nfs/dbraw/zinc/17/78/53/473177853.db2.gz QPYIOBNNYZDENY-SFHVURJKSA-N 0 3 346.383 2.648 20 5 EFBDHN CN(C)C[C@H]1CCCCN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000066946673 473182419 /nfs/dbraw/zinc/18/24/19/473182419.db2.gz QJHNPYKBJZFNBH-CYBMUJFWSA-N 0 3 330.388 2.632 20 5 EFBDHN CN(CCNC(=O)c1ccc(F)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000123786360 473185423 /nfs/dbraw/zinc/18/54/23/473185423.db2.gz PCLXVWSEGVHCBO-UHFFFAOYSA-N 0 3 331.347 2.596 20 5 EFBDHN Cn1ccnc1C[C@H]1CCCN(CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000123798042 473186417 /nfs/dbraw/zinc/18/64/17/473186417.db2.gz FJPQCVMRVXHTHF-OAHLLOKOSA-N 0 3 344.415 2.662 20 5 EFBDHN CCN1CCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000124006789 473204681 /nfs/dbraw/zinc/20/46/81/473204681.db2.gz LKEAUYNHLJFTOJ-GFCCVEGCSA-N 0 3 345.321 2.828 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000177683517 473417220 /nfs/dbraw/zinc/41/72/20/473417220.db2.gz CVRPFWAXDLUOLD-HIFRSBDPSA-N 0 3 332.404 2.994 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@H]1CCCN(C)C1 ZINC000185410447 473419979 /nfs/dbraw/zinc/41/99/79/473419979.db2.gz VKXDDXILFUTQLE-WBVHZDCISA-N 0 3 333.432 2.716 20 5 EFBDHN C[C@H](C(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000185489497 473440340 /nfs/dbraw/zinc/44/03/40/473440340.db2.gz JSHAQSBINFWIPY-GRYCIOLGSA-N 0 3 335.379 2.579 20 5 EFBDHN C[C@@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H]1COc2ccccc21 ZINC000185579565 473461059 /nfs/dbraw/zinc/46/10/59/473461059.db2.gz CLUPDLBBHZTMRN-OCCSQVGLSA-N 0 3 341.367 2.688 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCN(CCO)[C@H]1CCc2ccccc21 ZINC000114466468 473469096 /nfs/dbraw/zinc/46/90/96/473469096.db2.gz XXUDHADWJCBFOE-KRWDZBQOSA-N 0 3 342.395 2.955 20 5 EFBDHN O=C(NC[C@H]1CCCN1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000114644709 473488843 /nfs/dbraw/zinc/48/88/43/473488843.db2.gz JMLLMYGQWSUSQM-GOSISDBHSA-N 0 3 339.395 2.989 20 5 EFBDHN CC[C@@H](N[C@@H](C(=O)N1CCOCC1)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000164952804 473503114 /nfs/dbraw/zinc/50/31/14/473503114.db2.gz ZIXOBQGGHGDLAX-IAGOWNOFSA-N 0 3 349.431 2.519 20 5 EFBDHN CCn1c(SC[C@@H]2CCN(C)C2)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000191197767 473504585 /nfs/dbraw/zinc/50/45/85/473504585.db2.gz XFWUVQJXINEFNF-GFCCVEGCSA-N 0 3 347.444 2.917 20 5 EFBDHN CN(C)[C@H](CNC(=O)Cc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000152045301 473519478 /nfs/dbraw/zinc/51/94/78/473519478.db2.gz HDRKWOZTLUJLTK-QGZVFWFLSA-N 0 3 327.384 2.556 20 5 EFBDHN COc1cc(C(=O)N(CCN(C)C)C2CCCC2)cc([N+](=O)[O-])c1C ZINC000191678935 473568160 /nfs/dbraw/zinc/56/81/60/473568160.db2.gz MQONIEWUMULHPM-UHFFFAOYSA-N 0 3 349.431 2.858 20 5 EFBDHN CCc1nc2c(s1)[C@H](N(C)CCn1ccc([N+](=O)[O-])n1)CCC2 ZINC000152494047 473569607 /nfs/dbraw/zinc/56/96/07/473569607.db2.gz BQKAOLVPWJZFKG-GFCCVEGCSA-N 0 3 335.433 2.820 20 5 EFBDHN CC(C)(C)OC(=O)NC[C@H]1CCN(CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000170647413 473573314 /nfs/dbraw/zinc/57/33/14/473573314.db2.gz MACZHVKGDIVNMF-OAHLLOKOSA-N 0 3 349.431 2.984 20 5 EFBDHN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@H](N2CCCC2)C1 ZINC000170719369 473595047 /nfs/dbraw/zinc/59/50/47/473595047.db2.gz WQSXTCMBIBCMJU-LBPRGKRZSA-N 0 3 338.795 2.950 20 5 EFBDHN C[C@H](CN1CCCCC1)NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000152826087 473595675 /nfs/dbraw/zinc/59/56/75/473595675.db2.gz FZJMMWMPIPOAKT-CYBMUJFWSA-N 0 3 344.415 2.609 20 5 EFBDHN CC(=O)N1CC[C@@H](NCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000152905303 473599713 /nfs/dbraw/zinc/59/97/13/473599713.db2.gz MNXJEBOMYQZONA-CQSZACIVSA-N 0 3 329.356 2.565 20 5 EFBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CCN(CC2CCOCC2)CC1 ZINC000172427024 473608002 /nfs/dbraw/zinc/60/80/02/473608002.db2.gz NVKUTHXJMPFTCD-OAHLLOKOSA-N 0 3 333.432 2.700 20 5 EFBDHN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCC[C@@H]1CN1CCCC1 ZINC000172511342 473628924 /nfs/dbraw/zinc/62/89/24/473628924.db2.gz GGAOXDIPAYFWDZ-CQSZACIVSA-N 0 3 337.807 2.949 20 5 EFBDHN C[C@@H]1CN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CCCO1 ZINC000170917193 473645408 /nfs/dbraw/zinc/64/54/08/473645408.db2.gz RRFJWMUFEYPWOT-CYBMUJFWSA-N 0 3 331.372 2.903 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1OC[C@H](O)CN(C)Cc1ccccc1 ZINC000154074422 473666792 /nfs/dbraw/zinc/66/67/92/473666792.db2.gz RYWMHCXZFVCSAT-QGZVFWFLSA-N 0 3 330.384 2.775 20 5 EFBDHN CN(CCCNC(=O)Cc1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000172700774 473673455 /nfs/dbraw/zinc/67/34/55/473673455.db2.gz GKHFNVUFPXTKDO-UHFFFAOYSA-N 0 3 341.411 2.776 20 5 EFBDHN C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1N)[C@@H](c1ccccc1)N(C)C ZINC000186481786 473680273 /nfs/dbraw/zinc/68/02/73/473680273.db2.gz LPDRVFVCANJBLH-PXAZEXFGSA-N 0 3 342.399 2.598 20 5 EFBDHN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)C1CCN(C2CC2)CC1 ZINC000192588275 473694173 /nfs/dbraw/zinc/69/41/73/473694173.db2.gz WTSVUSZDTYDIFX-UHFFFAOYSA-N 0 3 345.443 2.908 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CN2CC[C@]3(C2)OCc2ccccc23)c1 ZINC000186614496 473700040 /nfs/dbraw/zinc/70/00/40/473700040.db2.gz JJJIGLZSMVOOQR-RBUKOAKNSA-N 0 3 340.379 2.760 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)NCc2ccccc2CN(C)C)c1 ZINC000172968639 473716165 /nfs/dbraw/zinc/71/61/65/473716165.db2.gz VYGIVDJWRBNCMZ-UHFFFAOYSA-N 0 3 327.384 2.895 20 5 EFBDHN C[C@H]1CCCC[C@@H]1N(C)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000192799214 473728301 /nfs/dbraw/zinc/72/83/01/473728301.db2.gz SWDYRKRKWBGNDM-AAEUAGOBSA-N 0 3 349.387 2.773 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)NCc2cccc(CN(C)C)c2)c1 ZINC000173030758 473729273 /nfs/dbraw/zinc/72/92/73/473729273.db2.gz FMDVRMNATTYGHA-UHFFFAOYSA-N 0 3 327.384 2.895 20 5 EFBDHN CN1CC[C@H]2[C@H](CCCN2C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC000269204578 473731413 /nfs/dbraw/zinc/73/14/13/473731413.db2.gz PPFFFNIDKKGEJG-HIFRSBDPSA-N 0 3 342.399 2.632 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCN(CC3CCCC3)C2)c1 ZINC000173275617 473790217 /nfs/dbraw/zinc/79/02/17/473790217.db2.gz SSJRIXYXTRIJSR-AWEZNQCLSA-N 0 3 347.415 2.598 20 5 EFBDHN O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CC[C@H](N2CCCCC2)C1 ZINC000274377699 473799416 /nfs/dbraw/zinc/79/94/16/473799416.db2.gz LZXGXBKKJDQXNY-ZDUSSCGKSA-N 0 3 337.807 2.949 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(NC2CCN(C)CC2)cc1Cl ZINC000269406430 473802836 /nfs/dbraw/zinc/80/28/36/473802836.db2.gz YCKFJJQVBKXJTE-UHFFFAOYSA-N 0 3 327.768 2.541 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@H]3CN(C)CC[C@H]32)c1 ZINC000246257252 473807282 /nfs/dbraw/zinc/80/72/82/473807282.db2.gz KNUZYVPYNTZQRQ-SWLSCSKDSA-N 0 3 349.456 2.873 20 5 EFBDHN C[C@H](CCC1CC1)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000274418305 473814941 /nfs/dbraw/zinc/81/49/41/473814941.db2.gz HTWGAEPEFRMTGW-GFCCVEGCSA-N 0 3 326.418 2.537 20 5 EFBDHN CCCC(=O)NC[C@@H]1CCCN(CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000263712084 473816352 /nfs/dbraw/zinc/81/63/52/473816352.db2.gz KJCGGWXKHGARRS-INIZCTEOSA-N 0 3 333.432 2.766 20 5 EFBDHN C[C@@H]1CCCN(CCNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1 ZINC000193970458 473824012 /nfs/dbraw/zinc/82/40/12/473824012.db2.gz IHUBSOVCQSVKNV-GFCCVEGCSA-N 0 3 332.404 2.623 20 5 EFBDHN CN1CCN(CCNc2ccc([N+](=O)[O-])c3cnccc23)CC1(C)C ZINC000281744233 473825222 /nfs/dbraw/zinc/82/52/22/473825222.db2.gz XGQMOTWBIYCIPU-UHFFFAOYSA-N 0 3 343.431 2.581 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@@H]2CCN(Cc3ccc4c(c3)CCO4)C2)nc1 ZINC000173465255 473845726 /nfs/dbraw/zinc/84/57/26/473845726.db2.gz DZBRDLVOEQXJQB-OAHLLOKOSA-N 0 3 340.383 2.611 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@H]2CCN(Cc3ccc4c(c3)CCO4)C2)nc1 ZINC000173465239 473845935 /nfs/dbraw/zinc/84/59/35/473845935.db2.gz DZBRDLVOEQXJQB-HNNXBMFYSA-N 0 3 340.383 2.611 20 5 EFBDHN CNC(=O)[C@H](C)CN(C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000180292515 473847829 /nfs/dbraw/zinc/84/78/29/473847829.db2.gz GYMGRPZRSZNBKO-GFCCVEGCSA-N 0 3 331.372 2.669 20 5 EFBDHN Cc1c(CC(=O)N2CC[C@@H](N3CCCCC3)C2)cccc1[N+](=O)[O-] ZINC000269648561 473850565 /nfs/dbraw/zinc/85/05/65/473850565.db2.gz CWXLELPPSQMCAV-MRXNPFEDSA-N 0 3 331.416 2.533 20 5 EFBDHN O=C(NCCc1ccccc1[N+](=O)[O-])[C@@H]1CCCN1C1CCCC1 ZINC000269658489 473855952 /nfs/dbraw/zinc/85/59/52/473855952.db2.gz JKPGCKNYKAXSDR-KRWDZBQOSA-N 0 3 331.416 2.661 20 5 EFBDHN C[C@H](CCN1CCN(C)CC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000274520708 473860446 /nfs/dbraw/zinc/86/04/46/473860446.db2.gz WOCXFONYUXYVOC-GFCCVEGCSA-N 0 3 326.828 2.686 20 5 EFBDHN O=C(CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)NCC1CC1 ZINC000180385737 473864573 /nfs/dbraw/zinc/86/45/73/473864573.db2.gz ANNZBPPMACXFGD-UHFFFAOYSA-N 0 3 345.424 2.939 20 5 EFBDHN C[C@H](NC[C@@H](O)COCc1cccs1)c1cccc([N+](=O)[O-])c1 ZINC000180436006 473877354 /nfs/dbraw/zinc/87/73/54/473877354.db2.gz DHZXIQHSQZDTDR-SWLSCSKDSA-N 0 3 336.413 2.885 20 5 EFBDHN C[C@H](NC[C@@H](O)COCc1ccccc1F)c1cccc([N+](=O)[O-])c1 ZINC000180443747 473879752 /nfs/dbraw/zinc/87/97/52/473879752.db2.gz FQTNOOAVONOHKR-SUMWQHHRSA-N 0 3 348.374 2.962 20 5 EFBDHN CN1CCN(CCCNc2c(Cl)cc([N+](=O)[O-])cc2Cl)CC1 ZINC000274597024 473888861 /nfs/dbraw/zinc/88/88/61/473888861.db2.gz LGBBYEVIHZWQEN-UHFFFAOYSA-N 0 3 347.246 2.951 20 5 EFBDHN COc1ccc(CNCCc2ccc([N+](=O)[O-])cc2)cc1[N+](=O)[O-] ZINC000194416484 473895302 /nfs/dbraw/zinc/89/53/02/473895302.db2.gz OSBPHKWYJVMOTC-UHFFFAOYSA-N 0 3 331.328 2.844 20 5 EFBDHN CS[C@H]1CN(c2ccc([N+](=O)[O-])cc2F)C[C@@H]1N1CCCC1 ZINC000274713171 473929893 /nfs/dbraw/zinc/92/98/93/473929893.db2.gz YSKNJVXDXUQMTQ-GJZGRUSLSA-N 0 3 325.409 2.750 20 5 EFBDHN CSc1cccc(C(=O)NCCN2CCC[C@H](C)C2)c1[N+](=O)[O-] ZINC000188058922 473966607 /nfs/dbraw/zinc/96/66/07/473966607.db2.gz PXULZZGFCNUPHI-LBPRGKRZSA-N 0 3 337.445 2.778 20 5 EFBDHN Cc1cc(NC(=O)N2CC[C@H](N3CCCCC3)C2)ccc1[N+](=O)[O-] ZINC000274812979 473969744 /nfs/dbraw/zinc/96/97/44/473969744.db2.gz NBHKRQDCHCFAHP-HNNXBMFYSA-N 0 3 332.404 2.995 20 5 EFBDHN CSc1cccc(C(=O)N2CC[C@H](N3CCCC3)C2)c1[N+](=O)[O-] ZINC000188119210 473990139 /nfs/dbraw/zinc/99/01/39/473990139.db2.gz XXKGUNCNEUETTP-LBPRGKRZSA-N 0 3 335.429 2.627 20 5 EFBDHN CN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000246885290 473992750 /nfs/dbraw/zinc/99/27/50/473992750.db2.gz IIWSUUNSSNDXOD-XHDPSFHLSA-N 0 3 337.807 2.805 20 5 EFBDHN CCN(CCOCCO)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000282244668 473995163 /nfs/dbraw/zinc/99/51/63/473995163.db2.gz ATQYLQNKTQMYEJ-UHFFFAOYSA-N 0 3 334.372 2.686 20 5 EFBDHN Cc1cc([N+](=O)[O-])cnc1NCc1ccc(OCCN(C)C)cc1 ZINC000264467855 474003388 /nfs/dbraw/zinc/00/33/88/474003388.db2.gz MOQPBTCJLJWJGW-UHFFFAOYSA-N 0 3 330.388 2.851 20 5 EFBDHN Cn1cc(CNCCOCC2CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000264485219 474009789 /nfs/dbraw/zinc/00/97/89/474009789.db2.gz MSIUMJWSEHHEFJ-UHFFFAOYSA-N 0 3 330.388 2.512 20 5 EFBDHN O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CC[C@H](N2CCCCC2)C1 ZINC000264488882 474010963 /nfs/dbraw/zinc/01/09/63/474010963.db2.gz IYKWYLANWKDPSP-AWEZNQCLSA-N 0 3 342.399 2.777 20 5 EFBDHN Cc1ccc(NC(=O)N2CC[C@@H](N3CCCCC3)C2)cc1[N+](=O)[O-] ZINC000264512125 474018768 /nfs/dbraw/zinc/01/87/68/474018768.db2.gz TVCXMWKKEYYZMP-OAHLLOKOSA-N 0 3 332.404 2.995 20 5 EFBDHN CCn1c(C)nc([N+](=O)[O-])c1N(CCN(C)C)Cc1cccc(F)c1 ZINC000288796450 474054942 /nfs/dbraw/zinc/05/49/42/474054942.db2.gz GGWYLYWPOIEMAU-UHFFFAOYSA-N 0 3 349.410 2.827 20 5 EFBDHN CN(CCc1cccc([N+](=O)[O-])c1)C[C@H](O)COc1ccc(F)cc1 ZINC000282445912 474069079 /nfs/dbraw/zinc/06/90/79/474069079.db2.gz LLCNEUKAUDJPCD-KRWDZBQOSA-N 0 3 348.374 2.648 20 5 EFBDHN COc1cccc(C(=O)NCC(C)(C)N2CCC[C@@H](C)C2)c1[N+](=O)[O-] ZINC000195448491 474077123 /nfs/dbraw/zinc/07/71/23/474077123.db2.gz LZRGBYWTJWBVDN-CYBMUJFWSA-N 0 3 349.431 2.844 20 5 EFBDHN CCOc1ccc([C@@H](C)NCC2([S@](C)=O)CC2)cc1[N+](=O)[O-] ZINC000282476966 474078896 /nfs/dbraw/zinc/07/88/96/474078896.db2.gz WRKKQIASHXKGPX-XFNZEKPQSA-N 0 3 326.418 2.555 20 5 EFBDHN Cc1cccc(NCc2ccnc(OCCN(C)C)c2)c1[N+](=O)[O-] ZINC000188388687 474079753 /nfs/dbraw/zinc/07/97/53/474079753.db2.gz SXOMDMHGWLWCNR-UHFFFAOYSA-N 0 3 330.388 2.851 20 5 EFBDHN CN(C)Cc1ccc(C(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000195485811 474082558 /nfs/dbraw/zinc/08/25/58/474082558.db2.gz FBSRPVQPQMRKCX-UHFFFAOYSA-N 0 3 327.384 2.629 20 5 EFBDHN CO[C@@H]1CCCC[C@@H]1NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000275209633 474104975 /nfs/dbraw/zinc/10/49/75/474104975.db2.gz JMCQISHHNZRVJI-UONOGXRCSA-N 0 3 341.795 2.734 20 5 EFBDHN CC[C@H]1CN(Cc2ccc([N+](=O)[O-])cc2Cl)CCN1C[C@@H](C)O ZINC000182137151 474107174 /nfs/dbraw/zinc/10/71/74/474107174.db2.gz NUXNLHOSOXBIDF-OCCSQVGLSA-N 0 3 341.839 2.525 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000264753539 474115643 /nfs/dbraw/zinc/11/56/43/474115643.db2.gz SUXAHSMUJVHDRB-LBPRGKRZSA-N 0 3 337.445 2.921 20 5 EFBDHN CS[C@@H]1CCCCN(C[C@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000182222967 474126558 /nfs/dbraw/zinc/12/65/58/474126558.db2.gz URRMXYFKQQLPKR-UONOGXRCSA-N 0 3 340.445 2.552 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000264814387 474136650 /nfs/dbraw/zinc/13/66/50/474136650.db2.gz WFMUPJGRQQWPII-ZDUSSCGKSA-N 0 3 330.388 2.680 20 5 EFBDHN CC(C)C[C@H](C)CNCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000289071867 474139865 /nfs/dbraw/zinc/13/98/65/474139865.db2.gz AJJJQGJNHABWAE-ZDUSSCGKSA-N 0 3 328.434 2.640 20 5 EFBDHN COc1ccc([C@@H](CCO)NCCOc2cccc([N+](=O)[O-])c2)cc1 ZINC000182389141 474163642 /nfs/dbraw/zinc/16/36/42/474163642.db2.gz RAGMLYGYFQIZHO-GOSISDBHSA-N 0 3 346.383 2.696 20 5 EFBDHN Cc1ccc([C@@H](C)NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1 ZINC000182394295 474165858 /nfs/dbraw/zinc/16/58/58/474165858.db2.gz HBHXYUBKTGALCP-GDBMZVCRSA-N 0 3 330.384 2.994 20 5 EFBDHN COCCCN1CCC(Nc2cc(OC)c([N+](=O)[O-])cc2F)CC1 ZINC000270563834 474170905 /nfs/dbraw/zinc/17/09/05/474170905.db2.gz MAKNYRBDCHCKAF-UHFFFAOYSA-N 0 3 341.383 2.655 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCOCC12CCCC2 ZINC000270603728 474187504 /nfs/dbraw/zinc/18/75/04/474187504.db2.gz HEINFLJMGDKVSP-UHFFFAOYSA-N 0 3 347.415 2.877 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c1 ZINC000282793388 474197723 /nfs/dbraw/zinc/19/77/23/474197723.db2.gz HMGWFIYVHWAMJP-QWHCGFSZSA-N 0 3 335.404 2.548 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nc(CNC[C@H]3CC[C@@H](O)C3)cs2)c1 ZINC000188846996 474214487 /nfs/dbraw/zinc/21/44/87/474214487.db2.gz XAJNOTXOSKWBHV-XHDPSFHLSA-N 0 3 333.413 2.969 20 5 EFBDHN CN(C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@H]1CCc2ccccc21 ZINC000247971051 474235272 /nfs/dbraw/zinc/23/52/72/474235272.db2.gz HQIKAGHFDVKPHB-LPHOPBHVSA-N 0 3 342.395 2.954 20 5 EFBDHN COc1cc(CNCC[C@H](O)c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000289389668 474249632 /nfs/dbraw/zinc/24/96/32/474249632.db2.gz DTAPHTSVWAFDMP-INIZCTEOSA-N 0 3 346.383 2.825 20 5 EFBDHN CN1CCC(N(Cc2ccco2)C(=O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000248108606 474261021 /nfs/dbraw/zinc/26/10/21/474261021.db2.gz GOURKMIFINRIPK-UHFFFAOYSA-N 0 3 343.383 2.924 20 5 EFBDHN O=[N+]([O-])c1cncc(Br)c1NC[C@@H]1CCN(C2CC2)C1 ZINC000231628924 474264548 /nfs/dbraw/zinc/26/45/48/474264548.db2.gz GONNKBHGXIRCHU-VIFPVBQESA-N 0 3 341.209 2.649 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccccc2CCN(C)C)c1 ZINC000275658962 474269767 /nfs/dbraw/zinc/26/97/67/474269767.db2.gz NWKVKSLWZSJOJH-UHFFFAOYSA-N 0 3 343.383 2.960 20 5 EFBDHN CN1CC[C@H](CNC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C1 ZINC000275660300 474270630 /nfs/dbraw/zinc/27/06/30/474270630.db2.gz LMCQHEJIDNJOMN-CYBMUJFWSA-N 0 3 335.407 2.775 20 5 EFBDHN Cn1cc([C@H]2OCCC[C@@H]2NC/C=C/c2ccccc2[N+](=O)[O-])cn1 ZINC000275662328 474271284 /nfs/dbraw/zinc/27/12/84/474271284.db2.gz VCTNYADBVWGFAI-VCUNKILJSA-N 0 3 342.399 2.851 20 5 EFBDHN CC(C)N1CCCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)CC1 ZINC000270810934 474275960 /nfs/dbraw/zinc/27/59/60/474275960.db2.gz LYWDWXFMNIHSQT-UHFFFAOYSA-N 0 3 342.399 2.699 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN[C@@H](C)c1cccnc1 ZINC000182889589 474279994 /nfs/dbraw/zinc/27/99/94/474279994.db2.gz NLLUVZNUIPRRAG-ZDUSSCGKSA-N 0 3 328.372 2.978 20 5 EFBDHN Cc1ccnc(NCC2(N3CCCCC3)CCOCC2)c1[N+](=O)[O-] ZINC000265656084 474284956 /nfs/dbraw/zinc/28/49/56/474284956.db2.gz WFPUEAHLZNZACM-UHFFFAOYSA-N 0 3 334.420 2.745 20 5 EFBDHN CCn1ccnc1[C@H]1OCC[C@@H]1NC/C=C/c1ccccc1[N+](=O)[O-] ZINC000275730051 474298075 /nfs/dbraw/zinc/29/80/75/474298075.db2.gz ZSNHXVJGPMBQHY-TWZYUJDSSA-N 0 3 342.399 2.944 20 5 EFBDHN C[C@@H]1CN(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)[C@@H]2CCCC[C@H]21 ZINC000248417178 474315600 /nfs/dbraw/zinc/31/56/00/474315600.db2.gz JHPIIKDHHKWCBP-XOKHGSTOSA-N 0 3 343.427 2.994 20 5 EFBDHN CC(C)N1CCN(C2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)CC1 ZINC000270917019 474320410 /nfs/dbraw/zinc/32/04/10/474320410.db2.gz OPGGAKPIFVWCLK-UHFFFAOYSA-N 0 3 346.475 2.585 20 5 EFBDHN CC[C@@H](c1ccncc1)N(C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248450281 474326791 /nfs/dbraw/zinc/32/67/91/474326791.db2.gz IOHKXDGPZSCPAL-CVEARBPZSA-N 0 3 345.399 2.813 20 5 EFBDHN COC[C@@H](CCO)NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000265766867 474328450 /nfs/dbraw/zinc/32/84/50/474328450.db2.gz LEJBTZTVSZHLNV-GFCCVEGCSA-N 0 3 336.413 2.810 20 5 EFBDHN C[S@@](=O)C[C@@H](NCCOc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000183120120 474333332 /nfs/dbraw/zinc/33/33/32/474333332.db2.gz KTUGMBCEDJSHMU-OYLFLEFRSA-N 0 3 348.424 2.683 20 5 EFBDHN C[C@H]1c2ccccc2CCN1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248475241 474336544 /nfs/dbraw/zinc/33/65/44/474336544.db2.gz XQHDITZMMRJCME-GOEBONIOSA-N 0 3 342.395 2.954 20 5 EFBDHN C[C@@H]1c2ccccc2CCN1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248475240 474336630 /nfs/dbraw/zinc/33/66/30/474336630.db2.gz XQHDITZMMRJCME-GDBMZVCRSA-N 0 3 342.395 2.954 20 5 EFBDHN COc1cc(CN2CCCN(C(C)C)CC2)c([N+](=O)[O-])cc1OC ZINC000270983112 474353105 /nfs/dbraw/zinc/35/31/05/474353105.db2.gz DWQSYHCDVXDIGX-UHFFFAOYSA-N 0 3 337.420 2.528 20 5 EFBDHN CC1CCN(CCNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000265839065 474357418 /nfs/dbraw/zinc/35/74/18/474357418.db2.gz VFZALPGHYFLOFJ-UHFFFAOYSA-N 0 3 333.432 2.721 20 5 EFBDHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000265868188 474365586 /nfs/dbraw/zinc/36/55/86/474365586.db2.gz IDUYPSYOYZJTRG-AWEZNQCLSA-N 0 3 342.399 2.660 20 5 EFBDHN Cc1c2ccccc2oc1[C@@H](C)NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000183536356 474390858 /nfs/dbraw/zinc/39/08/58/474390858.db2.gz YHBJYQHLBNTRNR-TZMCWYRMSA-N 0 3 344.371 2.558 20 5 EFBDHN C[C@@H]1CN(CC(C)(C)O)CCN1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000189434099 474395188 /nfs/dbraw/zinc/39/51/88/474395188.db2.gz STDNHUKSWBUWLS-GFCCVEGCSA-N 0 3 341.839 2.525 20 5 EFBDHN CN(CCCOc1ccc(Cl)cc1)CCn1ccc([N+](=O)[O-])n1 ZINC000176213642 474412373 /nfs/dbraw/zinc/41/23/73/474412373.db2.gz MUHKXSIEVUXJBD-UHFFFAOYSA-N 0 3 338.795 2.846 20 5 EFBDHN C[C@H](N[C@@H](C)[C@H]1CCOC1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000266280930 474427638 /nfs/dbraw/zinc/42/76/38/474427638.db2.gz GMTVTIGOHLHYIE-DCAQKATOSA-N 0 3 341.795 2.590 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@H]1CN(C2CC2)C[C@@H]1C ZINC000271230148 474453339 /nfs/dbraw/zinc/45/33/39/474453339.db2.gz CYONAWOCDOGREQ-WFASDCNBSA-N 0 3 331.416 2.733 20 5 EFBDHN C[C@H](N[C@H]1CCC[C@H](S(C)(=O)=O)C1)c1cccc([N+](=O)[O-])c1 ZINC000266792413 474484000 /nfs/dbraw/zinc/48/40/00/474484000.db2.gz PQPHDYXDOAKIJG-WHOFXGATSA-N 0 3 326.418 2.601 20 5 EFBDHN CS[C@H]1CN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)C[C@@H]1N(C)C ZINC000271308061 474486497 /nfs/dbraw/zinc/48/64/97/474486497.db2.gz IAVFRLBCPZUFOA-AAEUAGOBSA-N 0 3 347.387 2.678 20 5 EFBDHN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H]2CCN(C)C[C@H]21 ZINC000289949658 474499512 /nfs/dbraw/zinc/49/95/12/474499512.db2.gz XPDQMGZWEJTXRW-CZUORRHYSA-N 0 3 332.404 2.715 20 5 EFBDHN COc1ccc([C@H](CN(C)C)NCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000283804679 474500087 /nfs/dbraw/zinc/50/00/87/474500087.db2.gz AYVSLDZWAVNGJW-SFHVURJKSA-N 0 3 329.400 2.996 20 5 EFBDHN C[C@@H]1CN(Cc2ccc(Cl)cc2[N+](=O)[O-])CCN1CC(C)(C)O ZINC000189917985 474505774 /nfs/dbraw/zinc/50/57/74/474505774.db2.gz PZULMNIPKGLCHX-GFCCVEGCSA-N 0 3 341.839 2.525 20 5 EFBDHN CSc1cccc(C(=O)N2CC[C@H]3CC[C@@H](C2)N3C)c1[N+](=O)[O-] ZINC000249121231 474531408 /nfs/dbraw/zinc/53/14/08/474531408.db2.gz HIKUWYCWOJZLFM-NEPJUHHUSA-N 0 3 335.429 2.625 20 5 EFBDHN CSc1cccc(C(=O)N2CCC[C@H]3CN(C)CC[C@H]32)c1[N+](=O)[O-] ZINC000249131771 474534962 /nfs/dbraw/zinc/53/49/62/474534962.db2.gz LTJCLVVHMIKODL-GXTWGEPZSA-N 0 3 349.456 2.873 20 5 EFBDHN C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)N[C@H]1CCCc2c[nH]nc21 ZINC000271432785 474545283 /nfs/dbraw/zinc/54/52/83/474545283.db2.gz BHINKUBQSLWRKM-ABAIWWIYSA-N 0 3 343.387 2.702 20 5 EFBDHN C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)N[C@H]1CCCc2c[nH]nc21 ZINC000271432792 474545591 /nfs/dbraw/zinc/54/55/91/474545591.db2.gz BHINKUBQSLWRKM-NHYWBVRUSA-N 0 3 343.387 2.702 20 5 EFBDHN CCOCCCN1CC[C@H](Nc2ncc([N+](=O)[O-])s2)[C@@H](C)C1 ZINC000249363824 474560570 /nfs/dbraw/zinc/56/05/70/474560570.db2.gz VGJHCGRPPOYSDY-RYUDHWBXSA-N 0 3 328.438 2.600 20 5 EFBDHN CCOCCCN1CC[C@@H](Nc2ncc([N+](=O)[O-])s2)[C@@H](C)C1 ZINC000249363822 474560878 /nfs/dbraw/zinc/56/08/78/474560878.db2.gz VGJHCGRPPOYSDY-NWDGAFQWSA-N 0 3 328.438 2.600 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CNC[C@@]2(O)CCSC2)o1 ZINC000267005724 474562521 /nfs/dbraw/zinc/56/25/21/474562521.db2.gz FEZRMAVFLWJKIU-INIZCTEOSA-N 0 3 334.397 2.812 20 5 EFBDHN COc1ccc([C@@H](CN(C)C)NC(=O)c2csc([N+](=O)[O-])c2)cc1 ZINC000284105307 474573563 /nfs/dbraw/zinc/57/35/63/474573563.db2.gz BYGITWYGUZRKLC-CQSZACIVSA-N 0 3 349.412 2.698 20 5 EFBDHN C[C@H](CNC(=O)NCc1ccccc1[N+](=O)[O-])N1CCC[C@@H](C)C1 ZINC000249510120 474583409 /nfs/dbraw/zinc/58/34/09/474583409.db2.gz NVAWJOBVALTHEZ-ZIAGYGMSSA-N 0 3 334.420 2.514 20 5 EFBDHN COCc1cc([N+](=O)[O-])ccc1NC[C@@]1(N(C)C)CCSC1 ZINC000267111857 474593045 /nfs/dbraw/zinc/59/30/45/474593045.db2.gz RGKIKDUBCSBKMX-HNNXBMFYSA-N 0 3 325.434 2.590 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H](N(C)C)C1 ZINC000184727845 474596307 /nfs/dbraw/zinc/59/63/07/474596307.db2.gz AHJAFGKIJNFOAH-RDJZCZTQSA-N 0 3 333.432 2.716 20 5 EFBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN[C@H]1CCCC[C@@H]1C(N)=O ZINC000184828457 474616054 /nfs/dbraw/zinc/61/60/54/474616054.db2.gz FOHLLWMWOXWDLC-GJZGRUSLSA-N 0 3 335.404 2.516 20 5 EFBDHN CC(C)(CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-])OCCO ZINC000291592358 474626546 /nfs/dbraw/zinc/62/65/46/474626546.db2.gz PXOUCTVDIDBZDP-UHFFFAOYSA-N 0 3 337.203 2.779 20 5 EFBDHN CCN1CCCN(c2cc(C)nc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000267252576 474628986 /nfs/dbraw/zinc/62/89/86/474628986.db2.gz URFLIQJACRMTDM-UHFFFAOYSA-N 0 3 341.415 2.892 20 5 EFBDHN C[C@@H](CN1CCCCC1)Nc1ccc([N+](=O)[O-])cc1N1CCOC1=O ZINC000267260447 474631502 /nfs/dbraw/zinc/63/15/02/474631502.db2.gz WSESFJJMMBXRBZ-ZDUSSCGKSA-N 0 3 348.403 2.838 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)N[C@@H](C)C2=CCN(C)CC2)cc1[N+](=O)[O-] ZINC000272885036 474633801 /nfs/dbraw/zinc/63/38/01/474633801.db2.gz YMCQDPKVXMBLKQ-UONOGXRCSA-N 0 3 346.431 2.914 20 5 EFBDHN CCOc1ccc([C@H](C)NCC2(O)CC(OCC)C2)cc1[N+](=O)[O-] ZINC000278439871 474645345 /nfs/dbraw/zinc/64/53/45/474645345.db2.gz KGDDCBJUIYLYQX-MKQDKFQKSA-N 0 3 338.404 2.574 20 5 EFBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNC[C@H](CO)[C@@H]1CCOC1 ZINC000291679322 474647528 /nfs/dbraw/zinc/64/75/28/474647528.db2.gz XDOHQYNQNOUBAL-MWLCHTKSSA-N 0 3 349.214 2.636 20 5 EFBDHN Cc1cccc(CN(C)C[C@H](O)COc2ccccc2[N+](=O)[O-])c1 ZINC000272976229 474656368 /nfs/dbraw/zinc/65/63/68/474656368.db2.gz WZCGCBJCPNEYRJ-INIZCTEOSA-N 0 3 330.384 2.775 20 5 EFBDHN C[C@H]1[C@H](NC(=O)c2ccccc2[N+](=O)[O-])CCN1Cc1ccccc1 ZINC000291730273 474658926 /nfs/dbraw/zinc/65/89/26/474658926.db2.gz IGKCRKROUQGZRZ-WMLDXEAASA-N 0 3 339.395 2.988 20 5 EFBDHN CS[C@@H]1CN(c2cc(C)nc3ccc([N+](=O)[O-])cc32)C[C@@H]1N(C)C ZINC000340783286 474662827 /nfs/dbraw/zinc/66/28/27/474662827.db2.gz QWCMRAFGXJEUFG-DLBZAZTESA-N 0 3 346.456 2.933 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@@H](Cc2ccccc2)[C@H](O)C(F)F)cc1 ZINC000344349213 474674192 /nfs/dbraw/zinc/67/41/92/474674192.db2.gz VODZLJRQTOOGLG-HOTGVXAUSA-N 0 3 336.338 2.922 20 5 EFBDHN Cc1cc(C2CCN(C[C@H](O)c3cccc([N+](=O)[O-])c3)CC2)n[nH]1 ZINC000273019524 474674574 /nfs/dbraw/zinc/67/45/74/474674574.db2.gz RWFUMKIYLZWFBK-KRWDZBQOSA-N 0 3 330.388 2.539 20 5 EFBDHN Cc1cc(C2CCN(C[C@H](O)c3cccc([N+](=O)[O-])c3)CC2)[nH]n1 ZINC000273019524 474674583 /nfs/dbraw/zinc/67/45/83/474674583.db2.gz RWFUMKIYLZWFBK-KRWDZBQOSA-N 0 3 330.388 2.539 20 5 EFBDHN CC(C)[C@H]1N(C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC12CCC2 ZINC000291796121 474691458 /nfs/dbraw/zinc/69/14/58/474691458.db2.gz AHDBNTHIBFNIJI-RHSMWYFYSA-N 0 3 334.416 2.845 20 5 EFBDHN O=[N+]([O-])c1c(F)cccc1NCc1ccccc1CN1CC[C@H](O)C1 ZINC000273050941 474692116 /nfs/dbraw/zinc/69/21/16/474692116.db2.gz BNBKVUJSPMTQNZ-HNNXBMFYSA-N 0 3 345.374 2.913 20 5 EFBDHN C[C@@H](NC[C@@H](O)COc1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000305115038 474694527 /nfs/dbraw/zinc/69/45/27/474694527.db2.gz HOIMEOAHAOFTAR-MLGOLLRUSA-N 0 3 334.347 2.824 20 5 EFBDHN CN1CCN(CCc2ccc([N+](=O)[O-])cc2)C[C@H]1Cc1ccccc1 ZINC000284679316 474718541 /nfs/dbraw/zinc/71/85/41/474718541.db2.gz GXRBBKFRKNIRKT-HXUWFJFHSA-N 0 3 339.439 2.996 20 5 EFBDHN CC(C)[C@@H](NCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C1(CO)CCC1 ZINC000292962623 474737111 /nfs/dbraw/zinc/73/71/11/474737111.db2.gz FUFGQSUEYNDVSP-OAHLLOKOSA-N 0 3 337.376 2.780 20 5 EFBDHN Cc1ccc(C(=O)N(CCN(C)C)Cc2ccco2)cc1[N+](=O)[O-] ZINC000268029981 474759787 /nfs/dbraw/zinc/75/97/87/474759787.db2.gz XMBQVXRWUITXQN-UHFFFAOYSA-N 0 3 331.372 2.700 20 5 EFBDHN COc1ccc([C@H](CN2CCCC2)Nc2c([N+](=O)[O-])ncn2C)cc1 ZINC000273193010 474769079 /nfs/dbraw/zinc/76/90/79/474769079.db2.gz DAKDJUWKOPIIKI-HNNXBMFYSA-N 0 3 345.403 2.586 20 5 EFBDHN C[C@@H](CNC(=O)NCc1cc([N+](=O)[O-])ccc1Cl)N(C)C1CC1 ZINC000268083609 474788855 /nfs/dbraw/zinc/78/88/55/474788855.db2.gz JCYGVEPWNVRLAJ-JTQLQIEISA-N 0 3 340.811 2.530 20 5 EFBDHN CO[C@H](CNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000293056562 474789576 /nfs/dbraw/zinc/78/95/76/474789576.db2.gz RXBUXKUKGSIEOW-MRXNPFEDSA-N 0 3 330.388 2.510 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCN1CC[C@@](CO)(c2ccccc2)C1 ZINC000291994602 474793354 /nfs/dbraw/zinc/79/33/54/474793354.db2.gz XBHYXBORXZVNPG-LJQANCHMSA-N 0 3 342.395 2.610 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCN1CC[C@](CO)(c2ccccc2)C1 ZINC000291994599 474794026 /nfs/dbraw/zinc/79/40/26/474794026.db2.gz XBHYXBORXZVNPG-IBGZPJMESA-N 0 3 342.395 2.610 20 5 EFBDHN Cc1c(CN2CCN(C3CCOCC3)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000278721376 474795293 /nfs/dbraw/zinc/79/52/93/474795293.db2.gz RUGVQPWRRGHRKL-CQSZACIVSA-N 0 3 333.432 2.588 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CNCCC(=O)N1CCCCC1 ZINC000344834966 474798620 /nfs/dbraw/zinc/79/86/20/474798620.db2.gz QLVDIOBHHHMQHN-QINSGFPZSA-N 0 3 331.416 2.990 20 5 EFBDHN C[C@H](CNC(=O)NCCc1ccccc1[N+](=O)[O-])N1CCC[C@H](C)C1 ZINC000340940349 474800103 /nfs/dbraw/zinc/80/01/03/474800103.db2.gz RBCPWAWBLIOMOC-LSDHHAIUSA-N 0 3 348.447 2.557 20 5 EFBDHN C[C@@H](CNC(=O)NCCc1ccccc1[N+](=O)[O-])N1CCCC[C@@H]1C ZINC000340942985 474803054 /nfs/dbraw/zinc/80/30/54/474803054.db2.gz XMVWTPIKNLTWFJ-GJZGRUSLSA-N 0 3 348.447 2.699 20 5 EFBDHN CC(C)N1C[C@H](C)[C@H](NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC000268138443 474820617 /nfs/dbraw/zinc/82/06/17/474820617.db2.gz PEUAMFHRQDRZPY-SMDDNHRTSA-N 0 3 330.388 2.535 20 5 EFBDHN O=[N+]([O-])c1ccc(NCc2ccccc2CN2CC[C@@H](O)C2)cc1 ZINC000273286093 474824336 /nfs/dbraw/zinc/82/43/36/474824336.db2.gz YSXMSHONTACBJW-GOSISDBHSA-N 0 3 327.384 2.774 20 5 EFBDHN Nc1ccc(N[C@@H]2CCCN(Cc3ccccc3)C2)nc1[N+](=O)[O-] ZINC000310230441 474826215 /nfs/dbraw/zinc/82/62/15/474826215.db2.gz JIJUVYMCJBXGDT-CQSZACIVSA-N 0 3 327.388 2.649 20 5 EFBDHN CCc1nn(C)c(N[C@H]2CCN(Cc3ccccc3)[C@H]2C)c1[N+](=O)[O-] ZINC000310687727 474828724 /nfs/dbraw/zinc/82/87/24/474828724.db2.gz MVFQJQCDEIOZAR-BBRMVZONSA-N 0 3 343.431 2.966 20 5 EFBDHN CCc1nn(C)c(N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)c1[N+](=O)[O-] ZINC000310687730 474829080 /nfs/dbraw/zinc/82/90/80/474829080.db2.gz MVFQJQCDEIOZAR-CJNGLKHVSA-N 0 3 343.431 2.966 20 5 EFBDHN Nc1ccc(NC[C@H]2CCCN(Cc3ccccc3)C2)nc1[N+](=O)[O-] ZINC000310778888 474829335 /nfs/dbraw/zinc/82/93/35/474829335.db2.gz BDDRMULYWNPYGM-OAHLLOKOSA-N 0 3 341.415 2.896 20 5 EFBDHN COC(=O)CCN(C/C=C\c1ccccc1[N+](=O)[O-])C[C@@H]1CCCO1 ZINC000255380004 474845608 /nfs/dbraw/zinc/84/56/08/474845608.db2.gz CVTMWMSSTOLBAF-OUOZUETKSA-N 0 3 348.399 2.652 20 5 EFBDHN CC(C)C[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1F)N(C)C ZINC000273352507 474855161 /nfs/dbraw/zinc/85/51/61/474855161.db2.gz CTAYQBXCSIPEHQ-GFCCVEGCSA-N 0 3 326.372 2.832 20 5 EFBDHN CS[C@H]1CN(C(=O)c2c(C)cccc2[N+](=O)[O-])C[C@@H]1N1CCCC1 ZINC000278829800 474859533 /nfs/dbraw/zinc/85/95/33/474859533.db2.gz VDIFWQDNEZOYOD-GJZGRUSLSA-N 0 3 349.456 2.555 20 5 EFBDHN C[C@@H]1CN(C2CCOCC2)CCN1c1ccc(Cl)cc1[N+](=O)[O-] ZINC000278874566 474886187 /nfs/dbraw/zinc/88/61/87/474886187.db2.gz ZRWNVYPEJXVZGF-GFCCVEGCSA-N 0 3 339.823 2.938 20 5 EFBDHN CCCC(CCC)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000273453211 474904929 /nfs/dbraw/zinc/90/49/29/474904929.db2.gz PCUSFFNMUIGXLH-UHFFFAOYSA-N 0 3 328.434 2.927 20 5 EFBDHN CS[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2C)C[C@H]1N1CCCC1 ZINC000273451880 474905511 /nfs/dbraw/zinc/90/55/11/474905511.db2.gz CVBNGTJTOLGCII-CVEARBPZSA-N 0 3 349.456 2.555 20 5 EFBDHN CN(C(=O)/C=C\c1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CCCN(C)C1 ZINC000255846099 474907564 /nfs/dbraw/zinc/90/75/64/474907564.db2.gz PQUWCNDQQQOETP-WOLRVDTOSA-N 0 3 337.807 2.814 20 5 EFBDHN C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@H]2CCN(C)C[C@@H]21 ZINC000273457669 474907884 /nfs/dbraw/zinc/90/78/84/474907884.db2.gz DXRAJGZKRUOVSK-OHKBXWSGSA-N 0 3 329.400 2.551 20 5 EFBDHN CC1(C)CCC[C@@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000273467395 474915607 /nfs/dbraw/zinc/91/56/07/474915607.db2.gz RJPRNGCVAVWATG-CYBMUJFWSA-N 0 3 340.445 2.927 20 5 EFBDHN CS[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)C[C@H]1N1CCCC1 ZINC000273523791 474944288 /nfs/dbraw/zinc/94/42/88/474944288.db2.gz PYNCDRNHTKDHSQ-HZPDHXFCSA-N 0 3 349.456 2.555 20 5 EFBDHN CS[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)C[C@@H]1N1CCCC1 ZINC000273523790 474944893 /nfs/dbraw/zinc/94/48/93/474944893.db2.gz PYNCDRNHTKDHSQ-HOTGVXAUSA-N 0 3 349.456 2.555 20 5 EFBDHN O=[N+]([O-])c1ccc(CNC2CCN(CC(F)(F)F)CC2)c(F)c1 ZINC000345161683 474948208 /nfs/dbraw/zinc/94/82/08/474948208.db2.gz HXVWYSCUYQYXAW-UHFFFAOYSA-N 0 3 335.301 2.850 20 5 EFBDHN C[C@@H](C1CCN(C)CC1)N(C)C(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000273545937 474957681 /nfs/dbraw/zinc/95/76/81/474957681.db2.gz UXPDMKAWLLRTKL-AWEZNQCLSA-N 0 3 348.447 2.509 20 5 EFBDHN CN(Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C1(CO)CCOCC1 ZINC000339130567 474959707 /nfs/dbraw/zinc/95/97/07/474959707.db2.gz ZGYUQDHXCSPANU-UHFFFAOYSA-N 0 3 348.321 2.587 20 5 EFBDHN CCN(CC)CCCCNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000345175146 474962472 /nfs/dbraw/zinc/96/24/72/474962472.db2.gz PQWXDUWKBVEEPT-UHFFFAOYSA-N 0 3 343.449 2.532 20 5 EFBDHN Cc1ccc(C)c(OC[C@H](O)CNCc2cccc([N+](=O)[O-])c2)c1 ZINC000324478740 474969918 /nfs/dbraw/zinc/96/99/18/474969918.db2.gz CJQGLJKLBKLTMN-QGZVFWFLSA-N 0 3 330.384 2.741 20 5 EFBDHN C[C@@H](N[C@@H](CO)Cc1ccc(F)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000285358833 474988523 /nfs/dbraw/zinc/98/85/23/474988523.db2.gz VONVSMSEMMGKIW-IAQYHMDHSA-N 0 3 333.363 2.570 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CNCCC2(O)CCOCC2)o1 ZINC000285367688 474990571 /nfs/dbraw/zinc/99/05/71/474990571.db2.gz BVXZCOVLVKNRSR-UHFFFAOYSA-N 0 3 346.383 2.876 20 5 EFBDHN Cc1cc(C(=O)N2CCN(C3CCC3)C[C@@H](C)C2)cc([N+](=O)[O-])c1 ZINC000292378702 474992425 /nfs/dbraw/zinc/99/24/25/474992425.db2.gz MTYZIUGLUNTRIV-CQSZACIVSA-N 0 3 331.416 2.850 20 5 EFBDHN Cc1c(C(=O)NC[C@@H]2NCCc3ccccc32)cccc1[N+](=O)[O-] ZINC000261624994 475001100 /nfs/dbraw/zinc/00/11/00/475001100.db2.gz GPOZBLRLPAQRPI-INIZCTEOSA-N 0 3 325.368 2.520 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1Nc1ncc([N+](=O)[O-])cn1 ZINC000273665825 475004601 /nfs/dbraw/zinc/00/46/01/475004601.db2.gz WXFNJBZKTBVMRX-CJNGLKHVSA-N 0 3 327.388 2.707 20 5 EFBDHN CN(C[C@@H]1CCCN(C)C1)c1ncc(Br)cc1[N+](=O)[O-] ZINC000268485397 475009499 /nfs/dbraw/zinc/00/94/99/475009499.db2.gz MNADRRXTAZJGFH-SNVBAGLBSA-N 0 3 343.225 2.530 20 5 EFBDHN CN(CCc1ccccc1[N+](=O)[O-])C[C@@H](O)COc1ccc(F)cc1 ZINC000285436838 475025044 /nfs/dbraw/zinc/02/50/44/475025044.db2.gz XFOSISFQTVCPBD-MRXNPFEDSA-N 0 3 348.374 2.648 20 5 EFBDHN CCOc1cc(CN2C[C@@H](C)[C@@](C)(C(=O)OC)C2)ccc1[N+](=O)[O-] ZINC000337479055 475054988 /nfs/dbraw/zinc/05/49/88/475054988.db2.gz ZTBJPMMFHANZKA-PXAZEXFGSA-N 0 3 336.388 2.625 20 5 EFBDHN CCc1ccc(C(=O)N2C[C@@H](c3ccccc3)[C@H](N)C2)cc1[N+](=O)[O-] ZINC000261808101 475070802 /nfs/dbraw/zinc/07/08/02/475070802.db2.gz RKCVPZVKUSQADC-DLBZAZTESA-N 0 3 339.395 2.724 20 5 EFBDHN C[C@H](NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)C1=CCN(C)CC1 ZINC000273863873 475089185 /nfs/dbraw/zinc/08/91/85/475089185.db2.gz OLBPDGLKIWZXKZ-LBPRGKRZSA-N 0 3 349.406 2.778 20 5 EFBDHN COC[C@@H](O)CN[C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000268965114 475099574 /nfs/dbraw/zinc/09/95/74/475099574.db2.gz YOIHUTNWXSIGJV-RYUDHWBXSA-N 0 3 336.413 2.981 20 5 EFBDHN COc1cc(C[NH2+]C[C@H](CO)CC2CCCC2)c([N+](=O)[O-])cc1[O-] ZINC000341513186 475103933 /nfs/dbraw/zinc/10/39/33/475103933.db2.gz PQHGUSDWQJVTCQ-CYBMUJFWSA-N 0 3 338.404 2.587 20 5 EFBDHN C[C@@H](CN(C)C)NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000287354949 475109433 /nfs/dbraw/zinc/10/94/33/475109433.db2.gz ZYBDSKZADRDYMM-AWEZNQCLSA-N 0 3 348.447 2.511 20 5 EFBDHN COc1cc(NCCCCN2C[C@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000269044129 475144631 /nfs/dbraw/zinc/14/46/31/475144631.db2.gz NMIXOQCGERLEJF-KBPBESRZSA-N 0 3 337.420 2.905 20 5 EFBDHN COc1cc(NCCCCN2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000269044131 475145054 /nfs/dbraw/zinc/14/50/54/475145054.db2.gz NMIXOQCGERLEJF-OKILXGFUSA-N 0 3 337.420 2.905 20 5 EFBDHN C[C@H](CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)N(C)C1CC1 ZINC000273996771 475156140 /nfs/dbraw/zinc/15/61/40/475156140.db2.gz YWXZZXHVCRFEES-LLVKDONJSA-N 0 3 337.395 2.610 20 5 EFBDHN COc1cc(CN[C@@H]2[C@@H]3CCO[C@H]3C23CCC3)c([N+](=O)[O-])cc1F ZINC000296041238 475175142 /nfs/dbraw/zinc/17/51/42/475175142.db2.gz ODDSQROMRYTWQF-IUIKQTSFSA-N 0 3 336.363 2.790 20 5 EFBDHN CN1CCC[C@]2(CCN(c3cc(C(F)(F)F)ncc3[N+](=O)[O-])C2)C1 ZINC000292796300 475199332 /nfs/dbraw/zinc/19/93/32/475199332.db2.gz MZFSIXLNKDSTMN-AWEZNQCLSA-N 0 3 344.337 2.931 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@]2(C1)CCCN(C)C2 ZINC000296127603 475205001 /nfs/dbraw/zinc/20/50/01/475205001.db2.gz IQTNFEHZOUGOIN-QGZVFWFLSA-N 0 3 348.403 2.553 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCN1CCNC[C@H]1c1cccc(F)c1 ZINC000262309309 475218295 /nfs/dbraw/zinc/21/82/95/475218295.db2.gz YRSSALCFKMFFFQ-KRWDZBQOSA-N 0 3 345.374 2.759 20 5 EFBDHN CN(C)Cc1ccccc1C(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000345507597 475226393 /nfs/dbraw/zinc/22/63/93/475226393.db2.gz PKIYLLSVNFLTEY-UHFFFAOYSA-N 0 3 327.384 2.929 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CNC2(c3ccc(F)cc3)CC2)c1 ZINC000341693796 475227234 /nfs/dbraw/zinc/22/72/34/475227234.db2.gz MGTCCBHGSJNODT-INIZCTEOSA-N 0 3 346.358 2.753 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCN(C2CC2)C1 ZINC000361159166 475232088 /nfs/dbraw/zinc/23/20/88/475232088.db2.gz ISGMEYZDVBPDNU-CABCVRRESA-N 0 3 331.416 2.516 20 5 EFBDHN COCCOC[C@@H]1CCN(C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000347354038 475259748 /nfs/dbraw/zinc/25/97/48/475259748.db2.gz HZKWQGPTNQFGFK-XBNGYDHASA-N 0 3 334.416 2.983 20 5 EFBDHN CC(=O)NCC1CCN(C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC1 ZINC000347370361 475273316 /nfs/dbraw/zinc/27/33/16/475273316.db2.gz VFHIHEPEBGTSNS-GXDHUFHOSA-N 0 3 331.416 2.846 20 5 EFBDHN Cc1ccc(CN(C)C)cc1NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 ZINC000361219476 475278709 /nfs/dbraw/zinc/27/87/09/475278709.db2.gz DPYNYRLHFSOZDT-UHFFFAOYSA-N 0 3 345.403 2.535 20 5 EFBDHN CC(C)c1nnc(CN[C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)[nH]1 ZINC000296427118 475311395 /nfs/dbraw/zinc/31/13/95/475311395.db2.gz LRHQYBARKOZYTP-AWEZNQCLSA-N 0 3 329.404 2.947 20 5 EFBDHN CC(C)c1nnc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)[n-]1 ZINC000296427118 475311400 /nfs/dbraw/zinc/31/14/00/475311400.db2.gz LRHQYBARKOZYTP-AWEZNQCLSA-N 0 3 329.404 2.947 20 5 EFBDHN Cc1ccc2c(c1)CN(CCn1cc([N+](=O)[O-])ccc1=O)C(C)(C)C2 ZINC000339636302 475365255 /nfs/dbraw/zinc/36/52/55/475365255.db2.gz NGJMVGIDOWOONY-UHFFFAOYSA-N 0 3 341.411 2.902 20 5 EFBDHN COCC[C@@H](N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000337845445 475371721 /nfs/dbraw/zinc/37/17/21/475371721.db2.gz HBWNPHWQCCSBJJ-IUODEOHRSA-N 0 3 337.420 2.963 20 5 EFBDHN COCC[C@@H](N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000337845448 475372191 /nfs/dbraw/zinc/37/21/91/475372191.db2.gz HBWNPHWQCCSBJJ-SWLSCSKDSA-N 0 3 337.420 2.963 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCNC1(c2ccc(Cl)cc2)CC1 ZINC000341875747 475374217 /nfs/dbraw/zinc/37/42/17/475374217.db2.gz JPRPHGIYHZTETD-UHFFFAOYSA-N 0 3 333.775 2.689 20 5 EFBDHN COCC[C@@H](N[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)C(C)(C)C ZINC000337853048 475378247 /nfs/dbraw/zinc/37/82/47/475378247.db2.gz KBEUZJIXWLFQAJ-IUODEOHRSA-N 0 3 337.420 2.963 20 5 EFBDHN COCC[C@@H](N[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])C(C)(C)C ZINC000337862914 475387129 /nfs/dbraw/zinc/38/71/29/475387129.db2.gz OEFWZXOXVUZCQY-SWLSCSKDSA-N 0 3 337.420 2.963 20 5 EFBDHN COCC[C@H](N[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])C(C)(C)C ZINC000337862912 475387377 /nfs/dbraw/zinc/38/73/77/475387377.db2.gz OEFWZXOXVUZCQY-DOMZBBRYSA-N 0 3 337.420 2.963 20 5 EFBDHN COCC[C@@H](N[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])C(C)(C)C ZINC000337862913 475387917 /nfs/dbraw/zinc/38/79/17/475387917.db2.gz OEFWZXOXVUZCQY-IUODEOHRSA-N 0 3 337.420 2.963 20 5 EFBDHN CN1CCC[C@@]2(CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3F)C2)C1 ZINC000296605244 475392385 /nfs/dbraw/zinc/39/23/85/475392385.db2.gz OVJAAMSEYLWUCH-MRXNPFEDSA-N 0 3 336.367 2.684 20 5 EFBDHN Cc1ccccc1OC[C@@H](O)CN(C)CCc1ccccc1[N+](=O)[O-] ZINC000352543296 475397459 /nfs/dbraw/zinc/39/74/59/475397459.db2.gz COTZJBTUYIIKEV-KRWDZBQOSA-N 0 3 344.411 2.817 20 5 EFBDHN C[C@@H]1[C@H](NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)CCCN1C ZINC000345740978 475409573 /nfs/dbraw/zinc/40/95/73/475409573.db2.gz HXTQSOYNRIATNU-CZUORRHYSA-N 0 3 346.431 2.752 20 5 EFBDHN COc1cc(CN2CCN(C3CC3)C[C@@H](C)C2)c([N+](=O)[O-])cc1F ZINC000296707648 475439322 /nfs/dbraw/zinc/43/93/22/475439322.db2.gz LOSFPAXFJYFTCS-LBPRGKRZSA-N 0 3 337.395 2.659 20 5 EFBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCCN(C)[C@H]1C ZINC000345778190 475442994 /nfs/dbraw/zinc/44/29/94/475442994.db2.gz LEOMHAFAWVTKMK-WMLDXEAASA-N 0 3 348.447 2.998 20 5 EFBDHN CCc1ccc(C(=O)N[C@H]2CCN(C3CCCC3)C2)cc1[N+](=O)[O-] ZINC000331962636 475470049 /nfs/dbraw/zinc/47/00/49/475470049.db2.gz QWQOFDQBGKHCPD-HNNXBMFYSA-N 0 3 331.416 2.904 20 5 EFBDHN CCc1ccc(C(=O)N[C@@H]2CCN(C3CCCC3)C2)cc1[N+](=O)[O-] ZINC000331962639 475470273 /nfs/dbraw/zinc/47/02/73/475470273.db2.gz QWQOFDQBGKHCPD-OAHLLOKOSA-N 0 3 331.416 2.904 20 5 EFBDHN CN(CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@@H]1CCC(C)(C)C1 ZINC000361468252 475471710 /nfs/dbraw/zinc/47/17/10/475471710.db2.gz FSKVGUFVSQVHHR-OAHLLOKOSA-N 0 3 331.416 2.994 20 5 EFBDHN CS[C@@H]1CN(C(=O)c2cc(C)ccc2[N+](=O)[O-])C[C@H]1N1CCCC1 ZINC000332070171 475499508 /nfs/dbraw/zinc/49/95/08/475499508.db2.gz BMMODXNMCKQEDI-HZPDHXFCSA-N 0 3 349.456 2.555 20 5 EFBDHN C[C@H](NC[C@@H](O)COCc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000296846305 475503188 /nfs/dbraw/zinc/50/31/88/475503188.db2.gz XPPVQVXUNKGKCE-KBXCAEBGSA-N 0 3 330.384 2.823 20 5 EFBDHN CC[C@H]1[C@@H](C)CCN1Cc1ccc(OCC(=O)OC)c([N+](=O)[O-])c1 ZINC000354914541 475514730 /nfs/dbraw/zinc/51/47/30/475514730.db2.gz DPCQUNFLUKXTJP-JSGCOSHPSA-N 0 3 336.388 2.767 20 5 EFBDHN COC(=O)COc1ccc(CN2CCCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000354924365 475525198 /nfs/dbraw/zinc/52/51/98/475525198.db2.gz OGCVAZDZUOCWDD-CYBMUJFWSA-N 0 3 336.388 2.769 20 5 EFBDHN Cn1nccc1[C@@H]1CCCN(CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000338031596 475525426 /nfs/dbraw/zinc/52/54/26/475525426.db2.gz VLECBTNHQSXVHC-CQSZACIVSA-N 0 3 330.388 2.587 20 5 EFBDHN COC(=O)[C@@]12CN(Cc3cc([N+](=O)[O-])ccc3OC)C[C@@H]1CCCC2 ZINC000342158897 475565861 /nfs/dbraw/zinc/56/58/61/475565861.db2.gz RXMJTFYLODAGPJ-KSSFIOAISA-N 0 3 348.399 2.769 20 5 EFBDHN CCOc1cccc(NC[C@@]2(N(C)C)CCSC2)c1[N+](=O)[O-] ZINC000358294477 475566616 /nfs/dbraw/zinc/56/66/16/475566616.db2.gz YKUDHXXOFRJFTD-HNNXBMFYSA-N 0 3 325.434 2.843 20 5 EFBDHN CC(C)[C@@H](CN(C)Cc1ccccc1)Nc1c([N+](=O)[O-])ncn1C ZINC000346224643 475573398 /nfs/dbraw/zinc/57/33/98/475573398.db2.gz RVZRMKZQXAPQJO-OAHLLOKOSA-N 0 3 331.420 2.897 20 5 EFBDHN COC(=O)[C@H]1CSCCN([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000332258413 475576637 /nfs/dbraw/zinc/57/66/37/475576637.db2.gz ZZQDZDRCTWRTHQ-QWHCGFSZSA-N 0 3 338.429 2.802 20 5 EFBDHN C[C@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1F)N1CCCC[C@@H]1C ZINC000358327287 475592784 /nfs/dbraw/zinc/59/27/84/475592784.db2.gz FYGDVLFBXQWHMT-QWHCGFSZSA-N 0 3 337.395 2.656 20 5 EFBDHN CN(C)Cc1ccccc1CNC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000358327308 475593276 /nfs/dbraw/zinc/59/32/76/475593276.db2.gz GERYLPVZJHJOHM-UHFFFAOYSA-N 0 3 345.374 2.654 20 5 EFBDHN COC(=O)COc1ccc(CN2CC[C@@H]3CCC[C@@H]32)cc1[N+](=O)[O-] ZINC000355034381 475613371 /nfs/dbraw/zinc/61/33/71/475613371.db2.gz HCWBDZARJMMTDD-KBPBESRZSA-N 0 3 334.372 2.521 20 5 EFBDHN C[C@H](C(=O)N1CCC[C@@H](N2CCCC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000332388300 475623222 /nfs/dbraw/zinc/62/32/22/475623222.db2.gz CHFYQECYEHQJQS-DZGCQCFKSA-N 0 3 349.406 2.924 20 5 EFBDHN C[C@H]1CSC[C@@H]1NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000352789292 475627790 /nfs/dbraw/zinc/62/77/90/475627790.db2.gz BQUVZMPWGYCBCK-UFBFGSQYSA-N 0 3 329.809 2.528 20 5 EFBDHN C[C@H]1CSC[C@H]1NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000352803190 475639890 /nfs/dbraw/zinc/63/98/90/475639890.db2.gz XXMXRRRQTVLQGD-GZMMTYOYSA-N 0 3 329.809 2.528 20 5 EFBDHN C[C@H](CNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12)N1CCC[C@@H](C)C1 ZINC000342923721 475655367 /nfs/dbraw/zinc/65/53/67/475655367.db2.gz FYWRPMAKWNTMGR-CHWSQXEVSA-N 0 3 344.415 2.926 20 5 EFBDHN COc1cc(CN2C[C@@H]3CCCCN3C[C@@H]2C)c([N+](=O)[O-])cc1F ZINC000332524396 475658229 /nfs/dbraw/zinc/65/82/29/475658229.db2.gz RBMSBONXKLFTSK-JSGCOSHPSA-N 0 3 337.395 2.801 20 5 EFBDHN CC[C@H]1CN2CCC[C@H]2CN1C(=O)CSc1ccccc1[N+](=O)[O-] ZINC000332577170 475674246 /nfs/dbraw/zinc/67/42/46/475674246.db2.gz GKLSCFCFYHOIFJ-KBPBESRZSA-N 0 3 349.456 2.772 20 5 EFBDHN CCCN1CCC[C@H]1CNCc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000353125428 475700498 /nfs/dbraw/zinc/70/04/98/475700498.db2.gz LCFOPABOALTNMR-AWEZNQCLSA-N 0 3 337.420 2.576 20 5 EFBDHN CC(C)(C(=O)N1CC[C@H](N2CCCCC2)C1)c1ccccc1[N+](=O)[O-] ZINC000340055312 475720844 /nfs/dbraw/zinc/72/08/44/475720844.db2.gz VLYYXQRZYDRFOK-HNNXBMFYSA-N 0 3 345.443 2.959 20 5 EFBDHN C[C@H](N[C@H]1CCC[C@H]1OC(F)F)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000348531969 475732188 /nfs/dbraw/zinc/73/21/88/475732188.db2.gz MXJUWPRMHLQHGA-TVYUQYBPSA-N 0 3 343.330 2.672 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@@H]1CCC[C@H]1OC(F)F ZINC000348538664 475739481 /nfs/dbraw/zinc/73/94/81/475739481.db2.gz UPSFNBNPILZABE-CHWSQXEVSA-N 0 3 343.330 2.592 20 5 EFBDHN NC(=O)[C@H](CNCc1ccccc1[N+](=O)[O-])Cc1ccccc1Cl ZINC000346675085 475754216 /nfs/dbraw/zinc/75/42/16/475754216.db2.gz OAUOVSDXUHNZTQ-AWEZNQCLSA-N 0 3 347.802 2.682 20 5 EFBDHN Cc1c(CNC(=O)NC[C@H](C)N2CCCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000358548137 475762298 /nfs/dbraw/zinc/76/22/98/475762298.db2.gz TUNBVAQDMBGHAE-KBPBESRZSA-N 0 3 348.447 2.965 20 5 EFBDHN Cc1c(CNC(=O)NC[C@H](C)N2CCCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000358548138 475762655 /nfs/dbraw/zinc/76/26/55/475762655.db2.gz TUNBVAQDMBGHAE-KGLIPLIRSA-N 0 3 348.447 2.965 20 5 EFBDHN C[C@H](Cc1ccc(O)cc1)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000353226301 475785352 /nfs/dbraw/zinc/78/53/52/475785352.db2.gz GIRNLLAEABAIDD-LLVKDONJSA-N 0 3 326.356 2.898 20 5 EFBDHN C[C@H](NC(=O)N(C)[C@H]1CCN(C)C[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000297544080 475800622 /nfs/dbraw/zinc/80/06/22/475800622.db2.gz JCZOLLYUXZDMGR-WWGRRREGSA-N 0 3 334.420 2.637 20 5 EFBDHN C[C@H](NC(=O)N1CC[C@@]2(C1)CCCN(C)C2)c1ccc([N+](=O)[O-])cc1 ZINC000297552669 475805021 /nfs/dbraw/zinc/80/50/21/475805021.db2.gz JWXYGASRZLYBAK-KSSFIOAISA-N 0 3 346.431 2.783 20 5 EFBDHN COCC[C@@H](NCC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000338344324 475807391 /nfs/dbraw/zinc/80/73/91/475807391.db2.gz AOAOGDNNYHFGFS-OAHLLOKOSA-N 0 3 337.420 2.598 20 5 EFBDHN COCC[C@H](NCC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C(C)(C)C ZINC000338347879 475811791 /nfs/dbraw/zinc/81/17/91/475811791.db2.gz DFKPVGQJOAPXGC-INIZCTEOSA-N 0 3 349.431 2.525 20 5 EFBDHN Cc1nc(N(C)[C@H]2CCCN(Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000297618531 475830271 /nfs/dbraw/zinc/83/02/71/475830271.db2.gz WGWJIBKAQCGXEV-INIZCTEOSA-N 0 3 341.415 2.794 20 5 EFBDHN CC(C)CN(CCN(C)C)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000355338260 475842089 /nfs/dbraw/zinc/84/20/89/475842089.db2.gz RIYNGDBJSNSGFH-UHFFFAOYSA-N 0 3 348.447 2.829 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N(CCN(C)C)C2CCCC2)c1 ZINC000338437587 475903229 /nfs/dbraw/zinc/90/32/29/475903229.db2.gz DQNGPJYKSSTDSD-UHFFFAOYSA-N 0 3 349.431 2.940 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCN(C)[C@H](C)C1 ZINC000343286309 475920451 /nfs/dbraw/zinc/92/04/51/475920451.db2.gz XTXKCHNLZKQBRS-VXGBXAGGSA-N 0 3 337.445 2.919 20 5 EFBDHN C[C@@H]1CCN(C)CCN1Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000353458357 475986787 /nfs/dbraw/zinc/98/67/87/475986787.db2.gz CDDBCWDLVBTFRF-LLVKDONJSA-N 0 3 329.347 2.722 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCN2CCC(c3ccncn3)CC2)cc1 ZINC000298139636 475994941 /nfs/dbraw/zinc/99/49/41/475994941.db2.gz LLGJMYPCUGSSAC-UHFFFAOYSA-N 0 3 328.372 2.643 20 5 EFBDHN CCOC1(C)CCN(CCOc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC000298247516 476033530 /nfs/dbraw/zinc/03/35/30/476033530.db2.gz KATCHSKIRGIGAD-UHFFFAOYSA-N 0 3 338.404 2.873 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NCCN2CCCC(C)(C)C2)c1 ZINC000338605584 476047894 /nfs/dbraw/zinc/04/78/94/476047894.db2.gz AKHWPBZMYMAXBX-UHFFFAOYSA-N 0 3 349.431 2.845 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCCN(C)[C@H]1C ZINC000343438779 476065933 /nfs/dbraw/zinc/06/59/33/476065933.db2.gz LOPVKZNEJNOOJE-SMDDNHRTSA-N 0 3 337.445 2.919 20 5 EFBDHN C[C@H]1C[C@H](N2CCCC2)CN1c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000343593045 476090945 /nfs/dbraw/zinc/09/09/45/476090945.db2.gz PBIMYMXOJCPLJT-WFASDCNBSA-N 0 3 343.387 2.708 20 5 EFBDHN C[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1F)N1CCC[C@H](C)C1 ZINC000334043750 476096832 /nfs/dbraw/zinc/09/68/32/476096832.db2.gz MMKMPMHXADGZSU-NWDGAFQWSA-N 0 3 338.383 2.976 20 5 EFBDHN O=C1NCCc2ccc(CNC/C=C\c3ccccc3[N+](=O)[O-])cc21 ZINC000350269816 476114623 /nfs/dbraw/zinc/11/46/23/476114623.db2.gz SAOWQXWWIMWEJU-HYXAFXHYSA-N 0 3 337.379 2.684 20 5 EFBDHN CCNC(=O)[C@H](C)NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000338714623 476127448 /nfs/dbraw/zinc/12/74/48/476127448.db2.gz UHDJUMUHMVRTHL-NSHDSACASA-N 0 3 333.413 2.938 20 5 EFBDHN CN(C)C[C@H](NC(=O)c1cc([N+](=O)[O-])c[nH]1)c1ccc(Cl)cc1 ZINC000338751310 476155067 /nfs/dbraw/zinc/15/50/67/476155067.db2.gz AGMLIFOZWOTWNB-AWEZNQCLSA-N 0 3 336.779 2.609 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CNCCn2cncn2)s1 ZINC000336897274 476186520 /nfs/dbraw/zinc/18/65/20/476186520.db2.gz OHKHJSNNAPXPPD-UHFFFAOYSA-N 0 3 329.385 2.705 20 5 EFBDHN CN(C)c1nccc(CN[C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)n1 ZINC000344293703 476224932 /nfs/dbraw/zinc/22/49/32/476224932.db2.gz IKBPUMGQDXLIII-INIZCTEOSA-N 0 3 341.415 2.562 20 5 EFBDHN C[C@H](CN1CCC[C@@H](C)C1)NC(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000347295678 476239058 /nfs/dbraw/zinc/23/90/58/476239058.db2.gz YSYFCZQBIYQJHE-VXGBXAGGSA-N 0 3 338.383 2.976 20 5 EFBDHN O=[N+]([O-])c1cccc(CN[C@@H](CO)Cc2c[nH]c3ccccc23)c1 ZINC000344315359 476243153 /nfs/dbraw/zinc/24/31/53/476243153.db2.gz IUGAUYGTQLOBDP-OAHLLOKOSA-N 0 3 325.368 2.769 20 5 EFBDHN CN(Cc1ccccc1)[C@@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]1)C1CC1 ZINC000357306620 476324619 /nfs/dbraw/zinc/32/46/19/476324619.db2.gz NWZDPHKQLSPRLI-KRWDZBQOSA-N 0 3 342.399 2.563 20 5 EFBDHN CN(C[C@H]1CCN(C)[C@H]1c1cccnc1)c1ccc([N+](=O)[O-])nc1 ZINC000362677253 476348558 /nfs/dbraw/zinc/34/85/58/476348558.db2.gz XLXJKBSNVUCTGF-PBHICJAKSA-N 0 3 327.388 2.514 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2ccc(CNC[C@H](CO)[C@H]3CCOC3)o2)c1 ZINC000360761713 476371502 /nfs/dbraw/zinc/37/15/02/476371502.db2.gz CLJFRZNGHZNBBV-LSDHHAIUSA-N 0 3 346.383 2.589 20 5 EFBDHN O=C(CCN1CCC(C(F)F)CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000362733136 476376779 /nfs/dbraw/zinc/37/67/79/476376779.db2.gz ISAMFIMFOPXBPH-UHFFFAOYSA-N 0 3 327.331 2.901 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN2CCC(OCCO)CC2)o1 ZINC000354034084 476381677 /nfs/dbraw/zinc/38/16/77/476381677.db2.gz PABXWAHMGGNNKL-UHFFFAOYSA-N 0 3 346.383 2.828 20 5 EFBDHN COc1ccc(-c2ccc(CN3CC[C@@](C)(O)C3)o2)c([N+](=O)[O-])c1 ZINC000354045078 476388348 /nfs/dbraw/zinc/38/83/48/476388348.db2.gz PMXNQAGQDFBSQB-QGZVFWFLSA-N 0 3 332.356 2.820 20 5 EFBDHN CN(C)Cc1ccccc1C(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000362862243 476447981 /nfs/dbraw/zinc/44/79/81/476447981.db2.gz IRZHNJGETWKRSO-UHFFFAOYSA-N 0 3 327.384 2.629 20 5 EFBDHN CN(Cc1ccccc1)[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])o2)C1 ZINC000369709078 476487905 /nfs/dbraw/zinc/48/79/05/476487905.db2.gz NQINQOFNWCRRIH-CQSZACIVSA-N 0 3 329.356 2.534 20 5 EFBDHN CN(Cc1ccccc1)[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])o2)C1 ZINC000369709077 476488028 /nfs/dbraw/zinc/48/80/28/476488028.db2.gz NQINQOFNWCRRIH-AWEZNQCLSA-N 0 3 329.356 2.534 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H]2CCN(C)C[C@H]21 ZINC000360944821 476493729 /nfs/dbraw/zinc/49/37/29/476493729.db2.gz PENLEPBXHMMYCX-JFIYKMOQSA-N 0 3 345.443 2.716 20 5 EFBDHN COc1ccc(-c2ccc(CNC[C@H](O)C3CC3)o2)c([N+](=O)[O-])c1 ZINC000357755985 476581490 /nfs/dbraw/zinc/58/14/90/476581490.db2.gz BDCSWLATDMEDQN-INIZCTEOSA-N 0 3 332.356 2.724 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCN([C@@H]2CCCN(C)C2)CC1 ZINC000374916800 476592224 /nfs/dbraw/zinc/59/22/24/476592224.db2.gz PSVYAQXTUKIVEP-FUHWJXTLSA-N 0 3 346.475 2.676 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1N1CCC(C)(CN2CCN(C)CC2)CC1 ZINC000374926822 476599603 /nfs/dbraw/zinc/59/96/03/476599603.db2.gz LFABQETXTDPIJN-UHFFFAOYSA-N 0 3 346.475 2.757 20 5 EFBDHN CC(C)NC(=O)c1ccc(N[C@@H]2CCN(C)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000361100200 476601587 /nfs/dbraw/zinc/60/15/87/476601587.db2.gz XYMQOHYMXHPLJV-TZMCWYRMSA-N 0 3 334.420 2.628 20 5 EFBDHN CCc1cnccc1[C@H](C)NC[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000361129207 476621167 /nfs/dbraw/zinc/62/11/67/476621167.db2.gz DKOGCHYGNBRRJV-XJKSGUPXSA-N 0 3 345.399 2.643 20 5 EFBDHN CCc1cnccc1[C@H](C)NC[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000361129204 476621225 /nfs/dbraw/zinc/62/12/25/476621225.db2.gz DKOGCHYGNBRRJV-BBRMVZONSA-N 0 3 345.399 2.643 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CCC[C@H](C[C@@H]3CCOC3)C2)c1 ZINC000375010967 476633782 /nfs/dbraw/zinc/63/37/82/476633782.db2.gz DDMPQMMGRIHSJY-RVKKMQEKSA-N 0 3 334.416 2.767 20 5 EFBDHN O=C(Nc1cccc([N+](=O)[O-])c1Cl)N1CC[C@@H](N2CCCC2)C1 ZINC000375083633 476672331 /nfs/dbraw/zinc/67/23/31/476672331.db2.gz GTISZPYSCKQUKL-LLVKDONJSA-N 0 3 338.795 2.950 20 5 EFBDHN CN(C[C@@H]1CCCN1C)C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000421709633 476691172 /nfs/dbraw/zinc/69/11/72/476691172.db2.gz GFLMJKFXUBEUKU-NSHDSACASA-N 0 3 345.321 2.780 20 5 EFBDHN CC(C)Oc1cc(C(=O)N[C@@H]2CCCN(C(C)C)C2)ccc1[N+](=O)[O-] ZINC000413715459 476703062 /nfs/dbraw/zinc/70/30/62/476703062.db2.gz RNYKSEQQJLUXSQ-OAHLLOKOSA-N 0 3 349.431 2.985 20 5 EFBDHN C[C@@H](N(C)Cc1ccc(Br)cc1[N+](=O)[O-])C(C)(C)O ZINC000382809713 476746943 /nfs/dbraw/zinc/74/69/43/476746943.db2.gz OXMUXCQWTKRQPV-SECBINFHSA-N 0 3 331.210 2.949 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CCN(C(C)C)C2)c1 ZINC000457084252 476865674 /nfs/dbraw/zinc/86/56/74/476865674.db2.gz GFPOUAPXBXCIJX-ZDUSSCGKSA-N 0 3 335.404 2.548 20 5 EFBDHN C[C@@H](C(=O)N1CCN(C2CC2)C[C@H](C)C1)c1ccc([N+](=O)[O-])cc1F ZINC000452174025 476869152 /nfs/dbraw/zinc/86/91/52/476869152.db2.gz OQFSEQAMBKLBHH-QWHCGFSZSA-N 0 3 349.406 2.780 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(NC[C@]2(O)CCN(Cc3ccccc3)C2)c1 ZINC000447079135 476951051 /nfs/dbraw/zinc/95/10/51/476951051.db2.gz SZVWOBRWWUOIFI-LJQANCHMSA-N 0 3 341.411 2.952 20 5 EFBDHN Cc1ccc(CN[C@H]2CCCN(C(=O)N3CCCC3)C2)cc1[N+](=O)[O-] ZINC000375757426 476990695 /nfs/dbraw/zinc/99/06/95/476990695.db2.gz ZTSXXXSHORQSIQ-INIZCTEOSA-N 0 3 346.431 2.673 20 5 EFBDHN CC(C)c1ccc(CN[C@@H]2CCN(c3cnn(C)c3)C2)cc1[N+](=O)[O-] ZINC000370906334 477033434 /nfs/dbraw/zinc/03/34/34/477033434.db2.gz VGNBOWRIYINCFR-OAHLLOKOSA-N 0 3 343.431 2.820 20 5 EFBDHN CN(C)[C@@H](CC(=O)NCCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000416158246 477045451 /nfs/dbraw/zinc/04/54/51/477045451.db2.gz SGYMPGMIGDTHQX-SFHVURJKSA-N 0 3 341.411 2.947 20 5 EFBDHN C[C@@H]1CN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)CN1 ZINC000423507400 477053722 /nfs/dbraw/zinc/05/37/22/477053722.db2.gz QAHZQERSNRRZMR-ZJUUUORDSA-N 0 3 343.836 2.549 20 5 EFBDHN C[C@@H]1C[C@H](NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)CCN1C ZINC000431666442 477072142 /nfs/dbraw/zinc/07/21/42/477072142.db2.gz TYLBXHPCNIQZGL-TZMCWYRMSA-N 0 3 334.420 2.612 20 5 EFBDHN CN(C)[C@H](CC(=O)NCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000431728163 477084139 /nfs/dbraw/zinc/08/41/39/477084139.db2.gz NDQKOIXCIDSKSR-QGZVFWFLSA-N 0 3 327.384 2.904 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1CN1CCC[C@H](Cc2nccn2C)C1 ZINC000366610614 477096948 /nfs/dbraw/zinc/09/69/48/477096948.db2.gz SNTPHVHLNCUMMB-CQSZACIVSA-N 0 3 344.415 2.792 20 5 EFBDHN O=C([C@H]1CCCN1C1CC1)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452833885 477101424 /nfs/dbraw/zinc/10/14/24/477101424.db2.gz BJANNKGWLAVXRA-CRAIPNDOSA-N 0 3 343.427 2.928 20 5 EFBDHN CN(C)CC(C)(C)NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000411100228 477113575 /nfs/dbraw/zinc/11/35/75/477113575.db2.gz NIWUXHOJOYYQAK-UHFFFAOYSA-N 0 3 333.310 2.684 20 5 EFBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CN[C@H]2CCc3c[nH]nc3C2)c1 ZINC000371138955 477145829 /nfs/dbraw/zinc/14/58/29/477145829.db2.gz ILGFISRGMZEQIW-NSHDSACASA-N 0 3 338.314 2.566 20 5 EFBDHN CC(C)Oc1cc(C(=O)NC2CCN(C3CC3)CC2)ccc1[N+](=O)[O-] ZINC000411236579 477165387 /nfs/dbraw/zinc/16/53/87/477165387.db2.gz IFNRIOHIGOHEBA-UHFFFAOYSA-N 0 3 347.415 2.739 20 5 EFBDHN CC1CCN(C[C@H](O)CNc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000432315016 477193397 /nfs/dbraw/zinc/19/33/97/477193397.db2.gz SIDFCTHTAQBYLV-GFCCVEGCSA-N 0 3 327.812 2.753 20 5 EFBDHN CN(C)CCOC1CCN(c2ccnc3c2cccc3[N+](=O)[O-])CC1 ZINC000432339543 477198100 /nfs/dbraw/zinc/19/81/00/477198100.db2.gz SQVIJYZQGQHCMA-UHFFFAOYSA-N 0 3 344.415 2.690 20 5 EFBDHN CC(C)Oc1cc(C(=O)NCCN2CCCCCC2)ccc1[N+](=O)[O-] ZINC000411383642 477213420 /nfs/dbraw/zinc/21/34/20/477213420.db2.gz HBZWAILHHCHPDR-UHFFFAOYSA-N 0 3 349.431 2.988 20 5 EFBDHN CCOc1ccc([C@H](C)NC[C@@H]2CN3CCC[C@H]3CO2)cc1[N+](=O)[O-] ZINC000371316309 477238017 /nfs/dbraw/zinc/23/80/17/477238017.db2.gz CRHFGLANERJBGN-CWRNSKLLSA-N 0 3 349.431 2.507 20 5 EFBDHN CCc1ccccc1[C@@H](N)CNC(=O)c1cc([N+](=O)[O-])ccc1OC ZINC000423982609 477243940 /nfs/dbraw/zinc/24/39/40/477243940.db2.gz RSRLZNYAKFCOSK-INIZCTEOSA-N 0 3 343.383 2.596 20 5 EFBDHN CCc1ccccc1[C@H](N)CNC(=O)c1cc(C)cc([N+](=O)[O-])c1 ZINC000423984668 477246161 /nfs/dbraw/zinc/24/61/61/477246161.db2.gz UPBSEWUBIPCABD-QGZVFWFLSA-N 0 3 327.384 2.895 20 5 EFBDHN Cc1c(CN2CCC[C@H]2C[C@@H](O)c2cnn(C)c2)cccc1[N+](=O)[O-] ZINC000371333729 477250365 /nfs/dbraw/zinc/25/03/65/477250365.db2.gz BLMYACGLPVOVDG-FUHWJXTLSA-N 0 3 344.415 2.725 20 5 EFBDHN CN(C/C=C\c1ccccc1[N+](=O)[O-])CCCNC(=O)C1CCC1 ZINC000432787700 477264669 /nfs/dbraw/zinc/26/46/69/477264669.db2.gz UOWRBLOXQWFACJ-YHYXMXQVSA-N 0 3 331.416 2.846 20 5 EFBDHN Cc1cccc(C(=O)N2C[C@@H](c3ccccc3F)[C@H](N)C2)c1[N+](=O)[O-] ZINC000424043467 477271862 /nfs/dbraw/zinc/27/18/62/477271862.db2.gz YOZRFLZOACGDQV-GOEBONIOSA-N 0 3 343.358 2.609 20 5 EFBDHN CN1CCC[C@@H]1CNC(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000454625600 477299050 /nfs/dbraw/zinc/29/90/50/477299050.db2.gz FOTAOVNHDLYMEM-DOTOQJQBSA-N 0 3 346.431 2.578 20 5 EFBDHN Cn1nccc1[C@@H]1CCCN(CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000371451959 477327091 /nfs/dbraw/zinc/32/70/91/477327091.db2.gz KBRSWFAVYIAUGT-OAHLLOKOSA-N 0 3 344.415 2.977 20 5 EFBDHN C[C@@H](CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCC(C)CC1 ZINC000411697701 477333686 /nfs/dbraw/zinc/33/36/86/477333686.db2.gz SEHYXBJEUQZPMT-JCGIZDLHSA-N 0 3 345.443 2.935 20 5 EFBDHN C[C@@H]1[C@H](N2CCCC2)CCN1C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000376446136 477339303 /nfs/dbraw/zinc/33/93/03/477339303.db2.gz FJBUQZRCDIVYKY-IAQYHMDHSA-N 0 3 337.807 2.947 20 5 EFBDHN Cc1ccc([C@@H]2CCCN2CCn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC000367129282 477357152 /nfs/dbraw/zinc/35/71/52/477357152.db2.gz PBMLCCHXPWCQHZ-KRWDZBQOSA-N 0 3 327.384 2.902 20 5 EFBDHN O=C(CCN1CCSC[C@H]1C1CC1)Nc1ccccc1[N+](=O)[O-] ZINC000411793408 477370823 /nfs/dbraw/zinc/37/08/23/477370823.db2.gz RXNOEWOFCBRYQG-HNNXBMFYSA-N 0 3 335.429 2.751 20 5 EFBDHN O=C(CCN1CCSC[C@@H]1C1CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411796291 477371704 /nfs/dbraw/zinc/37/17/04/477371704.db2.gz VUGRWVNQXFVPNT-OAHLLOKOSA-N 0 3 335.429 2.751 20 5 EFBDHN CN(Cc1ccccc1)[C@@H]1CCN(c2cc(N)ccc2[N+](=O)[O-])C1 ZINC000367174364 477376753 /nfs/dbraw/zinc/37/67/53/477376753.db2.gz UWPOQBREKBHULE-MRXNPFEDSA-N 0 3 326.400 2.888 20 5 EFBDHN CCOc1ccc(C(=O)N[C@H]2CCN(C3CCCC3)C2)cc1[N+](=O)[O-] ZINC000371597500 477403455 /nfs/dbraw/zinc/40/34/55/477403455.db2.gz QNYJOCNZNBWTDK-AWEZNQCLSA-N 0 3 347.415 2.740 20 5 EFBDHN CNC(=O)c1cccc(CN[C@@H](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000449075754 477423915 /nfs/dbraw/zinc/42/39/15/477423915.db2.gz WADBOBRXTCBGJV-ZDUSSCGKSA-N 0 3 327.384 2.675 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N[C@@H](C)C(=O)NCc1ccccc1 ZINC000449088760 477433675 /nfs/dbraw/zinc/43/36/75/477433675.db2.gz CCNAWZOASCJRME-CABCVRRESA-N 0 3 341.411 2.820 20 5 EFBDHN COc1cccc([C@H]2C[C@@H](C)CN2CCn2ccc([N+](=O)[O-])n2)c1 ZINC000371716035 477461179 /nfs/dbraw/zinc/46/11/79/477461179.db2.gz MRPOCXPGKYTKEQ-CZUORRHYSA-N 0 3 330.388 2.883 20 5 EFBDHN CCO[C@@H]1C[C@](CO)(NC/C=C\c2ccccc2[N+](=O)[O-])C1(C)C ZINC000436384559 477473607 /nfs/dbraw/zinc/47/36/07/477473607.db2.gz GMWCLIUQZVIRAL-OWUNDVQQSA-N 0 3 334.416 2.764 20 5 EFBDHN O=[N+]([O-])c1cnc(NCCCN2CCc3ccccc3C2)c(F)c1 ZINC000413048041 477486042 /nfs/dbraw/zinc/48/60/42/477486042.db2.gz HOSJORIAGZIITG-UHFFFAOYSA-N 0 3 330.363 2.989 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])NCc1ccc2c(c1)C(=O)NCC2 ZINC000449236762 477499108 /nfs/dbraw/zinc/49/91/08/477499108.db2.gz LHJREUSFYUMKFZ-CYBMUJFWSA-N 0 3 339.395 2.602 20 5 EFBDHN COc1cc(C)ccc1CN1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000449287999 477527610 /nfs/dbraw/zinc/52/76/10/477527610.db2.gz LXMONIDVHPZHMQ-UHFFFAOYSA-N 0 3 330.388 2.945 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN1CCN(C2CC2)C[C@H](C)C1 ZINC000449350113 477558491 /nfs/dbraw/zinc/55/84/91/477558491.db2.gz YXVIJTNGEUBZHI-CQSZACIVSA-N 0 3 333.432 2.910 20 5 EFBDHN CS[C@@H]1CN(c2ccc([N+](=O)[O-])c3ncccc32)C[C@@H]1N(C)C ZINC000413211927 477572419 /nfs/dbraw/zinc/57/24/19/477572419.db2.gz QLZHUTPCUXSSCQ-LSDHHAIUSA-N 0 3 332.429 2.625 20 5 EFBDHN CN1CCC[C@@]2(CCN(C(=O)Nc3cc(F)cc([N+](=O)[O-])c3)C2)C1 ZINC000455321034 477587393 /nfs/dbraw/zinc/58/73/93/477587393.db2.gz BLYQVCJLMPEHQJ-MRXNPFEDSA-N 0 3 336.367 2.684 20 5 EFBDHN O=[N+]([O-])c1cnc(N2C[C@H]3CN(Cc4ccccc4)C[C@H]3C2)c(F)c1 ZINC000413270081 477600584 /nfs/dbraw/zinc/60/05/84/477600584.db2.gz PZIKVORDQGVCMI-GASCZTMLSA-N 0 3 342.374 2.697 20 5 EFBDHN COC(=O)Cc1ccc(NC[C@H]2CCCCN2C2CC2)c([N+](=O)[O-])c1 ZINC000450481235 477603210 /nfs/dbraw/zinc/60/32/10/477603210.db2.gz DKKWTPOEUWEDDR-OAHLLOKOSA-N 0 3 347.415 2.739 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H]2CN(C)C[C@H]21 ZINC000425042998 477615316 /nfs/dbraw/zinc/61/53/16/477615316.db2.gz FFUGKPBMOWWPCA-DVOMOZLQSA-N 0 3 349.456 2.628 20 5 EFBDHN O=[N+]([O-])c1ccc(NC[C@@H]2CCCN2CCCO)c(C(F)(F)F)c1 ZINC000450599581 477648525 /nfs/dbraw/zinc/64/85/25/477648525.db2.gz STWSTTOJHDXSJY-LBPRGKRZSA-N 0 3 347.337 2.872 20 5 EFBDHN C[C@@H]1CN(Cc2ccc(Br)cc2[N+](=O)[O-])[C@@H](C)CN1C ZINC000425419749 477682420 /nfs/dbraw/zinc/68/24/20/477682420.db2.gz LKFXXEFYJFWYNN-MNOVXSKESA-N 0 3 342.237 2.882 20 5 EFBDHN CC(=O)c1ccc([N+](=O)[O-])cc1NC1CCN(C[C@@H]2CCOC2)CC1 ZINC000367936743 477761453 /nfs/dbraw/zinc/76/14/53/477761453.db2.gz YYRSFIOMMOBEBL-AWEZNQCLSA-N 0 3 347.415 2.710 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2ccc(CN(CCO)C3CCOCC3)o2)c1 ZINC000438334511 477827094 /nfs/dbraw/zinc/82/70/94/477827094.db2.gz XYOARZGYBBHKAS-UHFFFAOYSA-N 0 3 346.383 2.828 20 5 EFBDHN CC(C)c1ccc(CN2CCN(CC(C)(C)O)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000438336958 477829401 /nfs/dbraw/zinc/82/94/01/477829401.db2.gz CYXHEQLLIIVVRN-HNNXBMFYSA-N 0 3 349.475 2.995 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C1 ZINC000456350413 477878492 /nfs/dbraw/zinc/87/84/92/477878492.db2.gz WDGDHJNLXVVHDH-CQSZACIVSA-N 0 3 342.399 2.517 20 5 EFBDHN CC[C@]1(C(C)C)C[C@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000516276847 477918012 /nfs/dbraw/zinc/91/80/12/477918012.db2.gz OCUPQCUHTNCSBM-HZPDHXFCSA-N 0 3 340.445 2.783 20 5 EFBDHN CCOc1cc(CN[C@@H](C)C2(OC)CCOCC2)ccc1[N+](=O)[O-] ZINC000421033772 477921686 /nfs/dbraw/zinc/92/16/86/477921686.db2.gz NBFNMWYBEZLGPY-ZDUSSCGKSA-N 0 3 338.404 2.667 20 5 EFBDHN CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N[C@H]1CCN(C)[C@@H](C)C1 ZINC000462895571 477923627 /nfs/dbraw/zinc/92/36/27/477923627.db2.gz QUUZCHKYXRLESQ-QWRGUYRKSA-N 0 3 339.367 2.805 20 5 EFBDHN CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N[C@H]1CCN(C)[C@H](C)C1 ZINC000462895569 477923918 /nfs/dbraw/zinc/92/39/18/477923918.db2.gz QUUZCHKYXRLESQ-MNOVXSKESA-N 0 3 339.367 2.805 20 5 EFBDHN C/C(=C\c1ccccc1)CN(C)CCn1cc([N+](=O)[O-])ccc1=O ZINC000494291471 477960870 /nfs/dbraw/zinc/96/08/70/477960870.db2.gz WTZPEGFWXONHDV-NTCAYCPXSA-N 0 3 327.384 2.792 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)C[C@H]1CCCN1C ZINC000421110193 477966949 /nfs/dbraw/zinc/96/69/49/477966949.db2.gz AWPHPRMBZKEGCD-CYBMUJFWSA-N 0 3 336.392 2.551 20 5 EFBDHN C[C@@H]1CC[C@@H](C)N1CC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000428730931 477970834 /nfs/dbraw/zinc/97/08/34/477970834.db2.gz QILQJYHIJLGMMH-ZIAGYGMSSA-N 0 3 331.416 2.959 20 5 EFBDHN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000451414597 478001775 /nfs/dbraw/zinc/00/17/75/478001775.db2.gz IJYVDDWMIZOPEI-YYQUZTFQSA-N 0 3 347.415 2.547 20 5 EFBDHN C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000451414595 478001950 /nfs/dbraw/zinc/00/19/50/478001950.db2.gz IJYVDDWMIZOPEI-BASLNEPJSA-N 0 3 347.415 2.547 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@@H]1CCC12CCCC2 ZINC000451451862 478024386 /nfs/dbraw/zinc/02/43/86/478024386.db2.gz BNMFFNBIYSWPAL-OAHLLOKOSA-N 0 3 333.388 2.854 20 5 EFBDHN COc1ccc(NC(=O)CN[C@H]2CCC23CCCC3)c([N+](=O)[O-])c1 ZINC000451454242 478026666 /nfs/dbraw/zinc/02/66/66/478026666.db2.gz HVFHBVVQHZKGJL-HNNXBMFYSA-N 0 3 333.388 2.854 20 5 EFBDHN O=C(CN[C@@H]1CCC12CCCC2)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000451457837 478027992 /nfs/dbraw/zinc/02/79/92/478027992.db2.gz NTOXNBCYALUGEQ-MRXNPFEDSA-N 0 3 329.400 2.796 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H](C)N1CCCC[C@H]1C ZINC000494657233 478035393 /nfs/dbraw/zinc/03/53/93/478035393.db2.gz YXNFBVVWGCLWJZ-CHWSQXEVSA-N 0 3 335.404 2.596 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@@H]1[C@@H]2CCCO[C@H]2C1(C)C ZINC000451477140 478037789 /nfs/dbraw/zinc/03/77/89/478037789.db2.gz HGIFYXQJBLEBJI-IAOVAPTHSA-N 0 3 347.415 2.635 20 5 EFBDHN CCO[C@@H]1C[C@@H](N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C12CCC2 ZINC000451480014 478039678 /nfs/dbraw/zinc/03/96/78/478039678.db2.gz NZFXERLCAIUDPG-APHBMKBZSA-N 0 3 347.415 2.859 20 5 EFBDHN NC(=O)CC1(CNCc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000421351719 478046194 /nfs/dbraw/zinc/04/61/94/478046194.db2.gz ORVJVCGAOGYDHC-UHFFFAOYSA-N 0 3 329.356 2.600 20 5 EFBDHN CO[C@@H]1C[C@@H](NCC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC000451490466 478048016 /nfs/dbraw/zinc/04/80/16/478048016.db2.gz IBNDXISRDBHVHD-CHWSQXEVSA-N 0 3 341.795 2.590 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCCN(C)[C@H]1C ZINC000439917777 478049896 /nfs/dbraw/zinc/04/98/96/478049896.db2.gz SWUPHEAUMAZZNJ-AAEUAGOBSA-N 0 3 336.392 2.598 20 5 EFBDHN CO[C@@]1(C)C[C@H](NCC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1(C)C ZINC000451499876 478054646 /nfs/dbraw/zinc/05/46/46/478054646.db2.gz XPGBQGVKGKPOGM-GUYCJALGSA-N 0 3 335.404 2.635 20 5 EFBDHN CO[C@]1(C)C[C@H](NCC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1(C)C ZINC000451499878 478054809 /nfs/dbraw/zinc/05/48/09/478054809.db2.gz XPGBQGVKGKPOGM-SUMWQHHRSA-N 0 3 335.404 2.635 20 5 EFBDHN COc1cc(CN[C@@H]2[C@H](C)[C@@H](OC)C2(C)C)c([N+](=O)[O-])cc1F ZINC000451506881 478057406 /nfs/dbraw/zinc/05/74/06/478057406.db2.gz WJBJVHSXKUPGIF-TZTCFGBESA-N 0 3 326.368 2.892 20 5 EFBDHN COc1cc(CN[C@@H]2[C@@H](C)[C@@H](OC)C2(C)C)c([N+](=O)[O-])cc1F ZINC000451506880 478058118 /nfs/dbraw/zinc/05/81/18/478058118.db2.gz WJBJVHSXKUPGIF-DFKRKDTASA-N 0 3 326.368 2.892 20 5 EFBDHN CON1CCC(NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000421393464 478069807 /nfs/dbraw/zinc/06/98/07/478069807.db2.gz DROKMJXLJFQNEN-UHFFFAOYSA-N 0 3 331.372 2.970 20 5 EFBDHN CCO[C@@H]1CCN(CCOc2ccc(OC)cc2[N+](=O)[O-])C[C@H]1C ZINC000451550041 478084618 /nfs/dbraw/zinc/08/46/18/478084618.db2.gz WJFBMAMWMKOZFG-CZUORRHYSA-N 0 3 338.404 2.729 20 5 EFBDHN CC(C)(NC[C@@H](O)COc1cccc([N+](=O)[O-])c1)c1ccccc1F ZINC000429234454 478084973 /nfs/dbraw/zinc/08/49/73/478084973.db2.gz HFABQVPXDQSJCU-CQSZACIVSA-N 0 3 348.374 2.999 20 5 EFBDHN CC(C)COC[C@H](O)CN1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548749 478084871 /nfs/dbraw/zinc/08/48/71/478084871.db2.gz OGSSWXHSXGVOCC-FUHWJXTLSA-N 0 3 336.432 2.808 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCN1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000459786125 478089781 /nfs/dbraw/zinc/08/97/81/478089781.db2.gz CYENXOXCAHHSBO-DOTOQJQBSA-N 0 3 334.416 2.847 20 5 EFBDHN C[C@H]1CN(C2CC2)C[C@H]1Nc1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000534144706 478128291 /nfs/dbraw/zinc/12/82/91/478128291.db2.gz RIZROCYUNDSVHC-XJKSGUPXSA-N 0 3 338.411 2.973 20 5 EFBDHN C[C@@H]1CN(C2CC2)C[C@H]1Nc1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000534144704 478128383 /nfs/dbraw/zinc/12/83/83/478128383.db2.gz RIZROCYUNDSVHC-CZUORRHYSA-N 0 3 338.411 2.973 20 5 EFBDHN CCOc1cc(CN2CC[C@@H]3C[C@H](O)CC[C@H]3C2)ccc1[N+](=O)[O-] ZINC000451698763 478162281 /nfs/dbraw/zinc/16/22/81/478162281.db2.gz JVPHSECOXSCSJK-OWCLPIDISA-N 0 3 334.416 2.976 20 5 EFBDHN COC(=O)C[C@@](C)(NCCc1ccc([N+](=O)[O-])cc1)c1ccccn1 ZINC000429672567 478170825 /nfs/dbraw/zinc/17/08/25/478170825.db2.gz OPERHQYEVJBCGS-GOSISDBHSA-N 0 3 343.383 2.600 20 5 EFBDHN COc1cc(N2CCN([C@@H]3C[C@H]3C)C[C@H](C)C2)c(F)cc1[N+](=O)[O-] ZINC000488716347 478173352 /nfs/dbraw/zinc/17/33/52/478173352.db2.gz BTZMEGBHBKHMSU-OUCADQQQSA-N 0 3 337.395 2.909 20 5 EFBDHN COc1cc(N2CCN([C@@H]3C[C@@H]3C)C[C@H](C)C2)c(F)cc1[N+](=O)[O-] ZINC000488716348 478173783 /nfs/dbraw/zinc/17/37/83/478173783.db2.gz BTZMEGBHBKHMSU-SGMGOOAPSA-N 0 3 337.395 2.909 20 5 EFBDHN CC1(C)COC[C@H]1NCCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000451815315 478214059 /nfs/dbraw/zinc/21/40/59/478214059.db2.gz WCPWCCIONQTWLH-OAHLLOKOSA-N 0 3 331.372 2.807 20 5 EFBDHN C[C@@H]1C[C@@H](NC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])CCN1C ZINC000489401652 478241211 /nfs/dbraw/zinc/24/12/11/478241211.db2.gz LKMPWSBHVQFQPV-OLZOCXBDSA-N 0 3 334.420 2.612 20 5 EFBDHN O=[N+]([O-])c1cc(CN2CCC[C@H]2[C@H]2CCCOC2)c2c(c1)COCO2 ZINC000579350059 478276241 /nfs/dbraw/zinc/27/62/41/478276241.db2.gz YQKFKZOIJWOCTI-GUYCJALGSA-N 0 3 348.399 2.852 20 5 EFBDHN C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCCc2c[nH]nc21 ZINC000536843492 478276756 /nfs/dbraw/zinc/27/67/56/478276756.db2.gz CXOPJDGZGPJUMZ-XHDPSFHLSA-N 0 3 343.387 2.702 20 5 EFBDHN Cc1c(CNC(=O)N[C@H]2CCCN3CCCC[C@H]23)cccc1[N+](=O)[O-] ZINC000594241860 478297025 /nfs/dbraw/zinc/29/70/25/478297025.db2.gz IQBNGYDCFQTKNT-DOTOQJQBSA-N 0 3 346.431 2.719 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)CCN(c2cccnc2[N+](=O)[O-])C1 ZINC000590723254 478307487 /nfs/dbraw/zinc/30/74/87/478307487.db2.gz CZDFRXVYFKEFEG-OAHLLOKOSA-N 0 3 326.400 2.948 20 5 EFBDHN O=C(N[C@@H]1CCCN2CCCC[C@H]12)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000594418474 478374781 /nfs/dbraw/zinc/37/47/81/478374781.db2.gz JFLMTVQWBUWCEU-UKRRQHHQSA-N 0 3 342.399 2.823 20 5 EFBDHN CN1CC[C@@H]2CN(C(=O)c3ccc(C(C)(C)C)c([N+](=O)[O-])c3)C[C@@H]21 ZINC000590872549 478377357 /nfs/dbraw/zinc/37/73/57/478377357.db2.gz AVSFYCKASFUYFL-CJNGLKHVSA-N 0 3 331.416 2.668 20 5 EFBDHN CC(COC(=O)CCC1CCN(C(=O)OC(C)(C)C)CC1)[N+](=O)[O-] ZINC000495907008 478401203 /nfs/dbraw/zinc/40/12/03/478401203.db2.gz XSPMNXHRNAHDSO-GFCCVEGCSA-N 0 3 344.408 2.622 20 5 EFBDHN O=C(C1CCCC1)N1CC[C@H](N[C@H]2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000594502803 478415779 /nfs/dbraw/zinc/41/57/79/478415779.db2.gz OUUAHGVQLZXCRO-YOEHRIQHSA-N 0 3 343.427 2.963 20 5 EFBDHN O=C(NCC12CCCN1CCC2)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000597587784 478423001 /nfs/dbraw/zinc/42/30/01/478423001.db2.gz XWJJRXASGSXBEP-UHFFFAOYSA-N 0 3 329.356 2.699 20 5 EFBDHN CS(=O)(=O)C1(CN[C@H]2CCc3c2cccc3[N+](=O)[O-])CCCC1 ZINC000594518378 478423191 /nfs/dbraw/zinc/42/31/91/478423191.db2.gz GWUFOPCDAUNOJE-AWEZNQCLSA-N 0 3 338.429 2.529 20 5 EFBDHN CC[C@@H]1CN(C)CCCN1C(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000597605500 478430264 /nfs/dbraw/zinc/43/02/64/478430264.db2.gz PRKFUCIUFLARLH-OAHLLOKOSA-N 0 3 349.431 2.938 20 5 EFBDHN C[C@H](N[C@@H]1CCCN2CCCC[C@H]12)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000594554154 478435337 /nfs/dbraw/zinc/43/53/37/478435337.db2.gz OFIGWQQKDJUMSN-IAOVAPTHSA-N 0 3 346.431 2.528 20 5 EFBDHN C[C@H](N[C@@H]1CCCN2CCCC[C@H]12)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000594554084 478435658 /nfs/dbraw/zinc/43/56/58/478435658.db2.gz KJRUPRDWGMYSPC-SQWLQELKSA-N 0 3 346.431 2.528 20 5 EFBDHN CN1CCCC(C)(C)[C@@H]1CNC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000581766048 478437294 /nfs/dbraw/zinc/43/72/94/478437294.db2.gz SKWATYNQRPDQOD-HNNXBMFYSA-N 0 3 334.420 2.514 20 5 EFBDHN CC(C)Oc1cc(C(=O)N[C@@H]2CCN(CC3CC3)C2)ccc1[N+](=O)[O-] ZINC000591056196 478444224 /nfs/dbraw/zinc/44/42/24/478444224.db2.gz XEZBSLVNLCVPMR-OAHLLOKOSA-N 0 3 347.415 2.596 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@H]1[C@@H]1CCCOC1 ZINC000581882194 478458016 /nfs/dbraw/zinc/45/80/16/478458016.db2.gz IOAVCTNMZUBNRK-PBHICJAKSA-N 0 3 347.415 2.733 20 5 EFBDHN COC(=O)Cc1ccc(N[C@@H]2CCCN3CCCC[C@H]23)c([N+](=O)[O-])c1 ZINC000594599213 478458801 /nfs/dbraw/zinc/45/88/01/478458801.db2.gz IGIOQHJBCXEBHH-GDBMZVCRSA-N 0 3 347.415 2.739 20 5 EFBDHN CCOC(=O)c1ccnc(N[C@H]2CCCN3CCCC[C@H]23)c1[N+](=O)[O-] ZINC000594604042 478462564 /nfs/dbraw/zinc/46/25/64/478462564.db2.gz XCTKGUUZLAYVDH-UONOGXRCSA-N 0 3 348.403 2.595 20 5 EFBDHN CN1CC[C@@]2(C1)CCCN(C(=O)c1cc(Cl)cc([N+](=O)[O-])c1)C2 ZINC000597713602 478476067 /nfs/dbraw/zinc/47/60/67/478476067.db2.gz DJKNWMZMFSBXJS-MRXNPFEDSA-N 0 3 337.807 2.806 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC[C@H](CN2CCOC2=O)C1 ZINC000496017677 478481711 /nfs/dbraw/zinc/48/17/11/478481711.db2.gz YLBFPKCUPPPQBN-MBSJSRAVSA-N 0 3 345.399 2.772 20 5 EFBDHN CC(C)Oc1nc(N2CCC[C@H]3CN(C)CC[C@@H]32)ccc1[N+](=O)[O-] ZINC000582013859 478492112 /nfs/dbraw/zinc/49/21/12/478492112.db2.gz ZECATHXHKKOSGO-KBPBESRZSA-N 0 3 334.420 2.698 20 5 EFBDHN CC(C)Oc1nc(N2CCC[C@@H]3CN(C)CC[C@H]32)ccc1[N+](=O)[O-] ZINC000582013862 478492540 /nfs/dbraw/zinc/49/25/40/478492540.db2.gz ZECATHXHKKOSGO-ZIAGYGMSSA-N 0 3 334.420 2.698 20 5 EFBDHN COC(=O)COc1ccc(CN2CC[C@H](C3CCC3)C2)cc1[N+](=O)[O-] ZINC000591267869 478504093 /nfs/dbraw/zinc/50/40/93/478504093.db2.gz PSNHURIJWUPCNI-HNNXBMFYSA-N 0 3 348.399 2.769 20 5 EFBDHN Cc1ccc(C(=O)NCCN[C@H]2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000571061353 478514397 /nfs/dbraw/zinc/51/43/97/478514397.db2.gz WFPCPYJRELDDPP-KRWDZBQOSA-N 0 3 339.395 2.910 20 5 EFBDHN C[C@@H](NC(=O)Nc1cnc2c(c1)CNCC2)c1cccc([N+](=O)[O-])c1 ZINC000591310679 478517605 /nfs/dbraw/zinc/51/76/05/478517605.db2.gz BDEYSDBMDFDCFH-LLVKDONJSA-N 0 3 341.371 2.518 20 5 EFBDHN COC(=O)c1ccc(-c2ccc([C@@H]3CNCCO3)cc2)c([N+](=O)[O-])c1 ZINC000600787100 478520824 /nfs/dbraw/zinc/52/08/24/478520824.db2.gz XPCFDTTUVHHKNF-KRWDZBQOSA-N 0 3 342.351 2.709 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2NCc1ccc(OCCO)cc1 ZINC000571225067 478547338 /nfs/dbraw/zinc/54/73/38/478547338.db2.gz RYGKGJHLZQTJCY-QGZVFWFLSA-N 0 3 328.368 2.743 20 5 EFBDHN COc1cc(C(=O)N[C@@H]2CCN(C(C)(C)C)C2)cc([N+](=O)[O-])c1C ZINC000597923681 478577295 /nfs/dbraw/zinc/57/72/95/478577295.db2.gz OEXUCMOHJMLNLM-CYBMUJFWSA-N 0 3 335.404 2.514 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCN(C(C)(C)C)C2)c1 ZINC000597925784 478579068 /nfs/dbraw/zinc/57/90/68/478579068.db2.gz RDSORPZKZSCEPT-NSHDSACASA-N 0 3 337.445 2.919 20 5 EFBDHN CC(C)(C)N1CC[C@@H](NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000597924862 478579365 /nfs/dbraw/zinc/57/93/65/478579365.db2.gz TXOUFQGSQGARDR-GFCCVEGCSA-N 0 3 325.796 2.851 20 5 EFBDHN CC(C)(C)N1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000597925838 478579567 /nfs/dbraw/zinc/57/95/67/478579567.db2.gz SGOPWHDONWGVJZ-SNVBAGLBSA-N 0 3 325.796 2.851 20 5 EFBDHN CC(C)(C)N1CC[C@@H](NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000597925080 478579853 /nfs/dbraw/zinc/57/98/53/478579853.db2.gz NNWJKBTYVKLBME-CQSZACIVSA-N 0 3 346.431 2.772 20 5 EFBDHN CC(C)(C)N1CC[C@@H](NC(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000597925465 478579987 /nfs/dbraw/zinc/57/99/87/478579987.db2.gz VQLKVBKAFATCCK-SNVBAGLBSA-N 0 3 325.796 2.851 20 5 EFBDHN CC1(C)CNCCN1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000591678199 478605873 /nfs/dbraw/zinc/60/58/73/478605873.db2.gz NAOCLTWGFUXBMJ-UHFFFAOYSA-N 0 3 343.836 2.551 20 5 EFBDHN C[C@H]1CCCN(C(C)(C)CNC(=O)c2c(F)cccc2[N+](=O)[O-])C1 ZINC000601010117 478612866 /nfs/dbraw/zinc/61/28/66/478612866.db2.gz JTYQDKKLBPLMHU-LBPRGKRZSA-N 0 3 337.395 2.974 20 5 EFBDHN CCOc1ccc(OC[C@@H](O)CNCc2cccc([N+](=O)[O-])c2)cc1 ZINC000591728948 478614072 /nfs/dbraw/zinc/61/40/72/478614072.db2.gz DWMHNLPJAYIPAJ-INIZCTEOSA-N 0 3 346.383 2.523 20 5 EFBDHN C[C@H](CN1CCC(C)CC1)NCc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000594979245 478615413 /nfs/dbraw/zinc/61/54/13/478615413.db2.gz GQGKTBUPCRYMIP-CQSZACIVSA-N 0 3 349.431 2.576 20 5 EFBDHN CCC[C@H](NC[C@@H](O)COc1cccc([N+](=O)[O-])c1)c1ccccn1 ZINC000591734506 478615676 /nfs/dbraw/zinc/61/56/76/478615676.db2.gz HPFGAFUNRSYEFN-WBVHZDCISA-N 0 3 345.399 2.861 20 5 EFBDHN COc1cc(CNC[C@H](OC)C2CCCC2)c([N+](=O)[O-])cc1OC ZINC000594993403 478620870 /nfs/dbraw/zinc/62/08/70/478620870.db2.gz FDKADUQJRBTMJY-KRWDZBQOSA-N 0 3 338.404 2.907 20 5 EFBDHN CC(C)(C)N1C[C@H](CNCc2ccc([N+](=O)[O-])cc2Cl)CC1=O ZINC000594994363 478622195 /nfs/dbraw/zinc/62/21/95/478622195.db2.gz TXDOFOOGIHHSFP-NSHDSACASA-N 0 3 339.823 2.985 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NCCCOC[C@H]1CCOC1 ZINC000595007939 478626851 /nfs/dbraw/zinc/62/68/51/478626851.db2.gz LIDRRRSBUWXTCO-UONOGXRCSA-N 0 3 338.404 2.697 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@@]1(N(C)C)CCSC1 ZINC000595014273 478629452 /nfs/dbraw/zinc/62/94/52/478629452.db2.gz WAOHSQUNAOXOMQ-WBMJQRKESA-N 0 3 339.461 2.691 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCC1CCN(C(C)=O)CC1 ZINC000595012893 478629775 /nfs/dbraw/zinc/62/97/75/478629775.db2.gz PWXKELMDIZQVPT-GFCCVEGCSA-N 0 3 335.404 2.513 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NCCN(C)CC(F)(F)F ZINC000595020980 478631343 /nfs/dbraw/zinc/63/13/43/478631343.db2.gz WETNGUJPKACFJJ-JTQLQIEISA-N 0 3 335.326 2.748 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NCCCOC1CCOCC1 ZINC000595025090 478632727 /nfs/dbraw/zinc/63/27/27/478632727.db2.gz GBCQWIZEXZMTDG-ZDUSSCGKSA-N 0 3 338.404 2.840 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)N[C@H]1CCN(c2ccccn2)C1 ZINC000595035191 478637614 /nfs/dbraw/zinc/63/76/14/478637614.db2.gz HPGCHYAXBIGFSO-KGLIPLIRSA-N 0 3 342.399 2.928 20 5 EFBDHN Cn1ncc(C2CC2)c1CN[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000595079844 478653957 /nfs/dbraw/zinc/65/39/57/478653957.db2.gz ZOMOBDJZGRJBBV-HUUCEWRRSA-N 0 3 344.419 2.676 20 5 EFBDHN Cn1ncc(C2CC2)c1CN[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000595079845 478654214 /nfs/dbraw/zinc/65/42/14/478654214.db2.gz ZOMOBDJZGRJBBV-LSDHHAIUSA-N 0 3 344.419 2.676 20 5 EFBDHN CCN(C[C@H]1CCCN1CC)C(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000563947459 478671506 /nfs/dbraw/zinc/67/15/06/478671506.db2.gz RDMCEZIXILGDBF-CQSZACIVSA-N 0 3 335.404 2.550 20 5 EFBDHN C[C@@H](CNC(=O)c1c(F)cccc1[N+](=O)[O-])N(C)Cc1ccccc1 ZINC000601150201 478689755 /nfs/dbraw/zinc/68/97/55/478689755.db2.gz XZFMVYSRCQWULH-ZDUSSCGKSA-N 0 3 345.374 2.984 20 5 EFBDHN CCOC(=O)Cc1ccc(N[C@H]2CCN(C)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000591914923 478701069 /nfs/dbraw/zinc/70/10/69/478701069.db2.gz LNMKBSOCZIQERL-OCCSQVGLSA-N 0 3 335.404 2.595 20 5 EFBDHN COc1cccc(C(=O)N[C@@H]2CCN(C3CCCCC3)C2)c1[N+](=O)[O-] ZINC000598221504 478712691 /nfs/dbraw/zinc/71/26/91/478712691.db2.gz WICDVIDCOUYLTQ-CYBMUJFWSA-N 0 3 347.415 2.740 20 5 EFBDHN C[C@@H](CN1CCC(C)CC1)NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000598266525 478733501 /nfs/dbraw/zinc/73/35/01/478733501.db2.gz ZBXSPYIEBBCDDC-HNNXBMFYSA-N 0 3 348.447 2.633 20 5 EFBDHN C[C@H](CN1CCC(C)CC1)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000598265494 478733531 /nfs/dbraw/zinc/73/35/31/478733531.db2.gz TZEZEKOBEHSOBM-FHLIZLRMSA-N 0 3 345.443 2.935 20 5 EFBDHN Cc1noc(CN2CC[C@H](N(C)Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000595336716 478736605 /nfs/dbraw/zinc/73/66/05/478736605.db2.gz QNAIQBFQLGJOFR-HNNXBMFYSA-N 0 3 330.388 2.598 20 5 EFBDHN Cc1noc(CN2CC[C@@H](N(C)Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000595336740 478736826 /nfs/dbraw/zinc/73/68/26/478736826.db2.gz QNAIQBFQLGJOFR-OAHLLOKOSA-N 0 3 330.388 2.598 20 5 EFBDHN Cc1noc(CN(C)C2CCN(Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000595372831 478753047 /nfs/dbraw/zinc/75/30/47/478753047.db2.gz WCXXHGUCPDKTSN-UHFFFAOYSA-N 0 3 344.415 2.988 20 5 EFBDHN C[C@@H](CC(N)=O)NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000498365688 478760386 /nfs/dbraw/zinc/76/03/86/478760386.db2.gz SVAFULOEKXQJGJ-VIFPVBQESA-N 0 3 337.763 2.862 20 5 EFBDHN CCCN1CC[C@@H](NC(=O)[C@@H](CC)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000598341449 478775620 /nfs/dbraw/zinc/77/56/20/478775620.db2.gz BODFIBRNBZRHIT-JKSUJKDBSA-N 0 3 333.432 2.764 20 5 EFBDHN CCCN1CC[C@H](NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000598342537 478776147 /nfs/dbraw/zinc/77/61/47/478776147.db2.gz OSLVJMYZDNPTGD-NSHDSACASA-N 0 3 345.321 2.828 20 5 EFBDHN CCCN1CC[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000598342536 478776399 /nfs/dbraw/zinc/77/63/99/478776399.db2.gz OSLVJMYZDNPTGD-LLVKDONJSA-N 0 3 345.321 2.828 20 5 EFBDHN CCCN1CC[C@@H](NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000598342473 478777395 /nfs/dbraw/zinc/77/73/95/478777395.db2.gz IZRZJEFIDMEYJX-CHWSQXEVSA-N 0 3 337.445 2.676 20 5 EFBDHN C[C@H](CN1CCC(C)CC1)NC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000595445426 478787430 /nfs/dbraw/zinc/78/74/30/478787430.db2.gz BOSHVFYVQKKSJY-CQSZACIVSA-N 0 3 334.420 2.514 20 5 EFBDHN C[C@H](C(=O)N1CCN(C2CC2)C[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000572354137 478813597 /nfs/dbraw/zinc/81/35/97/478813597.db2.gz KEDVJDZIJGKDDR-KGLIPLIRSA-N 0 3 331.416 2.641 20 5 EFBDHN O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2N[C@@H]2c3ccccc3C[C@@H]2O)n1 ZINC000564812395 478819349 /nfs/dbraw/zinc/81/93/49/478819349.db2.gz MMIMHHZOEAZJSV-UIBIWLFHSA-N 0 3 342.399 2.523 20 5 EFBDHN C[C@@H]1CN(CCN2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C[C@@H](C)O1 ZINC000595527547 478835070 /nfs/dbraw/zinc/83/50/70/478835070.db2.gz VBIPZXHXEGCOCD-JFIYKMOQSA-N 0 3 347.459 2.883 20 5 EFBDHN CCN1CCCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H](C)C1 ZINC000595535284 478838649 /nfs/dbraw/zinc/83/86/49/478838649.db2.gz MDKPIAREOLDHIL-CYBMUJFWSA-N 0 3 345.403 2.561 20 5 EFBDHN C[C@H]1C[C@@]1(NCCn1cc([N+](=O)[O-])ccc1=O)c1ccc(Cl)cc1 ZINC000503389878 478839761 /nfs/dbraw/zinc/83/97/61/478839761.db2.gz IEEUEIOYNYEFMI-SJCJKPOMSA-N 0 3 347.802 2.935 20 5 EFBDHN C[C@H]1C[C@]1(NCCn1cc([N+](=O)[O-])ccc1=O)c1ccc(Cl)cc1 ZINC000503389880 478840047 /nfs/dbraw/zinc/84/00/47/478840047.db2.gz IEEUEIOYNYEFMI-YVEFUNNKSA-N 0 3 347.802 2.935 20 5 EFBDHN C[C@@H](CN1CCC(C)CC1)NC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000595572292 478862629 /nfs/dbraw/zinc/86/26/29/478862629.db2.gz DORLENQKAWEQMI-HNNXBMFYSA-N 0 3 348.447 2.557 20 5 EFBDHN CN(CCOc1cccc([N+](=O)[O-])c1)[C@H](CO)Cc1ccccc1 ZINC000595594612 478875363 /nfs/dbraw/zinc/87/53/63/478875363.db2.gz GMBKNSRAYQRQIN-KRWDZBQOSA-N 0 3 330.384 2.509 20 5 EFBDHN C[NH+](C)CCOc1ccc(-c2noc(-c3cc([N+](=O)[O-])c[n-]3)n2)cc1 ZINC000544972442 478875571 /nfs/dbraw/zinc/87/55/71/478875571.db2.gz MNEDSIUQHOJPHG-UHFFFAOYSA-N 0 3 343.343 2.580 20 5 EFBDHN CN(C)CCOc1ccc(-c2noc(-c3cc([N+](=O)[O-])c[nH]3)n2)cc1 ZINC000544972442 478875579 /nfs/dbraw/zinc/87/55/79/478875579.db2.gz MNEDSIUQHOJPHG-UHFFFAOYSA-N 0 3 343.343 2.580 20 5 EFBDHN C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)NCc1ccc(CO)cc1 ZINC000592393163 478882304 /nfs/dbraw/zinc/88/23/04/478882304.db2.gz PRSVADOCNXDUJF-CYBMUJFWSA-N 0 3 343.383 2.594 20 5 EFBDHN CC(C)[C@@H]1CN(C(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CCN1 ZINC000598573789 478903826 /nfs/dbraw/zinc/90/38/26/478903826.db2.gz ORJJDYGLZOCBIH-LBPRGKRZSA-N 0 3 345.321 2.684 20 5 EFBDHN O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2N[C@H](CCO)c2ccco2)n1 ZINC000583673727 478910858 /nfs/dbraw/zinc/91/08/58/478910858.db2.gz STRJMUFWILCLFP-MGPQQGTHSA-N 0 3 334.376 2.581 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCCN(CC3CCC3)CC2)c1 ZINC000583739232 478930365 /nfs/dbraw/zinc/93/03/65/478930365.db2.gz QUVPCLHORXMFRJ-UHFFFAOYSA-N 0 3 331.416 2.851 20 5 EFBDHN CCOC(=O)c1cc(N[C@H]2C[C@@H](C)N(C3CC3)C2)ccc1[N+](=O)[O-] ZINC000583784959 478940689 /nfs/dbraw/zinc/94/06/89/478940689.db2.gz FHDXADKLTPIWFM-YPMHNXCESA-N 0 3 333.388 2.809 20 5 EFBDHN O=C(N[C@H]1CCN(C2CCCCC2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000601670400 478942001 /nfs/dbraw/zinc/94/20/01/478942001.db2.gz DIBPIIGSJKAHAR-LBPRGKRZSA-N 0 3 335.379 2.871 20 5 EFBDHN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H]1CCN(C(C)(C)C)C1 ZINC000595703611 478948921 /nfs/dbraw/zinc/94/89/21/478948921.db2.gz MKOKFIQWSCRNBG-OAHLLOKOSA-N 0 3 348.447 2.652 20 5 EFBDHN CC(C)Oc1nc(N2CCN([C@H]3C[C@H]3C)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000565227075 478957409 /nfs/dbraw/zinc/95/74/09/478957409.db2.gz VAFUGCGZJJJMOX-LZWOXQAQSA-N 0 3 348.447 2.944 20 5 EFBDHN Cc1c(NC(=O)CCN(C)CC2=CCCOC2)cccc1[N+](=O)[O-] ZINC000595750374 478973910 /nfs/dbraw/zinc/97/39/10/478973910.db2.gz BAFKCXOBOXSDSO-UHFFFAOYSA-N 0 3 333.388 2.510 20 5 EFBDHN Cc1cccc(OC[C@@H](O)CN(C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511135477 478975571 /nfs/dbraw/zinc/97/55/71/478975571.db2.gz GNXQIRYIAXAHBC-KRWDZBQOSA-N 0 3 344.411 2.817 20 5 EFBDHN COc1ccc(NC(=O)[C@@H](C)N(C)C[C@@H]2CC2(C)C)c([N+](=O)[O-])c1 ZINC000595907538 479062502 /nfs/dbraw/zinc/06/25/02/479062502.db2.gz AHJCBUPKOJEBNI-NEPJUHHUSA-N 0 3 335.404 2.908 20 5 EFBDHN CCCN(C(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1)[C@H]1CCN(C)C1 ZINC000592828121 479063271 /nfs/dbraw/zinc/06/32/71/479063271.db2.gz CPTYEDUCRQEXAS-HNNXBMFYSA-N 0 3 349.431 2.938 20 5 EFBDHN CCCN(C(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1)[C@@H]1CCN(C)C1 ZINC000592828122 479063676 /nfs/dbraw/zinc/06/36/76/479063676.db2.gz CPTYEDUCRQEXAS-OAHLLOKOSA-N 0 3 349.431 2.938 20 5 EFBDHN CCCN(C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)[C@H]1CCN(C)C1 ZINC000592831680 479065061 /nfs/dbraw/zinc/06/50/61/479065061.db2.gz NOQPCAVVHTZZHQ-ZDUSSCGKSA-N 0 3 330.388 2.632 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N(C)C[C@@H]1CC1(C)C ZINC000595908722 479065255 /nfs/dbraw/zinc/06/52/55/479065255.db2.gz KBBYQFZPMLTJKL-RYUDHWBXSA-N 0 3 335.404 2.908 20 5 EFBDHN C[C@@H](NC(=O)c1cc2c(s1)CCNC2)c1cccc([N+](=O)[O-])c1 ZINC000595918427 479072323 /nfs/dbraw/zinc/07/23/23/479072323.db2.gz CJHGKJSCUZDXGB-SNVBAGLBSA-N 0 3 331.397 2.793 20 5 EFBDHN Cc1c(CNC(=O)c2cc3c(s2)CCNC3)cccc1[N+](=O)[O-] ZINC000595927129 479077675 /nfs/dbraw/zinc/07/76/75/479077675.db2.gz AMTQEWNJHZSAGN-UHFFFAOYSA-N 0 3 331.397 2.540 20 5 EFBDHN N[C@@H]1CN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])CC[C@H]1F ZINC000596030355 479100488 /nfs/dbraw/zinc/10/04/88/479100488.db2.gz VDFPWWVAWUXHLM-HUUCEWRRSA-N 0 3 343.358 2.701 20 5 EFBDHN CC(C)N1CC[C@H](N(C)C(=O)/C=C\c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000493671821 479108896 /nfs/dbraw/zinc/10/88/96/479108896.db2.gz COWHIXGLVNLLHB-PKYBCLHXSA-N 0 3 335.379 2.688 20 5 EFBDHN CN(C)CCN(CCc1ccc([N+](=O)[O-])cc1)Cc1ccccn1 ZINC000584358841 479109006 /nfs/dbraw/zinc/10/90/06/479109006.db2.gz IQHSBBSWCSNDQD-UHFFFAOYSA-N 0 3 328.416 2.596 20 5 EFBDHN O=c1[n-]ccc(NC[C@H](c2ccccc2)[NH+]2CCCC2)c1[N+](=O)[O-] ZINC000596055252 479110886 /nfs/dbraw/zinc/11/08/86/479110886.db2.gz UCRSDQSZUXZFDV-OAHLLOKOSA-N 0 3 328.372 2.944 20 5 EFBDHN C[C@H](CNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)N1CCC(C)CC1 ZINC000573654079 479111581 /nfs/dbraw/zinc/11/15/81/479111581.db2.gz DKNQEVILYRMNDR-CABCVRRESA-N 0 3 333.432 2.935 20 5 EFBDHN COc1cc(CNC[C@@H]2CCC[N@H+](CC3CC3)C2)c([N+](=O)[O-])cc1[O-] ZINC000596058079 479112210 /nfs/dbraw/zinc/11/22/10/479112210.db2.gz CDRLODVMFNUQIA-AWEZNQCLSA-N 0 3 349.431 2.521 20 5 EFBDHN COc1cc(CNC[C@@H]2CCC[N@@H+](CC3CC3)C2)c([N+](=O)[O-])cc1[O-] ZINC000596058079 479112217 /nfs/dbraw/zinc/11/22/17/479112217.db2.gz CDRLODVMFNUQIA-AWEZNQCLSA-N 0 3 349.431 2.521 20 5 EFBDHN Cc1ccc(CN[C@@H]2CCO[C@H]2c2ccc(=O)[nH]c2)cc1[N+](=O)[O-] ZINC000598997791 479120429 /nfs/dbraw/zinc/12/04/29/479120429.db2.gz ITXQQUKMAMORJS-PBHICJAKSA-N 0 3 329.356 2.624 20 5 EFBDHN Cc1ccccc1CN1CCCN(c2ccc(N)c([N+](=O)[O-])n2)CC1 ZINC000596078316 479124821 /nfs/dbraw/zinc/12/48/21/479124821.db2.gz WFUORERDKIBARG-UHFFFAOYSA-N 0 3 341.415 2.593 20 5 EFBDHN CCN1CCN([C@H](C)CNc2ccc(C(F)F)cc2[N+](=O)[O-])CC1 ZINC000596077514 479124894 /nfs/dbraw/zinc/12/48/94/479124894.db2.gz JXYBVNPJHHTOHZ-GFCCVEGCSA-N 0 3 342.390 2.970 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2csc(N[C@@H]3CCN(C4CC4)C3)n2)cc1 ZINC000596091585 479133792 /nfs/dbraw/zinc/13/37/92/479133792.db2.gz NWRAAYULHGKHNK-GFCCVEGCSA-N 0 3 330.413 2.789 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2csc(N[C@H]3CCN(C4CC4)C3)n2)cc1 ZINC000596091586 479134014 /nfs/dbraw/zinc/13/40/14/479134014.db2.gz NWRAAYULHGKHNK-LBPRGKRZSA-N 0 3 330.413 2.789 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2NC[C@H]1CCCN1CC(F)F ZINC000599067237 479146244 /nfs/dbraw/zinc/14/62/44/479146244.db2.gz ZFKJNRAXTVLRFU-BXUZGUMPSA-N 0 3 325.359 2.901 20 5 EFBDHN C[C@@H](N[C@@H]1CCO[C@H]1c1ccc(=O)[nH]c1)c1ccccc1[N+](=O)[O-] ZINC000599074698 479150782 /nfs/dbraw/zinc/15/07/82/479150782.db2.gz VGZOZJYRJIXJRC-ZLENFMNRSA-N 0 3 329.356 2.876 20 5 EFBDHN COCCCN(C)CCNc1c(Br)cccc1[N+](=O)[O-] ZINC000596139648 479160051 /nfs/dbraw/zinc/16/00/51/479160051.db2.gz DSNAKMRJDVMNPS-UHFFFAOYSA-N 0 3 346.225 2.738 20 5 EFBDHN CC1(F)CCN(CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)CC1 ZINC000602992762 479185017 /nfs/dbraw/zinc/18/50/17/479185017.db2.gz FNLDUMYFEHVLBG-UHFFFAOYSA-N 0 3 337.351 2.717 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN(C)CCOc1ccc(Cl)cc1 ZINC000610782877 479187158 /nfs/dbraw/zinc/18/71/58/479187158.db2.gz KVCFMDWEYBLIMG-UHFFFAOYSA-N 0 3 338.795 2.764 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)N(C)CCN1CCCCC1 ZINC000593128667 479194803 /nfs/dbraw/zinc/19/48/03/479194803.db2.gz LQGNJFCGURGSFA-UHFFFAOYSA-N 0 3 336.392 2.553 20 5 EFBDHN COc1cc(NCCCN2CCCO[C@H](C)C2)c([N+](=O)[O-])cc1C ZINC000596208785 479199974 /nfs/dbraw/zinc/19/99/74/479199974.db2.gz MEIVWAUKBSECDL-CQSZACIVSA-N 0 3 337.420 2.825 20 5 EFBDHN CN(CCc1ccccc1[N+](=O)[O-])C(=O)[C@@H]1CCN1C1CCCC1 ZINC000602151033 479203371 /nfs/dbraw/zinc/20/33/71/479203371.db2.gz MAFBHKGKJSEAPW-KRWDZBQOSA-N 0 3 331.416 2.613 20 5 EFBDHN C[C@H]1[C@H](Nc2cc[n-]c(=O)c2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000596235841 479216660 /nfs/dbraw/zinc/21/66/60/479216660.db2.gz NFWLISVEQQPQRI-GXTWGEPZSA-N 0 3 328.372 2.770 20 5 EFBDHN C[C@H]1[C@H](Nc2cc[n-]c(=O)c2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000596235841 479216665 /nfs/dbraw/zinc/21/66/65/479216665.db2.gz NFWLISVEQQPQRI-GXTWGEPZSA-N 0 3 328.372 2.770 20 5 EFBDHN Cc1ccc2c(c1)CC[C@@H]2NC[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000556860027 479229391 /nfs/dbraw/zinc/22/93/91/479229391.db2.gz TXZWKWJWHVWNFK-LPHOPBHVSA-N 0 3 342.395 2.920 20 5 EFBDHN C[C@@H]1CC[C@@H](C)N1CC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000610965069 479245538 /nfs/dbraw/zinc/24/55/38/479245538.db2.gz SKJXTDODTGXYSG-ZIAGYGMSSA-N 0 3 331.416 2.959 20 5 EFBDHN O=[N+]([O-])c1cccnc1NCC1CCN(Cc2ccncc2)CC1 ZINC000596441905 479297395 /nfs/dbraw/zinc/29/73/95/479297395.db2.gz RVSVESAXFQQOKL-UHFFFAOYSA-N 0 3 327.388 2.709 20 5 EFBDHN O=[N+]([O-])c1cccc(F)c1Cn1cc(CNC2CCCCC2)nn1 ZINC000603196339 479298121 /nfs/dbraw/zinc/29/81/21/479298121.db2.gz AJOTVUDYBOCMTC-UHFFFAOYSA-N 0 3 333.367 2.796 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCn2cc(CNC3CCCCC3)nn2)cc1 ZINC000603202101 479301589 /nfs/dbraw/zinc/30/15/89/479301589.db2.gz UKMHLENWJBRVSN-UHFFFAOYSA-N 0 3 345.403 2.688 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000611196485 479307724 /nfs/dbraw/zinc/30/77/24/479307724.db2.gz JZRWGOBNZICFCA-OLZOCXBDSA-N 0 3 342.399 2.775 20 5 EFBDHN CC[C@](C)(N)c1cn(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)nn1 ZINC000603232252 479313103 /nfs/dbraw/zinc/31/31/03/479313103.db2.gz VSSPLRFSZICQEY-ZDUSSCGKSA-N 0 3 343.309 2.837 20 5 EFBDHN C[C@@H]1CN(C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H](C)C1(F)F ZINC000599511849 479318051 /nfs/dbraw/zinc/31/80/51/479318051.db2.gz BYXNIOVYEBYQFN-SCRDCRAPSA-N 0 3 344.358 2.558 20 5 EFBDHN CC(C)(C)[C@@H](N)c1cn(Cc2c(F)cc([N+](=O)[O-])cc2F)nn1 ZINC000603246680 479319285 /nfs/dbraw/zinc/31/92/85/479319285.db2.gz FSDWVBZFRBWKSV-ZDUSSCGKSA-N 0 3 325.319 2.559 20 5 EFBDHN CC(C)(CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-])N1CCCCC1 ZINC000593388353 479321656 /nfs/dbraw/zinc/32/16/56/479321656.db2.gz FFUYACDHURPCRX-UHFFFAOYSA-N 0 3 337.395 2.657 20 5 EFBDHN Cn1cc(CN(CCO)CC(C)(C)C)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000611269781 479330672 /nfs/dbraw/zinc/33/06/72/479330672.db2.gz XSDGJAKXGNZEMR-UHFFFAOYSA-N 0 3 346.431 2.836 20 5 EFBDHN CC(C)[C@@H]1C[C@@H](NCc2cc3c(cc2[N+](=O)[O-])OCCO3)CCO1 ZINC000611314638 479347111 /nfs/dbraw/zinc/34/71/11/479347111.db2.gz WRNNQMVGFVLYHD-ZFWWWQNUSA-N 0 3 336.388 2.659 20 5 EFBDHN CCC1(O)CCC(NCc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1 ZINC000611314573 479347371 /nfs/dbraw/zinc/34/73/71/479347371.db2.gz MAAOJLMRTHCYRB-UHFFFAOYSA-N 0 3 336.388 2.539 20 5 EFBDHN O=C(CN[C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)NC1CCCC1 ZINC000611335725 479350462 /nfs/dbraw/zinc/35/04/62/479350462.db2.gz PCSSAHZIPQSOPD-MRXNPFEDSA-N 0 3 331.416 2.564 20 5 EFBDHN C[C@@H]1CN(c2c([N+](=O)[O-])ncn2C)[C@H](C)[C@H](C)N1Cc1ccccc1 ZINC000593483849 479361718 /nfs/dbraw/zinc/36/17/18/479361718.db2.gz JVDGSEMIMIMNQD-QLFBSQMISA-N 0 3 343.431 2.816 20 5 EFBDHN CN(C)C(C)(C)CNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602501064 479370596 /nfs/dbraw/zinc/37/05/96/479370596.db2.gz AALQNUNRVPYZIH-UHFFFAOYSA-N 0 3 336.255 2.849 20 5 EFBDHN CC(C)[C@H](CNCc1nc2cc([N+](=O)[O-])ccc2o1)N1CCCC1 ZINC000602510722 479374582 /nfs/dbraw/zinc/37/45/82/479374582.db2.gz MLKQICIQPHVDGM-HNNXBMFYSA-N 0 3 332.404 2.946 20 5 EFBDHN CCN(Cc1onc(C)c1[N+](=O)[O-])Cc1ccc(CN(C)C)cc1 ZINC000599661319 479377511 /nfs/dbraw/zinc/37/75/11/479377511.db2.gz SVWPPVWXARMNRK-UHFFFAOYSA-N 0 3 332.404 2.975 20 5 EFBDHN CN(C)C[C@H]1CN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CCO1 ZINC000587970207 479377720 /nfs/dbraw/zinc/37/77/20/479377720.db2.gz NISLHTXXTGIDLW-JTQLQIEISA-N 0 3 334.203 2.668 20 5 EFBDHN CC(C)C[C@H](CO)NCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602526522 479381672 /nfs/dbraw/zinc/38/16/72/479381672.db2.gz ORKRKXVSEJYCJE-MRVPVSSYSA-N 0 3 337.239 2.915 20 5 EFBDHN C[C@@H](CNCc1cc(Br)c([N+](=O)[O-])s1)N(C)C1CC1 ZINC000602545798 479391155 /nfs/dbraw/zinc/39/11/55/479391155.db2.gz WEHDMFWELFICLM-QMMMGPOBSA-N 0 3 348.266 2.991 20 5 EFBDHN CC(C)[C@](C)(O)CNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602554557 479393934 /nfs/dbraw/zinc/39/39/34/479393934.db2.gz FHYLZGIDMJXYEW-LLVKDONJSA-N 0 3 337.239 2.915 20 5 EFBDHN CC(C)[C@@](C)(O)CNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602554988 479395325 /nfs/dbraw/zinc/39/53/25/479395325.db2.gz FHYLZGIDMJXYEW-NSHDSACASA-N 0 3 337.239 2.915 20 5 EFBDHN C[C@@H](O)C[C@H](C)CNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602557772 479396961 /nfs/dbraw/zinc/39/69/61/479396961.db2.gz ILKUPTNOTDRITE-JGVFFNPUSA-N 0 3 337.239 2.915 20 5 EFBDHN CC[C@@H](CCO)CNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602574643 479404976 /nfs/dbraw/zinc/40/49/76/479404976.db2.gz XOPQWFHZSYXGMI-QMMMGPOBSA-N 0 3 337.239 2.917 20 5 EFBDHN CCn1nc(C)c(CN[C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c1C ZINC000575127159 479407792 /nfs/dbraw/zinc/40/77/92/479407792.db2.gz WCEUNUZBLFWJLI-CVEARBPZSA-N 0 3 346.435 2.898 20 5 EFBDHN O=C(CCN[C@@H]1CCc2c1cccc2[N+](=O)[O-])N1CCCCCC1 ZINC000575136752 479410224 /nfs/dbraw/zinc/41/02/24/479410224.db2.gz JLYSRUGNNNEDSE-MRXNPFEDSA-N 0 3 331.416 2.964 20 5 EFBDHN CN1CCN(CCCCNc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000603628849 479415142 /nfs/dbraw/zinc/41/51/42/479415142.db2.gz IENGRGKESISITQ-UHFFFAOYSA-N 0 3 326.828 2.688 20 5 EFBDHN O=C(NCCN[C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccccc1F ZINC000575195188 479418965 /nfs/dbraw/zinc/41/89/65/479418965.db2.gz DSLYXHGAAMANNR-MRXNPFEDSA-N 0 3 343.358 2.741 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CNCC[C@@]2(O)CCCOC2)o1 ZINC000593691273 479424051 /nfs/dbraw/zinc/42/40/51/479424051.db2.gz SUIOMDDDZMHFRA-SFHVURJKSA-N 0 3 346.383 2.876 20 5 EFBDHN COc1ccc(CN(C)C)cc1NC(=O)c1csc([N+](=O)[O-])c1 ZINC000603755867 479426249 /nfs/dbraw/zinc/42/62/49/479426249.db2.gz GZCBKAXTEFPRER-UHFFFAOYSA-N 0 3 335.385 2.979 20 5 EFBDHN O=[N+]([O-])c1c2cccnc2ccc1N1CCN(c2ccncc2)CC1 ZINC000603842619 479436484 /nfs/dbraw/zinc/43/64/84/479436484.db2.gz FVILILMVUHOIAL-UHFFFAOYSA-N 0 3 335.367 2.865 20 5 EFBDHN Cn1cc([N+](=O)[O-])cc1C(=O)N(CCN1CCCCCC1)C1CCC1 ZINC000588770707 479441531 /nfs/dbraw/zinc/44/15/31/479441531.db2.gz KCNGIMHGRUVATG-UHFFFAOYSA-N 0 3 348.447 2.804 20 5 EFBDHN CC(C)[C@@H](CO)CNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602653459 479449540 /nfs/dbraw/zinc/44/95/40/479449540.db2.gz IEIHRDXVFAPVAY-MRVPVSSYSA-N 0 3 337.239 2.773 20 5 EFBDHN C[C@@H](NCc1cc(Br)c([N+](=O)[O-])s1)C1(CO)CC1 ZINC000602709361 479493797 /nfs/dbraw/zinc/49/37/97/479493797.db2.gz RBYBLXWSBZFBNF-SSDOTTSWSA-N 0 3 335.223 2.669 20 5 EFBDHN CO[C@H]1COCC[C@@H]1CNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602674869 479468457 /nfs/dbraw/zinc/46/84/57/479468457.db2.gz GXMBPGMRWUUUFN-RISCZKNCSA-N 0 3 348.321 2.755 20 5 EFBDHN CCCN1CC[C@@H](NC(=O)Nc2cc([N+](=O)[O-])ccc2OCC)C1 ZINC000596889576 479475227 /nfs/dbraw/zinc/47/52/27/479475227.db2.gz IBSPNUVPZRZEOJ-GFCCVEGCSA-N 0 3 336.392 2.599 20 5 EFBDHN CC[C@@H](NCCc1ccc([N+](=O)[O-])cc1)C(=O)NCc1cccs1 ZINC000602695164 479482398 /nfs/dbraw/zinc/48/23/98/479482398.db2.gz FBNNLKZQEMFMQB-MRXNPFEDSA-N 0 3 347.440 2.883 20 5 EFBDHN CCN(C(=O)CCOc1cc(C)ccc1[N+](=O)[O-])C1CCN(C)CC1 ZINC000599985199 479486659 /nfs/dbraw/zinc/48/66/59/479486659.db2.gz ABLJCICLZIESFW-UHFFFAOYSA-N 0 3 349.431 2.615 20 5 EFBDHN COC(=O)COc1ccc(CN2CCC3(CCC3)CC2)cc1[N+](=O)[O-] ZINC000589188243 479493702 /nfs/dbraw/zinc/49/37/02/479493702.db2.gz QPBPGBISUJVDSS-UHFFFAOYSA-N 0 3 348.399 2.913 20 5 EFBDHN CN(CCN1CCCCC1)C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000593884776 479497121 /nfs/dbraw/zinc/49/71/21/479497121.db2.gz WOMCGURNHHHGPL-UHFFFAOYSA-N 0 3 325.796 2.806 20 5 EFBDHN CN1CCC2(CCN(C/C=C\c3ccccc3[N+](=O)[O-])CC2)C1=O ZINC000618620828 479516322 /nfs/dbraw/zinc/51/63/22/479516322.db2.gz UIWBUYKPDNUQHV-XQRVVYSFSA-N 0 3 329.400 2.552 20 5 EFBDHN COCCN(CCn1c(C)ncc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000602767103 479537544 /nfs/dbraw/zinc/53/75/44/479537544.db2.gz VWAJJVPZIYBSAB-AWEZNQCLSA-N 0 3 332.404 2.809 20 5 EFBDHN CCOc1cc(N2CCN(C[C@@H]3CCO[C@H]3C)CC2)ccc1[N+](=O)[O-] ZINC000602822090 479575643 /nfs/dbraw/zinc/57/56/43/479575643.db2.gz RKQOSIKULOUXMP-GJZGRUSLSA-N 0 3 349.431 2.541 20 5 EFBDHN CC[C@H](NCCn1c(C)ncc1[N+](=O)[O-])c1ccc(OC)c(OC)c1 ZINC000602827418 479578802 /nfs/dbraw/zinc/57/88/02/479578802.db2.gz CKTGTFCALSBMOJ-AWEZNQCLSA-N 0 3 348.403 2.858 20 5 EFBDHN CC1(C)CN(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)[C@H]2CCC[C@H]21 ZINC000590204426 479617659 /nfs/dbraw/zinc/61/76/59/479617659.db2.gz LBRBZAOLDQYNAU-CVEARBPZSA-N 0 3 343.427 2.994 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC[C@@H]2NC(=O)CC[C@@H]2C1 ZINC000597207181 479621436 /nfs/dbraw/zinc/62/14/36/479621436.db2.gz SQEKZLZVZHPGEV-IQUZECRKSA-N 0 3 329.400 2.599 20 5 EFBDHN C[C@H](C(=O)N[C@H]1CCCN2CCCC[C@H]12)c1cccc([N+](=O)[O-])c1 ZINC000594195428 479627055 /nfs/dbraw/zinc/62/70/55/479627055.db2.gz GYDAQJXKKPFOHM-RRQGHBQHSA-N 0 3 331.416 2.831 20 5 EFBDHN O=C(CCc1cccc([N+](=O)[O-])c1)N[C@@H]1CCCN2CCCC[C@@H]12 ZINC000594198710 479628881 /nfs/dbraw/zinc/62/88/81/479628881.db2.gz VEJGFQKJQNUVCV-SJORKVTESA-N 0 3 331.416 2.661 20 5 EFBDHN Cc1c(CC(=O)N[C@@H]2CCCN3CCCC[C@@H]23)cccc1[N+](=O)[O-] ZINC000594198684 479629015 /nfs/dbraw/zinc/62/90/15/479629015.db2.gz UVMJNBQPILKCGB-WBVHZDCISA-N 0 3 331.416 2.579 20 5 EFBDHN Cc1c(CC(=O)N[C@H]2CCCN3CCCC[C@H]23)cccc1[N+](=O)[O-] ZINC000594198681 479629706 /nfs/dbraw/zinc/62/97/06/479629706.db2.gz UVMJNBQPILKCGB-DOTOQJQBSA-N 0 3 331.416 2.579 20 5 EFBDHN O=C(N[C@H]1CCCN2CCCC[C@@H]12)c1ccc([N+](=O)[O-])cc1Cl ZINC000594202774 479631143 /nfs/dbraw/zinc/63/11/43/479631143.db2.gz RQLOXRDWDJBXAQ-GJZGRUSLSA-N 0 3 337.807 2.995 20 5 EFBDHN COc1ccc(OCCN2CCC(SC)CC2)c([N+](=O)[O-])c1 ZINC000602921434 479631245 /nfs/dbraw/zinc/63/12/45/479631245.db2.gz ZBQGRFSGKSHAMW-UHFFFAOYSA-N 0 3 326.418 2.810 20 5 EFBDHN COC(=O)[C@H]1C[C@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000597241094 479639501 /nfs/dbraw/zinc/63/95/01/479639501.db2.gz CJRXOLVUMOLBRM-JOCQHMNTSA-N 0 3 330.340 2.896 20 5 EFBDHN CN(Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1(CO)CCOCC1 ZINC000597251746 479644607 /nfs/dbraw/zinc/64/46/07/479644607.db2.gz LPZATQYIPCBPRA-UHFFFAOYSA-N 0 3 346.383 2.828 20 5 EFBDHN CC[C@H](CN1CCCC1)NC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000612544096 479689779 /nfs/dbraw/zinc/68/97/79/479689779.db2.gz LQYOCIIIRHKRNT-QWHCGFSZSA-N 0 3 337.395 2.828 20 5 EFBDHN CC[C@@H]1CN(C)CCCN1C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000619578777 479834711 /nfs/dbraw/zinc/83/47/11/479834711.db2.gz PEJPGXOAVYYMHA-MRXNPFEDSA-N 0 3 348.447 2.730 20 5 EFBDHN CCc1nc2ccccc2c(NCCn2cc([N+](=O)[O-])cn2)c1C ZINC000619587120 479836483 /nfs/dbraw/zinc/83/64/83/479836483.db2.gz COUBLVZQBBTXTQ-UHFFFAOYSA-N 0 3 325.372 2.744 20 5 EFBDHN NC(=O)C1(c2ccccc2)CCN(Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000609672855 480195304 /nfs/dbraw/zinc/19/53/04/480195304.db2.gz TXSGUNNGMATATE-UHFFFAOYSA-N 0 3 339.395 2.614 20 5 EFBDHN NC(=O)C1(c2ccccc2)CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000609672322 480195372 /nfs/dbraw/zinc/19/53/72/480195372.db2.gz FJFSWALZAQENSB-UHFFFAOYSA-N 0 3 339.395 2.614 20 5 EFBDHN CC[C@H](CN1CCCC1)NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000609877964 480216519 /nfs/dbraw/zinc/21/65/19/480216519.db2.gz RHWSSUUPDKDQKA-GFCCVEGCSA-N 0 3 330.388 2.680 20 5 EFBDHN CCCC(O)(CCC)CNCc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000610010063 480228599 /nfs/dbraw/zinc/22/85/99/480228599.db2.gz SKRBVPZHYLVQRT-UHFFFAOYSA-N 0 3 338.404 2.787 20 5 EFBDHN CN(Cc1ccc(C(C)(C)C)cc1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000610335363 480282480 /nfs/dbraw/zinc/28/24/80/480282480.db2.gz QNGUFVSLRBGFII-QGZVFWFLSA-N 0 3 346.431 2.582 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCCN(C[C@H]2CCCO2)CC1 ZINC000610391580 480296103 /nfs/dbraw/zinc/29/61/03/480296103.db2.gz DGPPAXSXEHOGAP-HZPDHXFCSA-N 0 3 333.432 2.843 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610583373 480343687 /nfs/dbraw/zinc/34/36/87/480343687.db2.gz MYSQTNIPRUISLZ-OCCSQVGLSA-N 0 3 330.388 2.795 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN3CC[C@H](N4CCCCC4)C3)nc2c1 ZINC000618280676 480603727 /nfs/dbraw/zinc/60/37/27/480603727.db2.gz PYIJQGXMEMJAOM-AWEZNQCLSA-N 0 3 329.404 2.531 20 5 EFBDHN C[C@H](NC[C@H](O)COCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000173382964 533900526 /nfs/dbraw/zinc/90/05/26/533900526.db2.gz XNEIQMOCCVGWML-KSSFIOAISA-N 0 3 330.384 2.823 20 5 EFBDHN C[C@H](CN(C)Cc1ccccc1)NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000179710362 534022701 /nfs/dbraw/zinc/02/27/01/534022701.db2.gz FYCRJVOMQXFXPG-OAHLLOKOSA-N 0 3 341.411 2.774 20 5 EFBDHN C[C@@H](CNC(=O)c1ccc(F)cc1[N+](=O)[O-])N(C)Cc1ccccc1 ZINC000129960597 534038454 /nfs/dbraw/zinc/03/84/54/534038454.db2.gz YKUGVIBDVLKDSY-ZDUSSCGKSA-N 0 3 345.374 2.984 20 5 EFBDHN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CC[C@H]2CC[C@@H](C1)N2C ZINC000191345422 534055625 /nfs/dbraw/zinc/05/56/25/534055625.db2.gz ODIVEWSKFOHCGY-KGLIPLIRSA-N 0 3 332.404 2.912 20 5 EFBDHN COC(=O)c1ccc(CN(C)C[C@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000178572030 534093853 /nfs/dbraw/zinc/09/38/53/534093853.db2.gz XGOJRMVDRXJCCF-KRWDZBQOSA-N 0 3 344.367 2.547 20 5 EFBDHN C[C@@H]1[C@@H](C)CCC[C@@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000129243654 534231039 /nfs/dbraw/zinc/23/10/39/534231039.db2.gz JRBJHKFHOJKZIW-ZENOOKHLSA-N 0 3 340.445 2.783 20 5 EFBDHN CN(CCCCCO)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000227052983 536332697 /nfs/dbraw/zinc/33/26/97/536332697.db2.gz IPBYOULEJDSKSN-UHFFFAOYSA-N 0 3 331.210 2.952 20 5 EFBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C[C@H](O)COCc1ccco1 ZINC000066484010 519655599 /nfs/dbraw/zinc/65/55/99/519655599.db2.gz BGYKOBGOLTZXNN-KRWDZBQOSA-N 0 3 348.399 2.976 20 5 EFBDHN C[C@@H]1CN(Cc2ccc(Cl)c([N+](=O)[O-])c2)CCN1CC(C)(C)O ZINC000189915398 534472088 /nfs/dbraw/zinc/47/20/88/534472088.db2.gz OEGVURQTSGCJRR-GFCCVEGCSA-N 0 3 341.839 2.525 20 5 EFBDHN CCCCNC(=O)C1CCN(CCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000065534393 520607774 /nfs/dbraw/zinc/60/77/74/520607774.db2.gz DXLMXORQJLZMDH-UHFFFAOYSA-N 0 3 349.431 2.602 20 5 EFBDHN CCOc1ccc([C@H](C)NCCCNC(=O)C(C)C)cc1[N+](=O)[O-] ZINC000090880935 521259057 /nfs/dbraw/zinc/25/90/57/521259057.db2.gz RVQLEAMCAPDOKO-ZDUSSCGKSA-N 0 3 337.420 2.806 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@H](C)CO[C@H]2CCOC2)cc1[N+](=O)[O-] ZINC000245507338 521260483 /nfs/dbraw/zinc/26/04/83/521260483.db2.gz PTGLQQYDUBDHBO-IPYPFGDCSA-N 0 3 338.404 2.838 20 5 EFBDHN CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1NC1CCN(CC)CC1 ZINC000156516394 521447720 /nfs/dbraw/zinc/44/77/20/521447720.db2.gz RJHSNFZHTXGVOL-UHFFFAOYSA-N 0 3 339.367 2.807 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000078638048 521601414 /nfs/dbraw/zinc/60/14/14/521601414.db2.gz FQHIXAJCJXXULP-INIZCTEOSA-N 0 3 344.415 2.540 20 5 EFBDHN CN(C)CCNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000153930772 521784676 /nfs/dbraw/zinc/78/46/76/521784676.db2.gz UFWCFGNGLWJDJH-UHFFFAOYSA-N 0 3 328.372 2.630 20 5 EFBDHN CN(C)Cc1ccc(C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000089420906 521902352 /nfs/dbraw/zinc/90/23/52/521902352.db2.gz PZVFYJVEYFIHEO-UHFFFAOYSA-N 0 3 339.355 2.785 20 5 EFBDHN CN(C)[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1F)Cc1ccccc1 ZINC000054059736 522084102 /nfs/dbraw/zinc/08/41/02/522084102.db2.gz QZQKLJCRZIYIPX-HNNXBMFYSA-N 0 3 345.374 2.637 20 5 EFBDHN COc1cc(C(=O)NCC(C)(C)N2CCCCC2)cc([N+](=O)[O-])c1C ZINC000190619827 522103121 /nfs/dbraw/zinc/10/31/21/522103121.db2.gz JOHBFYMXBYRNGQ-UHFFFAOYSA-N 0 3 349.431 2.906 20 5 EFBDHN CN(C)[C@H]1Cc2ccccc2N(C(=O)c2ccccc2[N+](=O)[O-])C1 ZINC000067203576 522108534 /nfs/dbraw/zinc/10/85/34/522108534.db2.gz JVAOHLJNEUXCEC-AWEZNQCLSA-N 0 3 325.368 2.728 20 5 EFBDHN CC[C@H](c1ccncc1)N(C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000245689111 522967698 /nfs/dbraw/zinc/96/76/98/522967698.db2.gz LKCUHNIOPXXCAN-SJLPKXTDSA-N 0 3 345.399 2.813 20 5 EFBDHN O=C(c1ccccc1)N1CCC(NCc2ccccc2[N+](=O)[O-])CC1 ZINC000191623042 534743534 /nfs/dbraw/zinc/74/35/34/534743534.db2.gz PRFMXALHGOIYPX-UHFFFAOYSA-N 0 3 339.395 2.989 20 5 EFBDHN COc1ccc(CN[C@@H](C)CO)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000121196518 524074236 /nfs/dbraw/zinc/07/42/36/524074236.db2.gz NCTXRGWMXFSPNW-ZDUSSCGKSA-N 0 3 346.383 2.653 20 5 EFBDHN C[C@H](CN1CCC[C@@H](C)C1)NC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000150788848 524337448 /nfs/dbraw/zinc/33/74/48/524337448.db2.gz YWEMTTCZUQEEDS-CHWSQXEVSA-N 0 3 337.395 2.513 20 5 EFBDHN Cc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2N)c(CN(C)C)c1 ZINC000178200347 525244834 /nfs/dbraw/zinc/24/48/34/525244834.db2.gz QMJLRXSGUBBOLE-UHFFFAOYSA-N 0 3 328.372 2.799 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](c2ccccc2)N(C)C)c1 ZINC000060063731 525449664 /nfs/dbraw/zinc/44/96/64/525449664.db2.gz RATAAUJDTAXKBD-QGZVFWFLSA-N 0 3 343.383 2.636 20 5 EFBDHN Cc1ccsc1CN(C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000078991280 525840071 /nfs/dbraw/zinc/84/00/71/525840071.db2.gz GBMXGHQGKSWMRI-CQSZACIVSA-N 0 3 336.413 2.836 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CCC(COc3ccccc3)CC2)c1 ZINC000174859258 534889081 /nfs/dbraw/zinc/88/90/81/534889081.db2.gz XBCOUYVPIHOYSI-UHFFFAOYSA-N 0 3 330.388 2.582 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]3CC[C@@H](C2)N3C)c1 ZINC000245455013 526080430 /nfs/dbraw/zinc/08/04/30/526080430.db2.gz SGODWXSPQCUBOL-NEPJUHHUSA-N 0 3 335.429 2.625 20 5 EFBDHN CCCN1CCC[C@H]1CNC(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000343569083 534909941 /nfs/dbraw/zinc/90/99/41/534909941.db2.gz LUEJLLSHSFLENG-AWEZNQCLSA-N 0 3 335.404 2.516 20 5 EFBDHN Cc1ccc(C(=O)NCCN[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000120917636 526168242 /nfs/dbraw/zinc/16/82/42/526168242.db2.gz FTDRUVZMNVCKQE-AWEZNQCLSA-N 0 3 327.384 2.984 20 5 EFBDHN CC(C)(C)[C@@H](CCO)NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000181485850 526615279 /nfs/dbraw/zinc/61/52/79/526615279.db2.gz IGKSWHYHCOZBAD-CYBMUJFWSA-N 0 3 343.811 2.573 20 5 EFBDHN CC(C)(C)[C@H](CCO)NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000183653096 526693334 /nfs/dbraw/zinc/69/33/34/526693334.db2.gz NEODERXRNJOLGO-ZDUSSCGKSA-N 0 3 343.811 2.573 20 5 EFBDHN COc1cc(C(=O)N[C@@H](C)CN2CCCCCC2)cc([N+](=O)[O-])c1C ZINC000359766648 536497330 /nfs/dbraw/zinc/49/73/30/536497330.db2.gz KRYKUHGEGVGGEV-ZDUSSCGKSA-N 0 3 349.431 2.906 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCCN2CCC[C@H](c3cc[nH]n3)C2)cc1 ZINC000193624073 527371404 /nfs/dbraw/zinc/37/14/04/527371404.db2.gz YVKMBOUVTBQLCL-AWEZNQCLSA-N 0 3 330.388 2.966 20 5 EFBDHN O=[N+]([O-])c1cccc(CN2CCC(CCN3CCOCC3)CC2)c1 ZINC000363666343 527387113 /nfs/dbraw/zinc/38/71/13/527387113.db2.gz POOMQDJATYSNDT-UHFFFAOYSA-N 0 3 333.432 2.529 20 5 EFBDHN CCO[C@@H]1C[C@H](N(C)C[C@H](O)c2cccc([N+](=O)[O-])c2)C12CCC2 ZINC000154460891 527902563 /nfs/dbraw/zinc/90/25/63/527902563.db2.gz PMLNESPOTYQMPL-YESZJQIVSA-N 0 3 334.416 2.908 20 5 EFBDHN CCO[C@H]1C[C@@](N)(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1(C)C ZINC000188003154 528119191 /nfs/dbraw/zinc/11/91/91/528119191.db2.gz YAASYDUJKLRPMA-XLWVJDPXSA-N 0 3 349.431 2.613 20 5 EFBDHN CCO[C@H]1C[C@](N)(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1(C)C ZINC000188003101 528160362 /nfs/dbraw/zinc/16/03/62/528160362.db2.gz YAASYDUJKLRPMA-QITLCBANSA-N 0 3 349.431 2.613 20 5 EFBDHN CCN(CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)Cc1ccccn1 ZINC000181741914 528399947 /nfs/dbraw/zinc/39/99/47/528399947.db2.gz KVIUTBXEJKQDFY-UHFFFAOYSA-N 0 3 346.362 2.980 20 5 EFBDHN CCOc1ccc([C@@H](C)N[C@@H]2CCN(C(=O)CC)C2)cc1[N+](=O)[O-] ZINC000154265812 528597317 /nfs/dbraw/zinc/59/73/17/528597317.db2.gz ZWHWISMIWZZMLZ-TZMCWYRMSA-N 0 3 335.404 2.655 20 5 EFBDHN CCOC[C@H]1CCCN(CCOc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000173749718 529020056 /nfs/dbraw/zinc/02/00/56/529020056.db2.gz JADDCIOWEIJUPI-AWEZNQCLSA-N 0 3 338.404 2.731 20 5 EFBDHN CC(C)Oc1cc(C(=O)N(C)[C@@H]2CCN(C)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000412120652 534942870 /nfs/dbraw/zinc/94/28/70/534942870.db2.gz DUGVLCUYDZYSNC-UKRRQHHQSA-N 0 3 349.431 2.794 20 5 EFBDHN CC(C)Oc1cc(C(=O)N[C@H]2C[C@@H](C)N(C3CC3)C2)ccc1[N+](=O)[O-] ZINC000412181945 534951546 /nfs/dbraw/zinc/95/15/46/534951546.db2.gz YVZBPKIVXHLXJG-OCCSQVGLSA-N 0 3 347.415 2.737 20 5 EFBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCN(C)[C@@H](C)C1 ZINC000341205070 535094196 /nfs/dbraw/zinc/09/41/96/535094196.db2.gz QKRJYXHMLNRHEQ-HOCLYGCPSA-N 0 3 348.447 2.998 20 5 EFBDHN CC(C)N(Cc1cccnc1)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000343724795 535109581 /nfs/dbraw/zinc/10/95/81/535109581.db2.gz YYYABCXRNAGJJH-MRXNPFEDSA-N 0 3 345.399 2.640 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@@H]2CC[C@H](C(=O)OC)C2)cc1[N+](=O)[O-] ZINC000193876108 535420742 /nfs/dbraw/zinc/42/07/42/535420742.db2.gz IYKMSYWRLMAAHE-FPMFFAJLSA-N 0 3 336.388 2.986 20 5 EFBDHN CCC[C@@H]1CN(Cc2cccc([N+](=O)[O-])c2C)CCN1CCOC ZINC000347580346 535437235 /nfs/dbraw/zinc/43/72/35/535437235.db2.gz LPZOVLNJWYVYHB-QGZVFWFLSA-N 0 3 335.448 2.836 20 5 EFBDHN CCC[C@H](NCCCS(=O)(=O)CC)c1cccc([N+](=O)[O-])c1 ZINC000414343223 535702791 /nfs/dbraw/zinc/70/27/91/535702791.db2.gz NBZKGSHSARJAIN-HNNXBMFYSA-N 0 3 328.434 2.850 20 5 EFBDHN CCOC(=O)N1CC[C@H](N[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000193300126 535782057 /nfs/dbraw/zinc/78/20/57/535782057.db2.gz UOTUNZATNUSQRL-XJKSGUPXSA-N 0 3 333.388 2.793 20 5 EFBDHN CN(C)CCN(C/C=C/c1ccccc1[N+](=O)[O-])C[C@H]1CCCO1 ZINC000349065148 535853907 /nfs/dbraw/zinc/85/39/07/535853907.db2.gz XVJHGGVMTFNXOE-ZGRWHYIRSA-N 0 3 333.432 2.651 20 5 EFBDHN CN1C[C@@H]2CCCN(Cc3cc([N+](=O)[O-])ccc3OC(F)F)[C@@H]2C1 ZINC000425352477 536488601 /nfs/dbraw/zinc/48/86/01/536488601.db2.gz HRAMXTLGTSMATJ-SMDDNHRTSA-N 0 3 341.358 2.722 20 5 EFBDHN COC1([C@@H](C)NCC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CCC1 ZINC000412017946 536706970 /nfs/dbraw/zinc/70/69/70/536706970.db2.gz APEKXQGVEFEGTD-SNVBAGLBSA-N 0 3 341.795 2.734 20 5 EFBDHN COc1cc(CN2CCC[C@@H](c3ccnn3C)C2)ccc1[N+](=O)[O-] ZINC000351970596 536753398 /nfs/dbraw/zinc/75/33/98/536753398.db2.gz FTKNLELUFHKESO-CQSZACIVSA-N 0 3 330.388 2.717 20 5 EFBDHN COc1cc(CNC[C@H]2CCC[C@H](CO)C2)c([N+](=O)[O-])cc1OC ZINC000342243295 536800332 /nfs/dbraw/zinc/80/03/32/536800332.db2.gz ITKWAUNCTDJRJS-STQMWFEESA-N 0 3 338.404 2.500 20 5 EFBDHN CO[C@]1(C)C[C@H](NCc2cc([N+](=O)[O-])cc3c2OCOC3)C1(C)C ZINC000266644050 536839434 /nfs/dbraw/zinc/83/94/34/536839434.db2.gz VOICUWZZKFBYLC-WMLDXEAASA-N 0 3 336.388 2.755 20 5 EFBDHN O=[N+]([O-])c1ccc([C@@H](O)CNCCOc2cccc(Cl)c2)cc1 ZINC000754251393 575410658 /nfs/dbraw/zinc/41/06/58/575410658.db2.gz SLWTWEXPZGBLCT-INIZCTEOSA-N 0 3 336.775 2.950 20 5 EFBDHN CC(C)[C@H](CN(C)C)NC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000754361537 575424970 /nfs/dbraw/zinc/42/49/70/575424970.db2.gz IIARBAJHFDRCQG-NHYWBVRUSA-N 0 3 325.384 2.540 20 5 EFBDHN C[C@H](CNC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)N1CCCCC1 ZINC000754364009 575425099 /nfs/dbraw/zinc/42/50/99/575425099.db2.gz DZIKZIKCFWJUQS-OLZOCXBDSA-N 0 3 337.395 2.828 20 5 EFBDHN COC[C@H](N[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)C(C)C ZINC000754383824 575428374 /nfs/dbraw/zinc/42/83/74/575428374.db2.gz JUAMNGLIIYIFCX-HZMBPMFUSA-N 0 3 343.811 2.836 20 5 EFBDHN C[C@@H](NCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CCCOC1 ZINC000754568705 575454108 /nfs/dbraw/zinc/45/41/08/575454108.db2.gz ODHPGRCGXUJHQR-MNOVXSKESA-N 0 3 341.795 2.591 20 5 EFBDHN CCCn1ccnc1CCCN(C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000759763568 575931117 /nfs/dbraw/zinc/93/11/17/575931117.db2.gz GSIPSLCWNODTLF-KRWDZBQOSA-N 0 3 346.431 2.799 20 5 EFBDHN C[C@H](CNC(=O)c1cc(F)c([N+](=O)[O-])cc1F)N1CCCC[C@H]1C ZINC000763407601 576376151 /nfs/dbraw/zinc/37/61/51/576376151.db2.gz NOHVOWQUNQKBFB-GHMZBOCLSA-N 0 3 341.358 2.866 20 5 EFBDHN C[C@H](NC[C@H](O)COc1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000765289191 577027782 /nfs/dbraw/zinc/02/77/82/577027782.db2.gz MVKIVDOEWIVNJT-LRDDRELGSA-N 0 3 334.347 2.824 20 5 EFBDHN CC[C@@H](CO)N(Cc1ccccc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000767816846 577235976 /nfs/dbraw/zinc/23/59/76/577235976.db2.gz BFKUECNWOYONRR-PKOBYXMFSA-N 0 3 344.411 2.901 20 5 EFBDHN CC[C@H](CN1CCCC1)NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000768711955 577296406 /nfs/dbraw/zinc/29/64/06/577296406.db2.gz KYCWDXUSVCEOCS-GFCCVEGCSA-N 0 3 325.796 2.852 20 5 EFBDHN O=[N+]([O-])c1ccc(Cl)cc1CNCCc1nnc2ccccn21 ZINC000740003438 577416984 /nfs/dbraw/zinc/41/69/84/577416984.db2.gz YDLVDYYQGBZPHE-UHFFFAOYSA-N 0 3 331.763 2.623 20 5 EFBDHN O=[N+]([O-])c1ccc(Cl)cc1CN[C@H]1CCO[C@@]2(CCOC2)C1 ZINC000770752892 581133530 /nfs/dbraw/zinc/13/35/30/581133530.db2.gz WKODOXSZASYMCP-ZFWWWQNUSA-N 0 3 326.780 2.676 20 5 EFBDHN O=[N+]([O-])c1ccc(Cl)cc1CN[C@H]1CCO[C@]2(CCOC2)C1 ZINC000770752889 581133569 /nfs/dbraw/zinc/13/35/69/581133569.db2.gz WKODOXSZASYMCP-DZGCQCFKSA-N 0 3 326.780 2.676 20 5 EFBDHN O=[N+]([O-])c1ccc([C@@H](O)CNC[C@H](O)c2ccc(Cl)cc2)cc1 ZINC000771568313 581223356 /nfs/dbraw/zinc/22/33/56/581223356.db2.gz SQCAFIZTVFURMW-HOTGVXAUSA-N 0 3 336.775 2.605 20 5 EFBDHN CCN(CC)CCOC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] ZINC000772091434 581281516 /nfs/dbraw/zinc/28/15/16/581281516.db2.gz MRAHOBKVVBVUGK-UHFFFAOYSA-N 0 3 342.417 2.824 20 5 EFBDHN CN1CCC(ONC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 ZINC000773552789 581444429 /nfs/dbraw/zinc/44/44/29/581444429.db2.gz UIUDTGUYWCLEQY-UHFFFAOYSA-N 0 3 335.385 2.565 20 5 EFBDHN COC(=O)N1CCC[C@H](N[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000774167444 581486335 /nfs/dbraw/zinc/48/63/35/581486335.db2.gz CZZSTJGTEVFNBY-XJKSGUPXSA-N 0 3 333.388 2.793 20 5 EFBDHN CC(COC(=O)C1(C(=O)OC(C)(C)C)CCCCCC1)[N+](=O)[O-] ZINC000851035956 1250765919 /nfs/dbraw/zinc/76/59/19/1250765919.db2.gz COKUWRFOIAOHJX-LBPRGKRZSA-N 0 3 329.393 2.877 20 5 EFBDHN CC([C@@H](OC(=O)Cn1cc(C2CC2)cn1)c1ccccc1F)[N+](=O)[O-] ZINC000851107935 1250799740 /nfs/dbraw/zinc/79/97/40/1250799740.db2.gz FRUSORKQRGHYOR-PIGZYNQJSA-N 0 3 347.346 2.849 20 5 EFBDHN CC([C@H](OC(=O)c1c(Cl)cnn1C)c1ccccc1F)[N+](=O)[O-] ZINC000851107930 1250800502 /nfs/dbraw/zinc/80/05/02/1250800502.db2.gz FQJZUVJLZPNRAG-OQPBUACISA-N 0 3 341.726 2.776 20 5 EFBDHN CC([C@H](OC(=O)c1ccnn1C(F)F)c1ccccc1F)[N+](=O)[O-] ZINC000851108960 1250806039 /nfs/dbraw/zinc/80/60/39/1250806039.db2.gz SUQUVKLINKGWAZ-UFBFGSQYSA-N 0 3 343.261 2.981 20 5 EFBDHN CC([C@H](OC(=O)c1cnc2n1CCC2)c1ccccc1F)[N+](=O)[O-] ZINC000851108871 1250806240 /nfs/dbraw/zinc/80/62/40/1250806240.db2.gz QMGHSQBVBDWZMP-BMIGLBTASA-N 0 3 333.319 2.532 20 5 EFBDHN O=C(c1ccco1)N1CCC(CNCc2csc([N+](=O)[O-])c2)CC1 ZINC000997476339 1257719916 /nfs/dbraw/zinc/71/99/16/1257719916.db2.gz ITXGCAMDTBRYGY-UHFFFAOYSA-N 0 3 349.412 2.891 20 5 EFBDHN O=C(c1ccc[nH]1)N1CCC(CNCc2csc([N+](=O)[O-])c2)CC1 ZINC000997538720 1257916623 /nfs/dbraw/zinc/91/66/23/1257916623.db2.gz VOLFTTAMSCXGLT-UHFFFAOYSA-N 0 3 348.428 2.626 20 5 EFBDHN C[C@@H](NC(=O)N[C@@H](C)C1=CCN(C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000921880604 1263110308 /nfs/dbraw/zinc/11/03/08/1263110308.db2.gz KAUBZFQQUXARTP-OLZOCXBDSA-N 0 3 332.404 2.605 20 5 EFBDHN CN(C)CCN(C(=O)/C=C/c1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC000733156644 1265103788 /nfs/dbraw/zinc/10/37/88/1265103788.db2.gz HPJMUHGHMXPQNZ-FMIVXFBMSA-N 0 3 331.416 2.941 20 5 EFBDHN O=[N+]([O-])c1ccc(CNC[C@H]2CCCN2CC(F)(F)F)c(F)c1 ZINC000922708295 1266629399 /nfs/dbraw/zinc/62/93/99/1266629399.db2.gz GLZZIHYJXNKVLM-GFCCVEGCSA-N 0 3 335.301 2.850 20 5 EFBDHN COC1CCC(N(C)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000734477991 1266996292 /nfs/dbraw/zinc/99/62/92/1266996292.db2.gz WYNSRIYVKHXXGU-UHFFFAOYSA-N 0 3 345.403 2.700 20 5 EFBDHN O=C(NC[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1)C1CCCC1 ZINC001086011890 1269512257 /nfs/dbraw/zinc/51/22/57/1269512257.db2.gz WXEPPGFNHSPSNM-AKAXFMLLSA-N 0 3 331.416 2.769 20 5 EFBDHN O=C(NC[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1)c1ccsc1 ZINC001086022563 1269550530 /nfs/dbraw/zinc/55/05/30/1269550530.db2.gz PBWODKSHSSSWAR-JNSHFYNHSA-N 0 3 345.424 2.955 20 5 EFBDHN O=C(NC[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1)c1ccccc1 ZINC001086295775 1270875994 /nfs/dbraw/zinc/87/59/94/1270875994.db2.gz BRRFQQDNGDGMCS-CZIWCDLHSA-N 0 3 339.395 2.893 20 5 EFBDHN O=C(CC1CC1)N[C@H]1CC[C@H](NCc2csc([N+](=O)[O-])c2)CC1 ZINC001034577143 1272320647 /nfs/dbraw/zinc/32/06/47/1272320647.db2.gz ADIMXIYVHGVFAY-HDJSIYSDSA-N 0 3 337.445 2.973 20 5 EFBDHN O=[N+]([O-])C[C@H]1CC[C@H](N2CCN(C/C=C/c3ccccc3)CC2)C1 ZINC001169009341 1272583878 /nfs/dbraw/zinc/58/38/78/1272583878.db2.gz VTNXXTQXYUIQEC-WYTIROKMSA-N 0 3 329.444 2.763 20 5 EFBDHN CC(C)(C)OC(=O)N1CC2(C1)CCCN2[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169011349 1272585050 /nfs/dbraw/zinc/58/50/50/1272585050.db2.gz KABSSAJQINCGNP-UONOGXRCSA-N 0 3 339.436 2.517 20 5 EFBDHN C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H](C)N1[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169012910 1272585313 /nfs/dbraw/zinc/58/53/13/1272585313.db2.gz SMQFMRJTCYXZEM-LXTVHRRPSA-N 0 3 341.452 2.762 20 5 EFBDHN O=[N+]([O-])C[C@H]1CC[C@H](N2CCN(Cc3ccc(Cl)cc3)CC2)C1 ZINC001169037558 1272602802 /nfs/dbraw/zinc/60/28/02/1272602802.db2.gz SMIBNSRVQDYCMB-RDJZCZTQSA-N 0 3 337.851 2.903 20 5 EFBDHN CC(C)(C)OC(=O)N1CCN([C@H]2CC[C@H](C[N+](=O)[O-])C2)C(C)(C)C1 ZINC001169038126 1272605727 /nfs/dbraw/zinc/60/57/27/1272605727.db2.gz VWLYRGKNUBBRNH-KBPBESRZSA-N 0 3 341.452 2.763 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1N[C@@H]1CCc3ccccc3[C@@H]1O)CNC2 ZINC001169619179 1273060368 /nfs/dbraw/zinc/06/03/68/1273060368.db2.gz HWQFSNRIRFWSAG-QAPCUYQASA-N 0 3 325.368 2.658 20 5 EFBDHN CC(C)(NCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCOCC1 ZINC000786151720 1275312253 /nfs/dbraw/zinc/31/22/53/1275312253.db2.gz UIIZAMWMYIJQHP-UHFFFAOYSA-N 0 3 346.387 2.940 20 5 EFBDHN CCn1cc(CN(C[C@H](O)c2ccc([N+](=O)[O-])cc2)C(C)C)cn1 ZINC000844422604 1278971234 /nfs/dbraw/zinc/97/12/34/1278971234.db2.gz HQKDQWBVNVRWIE-KRWDZBQOSA-N 0 3 332.404 2.755 20 5 EFBDHN COc1ccc(C[C@H](C)NCc2cn(CC3CC3)cn2)c([N+](=O)[O-])c1 ZINC001170325218 1279016017 /nfs/dbraw/zinc/01/60/17/1279016017.db2.gz STVYVEFPKHKXMA-ZDUSSCGKSA-N 0 3 344.415 2.931 20 5 EFBDHN COc1ccc(C[C@@H](C)NCc2ncn3ccccc23)c([N+](=O)[O-])c1 ZINC001170325442 1279016657 /nfs/dbraw/zinc/01/66/57/1279016657.db2.gz VJSRLHWCGRRLBV-CYBMUJFWSA-N 0 3 340.383 2.972 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CNCc2ccc3c(c2)OCCCO3)c1 ZINC000819008651 1276570713 /nfs/dbraw/zinc/57/07/13/1276570713.db2.gz XASANSHLXDTANA-INIZCTEOSA-N 0 3 344.367 2.579 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCOc3ccc(F)cc32)c1 ZINC000819048652 1276581036 /nfs/dbraw/zinc/58/10/36/1276581036.db2.gz OEPNFPFMYHBXNH-CVEARBPZSA-N 0 3 332.331 2.881 20 5 EFBDHN CC(C)Oc1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)ccn1 ZINC000819186115 1276665010 /nfs/dbraw/zinc/66/50/10/1276665010.db2.gz PISDQUMOPOWPOO-MRXNPFEDSA-N 0 3 331.372 2.600 20 5 EFBDHN O=C(NCCNCc1cccc([N+](=O)[O-])c1)c1csc(Cl)c1 ZINC001134806975 1287232878 /nfs/dbraw/zinc/23/28/78/1287232878.db2.gz VGSKWZQJKMOARO-UHFFFAOYSA-N 0 3 339.804 2.829 20 5 EFBDHN CCCCn1cc(CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c(C)n1 ZINC000819204826 1276677515 /nfs/dbraw/zinc/67/75/15/1276677515.db2.gz FNGVBRVIGRCLDM-QGZVFWFLSA-N 0 3 332.404 2.723 20 5 EFBDHN O=C(NCCNCc1ccc([N+](=O)[O-])cc1)c1ccsc1Cl ZINC001134812671 1287254506 /nfs/dbraw/zinc/25/45/06/1287254506.db2.gz PDAYJJJTALIFGS-UHFFFAOYSA-N 0 3 339.804 2.829 20 5 EFBDHN COc1ccc(C[C@@H](C)NCc2ccc(Cl)nn2)c([N+](=O)[O-])c1 ZINC001170306595 1279028647 /nfs/dbraw/zinc/02/86/47/1279028647.db2.gz YHQPIQKNWMLDIS-SNVBAGLBSA-N 0 3 336.779 2.768 20 5 EFBDHN C[C@@H]1CN(C(=O)[C@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)CCN(C2CC2)C1 ZINC000820874911 1277355012 /nfs/dbraw/zinc/35/50/12/1277355012.db2.gz VASLPZIQHSDXLY-KKXDTOCCSA-N 0 3 343.427 2.641 20 5 EFBDHN CCN(C(=O)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1)C1CCN(C)CC1 ZINC000821400741 1277536424 /nfs/dbraw/zinc/53/64/24/1277536424.db2.gz IENBEUIJEORPRX-DLBZAZTESA-N 0 3 331.416 2.641 20 5 EFBDHN CN1CCCC(C)(C)[C@@H]1CNC(=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000791118248 1277953006 /nfs/dbraw/zinc/95/30/06/1277953006.db2.gz WSXUVZNDCDLTLF-AWEZNQCLSA-N 0 3 341.358 2.723 20 5 EFBDHN COc1ccc(C[C@H](C)N2CCN(CC3CC3)CC2)c([N+](=O)[O-])c1 ZINC001170345429 1279049231 /nfs/dbraw/zinc/04/92/31/1279049231.db2.gz KJQTYYZKFLOYCP-AWEZNQCLSA-N 0 3 333.432 2.562 20 5 EFBDHN COc1ccc(C[C@@H](C)N2CCN3CCCC[C@H]3C2)c([N+](=O)[O-])c1 ZINC001170345051 1279050452 /nfs/dbraw/zinc/05/04/52/1279050452.db2.gz GXHHKOBIRCLOGH-ZBFHGGJFSA-N 0 3 333.432 2.705 20 5 EFBDHN Cc1n[nH]cc1C1CCN(C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000792929825 1279282804 /nfs/dbraw/zinc/28/28/04/1279282804.db2.gz ZINLCGATZSJRNG-KRWDZBQOSA-N 0 3 330.388 2.539 20 5 EFBDHN CC(C)(C)N1CC[C@H]1COC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000845737459 1279809404 /nfs/dbraw/zinc/80/94/04/1279809404.db2.gz HSKCCBCNNHSXHW-ZDUSSCGKSA-N 0 3 335.404 2.813 20 5 EFBDHN Cc1c(CCC(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])cnn1C ZINC000845873010 1279900663 /nfs/dbraw/zinc/90/06/63/1279900663.db2.gz BCZCKVITCZABOH-SJCJKPOMSA-N 0 3 349.362 2.750 20 5 EFBDHN CCCn1cc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])cn1 ZINC000845875971 1279901706 /nfs/dbraw/zinc/90/17/06/1279901706.db2.gz MIZBCPKNDXXWMF-NHYWBVRUSA-N 0 3 335.335 2.996 20 5 EFBDHN CC([C@@H](OC(=O)CC1CCOCC1)c1ccccc1F)[N+](=O)[O-] ZINC000845875932 1279901797 /nfs/dbraw/zinc/90/17/97/1279901797.db2.gz MBXXMNALMOFSCQ-BDJLRTHQSA-N 0 3 325.336 2.892 20 5 EFBDHN CC([C@H](OC(=O)c1cc2n(n1)CCC2)c1ccccc1F)[N+](=O)[O-] ZINC000845875638 1279901899 /nfs/dbraw/zinc/90/18/99/1279901899.db2.gz ASWONGHJFJFHTG-BMIGLBTASA-N 0 3 333.319 2.532 20 5 EFBDHN CC([C@@H](OC(=O)c1cc(C2CC2)n(C)n1)c1ccccc1F)[N+](=O)[O-] ZINC000845875925 1279902481 /nfs/dbraw/zinc/90/24/81/1279902481.db2.gz LYQPTAGEZYFYIP-MGPLVRAMSA-N 0 3 347.346 3.000 20 5 EFBDHN CC([C@@H](OC(=O)c1cc(C2CC2)n(C)n1)c1ccccc1F)[N+](=O)[O-] ZINC000845875930 1279902569 /nfs/dbraw/zinc/90/25/69/1279902569.db2.gz LYQPTAGEZYFYIP-QLJPJBMISA-N 0 3 347.346 3.000 20 5 EFBDHN CC([C@@H](OC(=O)c1cnn(C)c1Cl)c1ccccc1F)[N+](=O)[O-] ZINC000845877614 1279903002 /nfs/dbraw/zinc/90/30/02/1279903002.db2.gz FPDJOYJSQFBSKC-PRHODGIISA-N 0 3 341.726 2.776 20 5 EFBDHN CC([C@H](OC(=O)[C@@H]1C[C@H]1c1cnn(C)c1)c1ccccc1F)[N+](=O)[O-] ZINC000845877680 1279903712 /nfs/dbraw/zinc/90/37/12/1279903712.db2.gz FZOMMSSPJYOMMM-FTOGJNOLSA-N 0 3 347.346 2.612 20 5 EFBDHN COCC1(CC(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])CC1 ZINC000845881658 1279905280 /nfs/dbraw/zinc/90/52/80/1279905280.db2.gz MZFSFBAVOLEKOS-IAQYHMDHSA-N 0 3 325.336 2.892 20 5 EFBDHN CC([C@H](OC(=O)CCOCC(F)F)c1ccccc1F)[N+](=O)[O-] ZINC000845884402 1279907614 /nfs/dbraw/zinc/90/76/14/1279907614.db2.gz YZCVNIKZUASUQE-XPTSAGLGSA-N 0 3 335.278 2.747 20 5 EFBDHN CCCNC(=O)CCN[C@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872024317 1287403580 /nfs/dbraw/zinc/40/35/80/1287403580.db2.gz QBYHMWOSANYLDS-LLVKDONJSA-N 0 3 325.434 2.884 20 5 EFBDHN CC(C)c1ccc(C(=O)NCCNCc2cccc([N+](=O)[O-])c2)cn1 ZINC001129400677 1280187039 /nfs/dbraw/zinc/18/70/39/1280187039.db2.gz DVYGZGKCTLVQPM-UHFFFAOYSA-N 0 3 342.399 2.633 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@]1(O)CCSC1 ZINC000872040565 1287409649 /nfs/dbraw/zinc/40/96/49/1287409649.db2.gz MJFQIWXOOBYQBY-HZMBPMFUSA-N 0 3 328.459 2.835 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H]1CCc2nc(C)nn2C1 ZINC000872031986 1287406458 /nfs/dbraw/zinc/40/64/58/1287406458.db2.gz OSCRHGCAHIGKFY-CMPLNLGQSA-N 0 3 347.444 2.882 20 5 EFBDHN O=[N+]([O-])c1cc(CN[C@@H](C2CC2)[C@]2(CO)CCCO2)ccc1Cl ZINC000815290626 1287413807 /nfs/dbraw/zinc/41/38/07/1287413807.db2.gz LPHSKYZRCCHSFL-JKSUJKDBSA-N 0 3 340.807 2.658 20 5 EFBDHN O=C(Cc1cccc(F)c1)NCCCNCc1ccccc1[N+](=O)[O-] ZINC001175386477 1287415934 /nfs/dbraw/zinc/41/59/34/1287415934.db2.gz YJWGHEUSJVMDAQ-UHFFFAOYSA-N 0 3 345.374 2.573 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@]1(O)CCO[C@H]1C ZINC000872066088 1287417197 /nfs/dbraw/zinc/41/71/97/1287417197.db2.gz DMMQBQGLMUOVHW-PGUXBMHVSA-N 0 3 326.418 2.507 20 5 EFBDHN O=C(CCCc1ccsc1)NCCNCc1ccc([N+](=O)[O-])cc1 ZINC001129967580 1280382707 /nfs/dbraw/zinc/38/27/07/1280382707.db2.gz JPQLCDTUZVILPR-UHFFFAOYSA-N 0 3 347.440 2.885 20 5 EFBDHN O=C(NCCNCc1ccc([N+](=O)[O-])cc1)c1cc2sccc2[nH]1 ZINC001146600159 1280947662 /nfs/dbraw/zinc/94/76/62/1280947662.db2.gz RUBHITKJVWSVDV-UHFFFAOYSA-N 0 3 344.396 2.657 20 5 EFBDHN CC(C)c1cccc(C(=O)NCCNCc2ccc([N+](=O)[O-])cc2)n1 ZINC001130883842 1281258997 /nfs/dbraw/zinc/25/89/97/1281258997.db2.gz VNXYWQDQTRNICS-UHFFFAOYSA-N 0 3 342.399 2.633 20 5 EFBDHN Cc1oc(C)c(C(=O)NCCNCc2cccc([N+](=O)[O-])c2)c1C ZINC001131043841 1281415235 /nfs/dbraw/zinc/41/52/35/1281415235.db2.gz SYABFSXZCKFFOI-UHFFFAOYSA-N 0 3 331.372 2.633 20 5 EFBDHN Cc1ccc(C)c(C(=O)NCCNCc2ccc([N+](=O)[O-])cc2)c1 ZINC001148961819 1281822493 /nfs/dbraw/zinc/82/24/93/1281822493.db2.gz SWWOQPLXLMXWTF-UHFFFAOYSA-N 0 3 327.384 2.731 20 5 EFBDHN Cc1cc(C)cc(C(=O)NCCNCc2cccc([N+](=O)[O-])c2)c1 ZINC001148993276 1281835953 /nfs/dbraw/zinc/83/59/53/1281835953.db2.gz OBVWGVYSQKWWFP-UHFFFAOYSA-N 0 3 327.384 2.731 20 5 EFBDHN CCCN(CCN1CCCC1)C(=O)c1cc([N+](=O)[O-])cc(C)c1F ZINC000808918574 1281969765 /nfs/dbraw/zinc/96/97/65/1281969765.db2.gz DDAZPUCKKDRVAY-UHFFFAOYSA-N 0 3 337.395 2.990 20 5 EFBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN[C@H](CO)C1CCOCC1 ZINC000809974142 1282694235 /nfs/dbraw/zinc/69/42/35/1282694235.db2.gz NSJBIKTYNZLDBG-CYBMUJFWSA-N 0 3 349.214 2.779 20 5 EFBDHN CC(=O)Nc1ccc(CN[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000815556471 1287594707 /nfs/dbraw/zinc/59/47/07/1287594707.db2.gz VYDJSQCNELGWQF-NSHDSACASA-N 0 3 328.372 2.986 20 5 EFBDHN C[C@H](N[C@H]1CC(=O)N(c2ccccc2)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815567292 1287601787 /nfs/dbraw/zinc/60/17/87/1287601787.db2.gz SYAYOHJRJITUIK-JSGCOSHPSA-N 0 3 340.383 2.633 20 5 EFBDHN C[C@@H](NC[C@@H](O)c1c(F)cccc1F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815594638 1287622168 /nfs/dbraw/zinc/62/21/68/1287622168.db2.gz UYJSTYUMRWMZRK-RFAUZJTJSA-N 0 3 337.326 2.839 20 5 EFBDHN O=C(NCCNCc1ccc([N+](=O)[O-])cc1)c1coc(C(F)F)c1 ZINC001132936347 1284465378 /nfs/dbraw/zinc/46/53/78/1284465378.db2.gz NZQSFQUATPIMKU-UHFFFAOYSA-N 0 3 339.298 2.645 20 5 EFBDHN CCc1ccccc1C(=O)NCCNCc1cccc([N+](=O)[O-])c1 ZINC001133029990 1284682242 /nfs/dbraw/zinc/68/22/42/1284682242.db2.gz MDNNCVJJRAALAM-UHFFFAOYSA-N 0 3 327.384 2.677 20 5 EFBDHN Cc1cc(C(=O)NCCNCc2cccc([N+](=O)[O-])c2)ccc1F ZINC001133157306 1284888191 /nfs/dbraw/zinc/88/81/91/1284888191.db2.gz IBTHVDXMIRRRDP-UHFFFAOYSA-N 0 3 331.347 2.562 20 5 EFBDHN O=C1N(CN2C[C@@H]3CC=CC[C@@H]3C2)CCN1c1ccccc1[N+](=O)[O-] ZINC000872713098 1287755621 /nfs/dbraw/zinc/75/56/21/1287755621.db2.gz JHTPSGLRGPSPQP-GASCZTMLSA-N 0 3 342.399 2.692 20 5 EFBDHN Cc1ccc(F)c(C(=O)NCCNCc2cccc([N+](=O)[O-])c2)c1F ZINC001133305173 1285156074 /nfs/dbraw/zinc/15/60/74/1285156074.db2.gz JQGRNSKEBBTFHM-UHFFFAOYSA-N 0 3 349.337 2.701 20 5 EFBDHN CC(C)(C(=O)NCCCNc1ccccc1[N+](=O)[O-])N1CCCCC1 ZINC001094595549 1285408658 /nfs/dbraw/zinc/40/86/58/1285408658.db2.gz IDTDTZYNEJNVMU-UHFFFAOYSA-N 0 3 348.447 2.778 20 5 EFBDHN CC(COC(=O)c1ccc(-c2noc(C(F)(F)F)n2)cc1)[N+](=O)[O-] ZINC000813104407 1285653632 /nfs/dbraw/zinc/65/36/32/1285653632.db2.gz CBZZBNWMYBWUFF-ZETCQYMHSA-N 0 3 345.233 2.577 20 5 EFBDHN Cc1cc(C)cc(-n2ccnc2SCC(=O)OCC(C)[N+](=O)[O-])c1 ZINC000813103691 1285654889 /nfs/dbraw/zinc/65/48/89/1285654889.db2.gz FJCNSHDBPKKGEX-ZDUSSCGKSA-N 0 3 349.412 2.790 20 5 EFBDHN Cc1cc(NC(=O)c2ccco2)sc1C(=O)OCC(C)[N+](=O)[O-] ZINC000813102556 1285655178 /nfs/dbraw/zinc/65/51/78/1285655178.db2.gz RUEFHRGAPSKDLI-VIFPVBQESA-N 0 3 338.341 2.724 20 5 EFBDHN CC(COC(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1)[N+](=O)[O-] ZINC000813107436 1285678521 /nfs/dbraw/zinc/67/85/21/1285678521.db2.gz NKHSMVAGBBXVFU-LLVKDONJSA-N 0 3 346.314 2.900 20 5 EFBDHN Cc1ccc(C(=O)OCC(C)[N+](=O)[O-])cc1NC(=O)NC(C)(C)C ZINC000813108311 1285681361 /nfs/dbraw/zinc/68/13/61/1285681361.db2.gz DCWMFQFQDXHQNQ-LLVKDONJSA-N 0 3 337.376 2.737 20 5 EFBDHN Cc1nn(-c2ccc(C(=O)OCC(C)[N+](=O)[O-])cc2)c(C)c1Cl ZINC000813110071 1285682541 /nfs/dbraw/zinc/68/25/41/1285682541.db2.gz RTBDDJMGCXDUPC-VIFPVBQESA-N 0 3 337.763 2.965 20 5 EFBDHN COc1ccc(-c2nc(C)c(C(=O)OCC(C)[N+](=O)[O-])s2)cc1 ZINC000813112333 1285683714 /nfs/dbraw/zinc/68/37/14/1285683714.db2.gz FQCHZAGNTJSSDD-VIFPVBQESA-N 0 3 336.369 2.949 20 5 EFBDHN CC(COC(=O)[C@@H]1CCCN(c2nc3ccccc3s2)C1)[N+](=O)[O-] ZINC000813111490 1285683751 /nfs/dbraw/zinc/68/37/51/1285683751.db2.gz IOBBQZWWDPOPQL-NWDGAFQWSA-N 0 3 349.412 2.721 20 5 EFBDHN CC(COC(=O)C1CCN(c2nc3ccccc3s2)CC1)[N+](=O)[O-] ZINC000813112560 1285683770 /nfs/dbraw/zinc/68/37/70/1285683770.db2.gz IFQANALAFJCCTR-NSHDSACASA-N 0 3 349.412 2.721 20 5 EFBDHN CC(COC(=O)c1cn(-c2ccccc2)nc1C(C)(C)C)[N+](=O)[O-] ZINC000813113055 1285684427 /nfs/dbraw/zinc/68/44/27/1285684427.db2.gz ABXKOKQIDAORIC-LBPRGKRZSA-N 0 3 331.372 2.992 20 5 EFBDHN CCc1ccc(-n2nc(C(=O)OCC(C)[N+](=O)[O-])c3c2CCC3)cc1 ZINC000813114933 1285685338 /nfs/dbraw/zinc/68/53/38/1285685338.db2.gz YBDDZPGCLZDIMT-LBPRGKRZSA-N 0 3 343.383 2.745 20 5 EFBDHN CCCc1noc2nc(C3CC3)cc(C(=O)OCC(C)[N+](=O)[O-])c12 ZINC000813114290 1285685964 /nfs/dbraw/zinc/68/59/64/1285685964.db2.gz OWTBITYPXOCIOH-VIFPVBQESA-N 0 3 333.344 2.875 20 5 EFBDHN Cc1cc(F)ccc1C(=O)NCCCNCc1ccccc1[N+](=O)[O-] ZINC001171689328 1285752167 /nfs/dbraw/zinc/75/21/67/1285752167.db2.gz SGIMOIAZBNAINZ-UHFFFAOYSA-N 0 3 345.374 2.952 20 5 EFBDHN COc1ccc(C(=O)NCCCNCc2ccccc2[N+](=O)[O-])cc1 ZINC001171852486 1285856619 /nfs/dbraw/zinc/85/66/19/1285856619.db2.gz WGZBCSGFUCRTLU-UHFFFAOYSA-N 0 3 343.383 2.513 20 5 EFBDHN CC(C)c1ccc(C(=O)NCCNCc2ccc([N+](=O)[O-])cc2)nc1 ZINC001133833911 1286002261 /nfs/dbraw/zinc/00/22/61/1286002261.db2.gz JJOZANPKTQGFFJ-UHFFFAOYSA-N 0 3 342.399 2.633 20 5 EFBDHN COC(=O)[C@@]1(C)CCCN1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172904391 1286309149 /nfs/dbraw/zinc/30/91/49/1286309149.db2.gz MZPINFMKRVKEGT-MAUKXSAKSA-N 0 3 332.400 2.870 20 5 EFBDHN C[C@H](CNC(=O)C(C)(C)c1ccccc1[N+](=O)[O-])N1CCCCC1 ZINC000814107754 1286322252 /nfs/dbraw/zinc/32/22/52/1286322252.db2.gz SLWCEVCQYUSAHA-CQSZACIVSA-N 0 3 333.432 2.863 20 5 EFBDHN Cc1ccc(C(=O)NCCNCc2cccc([N+](=O)[O-])c2)c(F)c1F ZINC001134189220 1286436358 /nfs/dbraw/zinc/43/63/58/1286436358.db2.gz BVKZEVNDYIIZIS-UHFFFAOYSA-N 0 3 349.337 2.701 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)NCC(=O)C(C)(C)C)c1F ZINC001173175355 1286451165 /nfs/dbraw/zinc/45/11/65/1286451165.db2.gz ASZZZQFOWRZPPS-JTQLQIEISA-N 0 3 326.368 2.878 20 5 EFBDHN Cc1cccc(C)c1C(=O)NCCNCc1ccc([N+](=O)[O-])cc1 ZINC001134226883 1286472608 /nfs/dbraw/zinc/47/26/08/1286472608.db2.gz SYMPCGMBAGRUHF-UHFFFAOYSA-N 0 3 327.384 2.731 20 5 EFBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)NCc1ccccc1S(C)(=O)=O ZINC001173220201 1286474383 /nfs/dbraw/zinc/47/43/83/1286474383.db2.gz VSTMRNSQBRSVFL-CYBMUJFWSA-N 0 3 348.424 2.719 20 5 EFBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](NC(=O)C2CCC2)C1 ZINC001173238707 1286497093 /nfs/dbraw/zinc/49/70/93/1286497093.db2.gz WDFANWGOWYMSSP-WMLDXEAASA-N 0 3 345.443 2.907 20 5 EFBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CCC[C@H](Oc2ncccn2)C1 ZINC001173238992 1286497486 /nfs/dbraw/zinc/49/74/86/1286497486.db2.gz ZTMCOVWLCLXMJS-YOEHRIQHSA-N 0 3 342.399 2.859 20 5 EFBDHN Cc1ccccc1CCC(=O)NCCNCc1cccc([N+](=O)[O-])c1 ZINC001134296206 1286526048 /nfs/dbraw/zinc/52/60/48/1286526048.db2.gz OQUVMHYJUVNLOQ-UHFFFAOYSA-N 0 3 341.411 2.742 20 5 EFBDHN Cc1ccccc1CCC(=O)NCCNCc1ccc([N+](=O)[O-])cc1 ZINC001134299122 1286542899 /nfs/dbraw/zinc/54/28/99/1286542899.db2.gz VVDAJLJPLJFARX-UHFFFAOYSA-N 0 3 341.411 2.742 20 5 EFBDHN Cc1cc(NC2CCN(C(=O)CN(C)C(C)C)CC2)ccc1[N+](=O)[O-] ZINC001095228408 1286709794 /nfs/dbraw/zinc/70/97/94/1286709794.db2.gz IBJGHEDLMQEMQD-UHFFFAOYSA-N 0 3 348.447 2.646 20 5 EFBDHN CCN(CC)CC(=O)N1CCC(CNc2ccc([N+](=O)[O-])cc2)CC1 ZINC001095262118 1286820764 /nfs/dbraw/zinc/82/07/64/1286820764.db2.gz YNRGRQUZCITRRK-UHFFFAOYSA-N 0 3 348.447 2.587 20 5 EFBDHN O=C(NCCNCc1cccc([N+](=O)[O-])c1)c1cc(Cl)cs1 ZINC001134789020 1287190804 /nfs/dbraw/zinc/19/08/04/1287190804.db2.gz OHUXRUKSZCNKMR-UHFFFAOYSA-N 0 3 339.804 2.829 20 5 EFBDHN Cc1nc(C(=O)NCCCNCc2ccccc2[N+](=O)[O-])sc1C ZINC001176412411 1287982904 /nfs/dbraw/zinc/98/29/04/1287982904.db2.gz KMAISZFRRVDJNR-UHFFFAOYSA-N 0 3 348.428 2.578 20 5 EFBDHN CCC[C@@H](C)C(=O)NCCNCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000816625537 1288214494 /nfs/dbraw/zinc/21/44/94/1288214494.db2.gz HDAKKVRLTKSQTQ-LLVKDONJSA-N 0 3 327.812 2.890 20 5 EFBDHN Cc1cc(F)cc(C(=O)N2CCN(C3CCC3)C[C@@H](C)C2)c1[N+](=O)[O-] ZINC000817021521 1288376622 /nfs/dbraw/zinc/37/66/22/1288376622.db2.gz LAYVYIUPVOVXAR-GFCCVEGCSA-N 0 3 349.406 2.989 20 5 EFBDHN O=C(NCCCCCCNCc1csc([N+](=O)[O-])c1)C(F)F ZINC001177710932 1288523561 /nfs/dbraw/zinc/52/35/61/1288523561.db2.gz FXLMZQPWIJMKBZ-UHFFFAOYSA-N 0 3 335.376 2.688 20 5 EFBDHN CCCN(C(=O)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1)[C@H]1CCN(C)C1 ZINC000823500291 1289322138 /nfs/dbraw/zinc/32/21/38/1289322138.db2.gz WHNMZCNDUDVKBG-GVDBMIGSSA-N 0 3 331.416 2.641 20 5 EFBDHN Nc1ccc(NC(=O)N2CCN(C3CCCCC3)CC2)cc1[N+](=O)[O-] ZINC000823975077 1289504917 /nfs/dbraw/zinc/50/49/17/1289504917.db2.gz ZKHIMLRYHQCBOS-UHFFFAOYSA-N 0 3 347.419 2.659 20 5 EFBDHN CN(C)CCN(C(=O)Nc1ccc(N)c([N+](=O)[O-])c1)C1CCCC1 ZINC000823980393 1289505849 /nfs/dbraw/zinc/50/58/49/1289505849.db2.gz MDROPXZJVHVJPB-UHFFFAOYSA-N 0 3 335.408 2.515 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1CNCCNC(=O)c1ccccc1F ZINC000873020247 1289523257 /nfs/dbraw/zinc/52/32/57/1289523257.db2.gz LJCWZJIJQJRWOY-UHFFFAOYSA-N 0 3 345.374 2.870 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1CNCC1(S(C)(=O)=O)CCCC1 ZINC000873124480 1289581343 /nfs/dbraw/zinc/58/13/43/1289581343.db2.gz FMUQBDRHKIFKOU-UHFFFAOYSA-N 0 3 340.445 2.659 20 5 EFBDHN COc1ccc(OC)c([C@H](O)[C@@H](C)NCc2cccc([N+](=O)[O-])c2)c1 ZINC000873196460 1289635016 /nfs/dbraw/zinc/63/50/16/1289635016.db2.gz SIFCGYSLNMEGPJ-KZULUSFZSA-N 0 3 346.383 2.824 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@H]1Cc2ccccc2CN1 ZINC000873320292 1289728842 /nfs/dbraw/zinc/72/88/42/1289728842.db2.gz UEFOVJOJIPEVJJ-HNNXBMFYSA-N 0 3 340.383 2.739 20 5 EFBDHN Cn1nccc1CCNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000877362417 1291212558 /nfs/dbraw/zinc/21/25/58/1291212558.db2.gz CCUQLXGXBXRTIU-UHFFFAOYSA-N 0 3 328.294 2.679 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1C[C@@H](N2CCOCC2)C[C@H]1C ZINC000877517033 1291256035 /nfs/dbraw/zinc/25/60/35/1291256035.db2.gz KVUDAVLBBZRPGB-ZBFHGGJFSA-N 0 3 333.432 2.507 20 5 EFBDHN CC(=O)N1CCC2(CCN(Cc3cccc([N+](=O)[O-])c3)CC2)CC1 ZINC000957476134 1291620971 /nfs/dbraw/zinc/62/09/71/1291620971.db2.gz OPXLJRCJOAJDKU-UHFFFAOYSA-N 0 3 331.416 2.819 20 5 EFBDHN CCOC(=O)Cc1ccc(N2CCN([C@H](C)CC)CC2)c([N+](=O)[O-])c1 ZINC000826121671 1292242995 /nfs/dbraw/zinc/24/29/95/1292242995.db2.gz OJLJDBFPQFCUDC-CQSZACIVSA-N 0 3 349.431 2.621 20 5 EFBDHN O=[N+]([O-])c1ccc([C@H](O)CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1 ZINC000879996944 1292328299 /nfs/dbraw/zinc/32/82/99/1292328299.db2.gz VLVGOYDVCIMGBO-ZWKOTPCHSA-N 0 3 346.358 2.921 20 5 EFBDHN COCCCN1CCC(Oc2ccc([N+](=O)[O-])c(C(C)=O)c2)CC1 ZINC001233501207 1312944934 /nfs/dbraw/zinc/94/49/34/1312944934.db2.gz XXWDRBREFLIMOL-UHFFFAOYSA-N 0 3 336.388 2.677 20 5 EFBDHN CCN1CCN(Cc2ccc(Nc3ccc([N+](=O)[O-])nc3)cc2)CC1 ZINC001203574646 1312961285 /nfs/dbraw/zinc/96/12/85/1312961285.db2.gz DMIWPRQUYRFFDA-UHFFFAOYSA-N 0 3 341.415 2.871 20 5 EFBDHN Cc1ccc(C(=O)NCCCN(C)Cc2cccc([N+](=O)[O-])c2)cn1 ZINC001234012613 1313038177 /nfs/dbraw/zinc/03/81/77/1313038177.db2.gz YFVPAGATLCWFAE-UHFFFAOYSA-N 0 3 342.399 2.550 20 5 EFBDHN Cc1cccc(OCCN(C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000136869201 1294690714 /nfs/dbraw/zinc/69/07/14/1294690714.db2.gz JZEDEJZJKTYCEQ-GOSISDBHSA-N 0 3 330.384 2.947 20 5 EFBDHN Cc1ncsc1C(=O)NCCCN(C)Cc1cccc([N+](=O)[O-])c1 ZINC001234360015 1313113212 /nfs/dbraw/zinc/11/32/12/1313113212.db2.gz DFJLPTSRUOLKRU-UHFFFAOYSA-N 0 3 348.428 2.612 20 5 EFBDHN Cc1ccccc1[C@H](CO)N(C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000886439218 1294969786 /nfs/dbraw/zinc/96/97/86/1294969786.db2.gz RRCSJPALDWHZRH-ZWKOTPCHSA-N 0 3 330.384 2.602 20 5 EFBDHN Cc1ccccc1[C@@H](CO)N(C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000886439216 1294970717 /nfs/dbraw/zinc/97/07/17/1294970717.db2.gz RRCSJPALDWHZRH-QZTJIDSGSA-N 0 3 330.384 2.602 20 5 EFBDHN CCOC(=O)Cc1ccc([N+](=O)[O-])c(O[C@@H]2CCN(C(C)C)C2)c1 ZINC001234409779 1313121983 /nfs/dbraw/zinc/12/19/83/1313121983.db2.gz GYUJXDCHRMQOOX-CQSZACIVSA-N 0 3 336.388 2.562 20 5 EFBDHN C/C(=C\C(=O)NCCCN(C)Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001234530815 1313148446 /nfs/dbraw/zinc/14/84/46/1313148446.db2.gz ZTABEHGAPSEADD-WYMLVPIESA-N 0 3 331.416 2.889 20 5 EFBDHN COc1c(O[C@@H]2CCN(C)C2)c2nccc3c4ccccc4n(c32)c1=O ZINC001234718460 1313186087 /nfs/dbraw/zinc/18/60/87/1313186087.db2.gz LXMQJNZLMYSNMK-GFCCVEGCSA-N 0 3 349.390 2.530 20 5 EFBDHN CC1(C)CCN(CCNC(=O)c2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000890082405 1295895368 /nfs/dbraw/zinc/89/53/68/1295895368.db2.gz WGDFENUWRVYKLQ-UHFFFAOYSA-N 0 3 325.796 2.710 20 5 EFBDHN C[C@@H]1CSC[C@@H]1NCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000796401071 1299165711 /nfs/dbraw/zinc/16/57/11/1299165711.db2.gz CJBOBRDUUOEBQE-KCJUWKMLSA-N 0 3 329.809 2.528 20 5 EFBDHN CC1(C)OC[C@@H](CN2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)O1 ZINC000851790778 1299396218 /nfs/dbraw/zinc/39/62/18/1299396218.db2.gz OSUXFSGWDTZPJN-MRXNPFEDSA-N 0 3 336.388 2.590 20 5 EFBDHN COCCN(Cc1cccs1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776574198 1299605574 /nfs/dbraw/zinc/60/55/74/1299605574.db2.gz FARRIABUKFARHO-MRXNPFEDSA-N 0 3 336.413 2.838 20 5 EFBDHN COC[C@@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)c1cccc(OC)c1 ZINC000852444086 1299705807 /nfs/dbraw/zinc/70/58/07/1299705807.db2.gz SFTVHPKPWCSCDU-MSOLQXFVSA-N 0 3 346.383 2.614 20 5 EFBDHN O=[N+]([O-])c1ccc([C@@H](O)CN2CCC(Cc3cccnc3)CC2)cc1 ZINC000776599388 1299706730 /nfs/dbraw/zinc/70/67/30/1299706730.db2.gz ZTKHMIQICBCDCA-IBGZPJMESA-N 0 3 341.411 2.978 20 5 EFBDHN CN(Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1)C(C1CC1)C1CC1 ZINC000853494028 1300135279 /nfs/dbraw/zinc/13/52/79/1300135279.db2.gz XUVYWZBQMRBEKB-UHFFFAOYSA-N 0 3 327.388 2.931 20 5 EFBDHN CC(C)CO[C@H](C)C(=N)NOCc1c(F)cc([N+](=O)[O-])cc1F ZINC000853672664 1300223838 /nfs/dbraw/zinc/22/38/38/1300223838.db2.gz JFIUBBUHPRDUBC-SECBINFHSA-N 0 3 331.319 2.933 20 5 EFBDHN Nc1ccc(NCC2CCN(Cc3ccncc3)CC2)c([N+](=O)[O-])c1 ZINC000853810835 1300286759 /nfs/dbraw/zinc/28/67/59/1300286759.db2.gz KDHUFAHWJQCICL-UHFFFAOYSA-N 0 3 341.415 2.896 20 5 EFBDHN Cc1cc([N+](=O)[O-])c(F)c(C(=O)N(C)[C@H]2CCN(C(C)C)C2)c1F ZINC000854896011 1300726933 /nfs/dbraw/zinc/72/69/33/1300726933.db2.gz FSMNKZHXTDIJGU-NSHDSACASA-N 0 3 341.358 2.736 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCN2CCC[C@](O)(c3ccccc3)C2)cc1 ZINC000859583733 1301498919 /nfs/dbraw/zinc/49/89/19/1301498919.db2.gz GONURZGGNMGZIS-LJQANCHMSA-N 0 3 342.395 2.957 20 5 EFBDHN CCN(C)C(C)(C)C(=O)N[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(C)c2)C1 ZINC001097077875 1313840757 /nfs/dbraw/zinc/84/07/57/1313840757.db2.gz DPTCWUBFNBSGPN-SHTZXODSSA-N 0 3 348.447 2.693 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCN(C3CCOCC3)CC2)c(C(F)F)c1 ZINC000865579777 1303318458 /nfs/dbraw/zinc/31/84/58/1303318458.db2.gz FQQGCPGBVCTYRZ-UHFFFAOYSA-N 0 3 341.358 2.833 20 5 EFBDHN CCN(C)C(C)(C)C(=O)N[C@H]1C[C@@H](Nc2ccc(C)cc2[N+](=O)[O-])C1 ZINC001097231222 1313921613 /nfs/dbraw/zinc/92/16/13/1313921613.db2.gz VKABOTGKPLSWPW-OKILXGFUSA-N 0 3 348.447 2.693 20 5 EFBDHN COc1ccccc1[C@H](CO)N[C@H](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000866298169 1303593609 /nfs/dbraw/zinc/59/36/09/1303593609.db2.gz UIYSAKGVESSQIG-WBMJQRKESA-N 0 3 348.374 2.997 20 5 EFBDHN COc1ccccc1[C@@H](CO)N[C@H](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000866298168 1303594246 /nfs/dbraw/zinc/59/42/46/1303594246.db2.gz UIYSAKGVESSQIG-MLGOLLRUSA-N 0 3 348.374 2.997 20 5 EFBDHN C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])N[C@@H]1Cc2ccccc2NC1=O ZINC000866397975 1303622719 /nfs/dbraw/zinc/62/27/19/1303622719.db2.gz LDLGURWTHHFTNW-BDJLRTHQSA-N 0 3 343.358 2.818 20 5 EFBDHN Cc1ccccc1OCCN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000122278315 1304436580 /nfs/dbraw/zinc/43/65/80/1304436580.db2.gz JXTPYEZYQQBOPU-OAHLLOKOSA-N 0 3 342.399 2.863 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCC(F)(F)CC1 ZINC000796538245 1306165548 /nfs/dbraw/zinc/16/55/48/1306165548.db2.gz NQORHKRQPRBKPT-UHFFFAOYSA-N 0 3 327.331 2.963 20 5 EFBDHN CN(C)C(=O)OC[C@H]1CCCCN1CCc1ccc([N+](=O)[O-])cc1 ZINC000796551365 1306287263 /nfs/dbraw/zinc/28/72/63/1306287263.db2.gz XOFWCBZOVNEZHE-MRXNPFEDSA-N 0 3 335.404 2.690 20 5 EFBDHN CCN1CCC[C@H]1CNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC000900009425 1307595274 /nfs/dbraw/zinc/59/52/74/1307595274.db2.gz HXLCPIZJBAGPJL-JTQLQIEISA-N 0 3 329.759 2.601 20 5 EFBDHN CN(CCN1CCCC1)C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC000900560220 1308314554 /nfs/dbraw/zinc/31/45/54/1308314554.db2.gz HXLRTSUYDHCQBY-UHFFFAOYSA-N 0 3 329.759 2.555 20 5 EFBDHN C[C@@H](CN(C)CCc1cccc([N+](=O)[O-])c1)NC(=O)OC(C)(C)C ZINC000801601068 1310582945 /nfs/dbraw/zinc/58/29/45/1310582945.db2.gz AJJUDZFMCFWOEF-ZDUSSCGKSA-N 0 3 337.420 2.982 20 5 EFBDHN CN(C)[C@H](CNC(=O)c1cc(F)ccc1[N+](=O)[O-])Cc1ccccc1 ZINC000751304009 1311116931 /nfs/dbraw/zinc/11/69/31/1311116931.db2.gz PIVLYPDDNIABKT-HNNXBMFYSA-N 0 3 345.374 2.637 20 5 EFBDHN CC(=O)O[C@H]1C[C@@H]2C[C@H](OCc3ccc(C)c([N+](=O)[O-])c3)C[C@H]1N2C ZINC001223221486 1311231624 /nfs/dbraw/zinc/23/16/24/1311231624.db2.gz CWHHKWZNNRTAAP-ONIAQPFYSA-N 0 3 348.399 2.587 20 5 EFBDHN CC(=O)O[C@@H]1C[C@@H]2C[C@H](OCc3c(C)cccc3[N+](=O)[O-])C[C@H]1N2C ZINC001223539288 1311273097 /nfs/dbraw/zinc/27/30/97/1311273097.db2.gz PDCWKICFIZIILH-LBTBCDHLSA-N 0 3 348.399 2.587 20 5 EFBDHN O=C(CCCF)NCC1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001224105816 1311342684 /nfs/dbraw/zinc/34/26/84/1311342684.db2.gz LOSRSRBGFRTWLL-UHFFFAOYSA-N 0 3 337.395 2.673 20 5 EFBDHN CC(C)C(C)(C)C(=O)NCCCNCc1csc([N+](=O)[O-])c1 ZINC001158822584 1311395885 /nfs/dbraw/zinc/39/58/85/1311395885.db2.gz NHTLBTOGOGATCI-UHFFFAOYSA-N 0 3 327.450 2.934 20 5 EFBDHN C[C@H](Nc1ccc2c(ccc(Cl)c2[N+](=O)[O-])n1)[C@H]1CNCCO1 ZINC001159500998 1311528099 /nfs/dbraw/zinc/52/80/99/1311528099.db2.gz UWJFUATWANOLHL-TVQRCGJNSA-N 0 3 336.779 2.585 20 5 EFBDHN O=[N+]([O-])c1cc(F)cc([N+](=O)[O-])c1OC1CCN(C2CC2)CC1 ZINC001225889221 1311586687 /nfs/dbraw/zinc/58/66/87/1311586687.db2.gz KKCREHYPLOSKNG-UHFFFAOYSA-N 0 3 325.296 2.648 20 5 EFBDHN COCCN1CCC(Oc2cc([N+](=O)[O-])c(F)cc2Cl)CC1 ZINC001226196265 1311628502 /nfs/dbraw/zinc/62/85/02/1311628502.db2.gz ONBMKTLLHRPRPM-UHFFFAOYSA-N 0 3 332.759 2.877 20 5 EFBDHN O=[N+]([O-])c1cc([O-])cc(Nc2c(F)cccc2O[C@@H]2CC[NH2+]C2)c1 ZINC001160127848 1311648552 /nfs/dbraw/zinc/64/85/52/1311648552.db2.gz GVWJTIJWBXAYLN-CYBMUJFWSA-N 0 3 333.319 2.924 20 5 EFBDHN O=[N+]([O-])c1cc([O-])cc(Nc2cc(F)ccc2O[C@@H]2CC[NH2+]C2)c1 ZINC001160141308 1311653297 /nfs/dbraw/zinc/65/32/97/1311653297.db2.gz HRVJBTDPFBAXCK-CQSZACIVSA-N 0 3 333.319 2.924 20 5 EFBDHN C[C@H]1CCN(Cc2ccccc2)C[C@@H]1Oc1ncc([N+](=O)[O-])cn1 ZINC001226729190 1311714629 /nfs/dbraw/zinc/71/46/29/1311714629.db2.gz BPBXFQUTZKGHTR-BBRMVZONSA-N 0 3 328.372 2.674 20 5 EFBDHN O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)N2Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001048494035 1311823775 /nfs/dbraw/zinc/82/37/75/1311823775.db2.gz RZMJIDFZGZOMDK-ACHSLPGTSA-N 0 3 343.427 2.864 20 5 EFBDHN O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC001048495552 1311824843 /nfs/dbraw/zinc/82/48/43/1311824843.db2.gz URCBUPUXKQKRGT-AYGBPOKTSA-N 0 3 343.427 2.864 20 5 EFBDHN O=[N+]([O-])c1cccc(NC2CCN(Cc3ccc(O)cc3)CC2)n1 ZINC001161130276 1311865626 /nfs/dbraw/zinc/86/56/26/1311865626.db2.gz KIGIZGJIQLBEQH-UHFFFAOYSA-N 0 3 328.372 2.772 20 5 EFBDHN Cc1ccc2c(ccnc2NCCCN2CCN(C)CC2)c1[N+](=O)[O-] ZINC001161704052 1311955542 /nfs/dbraw/zinc/95/55/42/1311955542.db2.gz ZUDAXIRKUABBHE-UHFFFAOYSA-N 0 3 343.431 2.501 20 5 EFBDHN CC(C)CC(=O)N1C[C@H]2CN(Cc3ccccc3[N+](=O)[O-])C[C@H]2C1 ZINC001048649787 1312005801 /nfs/dbraw/zinc/00/58/01/1312005801.db2.gz VYMXNBJIPDJYNC-IYBDPMFKSA-N 0 3 331.416 2.531 20 5 EFBDHN O=C(CC1CCC1)N1C[C@H]2CN(Cc3cccc([N+](=O)[O-])c3)C[C@H]2C1 ZINC001048742277 1312093221 /nfs/dbraw/zinc/09/32/21/1312093221.db2.gz SVLLWTPHHCZAMA-CALCHBBNSA-N 0 3 343.427 2.675 20 5 EFBDHN O=C(C=C1CCC1)N1C[C@H]2CN(Cc3ccc([N+](=O)[O-])cc3)C[C@H]2C1 ZINC001048758990 1312111428 /nfs/dbraw/zinc/11/14/28/1312111428.db2.gz UNWQDMNKCYQBEH-CALCHBBNSA-N 0 3 341.411 2.595 20 5 EFBDHN CC(C)=C(F)C(=O)N1C[C@H]2CN(Cc3ccccc3[N+](=O)[O-])C[C@H]2C1 ZINC001048761625 1312113940 /nfs/dbraw/zinc/11/39/40/1312113940.db2.gz TWJSHIGJHZIUQW-GASCZTMLSA-N 0 3 347.390 2.748 20 5 EFBDHN Cc1ccc(C(=O)NCCCNCc2csc([N+](=O)[O-])c2)nc1C ZINC001162601833 1312133332 /nfs/dbraw/zinc/13/33/32/1312133332.db2.gz REIVKIXNVAZAIR-UHFFFAOYSA-N 0 3 348.428 2.578 20 5 EFBDHN Cc1cnc(C(=O)NCCCNCc2csc([N+](=O)[O-])c2)c(C)c1 ZINC001162969789 1312214881 /nfs/dbraw/zinc/21/48/81/1312214881.db2.gz CLAKRCZEWZFCLS-UHFFFAOYSA-N 0 3 348.428 2.578 20 5 EFBDHN CN1CCc2c(N[C@H]3CNCc4ccsc43)ccc([N+](=O)[O-])c2C1 ZINC001163230204 1312270111 /nfs/dbraw/zinc/27/01/11/1312270111.db2.gz NAPMAVWJSVFAEJ-HNNXBMFYSA-N 0 3 344.440 2.901 20 5 EFBDHN CC(C)c1cc(C(=O)NCCCNCc2ccccc2[N+](=O)[O-])no1 ZINC001163469171 1312319472 /nfs/dbraw/zinc/31/94/72/1312319472.db2.gz JRBHMLWQCHWWQU-UHFFFAOYSA-N 0 3 346.387 2.616 20 5 EFBDHN Cc1ccc(F)cc1C(=O)NCCCNCc1ccccc1[N+](=O)[O-] ZINC001163515176 1312330192 /nfs/dbraw/zinc/33/01/92/1312330192.db2.gz YKXXWXGBFAYRRW-UHFFFAOYSA-N 0 3 345.374 2.952 20 5 EFBDHN O=[N+]([O-])c1ccc2nc(N[C@H]3CCCC[C@@]34CNCCO4)ccc2c1 ZINC001163646842 1312353991 /nfs/dbraw/zinc/35/39/91/1312353991.db2.gz XQIMDFZLICFICW-FUHWJXTLSA-N 0 3 342.399 2.856 20 5 EFBDHN CCC1(C(=O)N2C[C@H]3CN(Cc4cccc([N+](=O)[O-])c4)C[C@H]3C2)CC1 ZINC001049034593 1312384442 /nfs/dbraw/zinc/38/44/42/1312384442.db2.gz OAEMYIFWQZEPJG-IYBDPMFKSA-N 0 3 343.427 2.675 20 5 EFBDHN O=[N+]([O-])c1cnc(N2C[C@H]3CCN(Cc4ccccc4)[C@@H]3C2)c(F)c1 ZINC001165084638 1312565499 /nfs/dbraw/zinc/56/54/99/1312565499.db2.gz KSVWJYOFJPSOEW-RHSMWYFYSA-N 0 3 342.374 2.840 20 5 EFBDHN COCCCN1CCN(c2ccc3ccc4cccnc4c3n2)CC1 ZINC001165097512 1312567876 /nfs/dbraw/zinc/56/78/76/1312567876.db2.gz KHTATJGQWKWHHK-UHFFFAOYSA-N 0 3 336.439 2.942 20 5 EFBDHN CCc1ccc(C(=O)N[C@H]2C[C@H](NCc3ccccc3[N+](=O)[O-])C2)o1 ZINC001020303355 1314721735 /nfs/dbraw/zinc/72/17/35/1314721735.db2.gz VLGBAKDGZGGKGB-HDJSIYSDSA-N 0 3 343.383 2.801 20 5 EFBDHN O=[N+]([O-])c1cc2[n-]c(O[C@H]3CCC[NH2+]C[C@H]3F)nc2cc1Cl ZINC001217945962 1315123343 /nfs/dbraw/zinc/12/33/43/1315123343.db2.gz FUXUTQBWGFZTGH-PELKAZGASA-N 0 3 328.731 2.593 20 5 EFBDHN O=[N+]([O-])c1cc2nc(O[C@H]3CCC[NH2+]C[C@H]3F)[n-]c2cc1Cl ZINC001217945962 1315123346 /nfs/dbraw/zinc/12/33/46/1315123346.db2.gz FUXUTQBWGFZTGH-PELKAZGASA-N 0 3 328.731 2.593 20 5 EFBDHN CCC(C)(C)c1cc([N+](=O)[O-])c(O[C@H]2CNC[C@@H]2F)c([N+](=O)[O-])c1 ZINC001218017640 1315134737 /nfs/dbraw/zinc/13/47/37/1315134737.db2.gz WTFGAXICFCUELM-GWCFXTLKSA-N 0 3 341.339 2.879 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)cc(Br)c1O[C@H]1CNC[C@@H]1F ZINC001218017343 1315134813 /nfs/dbraw/zinc/13/48/13/1315134813.db2.gz RPYVENUWAWDTAA-CBAPKCEASA-N 0 3 339.548 2.699 20 5 EFBDHN O=[N+]([O-])c1cccc(C(F)(F)F)c1O[C@H]1CNCCC1(F)F ZINC001218447276 1315197472 /nfs/dbraw/zinc/19/74/72/1315197472.db2.gz ILBMEHJYBCGFJX-VIFPVBQESA-N 0 3 326.221 2.990 20 5 EFBDHN O=[N+]([O-])c1ccc(Br)c(O[C@H]2CNCCC2(F)F)c1 ZINC001218449892 1315197958 /nfs/dbraw/zinc/19/79/58/1315197958.db2.gz WYCKXPFFSHYVCY-JTQLQIEISA-N 0 3 337.120 2.733 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1O[C@H]1CNCCC1(F)F ZINC001218449275 1315198153 /nfs/dbraw/zinc/19/81/53/1315198153.db2.gz SPRMWDPPYVYKMZ-JTQLQIEISA-N 0 3 326.221 2.990 20 5 EFBDHN COC(=O)c1ccc(C)c([N+](=O)[O-])c1O[C@@H]1CNCc2ccccc21 ZINC001218491311 1315204562 /nfs/dbraw/zinc/20/45/62/1315204562.db2.gz WJDMOWPVTPVKQH-OAHLLOKOSA-N 0 3 342.351 2.913 20 5 EFBDHN C[C@H]1CCN[C@H](C(=O)n2c3ccccc3cc3c(=O)c(N)ccc2-3)C1 ZINC001219254103 1315294845 /nfs/dbraw/zinc/29/48/45/1315294845.db2.gz UHDBERLXZLHKGD-LRDDRELGSA-N 0 3 335.407 2.717 20 5 EFBDHN C[C@@H](NC1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1cnccn1 ZINC001254468904 1315706913 /nfs/dbraw/zinc/70/69/13/1315706913.db2.gz QMUXJVAXKQOVLC-CYBMUJFWSA-N 0 3 327.388 2.704 20 5 EFBDHN COc1ccc(CN[C@@H](C)Cc2ccccc2[N+](=O)[O-])nc1OC ZINC001254544363 1315721849 /nfs/dbraw/zinc/72/18/49/1315721849.db2.gz JEYKVKSGAQETPD-LBPRGKRZSA-N 0 3 331.372 2.728 20 5 EFBDHN CCNC(=O)OC1CCN([C@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC001254563916 1315724217 /nfs/dbraw/zinc/72/42/17/1315724217.db2.gz GIUSYUMKHGVKKK-CYBMUJFWSA-N 0 3 335.404 2.736 20 5 EFBDHN CCN(C(C)=O)C1CCN([C@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC001254568556 1315725160 /nfs/dbraw/zinc/72/51/60/1315725160.db2.gz HEQXTEZDNVKQHI-CQSZACIVSA-N 0 3 333.432 2.859 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N1CCC[C@H](Oc2cnccn2)C1 ZINC001254569095 1315725178 /nfs/dbraw/zinc/72/51/78/1315725178.db2.gz HTGKSGBHCDTQCK-ZBFHGGJFSA-N 0 3 342.399 2.859 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N1CC[C@@H](Oc2ncc(F)cn2)C1 ZINC001254569985 1315725628 /nfs/dbraw/zinc/72/56/28/1315725628.db2.gz LMQMUQKNFLKNLQ-SWLSCSKDSA-N 0 3 346.362 2.608 20 5 EFBDHN N[C@H]([C@H]1CCCN([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1)C(F)(F)F ZINC001254587791 1315727990 /nfs/dbraw/zinc/72/79/90/1315727990.db2.gz BAQIGYIIKPTHNE-NILFDRSVSA-N 0 3 343.349 2.664 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@@H](N1CCCC[C@](O)(C(F)(F)F)C1)C2 ZINC001254593398 1315728219 /nfs/dbraw/zinc/72/82/19/1315728219.db2.gz LZUMTBBPOQAAGJ-LSDHHAIUSA-N 0 3 344.333 2.841 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@@H](N1CCCC[C@@](O)(C(F)(F)F)C1)C2 ZINC001254593396 1315728376 /nfs/dbraw/zinc/72/83/76/1315728376.db2.gz LZUMTBBPOQAAGJ-GJZGRUSLSA-N 0 3 344.333 2.841 20 5 EFBDHN Cc1nc([C@@H]2CCCN([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)no1 ZINC001254593566 1315729180 /nfs/dbraw/zinc/72/91/80/1315729180.db2.gz NBBPMVVETTUBNH-CJNGLKHVSA-N 0 3 328.372 2.633 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@@H](N1CCC[C@@](O)(C(F)(F)F)CC1)C2 ZINC001254599318 1315729291 /nfs/dbraw/zinc/72/92/91/1315729291.db2.gz NUDBYLPIJJKAKH-GJZGRUSLSA-N 0 3 344.333 2.841 20 5 EFBDHN COC(=O)CCN(Cc1ccco1)[C@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254597238 1315729320 /nfs/dbraw/zinc/72/93/20/1315729320.db2.gz CAXVSURITNUZAS-INIZCTEOSA-N 0 3 344.367 2.720 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@@H](N1CC[C@H](Oc3cccnc3)C1)C2 ZINC001254599941 1315729772 /nfs/dbraw/zinc/72/97/72/1315729772.db2.gz MZPRCEVRLDNYML-WMZOPIPTSA-N 0 3 325.368 2.610 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@@H](N1CCN3CCc4ccccc4[C@H]3C1)C2 ZINC001254607980 1315730319 /nfs/dbraw/zinc/73/03/19/1315730319.db2.gz OAKDVANVMFYJJG-PZJWPPBQSA-N 0 3 349.434 2.977 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@H](N1CC[C@@H](Oc3ccncc3)C1)C2 ZINC001254606835 1315730596 /nfs/dbraw/zinc/73/05/96/1315730596.db2.gz IDYUNIYDELVYSO-SJLPKXTDSA-N 0 3 325.368 2.610 20 5 EFBDHN Cc1cccc(O[C@H]2CCN([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)n1 ZINC001254612088 1315731603 /nfs/dbraw/zinc/73/16/03/1315731603.db2.gz UYMZAMGOYCDCEN-MSOLQXFVSA-N 0 3 339.395 2.919 20 5 EFBDHN CC(C)(C)C(=O)NC1CCN([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254612752 1315731739 /nfs/dbraw/zinc/73/17/39/1315731739.db2.gz YPOTVNZPRMDHCU-KRWDZBQOSA-N 0 3 345.443 2.689 20 5 EFBDHN COc1cc(N2CCC(N3CC(C(F)F)C3)CC2)ccc1[N+](=O)[O-] ZINC001256103934 1315904667 /nfs/dbraw/zinc/90/46/67/1315904667.db2.gz RRQGFVHPBSIFHQ-UHFFFAOYSA-N 0 3 341.358 2.769 20 5 EFBDHN COc1ccc([C@@H](C)NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC001262563704 1316472430 /nfs/dbraw/zinc/47/24/30/1316472430.db2.gz MFAYERXYZPWEEB-SJKOYZFVSA-N 0 3 346.383 2.996 20 5 EFBDHN O=C(c1ccccc1)N1CCC[C@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001320525685 1329153916 /nfs/dbraw/zinc/15/39/16/1329153916.db2.gz CXHLBIQUGIQESR-KRWDZBQOSA-N 0 3 339.395 2.989 20 5 EFBDHN CN(Cc1cc(C(C)(C)C)[nH]n1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001320875484 1329313257 /nfs/dbraw/zinc/31/32/57/1329313257.db2.gz CPQWWGALLKNNSE-OAHLLOKOSA-N 0 3 332.404 2.781 20 5 EFBDHN Cc1cncc([N+](=O)[O-])c1N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC001322535481 1329465880 /nfs/dbraw/zinc/46/58/80/1329465880.db2.gz RWPUAGASXBOVFR-GDBMZVCRSA-N 0 3 326.400 2.795 20 5 EFBDHN Cc1cncc([N+](=O)[O-])c1NC[C@H](c1ccccc1)N1CCCC1 ZINC001326352850 1329749740 /nfs/dbraw/zinc/74/97/40/1329749740.db2.gz UOYVIFZKMKCVAW-MRXNPFEDSA-N 0 3 326.400 2.969 20 5 EFBDHN O=[N+]([O-])c1ccc(CNC[C@H](CO)CC2CCOCC2)c(Cl)c1 ZINC001326560366 1330317582 /nfs/dbraw/zinc/31/75/82/1330317582.db2.gz FDHZELBGGJZUKX-CYBMUJFWSA-N 0 3 342.823 2.763 20 5 EFBDHN C[C@H]1CCCN(C(=O)CCN[C@@H]2CCc3c2cccc3[N+](=O)[O-])C1 ZINC001326845701 1330373606 /nfs/dbraw/zinc/37/36/06/1330373606.db2.gz WYVDMDXIXFZTRB-XJKSGUPXSA-N 0 3 331.416 2.820 20 5 EFBDHN Cc1cncc([N+](=O)[O-])c1N[C@H]1CCCN(Cc2ccccc2)C1 ZINC001326961385 1330390989 /nfs/dbraw/zinc/39/09/89/1330390989.db2.gz YPOVOMONXKADDU-INIZCTEOSA-N 0 3 326.400 2.797 20 5 EFBDHN C[C@@H]1[C@H](C)N(C)CCN1c1ncnc2c(Cl)cc([N+](=O)[O-])cc21 ZINC001328555918 1330602568 /nfs/dbraw/zinc/60/25/68/1330602568.db2.gz FYZGMHPCMHEJLC-VHSXEESVSA-N 0 3 335.795 2.720 20 5 EFBDHN O=C(c1cc2c(s1)CCNC2)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001329923644 1330752014 /nfs/dbraw/zinc/75/20/14/1330752014.db2.gz IFHBGMFQAKKEKN-UHFFFAOYSA-N 0 3 343.408 2.501 20 5 EFBDHN O=[N+]([O-])c1cnc(NC2CCN([C@@H]3CCOC3)CC2)c2ccccc21 ZINC001331147399 1330798707 /nfs/dbraw/zinc/79/87/07/1330798707.db2.gz VMVXIHDPWKLOIT-CQSZACIVSA-N 0 3 342.399 2.808 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1CNCCC(=O)N1CCC[C@H](C)C1 ZINC001332313961 1330956732 /nfs/dbraw/zinc/95/67/32/1330956732.db2.gz SSEDKENOLCONTG-ZDUSSCGKSA-N 0 3 333.432 2.950 20 5 EFBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1Cn1cc(CNCC2CC2)nn1 ZINC001333539255 1331163872 /nfs/dbraw/zinc/16/38/72/1331163872.db2.gz XHIVAJRPJJUMAD-UHFFFAOYSA-N 0 3 345.403 2.521 20 5 EFBDHN CCOC(=O)c1ncc(CNCCc2cccc([N+](=O)[O-])c2)s1 ZINC001336746464 1331499303 /nfs/dbraw/zinc/49/93/03/1331499303.db2.gz BJEXVCGNYMXLHA-UHFFFAOYSA-N 0 3 335.385 2.560 20 5 EFBDHN CCN1CCN(Cc2ccc([N+](=O)[O-])cc2Br)C[C@@H]1C ZINC001338318539 1331690875 /nfs/dbraw/zinc/69/08/75/1331690875.db2.gz GXJRCKUVXSRFCY-NSHDSACASA-N 0 3 342.237 2.883 20 5 EFBDHN O=C(c1cc2c(s1)CNCC2)N1CCc2ccc([N+](=O)[O-])cc21 ZINC001339823647 1332104870 /nfs/dbraw/zinc/10/48/70/1332104870.db2.gz WKUODNHUCLSPKR-UHFFFAOYSA-N 0 3 329.381 2.505 20 5 EFBDHN CC([C@@H](OC(=O)c1c2c(nn1C)CCC2)c1ccccc1F)[N+](=O)[O-] ZINC001345207385 1332522019 /nfs/dbraw/zinc/52/20/19/1332522019.db2.gz KTIFKXUFTXDGQA-QLJPJBMISA-N 0 3 347.346 2.611 20 5 EFBDHN Cc1cc([N+](=O)[O-])c(C)cc1-c1noc(C[C@@H]2CSCCN2)n1 ZINC001345957867 1332588116 /nfs/dbraw/zinc/58/81/16/1332588116.db2.gz PXKBFTCFGBHDNM-LLVKDONJSA-N 0 3 334.401 2.509 20 5 EFBDHN CN1CCCC[C@H]1CNC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001346435617 1332640554 /nfs/dbraw/zinc/64/05/54/1332640554.db2.gz MNJSSQOSRDKJGU-KRWDZBQOSA-N 0 3 346.431 2.753 20 5 EFBDHN Cc1ccc(CN2CC[C@@H](Nc3ncc([N+](=O)[O-])c(C)n3)C2)cc1 ZINC001348545953 1332846955 /nfs/dbraw/zinc/84/69/55/1332846955.db2.gz DPSWPAHOFVJPQO-OAHLLOKOSA-N 0 3 327.388 2.688 20 5 EFBDHN CC(C)[C@@H](CCO)NCc1cc([N+](=O)[O-])ccc1Br ZINC001351289366 1333206383 /nfs/dbraw/zinc/20/63/83/1333206383.db2.gz SOHQJGXIUXCOMJ-CYBMUJFWSA-N 0 3 331.210 2.854 20 5 EFBDHN O=C(N[C@H]1CCCN2CCCC[C@@H]12)c1cccc(Cl)c1[N+](=O)[O-] ZINC000847254931 1333449401 /nfs/dbraw/zinc/44/94/01/1333449401.db2.gz HXUKAIDLRVLMMB-KBPBESRZSA-N 0 3 337.807 2.995 20 5 EFBDHN CCC(C)(C)N1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CC1 ZINC000848300742 1334598570 /nfs/dbraw/zinc/59/85/70/1334598570.db2.gz BEVYMVTYQLEVLL-JXMROGBWSA-N 0 3 331.416 2.941 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1cnn(CN2CC[C@H]([C@@H]3CCOC3)C2)c1 ZINC000848482915 1334739233 /nfs/dbraw/zinc/73/92/33/1334739233.db2.gz VAJAYYHOOMYPSX-LSDHHAIUSA-N 0 3 342.399 2.774 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1cnn(CN2CC[C@@H]([C@@H]3CCOC3)C2)c1 ZINC000848482914 1334739311 /nfs/dbraw/zinc/73/93/11/1334739311.db2.gz VAJAYYHOOMYPSX-HUUCEWRRSA-N 0 3 342.399 2.774 20 5 EFBDHN CN(CCNCc1ccc([N+](=O)[O-])cc1)C(=O)C(C)(C)C(C)(F)F ZINC001753257227 1426332586 /nfs/dbraw/zinc/33/25/86/1426332586.db2.gz OSJSMNNZRJJQBN-UHFFFAOYSA-N 0 3 343.374 2.824 20 5 EFBDHN Cc1coc(C(=O)N[C@H]2C[C@H](NCc3ccccc3[N+](=O)[O-])C2)c1 ZINC001020491160 713072472 /nfs/dbraw/zinc/07/24/72/713072472.db2.gz AVMVEDHMEPVPTO-HDJSIYSDSA-N 0 3 329.356 2.547 20 5 EFBDHN CC1(C(=O)N[C@H]2C[C@H](NCc3ccccc3[N+](=O)[O-])C2)CC=CC1 ZINC001020544913 713130388 /nfs/dbraw/zinc/13/03/88/713130388.db2.gz BWBOIDBDFXMDMV-SHTZXODSSA-N 0 3 329.400 2.688 20 5 EFBDHN COc1c(O)ccc(CN[C@@H]2C[C@H](OC(C)C)C2(C)C)c1[N+](=O)[O-] ZINC000893624017 717903324 /nfs/dbraw/zinc/90/33/24/717903324.db2.gz LLRYATAVXGYASC-KGLIPLIRSA-N 0 3 338.404 2.991 20 5 EFBDHN COc1c([O-])ccc(C[NH2+][C@@H]2C[C@H](OC(C)C)C2(C)C)c1[N+](=O)[O-] ZINC000893624017 717903332 /nfs/dbraw/zinc/90/33/32/717903332.db2.gz LLRYATAVXGYASC-KGLIPLIRSA-N 0 3 338.404 2.991 20 5 EFBDHN C[C@H](NCc1cccc([N+](=O)[O-])c1Br)[C@H]1CCOC1 ZINC000235525217 713594831 /nfs/dbraw/zinc/59/48/31/713594831.db2.gz AFIRBHHHQOLKSW-ONGXEEELSA-N 0 3 329.194 2.872 20 5 EFBDHN O=C(Cc1ccsc1)N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001021798076 714486950 /nfs/dbraw/zinc/48/69/50/714486950.db2.gz OHOBHRZGSRCROW-GASCZTMLSA-N 0 3 345.424 2.636 20 5 EFBDHN COc1c([O-])ccc(CN2CCC[C@@H]2C[NH+]2CCCCC2)c1[N+](=O)[O-] ZINC000891749446 714995018 /nfs/dbraw/zinc/99/50/18/714995018.db2.gz YMTTYJRWAIZZIH-OAHLLOKOSA-N 0 3 349.431 2.759 20 5 EFBDHN CC[C@H](CNc1c2ccccc2n(C)c(=O)c1[N+](=O)[O-])N1CCCC1 ZINC000891810824 715032984 /nfs/dbraw/zinc/03/29/84/715032984.db2.gz XNZITJIXQNRJCP-CYBMUJFWSA-N 0 3 344.415 2.733 20 5 EFBDHN C[C@@H]1CCCN(CCNc2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])C1 ZINC000891836975 715051564 /nfs/dbraw/zinc/05/15/64/715051564.db2.gz BLLIJUJRQYLBSJ-CYBMUJFWSA-N 0 3 344.415 2.591 20 5 EFBDHN Cc1nn(CN(C)CCCn2ccnc2C)c2cc([N+](=O)[O-])ccc12 ZINC000121272776 715213239 /nfs/dbraw/zinc/21/32/39/715213239.db2.gz HQHFMTCFDBZMAZ-UHFFFAOYSA-N 0 3 342.403 2.737 20 5 EFBDHN O=C(N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1)C1CC2(CC2)C1 ZINC001022687881 715305756 /nfs/dbraw/zinc/30/57/56/715305756.db2.gz QQHOIIXHUZCRLL-GASCZTMLSA-N 0 3 329.400 2.522 20 5 EFBDHN C[C@@H](CNC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])N1CCCC[C@H]1C ZINC000727708860 724389672 /nfs/dbraw/zinc/38/96/72/724389672.db2.gz MZVJCRRQTJNKQL-MNOVXSKESA-N 0 3 341.358 2.866 20 5 EFBDHN C[C@@H](CNC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])N1CCCC[C@@H]1C ZINC000727708861 724390033 /nfs/dbraw/zinc/39/00/33/724390033.db2.gz MZVJCRRQTJNKQL-QWRGUYRKSA-N 0 3 341.358 2.866 20 5 EFBDHN CC(C)N1CCC[C@H]1C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000935277048 716887985 /nfs/dbraw/zinc/88/79/85/716887985.db2.gz QTWNARDOUBTBSI-AWEZNQCLSA-N 0 3 339.823 2.780 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]CCC2CCC(OC)CC2)c1[N+](=O)[O-] ZINC000893564568 717342389 /nfs/dbraw/zinc/34/23/89/717342389.db2.gz SDHDCHYOVBLAEF-UHFFFAOYSA-N 0 3 338.404 2.994 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)ccc1CN[C@H]1CCN(CC(F)(F)F)C1 ZINC000892754471 719122298 /nfs/dbraw/zinc/12/22/98/719122298.db2.gz AJZRGSRSVNGHCF-NSHDSACASA-N 0 3 337.729 2.974 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]CCc2cc(F)cc(F)c2)c1[N+](=O)[O-] ZINC000892851358 719235054 /nfs/dbraw/zinc/23/50/54/719235054.db2.gz HSAHHKPXRQXNMC-UHFFFAOYSA-N 0 3 338.310 2.920 20 5 EFBDHN C[C@@H]1CN(c2cc([N+](=O)[O-])cc3c(Cl)ncnc32)[C@@H](C)CN1C ZINC001164638496 719256562 /nfs/dbraw/zinc/25/65/62/719256562.db2.gz ZZBJMTKPQZGBGA-ZJUUUORDSA-N 0 3 335.795 2.720 20 5 EFBDHN CCO[C@@H]1C[C@@H](NCc2ccc(O)c(OC)c2[N+](=O)[O-])C12CCC2 ZINC000892958527 719345850 /nfs/dbraw/zinc/34/58/50/719345850.db2.gz BRHZLEZICDBCHH-ZIAGYGMSSA-N 0 3 336.388 2.746 20 5 EFBDHN CCO[C@@H]1C[C@@H]([NH2+]Cc2ccc([O-])c(OC)c2[N+](=O)[O-])C12CCC2 ZINC000892958527 719345852 /nfs/dbraw/zinc/34/58/52/719345852.db2.gz BRHZLEZICDBCHH-ZIAGYGMSSA-N 0 3 336.388 2.746 20 5 EFBDHN CCO[C@H]1C[C@H](NCc2ccc(O)c(OC)c2[N+](=O)[O-])C12CCC2 ZINC000892958524 719345962 /nfs/dbraw/zinc/34/59/62/719345962.db2.gz BRHZLEZICDBCHH-KBPBESRZSA-N 0 3 336.388 2.746 20 5 EFBDHN CCO[C@H]1C[C@H]([NH2+]Cc2ccc([O-])c(OC)c2[N+](=O)[O-])C12CCC2 ZINC000892958524 719345964 /nfs/dbraw/zinc/34/59/64/719345964.db2.gz BRHZLEZICDBCHH-KBPBESRZSA-N 0 3 336.388 2.746 20 5 EFBDHN COc1c(O)ccc(CNC[C@@H](C)Oc2ccccc2)c1[N+](=O)[O-] ZINC000892977971 719380489 /nfs/dbraw/zinc/38/04/89/719380489.db2.gz ZPFYWORXKSHCFD-GFCCVEGCSA-N 0 3 332.356 2.866 20 5 EFBDHN CC(COC(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1)[N+](=O)[O-] ZINC000893044757 719527089 /nfs/dbraw/zinc/52/70/89/719527089.db2.gz MMUCLLOALJVMFN-NSHDSACASA-N 0 3 338.360 2.880 20 5 EFBDHN CC(COC(=O)C1=Cc2ccccc2O[C@@H]1C(F)(F)F)[N+](=O)[O-] ZINC000893045570 719528247 /nfs/dbraw/zinc/52/82/47/719528247.db2.gz XXRJMGVIAFVTSM-UFBFGSQYSA-N 0 3 331.246 2.602 20 5 EFBDHN COc1c([O-])ccc(C[NH2+][C@@H]2[C@H]3CCCO[C@@H]3C2(C)C)c1[N+](=O)[O-] ZINC000893092695 719624974 /nfs/dbraw/zinc/62/49/74/719624974.db2.gz MVRJQMHWTIENOH-LYRGGWFBSA-N 0 3 336.388 2.602 20 5 EFBDHN CC1(C)OC[C@H](CNCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)O1 ZINC000894081778 720263035 /nfs/dbraw/zinc/26/30/35/720263035.db2.gz CWCBEQRFWWSVRB-LBPRGKRZSA-N 0 3 334.294 2.855 20 5 EFBDHN CN(C)/C=C/c1cc(N2CCN(C3CCCC3)CC2)ncc1[N+](=O)[O-] ZINC001165032038 721859373 /nfs/dbraw/zinc/85/93/73/721859373.db2.gz KLQYDLDYAKDWPH-BQYQJAHWSA-N 0 3 345.447 2.587 20 5 EFBDHN CN(C)/C=C\c1cc(N2CCN(C3CCCC3)CC2)ncc1[N+](=O)[O-] ZINC001165032039 721859626 /nfs/dbraw/zinc/85/96/26/721859626.db2.gz KLQYDLDYAKDWPH-FPLPWBNLSA-N 0 3 345.447 2.587 20 5 EFBDHN COc1c(O)ccc(CNC[C@@H](Cc2ccccc2)OC)c1[N+](=O)[O-] ZINC000894677901 722813727 /nfs/dbraw/zinc/81/37/27/722813727.db2.gz XKZAWYSUZUYMBL-OAHLLOKOSA-N 0 3 346.383 2.656 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]C[C@@H]2CCOC3(CCC3)C2)c1[N+](=O)[O-] ZINC000894711783 722823641 /nfs/dbraw/zinc/82/36/41/722823641.db2.gz LTMUWQXEOFEYEM-GFCCVEGCSA-N 0 3 336.388 2.748 20 5 EFBDHN CC(C)C[C@H]1CN(C)CCN1c1ncnc2ccc([N+](=O)[O-])cc21 ZINC000896651757 723423904 /nfs/dbraw/zinc/42/39/04/723423904.db2.gz XZHGVWVSOTWUOP-AWEZNQCLSA-N 0 3 329.404 2.705 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C1CCN(C(=O)CC2CC2)CC1 ZINC000985207472 723988450 /nfs/dbraw/zinc/98/84/50/723988450.db2.gz XVISJTCKTAWOFE-UHFFFAOYSA-N 0 3 331.416 2.818 20 5 EFBDHN COc1c(O)ccc(CNC[C@H](OC)C2CCCCC2)c1[N+](=O)[O-] ZINC000895454554 724145008 /nfs/dbraw/zinc/14/50/08/724145008.db2.gz DZMJSGPLKMOGBV-HNNXBMFYSA-N 0 3 338.404 2.994 20 5 EFBDHN CC(=O)N1C[C@H]2CN(Cc3ccc(C(C)C)c([N+](=O)[O-])c3)C[C@H]2C1 ZINC000895585001 724207427 /nfs/dbraw/zinc/20/74/27/724207427.db2.gz WYOHHCVKQOGEDB-IYBDPMFKSA-N 0 3 331.416 2.628 20 5 EFBDHN CCCN1CC[C@@H](NC(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)C1 ZINC000912683424 727734524 /nfs/dbraw/zinc/73/45/24/727734524.db2.gz IZTSLNOBQCCEIO-SNVBAGLBSA-N 0 3 329.759 2.601 20 5 EFBDHN CN(C)[C@@H](CNc1ccc([N+](=O)[O-])c2nonc21)c1cccc(F)c1 ZINC000912728225 727738455 /nfs/dbraw/zinc/73/84/55/727738455.db2.gz FCNIRDXPHDRFLI-AWEZNQCLSA-N 0 3 345.334 2.985 20 5 EFBDHN COc1ccc(CNC[C@@H](O)c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000917416684 727805122 /nfs/dbraw/zinc/80/51/22/727805122.db2.gz KZCVLPQRTYNQBO-OAHLLOKOSA-N 0 3 338.310 2.705 20 5 EFBDHN C[C@@H]1NC[C@H](C)N(C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)[C@H]1C ZINC001576881462 1089504433 /nfs/dbraw/zinc/50/44/33/1089504433.db2.gz VKSUQHOVKRBGAT-CIUDSAMLSA-N 0 3 329.759 2.598 20 5 EFBDHN O=C(C[C@H]1NCc2ccccc21)N1CCc2c1ccc([N+](=O)[O-])c2F ZINC001580523020 1090931471 /nfs/dbraw/zinc/93/14/71/1090931471.db2.gz OLYWWIXPRMWFKD-CQSZACIVSA-N 0 3 341.342 2.858 20 5 EFBDHN O=[N+]([O-])c1ccccc1CN(Cc1nc2c(s1)CNCC2)C1CC1 ZINC001580875357 1091031372 /nfs/dbraw/zinc/03/13/72/1091031372.db2.gz JFRBZPJBWNOUKZ-UHFFFAOYSA-N 0 3 344.440 2.862 20 5 EFBDHN CCN(CC)CC(=O)NCC1(Nc2ccccc2[N+](=O)[O-])CCCC1 ZINC001104395998 1092394356 /nfs/dbraw/zinc/39/43/56/1092394356.db2.gz MPIAKMKVKBFWMV-UHFFFAOYSA-N 0 3 348.447 2.778 20 5 EFBDHN C[C@@H](C[NH2+]Cc1cc(-c2nnn[n-]2)cs1)c1ccccc1[N+](=O)[O-] ZINC001589869947 1093160070 /nfs/dbraw/zinc/16/00/70/1093160070.db2.gz CMDHBPLIMQUYBX-JTQLQIEISA-N 0 3 344.400 2.730 20 5 EFBDHN C[C@@H](C[NH2+]Cc1cc(-c2nn[n-]n2)cs1)c1ccccc1[N+](=O)[O-] ZINC001589869947 1093160076 /nfs/dbraw/zinc/16/00/76/1093160076.db2.gz CMDHBPLIMQUYBX-JTQLQIEISA-N 0 3 344.400 2.730 20 5 EFBDHN C[C@H]1CCC[C@H]([N@H+](C)Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590245593 1093334465 /nfs/dbraw/zinc/33/44/65/1093334465.db2.gz XQPGRAFFGGDGAB-RYUDHWBXSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@H]1CCC[C@H]([N@@H+](C)Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590245593 1093334472 /nfs/dbraw/zinc/33/44/72/1093334472.db2.gz XQPGRAFFGGDGAB-RYUDHWBXSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@H]1CCC[C@H]([N@H+](C)Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590245593 1093334478 /nfs/dbraw/zinc/33/44/78/1093334478.db2.gz XQPGRAFFGGDGAB-RYUDHWBXSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@H]1CCC[C@H]([N@@H+](C)Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590245593 1093334487 /nfs/dbraw/zinc/33/44/87/1093334487.db2.gz XQPGRAFFGGDGAB-RYUDHWBXSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@@H]([N@H+](C)Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590245594 1093334916 /nfs/dbraw/zinc/33/49/16/1093334916.db2.gz XQPGRAFFGGDGAB-VXGBXAGGSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@@H]([N@@H+](C)Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590245594 1093334922 /nfs/dbraw/zinc/33/49/22/1093334922.db2.gz XQPGRAFFGGDGAB-VXGBXAGGSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@@H]([N@H+](C)Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590245594 1093334933 /nfs/dbraw/zinc/33/49/33/1093334933.db2.gz XQPGRAFFGGDGAB-VXGBXAGGSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@@H]([N@@H+](C)Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590245594 1093334939 /nfs/dbraw/zinc/33/49/39/1093334939.db2.gz XQPGRAFFGGDGAB-VXGBXAGGSA-N 0 3 330.392 2.785 20 5 EFBDHN CCC[C@H]1CCCC[N@@H+]1Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001590569037 1093493486 /nfs/dbraw/zinc/49/34/86/1093493486.db2.gz JNPHDSVFGUFDTB-LBPRGKRZSA-N 0 3 330.392 2.930 20 5 EFBDHN CCC[C@H]1CCCC[N@H+]1Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001590569037 1093493488 /nfs/dbraw/zinc/49/34/88/1093493488.db2.gz JNPHDSVFGUFDTB-LBPRGKRZSA-N 0 3 330.392 2.930 20 5 EFBDHN CCC[C@H]1CCCC[N@@H+]1Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001590569037 1093493492 /nfs/dbraw/zinc/49/34/92/1093493492.db2.gz JNPHDSVFGUFDTB-LBPRGKRZSA-N 0 3 330.392 2.930 20 5 EFBDHN CCC[C@H]1CCCC[N@H+]1Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001590569037 1093493494 /nfs/dbraw/zinc/49/34/94/1093493494.db2.gz JNPHDSVFGUFDTB-LBPRGKRZSA-N 0 3 330.392 2.930 20 5 EFBDHN CCCC1CC[NH+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])CC1 ZINC001590573009 1093496357 /nfs/dbraw/zinc/49/63/57/1093496357.db2.gz WSVUGONLTGTZQS-UHFFFAOYSA-N 0 3 330.392 2.787 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[N@@H+]1CCC[C@@H]1C1CCC1 ZINC001593481746 1094325381 /nfs/dbraw/zinc/32/53/81/1094325381.db2.gz JYUIOKCNTIYVTD-CQSZACIVSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[N@H+]1CCC[C@@H]1C1CCC1 ZINC001593481746 1094325384 /nfs/dbraw/zinc/32/53/84/1094325384.db2.gz JYUIOKCNTIYVTD-CQSZACIVSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[N@@H+]1CCC[C@@H]1C1CCC1 ZINC001593481746 1094325387 /nfs/dbraw/zinc/32/53/87/1094325387.db2.gz JYUIOKCNTIYVTD-CQSZACIVSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[N@H+]1CCC[C@@H]1C1CCC1 ZINC001593481746 1094325394 /nfs/dbraw/zinc/32/53/94/1094325394.db2.gz JYUIOKCNTIYVTD-CQSZACIVSA-N 0 3 328.376 2.539 20 5 EFBDHN CC(C)[C@H]1CCCC[N@@H+]1Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001603243767 1096482699 /nfs/dbraw/zinc/48/26/99/1096482699.db2.gz HPWBLKGGRACGNZ-CQSZACIVSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)[C@H]1CCCC[N@H+]1Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001603243767 1096482700 /nfs/dbraw/zinc/48/27/00/1096482700.db2.gz HPWBLKGGRACGNZ-CQSZACIVSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)[C@H]1CCCC[N@@H+]1Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001603243767 1096482704 /nfs/dbraw/zinc/48/27/04/1096482704.db2.gz HPWBLKGGRACGNZ-CQSZACIVSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)[C@H]1CCCC[N@H+]1Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001603243767 1096482707 /nfs/dbraw/zinc/48/27/07/1096482707.db2.gz HPWBLKGGRACGNZ-CQSZACIVSA-N 0 3 330.392 2.785 20 5 EFBDHN CCC(CC)[C@H](CNc1ccc([N+](=O)[O-])cc1-c1nnn[n-]1)[NH+](C)C ZINC001604023464 1096702912 /nfs/dbraw/zinc/70/29/12/1096702912.db2.gz RFRVTCQWNSECKK-HNNXBMFYSA-N 0 3 347.423 2.553 20 5 EFBDHN CCC(CC)[C@H](CNc1ccc([N+](=O)[O-])cc1-c1nn[n-]n1)[NH+](C)C ZINC001604023464 1096702916 /nfs/dbraw/zinc/70/29/16/1096702916.db2.gz RFRVTCQWNSECKK-HNNXBMFYSA-N 0 3 347.423 2.553 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[N@@H+]1CC[C@@H]2CCCC[C@@H]21 ZINC001607076849 1097504939 /nfs/dbraw/zinc/50/49/39/1097504939.db2.gz CHMJNCGVOVXBNR-FZMZJTMJSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[N@H+]1CC[C@@H]2CCCC[C@@H]21 ZINC001607076849 1097504943 /nfs/dbraw/zinc/50/49/43/1097504943.db2.gz CHMJNCGVOVXBNR-FZMZJTMJSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1C[N@@H+]1CC[C@@H]2CCCC[C@@H]21 ZINC001607076849 1097504947 /nfs/dbraw/zinc/50/49/47/1097504947.db2.gz CHMJNCGVOVXBNR-FZMZJTMJSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1C[N@H+]1CC[C@@H]2CCCC[C@@H]21 ZINC001607076849 1097504950 /nfs/dbraw/zinc/50/49/50/1097504950.db2.gz CHMJNCGVOVXBNR-FZMZJTMJSA-N 0 3 328.376 2.539 20 5 EFBDHN C[C@H]1CC[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])CC12CCC2 ZINC001609167781 1098181392 /nfs/dbraw/zinc/18/13/92/1098181392.db2.gz AVONRLVIXCZSFK-LBPRGKRZSA-N 0 3 342.403 2.787 20 5 EFBDHN C[C@H]1CC[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])CC12CCC2 ZINC001609167781 1098181395 /nfs/dbraw/zinc/18/13/95/1098181395.db2.gz AVONRLVIXCZSFK-LBPRGKRZSA-N 0 3 342.403 2.787 20 5 EFBDHN C[C@H]1CC[N@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])CC12CCC2 ZINC001609167781 1098181400 /nfs/dbraw/zinc/18/14/00/1098181400.db2.gz AVONRLVIXCZSFK-LBPRGKRZSA-N 0 3 342.403 2.787 20 5 EFBDHN C[C@H]1CC[N@@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])CC12CCC2 ZINC001609167781 1098181404 /nfs/dbraw/zinc/18/14/04/1098181404.db2.gz AVONRLVIXCZSFK-LBPRGKRZSA-N 0 3 342.403 2.787 20 5 EFBDHN CN1C[C@@H]2CCN(C(=O)c3cc4cccnc4c4ncccc34)[C@@H]2C1 ZINC001269514195 1098202532 /nfs/dbraw/zinc/20/25/32/1098202532.db2.gz GFXXMLZYWUABCV-WMLDXEAASA-N 0 3 332.407 2.559 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[N@@H+]1CCC[C@H]1C1CCCC1 ZINC001609602641 1098396204 /nfs/dbraw/zinc/39/62/04/1098396204.db2.gz AVHJEILOWTWAPB-HNNXBMFYSA-N 0 3 342.403 2.930 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[N@H+]1CCC[C@H]1C1CCCC1 ZINC001609602641 1098396208 /nfs/dbraw/zinc/39/62/08/1098396208.db2.gz AVHJEILOWTWAPB-HNNXBMFYSA-N 0 3 342.403 2.930 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[N@@H+]1CCC[C@H]1C1CCCC1 ZINC001609602641 1098396215 /nfs/dbraw/zinc/39/62/15/1098396215.db2.gz AVHJEILOWTWAPB-HNNXBMFYSA-N 0 3 342.403 2.930 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[N@H+]1CCC[C@H]1C1CCCC1 ZINC001609602641 1098396218 /nfs/dbraw/zinc/39/62/18/1098396218.db2.gz AVHJEILOWTWAPB-HNNXBMFYSA-N 0 3 342.403 2.930 20 5 EFBDHN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NCCN(C)Cc1ccccc1 ZINC000843773503 1099841656 /nfs/dbraw/zinc/84/16/56/1099841656.db2.gz CGSXZRSMPCQUDS-UHFFFAOYSA-N 0 3 345.374 2.904 20 5 EFBDHN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NC[C@H](C)N1CCC(C)CC1 ZINC000843776362 1100175938 /nfs/dbraw/zinc/17/59/38/1100175938.db2.gz MGTDETJMCUUYAA-LBPRGKRZSA-N 0 3 337.395 2.893 20 5 EFBDHN O=C(NCCCNCc1ccccc1[N+](=O)[O-])c1ccncc1Cl ZINC001167274896 1102224910 /nfs/dbraw/zinc/22/49/10/1102224910.db2.gz VSDNKNJZAJEEAA-UHFFFAOYSA-N 0 3 348.790 2.553 20 5 EFBDHN Cc1ccc(C(=O)NCCCNCc2ccccc2[N+](=O)[O-])c(F)c1 ZINC001167289692 1102307126 /nfs/dbraw/zinc/30/71/26/1102307126.db2.gz QKRQXKOCGOYDJY-UHFFFAOYSA-N 0 3 345.374 2.952 20 5 EFBDHN Cc1cc(C(=O)NCCCNCc2csc([N+](=O)[O-])c2)c(C)[nH]1 ZINC001167365894 1102880749 /nfs/dbraw/zinc/88/07/49/1102880749.db2.gz MDRURGPLHKUSRF-UHFFFAOYSA-N 0 3 336.417 2.511 20 5 EFBDHN Cc1cc(C(=O)NCCCNCc2csc([N+](=O)[O-])c2)cs1 ZINC001168386204 1104169514 /nfs/dbraw/zinc/16/95/14/1104169514.db2.gz UXSLQFNDIDVDHG-UHFFFAOYSA-N 0 3 339.442 2.936 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CCCCN2C2CC2)c1C ZINC000897576740 1105778685 /nfs/dbraw/zinc/77/86/85/1105778685.db2.gz NSKCHYNSNYLXTG-OAHLLOKOSA-N 0 3 331.416 2.958 20 5 EFBDHN COc1ccc(-c2ccc(CN3C[C@H](C)[C@H](O)C3)o2)c([N+](=O)[O-])c1 ZINC000897684003 1106047333 /nfs/dbraw/zinc/04/73/33/1106047333.db2.gz JBYUWTXQPPRQOW-MEDUHNTESA-N 0 3 332.356 2.676 20 5 EFBDHN COc1ccc(-c2ccc(CN3C[C@@H](C)[C@@H](O)C3)o2)c([N+](=O)[O-])c1 ZINC000897684001 1106047898 /nfs/dbraw/zinc/04/78/98/1106047898.db2.gz JBYUWTXQPPRQOW-BZNIZROVSA-N 0 3 332.356 2.676 20 5 EFBDHN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N1CC[C@H](N2CCCCC2)C1 ZINC000843791890 1106211077 /nfs/dbraw/zinc/21/10/77/1106211077.db2.gz PLOUXYKREXATOW-ZDUSSCGKSA-N 0 3 335.379 2.743 20 5 EFBDHN O=C(C1CCCC1)N1CCC(NCc2csc([N+](=O)[O-])c2)CC1 ZINC000989849544 1106712792 /nfs/dbraw/zinc/71/27/92/1106712792.db2.gz XIKDLNVLOOCJCN-UHFFFAOYSA-N 0 3 337.445 2.927 20 5 EFBDHN O=[N+]([O-])CCNC[C@H](c1ccccc1)N1CCc2sccc2C1 ZINC000899872246 1109533129 /nfs/dbraw/zinc/53/31/29/1109533129.db2.gz YARLHCLAFVAERA-MRXNPFEDSA-N 0 3 331.441 2.714 20 5 EFBDHN Cc1nn(CN2CCCN(Cc3ccccc3)CC2)c(C)c1[N+](=O)[O-] ZINC000073136324 1120697964 /nfs/dbraw/zinc/69/79/64/1120697964.db2.gz NJGMUJDWBNDXHH-UHFFFAOYSA-N 0 3 343.431 2.574 20 5 EFBDHN Cc1c(NC(=O)[C@H](C)N(C)C[C@@H]2CCCOC2)cccc1[N+](=O)[O-] ZINC000174149587 231133182 /nfs/dbraw/zinc/13/31/82/231133182.db2.gz VEVJFDITGJVZDK-KBPBESRZSA-N 0 3 335.404 2.589 20 5 EFBDHN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N1CC[C@@H](N2CC=CC2)C1 ZINC000174451515 231211973 /nfs/dbraw/zinc/21/19/73/231211973.db2.gz WHEKZHBEUXXJLJ-GFCCVEGCSA-N 0 3 336.779 2.726 20 5 EFBDHN CNC(=O)CCCN(C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000131833503 529852177 /nfs/dbraw/zinc/85/21/77/529852177.db2.gz QWRXZEJSZBEZRD-UHFFFAOYSA-N 0 3 331.372 2.813 20 5 EFBDHN CN(CCN(C)C1CC1)C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000186745270 529902306 /nfs/dbraw/zinc/90/23/06/529902306.db2.gz NELDNGJZJFEJFA-UHFFFAOYSA-N 0 3 345.321 2.780 20 5 EFBDHN Cc1cc(NC(=O)CCN(Cc2cccc([N+](=O)[O-])c2)C2CC2)no1 ZINC000178000463 232054246 /nfs/dbraw/zinc/05/42/46/232054246.db2.gz TWYXZTFWFCTWLP-UHFFFAOYSA-N 0 3 344.371 2.884 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N(C)CC2CCN(C)CC2)c1 ZINC000103452786 219301110 /nfs/dbraw/zinc/30/11/10/219301110.db2.gz ZEHDDVCELHFVBY-UHFFFAOYSA-N 0 3 337.445 2.731 20 5 EFBDHN CCN(CCC(=O)OC)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000104680021 219403053 /nfs/dbraw/zinc/40/30/53/219403053.db2.gz CZGXPAKRKSXVKY-UHFFFAOYSA-N 0 3 347.371 2.677 20 5 EFBDHN Cc1cc(NC(=O)CCN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)no1 ZINC000181811712 234333058 /nfs/dbraw/zinc/33/30/58/234333058.db2.gz VQLBIRXSSSFWEW-LBPRGKRZSA-N 0 3 332.360 2.879 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@]2(CO)CCOC2)s1 ZINC000184182783 235325668 /nfs/dbraw/zinc/32/56/68/235325668.db2.gz FRBKCTRCBOWJAL-INIZCTEOSA-N 0 3 334.397 2.564 20 5 EFBDHN CN(C)C1(CN(C)C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CCC1 ZINC000187017972 236095786 /nfs/dbraw/zinc/09/57/86/236095786.db2.gz ZNKZZGWRDKOWFE-UHFFFAOYSA-N 0 3 339.823 2.733 20 5 EFBDHN C[C@H](NCCn1ccc([N+](=O)[O-])n1)c1cccc(N2CCCC2)c1 ZINC000181856063 299301897 /nfs/dbraw/zinc/30/18/97/299301897.db2.gz DRPWQJAQYDQMRQ-AWEZNQCLSA-N 0 3 329.404 2.742 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CC[C@H](OCCCc3ccccc3)C2)c1 ZINC000175959264 239294429 /nfs/dbraw/zinc/29/44/29/239294429.db2.gz SFDQXDMQRBKILK-SFHVURJKSA-N 0 3 344.415 2.515 20 5 EFBDHN O=C(CN1C[C@@H]2CCCC[C@@H]2C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000177574007 239384255 /nfs/dbraw/zinc/38/42/55/239384255.db2.gz RJZMERXJQNDNDF-GASCZTMLSA-N 0 3 329.400 2.606 20 5 EFBDHN COc1cccc(C(=O)NCCN[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000193197572 240090820 /nfs/dbraw/zinc/09/08/20/240090820.db2.gz PTSSXNLNBPGJDQ-ZDUSSCGKSA-N 0 3 343.383 2.684 20 5 EFBDHN C[C@@H]1CCNC(=O)[C@@H]1NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000193679779 240263386 /nfs/dbraw/zinc/26/33/86/240263386.db2.gz BMXOWXKZCGHBOI-BDJLRTHQSA-N 0 3 345.424 2.938 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@@H](C)Cn1ccnc1C ZINC000236847383 242381003 /nfs/dbraw/zinc/38/10/03/242381003.db2.gz BPWPCYKOGKRGAK-CYBMUJFWSA-N 0 3 332.404 2.924 20 5 EFBDHN O=[N+]([O-])c1ccc(Cl)c(CNCCCOC[C@@H]2CCCO2)c1 ZINC000237826094 242811561 /nfs/dbraw/zinc/81/15/61/242811561.db2.gz DXROBXSQOBEEQS-AWEZNQCLSA-N 0 3 328.796 2.924 20 5 EFBDHN CO[C@H]1c2ccccc2C[C@H]1NCCOc1ccccc1[N+](=O)[O-] ZINC000411887311 243015665 /nfs/dbraw/zinc/01/56/65/243015665.db2.gz BXWDGNBYWFZPOI-QAPCUYQASA-N 0 3 328.368 2.876 20 5 EFBDHN CCN(CCNC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1)C1CC1 ZINC000411868029 243007231 /nfs/dbraw/zinc/00/72/31/243007231.db2.gz KKNVKLHGKLNJAU-UHFFFAOYSA-N 0 3 335.404 2.596 20 5 EFBDHN CO[C@](C)([C@H](C)NCc1cc([N+](=O)[O-])cc2c1OCOC2)C1CC1 ZINC000411936500 243035035 /nfs/dbraw/zinc/03/50/35/243035035.db2.gz CHUXLYDCVGGLFB-APPDUMDISA-N 0 3 336.388 2.755 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCN2C[C@@H](O)C[C@@H]2c2ccccc2)cc1 ZINC000411934058 243035430 /nfs/dbraw/zinc/03/54/30/243035430.db2.gz HCHDPELRGZOEAZ-FUHWJXTLSA-N 0 3 328.368 2.782 20 5 EFBDHN C[C@@H](c1cccc(O)c1)N(C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000245820713 243159022 /nfs/dbraw/zinc/15/90/22/243159022.db2.gz VXKZQWKGLYKZDO-SUMWQHHRSA-N 0 3 346.383 2.733 20 5 EFBDHN O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCCN(CC2CCC2)CC1 ZINC000412313233 243262501 /nfs/dbraw/zinc/26/25/01/243262501.db2.gz QHNNVWHBQCEKIK-UHFFFAOYSA-N 0 3 335.379 2.682 20 5 EFBDHN C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412338072 243275811 /nfs/dbraw/zinc/27/58/11/243275811.db2.gz NJYYZIDBEYGQIE-NKGKWGDASA-N 0 3 343.427 2.784 20 5 EFBDHN C[C@H]1CN(C)CC[C@H]1N(C)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000247452317 243426690 /nfs/dbraw/zinc/42/66/90/243426690.db2.gz QHSAYQKWIHJYNJ-XHDPSFHLSA-N 0 3 339.823 2.589 20 5 EFBDHN CCC[C@@H](NCCCS(=O)(=O)CC)c1cccc([N+](=O)[O-])c1 ZINC000414343224 244097516 /nfs/dbraw/zinc/09/75/16/244097516.db2.gz NBZKGSHSARJAIN-OAHLLOKOSA-N 0 3 328.434 2.850 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H](CO)[C@@H]2CCCOC2)o1 ZINC000414557379 244233462 /nfs/dbraw/zinc/23/34/62/244233462.db2.gz NNVQSSWVUKFEIH-CJNGLKHVSA-N 0 3 346.383 2.732 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1C[C@@H](c2ccccc2)[C@H](N)C1 ZINC000414657921 244279865 /nfs/dbraw/zinc/27/98/65/244279865.db2.gz KSIRRDFIUFUSAN-JKSUJKDBSA-N 0 3 340.383 2.862 20 5 EFBDHN C[C@H]1NCCN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)[C@@H]1C ZINC000262745161 245156892 /nfs/dbraw/zinc/15/68/92/245156892.db2.gz FSOYJVUJEVOTDG-GHMZBOCLSA-N 0 3 346.412 2.541 20 5 EFBDHN CC[C@@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@@H]1CC1(C)C ZINC000419324267 245379330 /nfs/dbraw/zinc/37/93/30/245379330.db2.gz VKYFOXIXLNZGSP-QWHCGFSZSA-N 0 3 335.404 2.956 20 5 EFBDHN C[C@@H](NC(C)(C)CNC(=O)c1ccc([N+](=O)[O-])[nH]1)c1ccccc1 ZINC000264532340 246603581 /nfs/dbraw/zinc/60/35/81/246603581.db2.gz FUNNWBPGNZZJDZ-GFCCVEGCSA-N 0 3 330.388 2.782 20 5 EFBDHN Nc1nc(S[C@H]2CCCN(Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000425276848 247026748 /nfs/dbraw/zinc/02/67/48/247026748.db2.gz DYAJLCRTLREYRI-ZDUSSCGKSA-N 0 3 345.428 2.554 20 5 EFBDHN C[C@@H]1CN(Cc2ccc(Br)cc2[N+](=O)[O-])[C@H](C)CN1C ZINC000425419745 247077837 /nfs/dbraw/zinc/07/78/37/247077837.db2.gz LKFXXEFYJFWYNN-GHMZBOCLSA-N 0 3 342.237 2.882 20 5 EFBDHN O=[N+]([O-])c1ccn(C2CCN(Cc3cccc4c[nH]nc43)CC2)n1 ZINC000425967467 247218257 /nfs/dbraw/zinc/21/82/57/247218257.db2.gz NWSFRZULMDOXCD-UHFFFAOYSA-N 0 3 326.360 2.505 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)CN1CCCCCC1 ZINC000427064449 247313305 /nfs/dbraw/zinc/31/33/05/247313305.db2.gz LREXZIWEJQSDDJ-ZDUSSCGKSA-N 0 3 335.404 2.598 20 5 EFBDHN CC(=O)Nc1ccc(CNC/C=C\c2ccccc2[N+](=O)[O-])cn1 ZINC000433192717 248026619 /nfs/dbraw/zinc/02/66/19/248026619.db2.gz MMTUPNHNZJIEIL-XQRVVYSFSA-N 0 3 326.356 2.751 20 5 EFBDHN COCCN(CCOc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCSC1 ZINC000433197237 248028001 /nfs/dbraw/zinc/02/80/01/248028001.db2.gz QRSXAWQCSQGNEN-OAHLLOKOSA-N 0 3 340.445 2.818 20 5 EFBDHN C[C@@H]1C[C@H](N(C)C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CCN1C ZINC000266098127 248094808 /nfs/dbraw/zinc/09/48/08/248094808.db2.gz RAEXTHWQRRYQKW-DGCLKSJQSA-N 0 3 330.388 2.631 20 5 EFBDHN C[C@@H]1C[C@H](N(C)C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CCN1C ZINC000266047796 248061754 /nfs/dbraw/zinc/06/17/54/248061754.db2.gz FKXOBBPIROENKJ-VXGBXAGGSA-N 0 3 330.388 2.631 20 5 EFBDHN CCO[C@H]1C[C@@H](NCc2cc([N+](=O)[O-])cc3c2OCOC3)C12CCC2 ZINC000266121930 248111629 /nfs/dbraw/zinc/11/16/29/248111629.db2.gz AFXOHIBYAPQZJR-CVEARBPZSA-N 0 3 348.399 2.899 20 5 EFBDHN COc1ccc(OCCN(C)CCCOC(C)C)c([N+](=O)[O-])c1 ZINC000266510162 248337775 /nfs/dbraw/zinc/33/77/75/248337775.db2.gz DFAIHAMNUUNEHF-UHFFFAOYSA-N 0 3 326.393 2.729 20 5 EFBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H](C(=O)NCC2CC2)C1 ZINC000266553968 248358281 /nfs/dbraw/zinc/35/82/81/248358281.db2.gz VIMBEPJXHXIJSP-DZGCQCFKSA-N 0 3 331.416 2.894 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CN(CCO)CCCO)s2)cc1 ZINC000093323827 218215955 /nfs/dbraw/zinc/21/59/55/218215955.db2.gz FKTNRQGDKULWQM-UHFFFAOYSA-N 0 3 336.413 2.500 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCCN1CCC[C@@H](C)C1 ZINC000093970201 218258395 /nfs/dbraw/zinc/25/83/95/218258395.db2.gz BLSAOUPVQJQDGS-GFCCVEGCSA-N 0 3 333.432 2.982 20 5 EFBDHN C[C@@](CO)(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CCCCC1 ZINC000444637986 250321117 /nfs/dbraw/zinc/32/11/17/250321117.db2.gz JMVUKXAVXPPKAE-KRWDZBQOSA-N 0 3 332.404 2.892 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN3CCC[C@@H]3C3CCOCC3)nc2c1 ZINC000444684750 250328896 /nfs/dbraw/zinc/32/88/96/250328896.db2.gz NSTQABLVEABAJL-MRXNPFEDSA-N 0 3 330.388 2.862 20 5 EFBDHN CC(=O)Nc1ccc(CN[C@H](C)Cc2ccccc2[N+](=O)[O-])cn1 ZINC000449293821 250985381 /nfs/dbraw/zinc/98/53/81/250985381.db2.gz WSVSGPCJNULBIH-GFCCVEGCSA-N 0 3 328.372 2.669 20 5 EFBDHN COC[C@]1(C(=O)OC)CCN(C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000449458638 251033210 /nfs/dbraw/zinc/03/32/10/251033210.db2.gz WLRNTXNVDTTXPH-MXHVWWQHSA-N 0 3 348.399 2.510 20 5 EFBDHN C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)c1ccc([N+](=O)[O-])o1 ZINC000267413248 251037509 /nfs/dbraw/zinc/03/75/09/251037509.db2.gz KTATXFZBCUAJKS-DZGCQCFKSA-N 0 3 343.383 2.828 20 5 EFBDHN CN1CC[C@@H]2CN(Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)C[C@@H]21 ZINC000449518311 251050450 /nfs/dbraw/zinc/05/04/50/251050450.db2.gz NOPUZLBXJHFIJJ-CJNGLKHVSA-N 0 3 344.440 2.854 20 5 EFBDHN CN1CC[C@@H]2CN(Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C[C@@H]21 ZINC000449519641 251051251 /nfs/dbraw/zinc/05/12/51/251051251.db2.gz QIHVHZKEOICCLB-PBHICJAKSA-N 0 3 327.384 2.991 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN1CC[C@@H]2C[C@@H](O)CC[C@H]2C1 ZINC000449559455 251065249 /nfs/dbraw/zinc/06/52/49/251065249.db2.gz YIPVKBDJKVXZGZ-KEYYUXOJSA-N 0 3 334.416 2.976 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)CCN1Cc1ccccc1 ZINC000267459489 251076808 /nfs/dbraw/zinc/07/68/08/251076808.db2.gz RFGQTSWFDPPBLC-ZFWWWQNUSA-N 0 3 342.399 2.706 20 5 EFBDHN CNC(=O)C[C@@H](C)NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000449599032 251078602 /nfs/dbraw/zinc/07/86/02/251078602.db2.gz FBMGHABELJEFOW-LLVKDONJSA-N 0 3 333.413 2.938 20 5 EFBDHN COC[C@@]1(CO)CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000449693673 251119594 /nfs/dbraw/zinc/11/95/94/251119594.db2.gz FBUUFXXISLSQEH-SFHVURJKSA-N 0 3 346.383 2.686 20 5 EFBDHN COC(=O)[C@H]1CN(Cc2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000449755818 251143313 /nfs/dbraw/zinc/14/33/13/251143313.db2.gz PCODKBHPIURJIR-IRXDYDNUSA-N 0 3 340.379 2.983 20 5 EFBDHN CC[C@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])s1)C(=O)NC ZINC000449782458 251154206 /nfs/dbraw/zinc/15/42/06/251154206.db2.gz YIGHCEKAHUPORK-ZDUSSCGKSA-N 0 3 333.413 2.938 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CN(C3CC3)C[C@@H]2C)c1 ZINC000268285173 251794792 /nfs/dbraw/zinc/79/47/92/251794792.db2.gz XYAIOKZBTPYHTO-IINYFYTJSA-N 0 3 335.429 2.529 20 5 EFBDHN C[C@H](CCc1ccccc1[N+](=O)[O-])N[C@@H]1C[C@@H]2CCCCN2C1=O ZINC000453452448 252040213 /nfs/dbraw/zinc/04/02/13/252040213.db2.gz SGXWNFHEOIVZDG-VNQPRFMTSA-N 0 3 331.416 2.659 20 5 EFBDHN C[C@H]1CN(Cc2ccccc2)CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)C1 ZINC000454310031 252210656 /nfs/dbraw/zinc/21/06/56/252210656.db2.gz FRGZDUILJTVVOB-AWEZNQCLSA-N 0 3 342.399 2.517 20 5 EFBDHN O=[N+]([O-])c1cc(CN2CC[C@H](C3CCOCC3)C2)c2c(c1)COCO2 ZINC000371072648 285086472 /nfs/dbraw/zinc/08/64/72/285086472.db2.gz DHJIGWBVXPJNCV-AWEZNQCLSA-N 0 3 348.399 2.710 20 5 EFBDHN C[C@@H](NC(=O)Cc1cccc([N+](=O)[O-])c1)[C@H](c1ccccc1)N(C)C ZINC000187165330 533096085 /nfs/dbraw/zinc/09/60/85/533096085.db2.gz FZWCPSKPYLOVEG-AUUYWEPGSA-N 0 3 341.411 2.945 20 5 EFBDHN C[C@@H](NC(=O)Cc1ccccc1[N+](=O)[O-])[C@@H](c1ccccc1)N(C)C ZINC000187180869 533096196 /nfs/dbraw/zinc/09/61/96/533096196.db2.gz JXBGKTMZCLWULU-KUHUBIRLSA-N 0 3 341.411 2.945 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@H](C)CO[C@@H]2CCOC2)cc1[N+](=O)[O-] ZINC000154192879 224217407 /nfs/dbraw/zinc/21/74/07/224217407.db2.gz PTGLQQYDUBDHBO-VNHYZAJKSA-N 0 3 338.404 2.838 20 5 EFBDHN COCOc1ccc(OC)cc1CNCCc1ccc([N+](=O)[O-])cc1 ZINC000154483791 224259826 /nfs/dbraw/zinc/25/98/26/224259826.db2.gz MGKVTMSBXMLOLI-UHFFFAOYSA-N 0 3 346.383 2.918 20 5 EFBDHN CCc1ccc(C(=O)N2CCC[C@H]3CN(C)CC[C@H]32)cc1[N+](=O)[O-] ZINC000118987915 221218608 /nfs/dbraw/zinc/21/86/08/221218608.db2.gz DAOMDSNHTOCMJG-JKSUJKDBSA-N 0 3 331.416 2.714 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CC[C@@H]3[C@H](CCCN3C3CC3)C2)c1 ZINC000154668797 224288091 /nfs/dbraw/zinc/28/80/91/224288091.db2.gz FIGDBJOYJPJDGG-ATZDWAIDSA-N 0 3 345.443 2.577 20 5 EFBDHN CCN1CCC[C@H]1CNC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000279846615 257938735 /nfs/dbraw/zinc/93/87/35/257938735.db2.gz DBCJYRVAZLECNE-NSHDSACASA-N 0 3 343.786 2.530 20 5 EFBDHN CN(c1ncccc1[N+](=O)[O-])C1CCN(CCc2ccccn2)CC1 ZINC000301133388 258016602 /nfs/dbraw/zinc/01/66/02/258016602.db2.gz VJNZFYDPCAMRKS-UHFFFAOYSA-N 0 3 341.415 2.528 20 5 EFBDHN C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N)[C@H](c1ccccc1)N(C)C ZINC000189825752 533278995 /nfs/dbraw/zinc/27/89/95/533278995.db2.gz MBOAAYTWDSWUPT-SJKOYZFVSA-N 0 3 342.399 2.598 20 5 EFBDHN C[C@@H]([NH2+]CCCNC(=O)c1cccc([O-])c1)c1cccc([N+](=O)[O-])c1 ZINC000173371995 533385368 /nfs/dbraw/zinc/38/53/68/533385368.db2.gz DSHMNJQEZODNKL-CYBMUJFWSA-N 0 3 343.383 2.771 20 5 EFBDHN COc1cccc(C2CCN(CCn3cc([N+](=O)[O-])cn3)CC2)c1 ZINC000174837291 533441398 /nfs/dbraw/zinc/44/13/98/533441398.db2.gz AETRIWUQQUZOPL-UHFFFAOYSA-N 0 3 330.388 2.680 20 5 EFBDHN C[C@@H](N[C@H]1CC(C)(C)OC1(C)C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000132407767 533540052 /nfs/dbraw/zinc/54/00/52/533540052.db2.gz CZQAMVXLNLSVBQ-RISCZKNCSA-N 0 3 335.404 2.858 20 5 EFBDHN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCN(c2ccncc2)CC1 ZINC000007922724 135681771 /nfs/dbraw/zinc/68/17/71/135681771.db2.gz RKTXCCAVLXEKSU-UHFFFAOYSA-N 0 3 346.774 2.606 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCC[C@@H]2CN2CCCCC2)c([N+](=O)[O-])c1 ZINC000160433670 296506382 /nfs/dbraw/zinc/50/63/82/296506382.db2.gz CYEDKBNYOAPOHG-CQSZACIVSA-N 0 3 334.376 2.958 20 5 EFBDHN CCCN(CCN1CCCC1)c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000343271725 141964864 /nfs/dbraw/zinc/96/48/64/141964864.db2.gz BPSXDSKPUSTJEC-UHFFFAOYSA-N 0 3 345.403 2.957 20 5 EFBDHN O=C(C1CCC1)N(CCCNCc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000343527237 142012679 /nfs/dbraw/zinc/01/26/79/142012679.db2.gz LLYKAIYGIFKUEQ-UHFFFAOYSA-N 0 3 331.416 2.866 20 5 EFBDHN CO[C@@H]1[C@H](C)[C@H](N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1(C)C ZINC000344473467 142023454 /nfs/dbraw/zinc/02/34/54/142023454.db2.gz LRGZWWACCSLDKE-HKCMKHECSA-N 0 3 335.404 2.571 20 5 EFBDHN C[C@H](CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CCC[C@H](C)C1 ZINC000344475841 142023768 /nfs/dbraw/zinc/02/37/68/142023768.db2.gz RAWBYLONCZZGGR-QWHCGFSZSA-N 0 3 344.415 2.926 20 5 EFBDHN CO[C@@H]1[C@H](C)[C@@H](N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1(C)C ZINC000344485848 142025962 /nfs/dbraw/zinc/02/59/62/142025962.db2.gz YEZJINXIYMJGRP-CZPYZCIJSA-N 0 3 349.431 2.879 20 5 EFBDHN C[C@H](NC(C)(C)CNC(=O)c1ccc([N+](=O)[O-])n1C)c1ccccc1 ZINC000344605153 142048002 /nfs/dbraw/zinc/04/80/02/142048002.db2.gz NJTHHJWKXXMVCC-ZDUSSCGKSA-N 0 3 344.415 2.793 20 5 EFBDHN CN1CCCC(C)(C)[C@H]1CNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000344607356 142048413 /nfs/dbraw/zinc/04/84/13/142048413.db2.gz DXHKYNJSDJJEDZ-OAHLLOKOSA-N 0 3 344.415 2.926 20 5 EFBDHN CNc1c(C(=O)N2CCN(C3CCC3)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000344717465 142066644 /nfs/dbraw/zinc/06/66/44/142066644.db2.gz AKLLTYNSDROWNY-ZDUSSCGKSA-N 0 3 346.431 2.583 20 5 EFBDHN C[C@H]1C[C@@H]1N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)C[C@@H](C)C1 ZINC000346187832 142164195 /nfs/dbraw/zinc/16/41/95/142164195.db2.gz OISSCBWYDDTKEQ-MKBNYLNASA-N 0 3 335.379 2.536 20 5 EFBDHN CCc1ccc(C(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000346260404 142178174 /nfs/dbraw/zinc/17/81/74/142178174.db2.gz LHGIEJLCNMAVMT-JKIFEVAISA-N 0 3 345.443 2.960 20 5 EFBDHN Cc1cc(C(=O)N2CCN([C@@H]3C[C@H]3C)C[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000346286919 142183578 /nfs/dbraw/zinc/18/35/78/142183578.db2.gz ZROPILYNSRJDQR-SUYBPPKGSA-N 0 3 331.416 2.706 20 5 EFBDHN CN(CCn1cc([N+](=O)[O-])cn1)[C@@H]1C[C@@H](Oc2ccccc2)C1(C)C ZINC000347490096 142225572 /nfs/dbraw/zinc/22/55/72/142225572.db2.gz ZEOXFMNPTJKWDB-IAGOWNOFSA-N 0 3 344.415 2.969 20 5 EFBDHN Cc1ccncc1CCCN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000347847518 142281483 /nfs/dbraw/zinc/28/14/83/142281483.db2.gz GOMIQIOSBATOAZ-MRXNPFEDSA-N 0 3 341.415 2.812 20 5 EFBDHN CC(C)N1CCC[C@@H](NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000347945978 142297903 /nfs/dbraw/zinc/29/79/03/142297903.db2.gz FFGBJDBOJQMJKK-OAHLLOKOSA-N 0 3 346.431 2.772 20 5 EFBDHN CC(C)N1CCC[C@H](NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000347952907 142298784 /nfs/dbraw/zinc/29/87/84/142298784.db2.gz NNUHUOHNWKPSEW-LBPRGKRZSA-N 0 3 325.796 2.851 20 5 EFBDHN CC(C)N1CCC[C@@H](NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000347951368 142298946 /nfs/dbraw/zinc/29/89/46/142298946.db2.gz MMHXGUOBRIDLLX-MRXNPFEDSA-N 0 3 348.447 2.776 20 5 EFBDHN C[C@@H](C(=O)N[C@@H](C)C1=CCN(C)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000347987121 142304333 /nfs/dbraw/zinc/30/43/33/142304333.db2.gz BAHUSWIZYDIZKE-NEPJUHHUSA-N 0 3 335.379 2.604 20 5 EFBDHN C[C@H](CC1CCCC1)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000349674592 142347194 /nfs/dbraw/zinc/34/71/94/142347194.db2.gz ZKDNCDVPDMLYDY-CYBMUJFWSA-N 0 3 340.445 2.927 20 5 EFBDHN C[C@H](c1ccccc1)N1CCC(NC(=O)c2cc([N+](=O)[O-])c[nH]2)CC1 ZINC000341403834 145046414 /nfs/dbraw/zinc/04/64/14/145046414.db2.gz RDAXUTLEBNMYHV-CYBMUJFWSA-N 0 3 342.399 2.878 20 5 EFBDHN COC(=O)[C@]12CN(Cc3ccc([N+](=O)[O-])cc3OC)C[C@H]1CCCC2 ZINC000342185161 145077656 /nfs/dbraw/zinc/07/76/56/145077656.db2.gz ZTKLRPOTGKSBEK-RDTXWAMCSA-N 0 3 348.399 2.769 20 5 EFBDHN CCCN(CCN1CCCC1)C(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000342297605 145095919 /nfs/dbraw/zinc/09/59/19/145095919.db2.gz XSRGEXXJUXWXAM-UHFFFAOYSA-N 0 3 335.404 2.551 20 5 EFBDHN Cc1ccc([C@@H](C)NCC2(CS(C)(=O)=O)CCC2)cc1[N+](=O)[O-] ZINC000342321058 145100196 /nfs/dbraw/zinc/10/01/96/145100196.db2.gz GNHSXGZAFZAJIN-CYBMUJFWSA-N 0 3 340.445 2.769 20 5 EFBDHN C[C@@H]1CCC[C@H](CNCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000342353819 145107792 /nfs/dbraw/zinc/10/77/92/145107792.db2.gz HFTCITMYDOUNEY-KGLIPLIRSA-N 0 3 340.445 2.784 20 5 EFBDHN C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000342361674 145108512 /nfs/dbraw/zinc/10/85/12/145108512.db2.gz LRWJQUMSDWSMKB-LRDDRELGSA-N 0 3 346.431 2.612 20 5 EFBDHN C[C@H]1C[C@H](N2CCCC2)CN1C(=O)CSc1ccccc1[N+](=O)[O-] ZINC000342446520 145128202 /nfs/dbraw/zinc/12/82/02/145128202.db2.gz SCWPRQHWWWAAGI-KBPBESRZSA-N 0 3 349.456 2.772 20 5 EFBDHN C[C@@H]1C[C@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CCN1C ZINC000342655660 145166883 /nfs/dbraw/zinc/16/68/83/145166883.db2.gz NCZFBUODTBJLRJ-ZYHUDNBSSA-N 0 3 340.811 2.530 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(NCc2ccnc(OCCN(C)C)c2)c1 ZINC000342767467 145188012 /nfs/dbraw/zinc/18/80/12/145188012.db2.gz CRHXBEWOXKOSGQ-UHFFFAOYSA-N 0 3 330.388 2.851 20 5 EFBDHN CCCN1CCC[C@@H]1CNC(=O)c1cccc(SC)c1[N+](=O)[O-] ZINC000343541559 145232919 /nfs/dbraw/zinc/23/29/19/145232919.db2.gz HFKUTKLHGPQKRQ-GFCCVEGCSA-N 0 3 337.445 2.921 20 5 EFBDHN CCCN1CCC[C@H]1CNC(=O)c1ccc(SC)c([N+](=O)[O-])c1 ZINC000343570809 145241272 /nfs/dbraw/zinc/24/12/72/145241272.db2.gz ACOQAIFPYDOONZ-ZDUSSCGKSA-N 0 3 337.445 2.921 20 5 EFBDHN CCCN1CCC[C@@H]1CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000343587655 145246154 /nfs/dbraw/zinc/24/61/54/145246154.db2.gz FGFJTUDQVSLKGH-MRXNPFEDSA-N 0 3 333.432 2.863 20 5 EFBDHN C[C@H](NC(C)(C)CNC(=O)c1cc([N+](=O)[O-])c[nH]1)c1ccccc1 ZINC000343721079 145279670 /nfs/dbraw/zinc/27/96/70/145279670.db2.gz WFGGWRRTSWACRR-LBPRGKRZSA-N 0 3 330.388 2.782 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CN(C2CC2)C[C@H]1C ZINC000343896036 145319455 /nfs/dbraw/zinc/31/94/55/145319455.db2.gz MBWIMRZQRTYHEV-ABAIWWIYSA-N 0 3 349.456 2.919 20 5 EFBDHN C[C@@H](NCc1ccncc1OCCN(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000343917708 145324247 /nfs/dbraw/zinc/32/42/47/145324247.db2.gz BDYUUOHEYQUHEL-CQSZACIVSA-N 0 3 344.415 2.781 20 5 EFBDHN CCO[C@H]1C[C@H](NCC(=O)Nc2ccccc2[N+](=O)[O-])C12CCCC2 ZINC000344097117 145367452 /nfs/dbraw/zinc/36/74/52/145367452.db2.gz IETRKMULAPPULE-HOTGVXAUSA-N 0 3 347.415 2.861 20 5 EFBDHN C[C@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000344215644 145394718 /nfs/dbraw/zinc/39/47/18/145394718.db2.gz QBUIDVCQRYBJGC-FRRDWIJNSA-N 0 3 337.395 2.830 20 5 EFBDHN CNC(=O)CC[C@@H]1CCCCN1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000348832218 146010034 /nfs/dbraw/zinc/01/00/34/146010034.db2.gz HSHMPDSRWQPRRL-IOBAAEILSA-N 0 3 331.416 2.989 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@H]1C1CCOCC1 ZINC000348919609 146024499 /nfs/dbraw/zinc/02/44/99/146024499.db2.gz NUVQDKBMWWKHHC-KRWDZBQOSA-N 0 3 347.415 2.733 20 5 EFBDHN CC[NH+](CC)Cc1ccc(NC(=O)c2cc([N+](=O)[O-])c[n-]c2=O)cc1 ZINC000349078879 146048842 /nfs/dbraw/zinc/04/88/42/146048842.db2.gz FTMVKQBVFBGPLN-UHFFFAOYSA-N 0 3 344.371 2.790 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@H]1CCCN(C)C1=O ZINC000349201477 146065700 /nfs/dbraw/zinc/06/57/00/146065700.db2.gz LANLXKBYJZENNW-OLZOCXBDSA-N 0 3 337.445 2.676 20 5 EFBDHN C[C@@H]1CN(C)[C@@H](C)CN1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000351944908 146243579 /nfs/dbraw/zinc/24/35/79/146243579.db2.gz NOKQTOHTZNTSCZ-UONOGXRCSA-N 0 3 344.415 2.817 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](NC[C@@H](O)[C@H]2CCOC2)c2ccccc2)c1 ZINC000352846541 146331924 /nfs/dbraw/zinc/33/19/24/146331924.db2.gz ABWVWFQSFBPIFN-QXAKKESOSA-N 0 3 342.395 2.671 20 5 EFBDHN C[C@@H](O)C[C@@H]1CCCCCN1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000352892201 146342626 /nfs/dbraw/zinc/34/26/26/146342626.db2.gz ISXBVRJXQHBNCZ-PBHICJAKSA-N 0 3 349.431 2.573 20 5 EFBDHN CS(=O)(=O)C1(CNC/C=C\c2ccccc2[N+](=O)[O-])CCCC1 ZINC000353088563 146393556 /nfs/dbraw/zinc/39/35/56/146393556.db2.gz MELRAZRXHBQKJK-VURMDHGXSA-N 0 3 338.429 2.555 20 5 EFBDHN COC(=O)COc1ccc(CN2CCC[C@H]2C(C)C)cc1[N+](=O)[O-] ZINC000355593653 147007002 /nfs/dbraw/zinc/00/70/02/147007002.db2.gz CVDNMZNIBLYGEO-AWEZNQCLSA-N 0 3 336.388 2.767 20 5 EFBDHN COC(=O)COc1ccc(CN2CCC[C@H]3CCC[C@@H]32)cc1[N+](=O)[O-] ZINC000355599732 147008518 /nfs/dbraw/zinc/00/85/18/147008518.db2.gz NZZZSZLBTYDHOM-CABCVRRESA-N 0 3 348.399 2.911 20 5 EFBDHN CC[C@H]1CCCN(Cc2ccc(OCC(=O)OC)c([N+](=O)[O-])c2)C1 ZINC000355607205 147011106 /nfs/dbraw/zinc/01/11/06/147011106.db2.gz MRUAJSVLLHYUEI-ZDUSSCGKSA-N 0 3 336.388 2.769 20 5 EFBDHN O=[N+]([O-])c1ccccc1NC[C@@]1(O)CCN(Cc2ccccc2)C1 ZINC000355711970 147041737 /nfs/dbraw/zinc/04/17/37/147041737.db2.gz AGKYDTSFVIBCLI-SFHVURJKSA-N 0 3 327.384 2.644 20 5 EFBDHN O=[N+]([O-])c1ccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)c(F)c1 ZINC000355762050 147055926 /nfs/dbraw/zinc/05/59/26/147055926.db2.gz UKWHANSSVMOMCL-SFHVURJKSA-N 0 3 345.374 2.783 20 5 EFBDHN CC(C)OCCN1CCC(Nc2ccc([N+](=O)[O-])c(N)c2F)CC1 ZINC000356170056 147166257 /nfs/dbraw/zinc/16/62/57/147166257.db2.gz PHKSEFKWVIUUNR-UHFFFAOYSA-N 0 3 340.399 2.617 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(CCN(C)C)C1CC1 ZINC000356875316 147360372 /nfs/dbraw/zinc/36/03/72/147360372.db2.gz ASRJPYWTDXKZFT-GFCCVEGCSA-N 0 3 337.445 2.628 20 5 EFBDHN O=C1CC[C@@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CN1 ZINC000356882787 147361991 /nfs/dbraw/zinc/36/19/91/147361991.db2.gz UQEYDRUALCUFAQ-SNVBAGLBSA-N 0 3 349.774 2.876 20 5 EFBDHN Cc1c(CNC(=O)N(C)[C@H](C)C2CCN(C)CC2)cccc1[N+](=O)[O-] ZINC000359549612 148119146 /nfs/dbraw/zinc/11/91/46/148119146.db2.gz FCNYZXOEYBHFKS-CQSZACIVSA-N 0 3 348.447 2.775 20 5 EFBDHN CO[C@]1(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCOC1 ZINC000359643734 148148707 /nfs/dbraw/zinc/14/87/07/148148707.db2.gz DROUZRHFMIZKMB-KRWDZBQOSA-N 0 3 332.356 2.750 20 5 EFBDHN Cc1c(CNCc2cn(C)nc2-c2cccnc2)cccc1[N+](=O)[O-] ZINC000359817561 148197055 /nfs/dbraw/zinc/19/70/55/148197055.db2.gz MTSXVYQRLRDQFG-UHFFFAOYSA-N 0 3 337.383 2.989 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H](CO)C2CCOCC2)o1 ZINC000359947644 148231456 /nfs/dbraw/zinc/23/14/56/148231456.db2.gz RAEIASCQEMDURY-INIZCTEOSA-N 0 3 346.383 2.732 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H](CO)C2CCOCC2)o1 ZINC000359947645 148231602 /nfs/dbraw/zinc/23/16/02/148231602.db2.gz RAEIASCQEMDURY-MRXNPFEDSA-N 0 3 346.383 2.732 20 5 EFBDHN Cc1cccc(C(=O)NCCN[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000360140276 148281539 /nfs/dbraw/zinc/28/15/39/148281539.db2.gz NUUDQTQCKKXAJM-AWEZNQCLSA-N 0 3 327.384 2.984 20 5 EFBDHN CN(C)C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000360206517 148298646 /nfs/dbraw/zinc/29/86/46/148298646.db2.gz AMSWDOWLVZYANA-MRXNPFEDSA-N 0 3 331.347 2.767 20 5 EFBDHN O=C(CCN1CCOCC2(CCCC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000369012867 150258133 /nfs/dbraw/zinc/25/81/33/150258133.db2.gz ZGJHCBYOPSLTGA-UHFFFAOYSA-N 0 3 347.415 2.816 20 5 EFBDHN COc1c(C(=O)NC[C@@H](c2ccccc2)N(C)C)cccc1[N+](=O)[O-] ZINC000353587054 286177504 /nfs/dbraw/zinc/17/75/04/286177504.db2.gz AZCVIXVGIZMNSR-INIZCTEOSA-N 0 3 343.383 2.636 20 5 EFBDHN Cc1ccc(CN2CC[C@]3(C2)c2ccccc2NC3=O)cc1[N+](=O)[O-] ZINC000373535050 151185860 /nfs/dbraw/zinc/18/58/60/151185860.db2.gz QBSGCGBAXCFAFH-IBGZPJMESA-N 0 3 337.379 2.999 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H](N2CCCC2)C1 ZINC000374072920 151280046 /nfs/dbraw/zinc/28/00/46/151280046.db2.gz VCCNYNWLGHPNAC-AWEZNQCLSA-N 0 3 348.403 2.696 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)[C@H](C2CC2)N2CCCC2)cc1[N+](=O)[O-] ZINC000127649418 292246160 /nfs/dbraw/zinc/24/61/60/292246160.db2.gz ICXKSMORPQZHKF-GUYCJALGSA-N 0 3 331.416 2.955 20 5 EFBDHN Cc1c(CNC(=O)N2CCCC23CCN(C)CC3)cccc1[N+](=O)[O-] ZINC000408327522 152176287 /nfs/dbraw/zinc/17/62/87/152176287.db2.gz BRUIWNXAKPIIPA-UHFFFAOYSA-N 0 3 346.431 2.673 20 5 EFBDHN Cc1nn(C)c(N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000160243073 225368762 /nfs/dbraw/zinc/36/87/62/225368762.db2.gz AHOHGDKISVCTMP-WFASDCNBSA-N 0 3 329.404 2.569 20 5 EFBDHN C[C@H]1C[C@@H](N(C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CCN1C ZINC000123358206 222264129 /nfs/dbraw/zinc/26/41/29/222264129.db2.gz HIKPQKZXJDBFKU-JSGCOSHPSA-N 0 3 345.403 2.559 20 5 EFBDHN C[C@@H]1C[C@H](N(C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CCN1C ZINC000124000874 222363722 /nfs/dbraw/zinc/36/37/22/222363722.db2.gz XEXWIJKZNXFSDE-IUODEOHRSA-N 0 3 345.403 2.559 20 5 EFBDHN Cc1ccc(CN2CCC[C@H]2CN2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000092506591 544546300 /nfs/dbraw/zinc/54/63/00/544546300.db2.gz FCZKDNSMOWYYEC-JZXOWHBKSA-N 0 3 347.459 2.977 20 5 EFBDHN CCN1CCC[C@@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000184738887 265025347 /nfs/dbraw/zinc/02/53/47/265025347.db2.gz VSIVFNUBOCSQTQ-GFCCVEGCSA-N 0 3 340.811 2.532 20 5 EFBDHN COC(=O)[C@](C)(CNCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000191581900 265269763 /nfs/dbraw/zinc/26/97/63/265269763.db2.gz BJEQUIQMKOIDTQ-GOSISDBHSA-N 0 3 328.368 2.815 20 5 EFBDHN COc1ccc([C@H](CNc2ccc([N+](=O)[O-])cn2)N(C)C)cc1OC ZINC000194905784 265396100 /nfs/dbraw/zinc/39/61/00/265396100.db2.gz JQGDZDOHEKTOAB-AWEZNQCLSA-N 0 3 346.387 2.722 20 5 EFBDHN COc1cccc([C@@H](C)NC[C@H](O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000271620681 266023466 /nfs/dbraw/zinc/02/34/66/266023466.db2.gz CYFPERRGEXNYDW-CJNGLKHVSA-N 0 3 346.383 2.694 20 5 EFBDHN COc1ccc(OCCN2CCC[C@]2(C)CCCO)c([N+](=O)[O-])c1 ZINC000272026399 266127875 /nfs/dbraw/zinc/12/78/75/266127875.db2.gz NXXVLENJOXQORZ-QGZVFWFLSA-N 0 3 338.404 2.609 20 5 EFBDHN C[C@H](C1CCN(C)CC1)N(C)C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000272247020 266203341 /nfs/dbraw/zinc/20/33/41/266203341.db2.gz YLBKMAHXRNGBTB-CQSZACIVSA-N 0 3 349.431 2.552 20 5 EFBDHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)[C@@H]2C1 ZINC000272305353 266222998 /nfs/dbraw/zinc/22/29/98/266222998.db2.gz QNPJSOCNJABARY-QMTHXVAHSA-N 0 3 338.795 2.806 20 5 EFBDHN COCCCCNCc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000272424079 266261339 /nfs/dbraw/zinc/26/13/39/266261339.db2.gz MFODJXQPGRAWOA-UHFFFAOYSA-N 0 3 348.346 2.764 20 5 EFBDHN COc1ccc(NC(=O)[C@@H]2CCCN2C2CCCC2)cc1[N+](=O)[O-] ZINC000272815545 266390290 /nfs/dbraw/zinc/39/02/90/266390290.db2.gz CHSFIATZWSRSNA-AWEZNQCLSA-N 0 3 333.388 2.949 20 5 EFBDHN CC(C)N(Cc1ccco1)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000273011261 266436389 /nfs/dbraw/zinc/43/63/89/266436389.db2.gz JFVPVSWSIQYPPF-CQSZACIVSA-N 0 3 334.372 2.838 20 5 EFBDHN CC(C)(NC[C@H](O)COc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000273041657 266442074 /nfs/dbraw/zinc/44/20/74/266442074.db2.gz PBVOBXDWGWZLCA-HNNXBMFYSA-N 0 3 330.384 2.859 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CNC1CCN(c2nccs2)CC1 ZINC000273159576 266457613 /nfs/dbraw/zinc/45/76/13/266457613.db2.gz KCISORYIDHZKRP-UHFFFAOYSA-N 0 3 348.428 2.819 20 5 EFBDHN CS[C@@H]1CN(C(=O)c2cccc(C)c2[N+](=O)[O-])C[C@H]1N1CCCC1 ZINC000273438407 266498901 /nfs/dbraw/zinc/49/89/01/266498901.db2.gz AQWMRMSHENZOON-HUUCEWRRSA-N 0 3 349.456 2.555 20 5 EFBDHN CS[C@@H]1CN(C(=O)c2ccc(C)c([N+](=O)[O-])c2)C[C@@H]1N1CCCC1 ZINC000273545224 266516563 /nfs/dbraw/zinc/51/65/63/266516563.db2.gz UNKISNZTVXEPJI-JKSUJKDBSA-N 0 3 349.456 2.555 20 5 EFBDHN CS[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2F)C[C@@H]1N1CCCC1 ZINC000275055061 266745516 /nfs/dbraw/zinc/74/55/16/266745516.db2.gz IWWMLFOTLUMNAT-JKSUJKDBSA-N 0 3 339.436 2.746 20 5 EFBDHN CN1CCC[C@H](CNC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C1 ZINC000108334741 273009194 /nfs/dbraw/zinc/00/91/94/273009194.db2.gz RQRALLBCWJTCBI-CYBMUJFWSA-N 0 3 333.432 2.964 20 5 EFBDHN CCO[C@@H]1C[C@H](NCc2cccc([N+](=O)[O-])c2C)C12CCOCC2 ZINC000276911569 267074539 /nfs/dbraw/zinc/07/45/39/267074539.db2.gz PEKWHGLYKLIPQB-DLBZAZTESA-N 0 3 334.416 2.967 20 5 EFBDHN O=c1[nH]c(CC(F)(F)F)c([O-])n1-c1ccc([N+](=O)[O-])cc1Cl ZINC000277247522 267137892 /nfs/dbraw/zinc/13/78/92/267137892.db2.gz HTMABIAVUHHGQT-ZETCQYMHSA-N 0 3 337.641 2.625 20 5 EFBDHN O=C1NC(CC(F)(F)F)C(=O)N1c1ccc([N+](=O)[O-])cc1Cl ZINC000277247522 267137896 /nfs/dbraw/zinc/13/78/96/267137896.db2.gz HTMABIAVUHHGQT-ZETCQYMHSA-N 0 3 337.641 2.625 20 5 EFBDHN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NC[C@H]1CCCCN1C1CC1 ZINC000277632139 267217510 /nfs/dbraw/zinc/21/75/10/267217510.db2.gz XGANYNLFNBHGDP-SCBHQAGPSA-N 0 3 329.400 2.741 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCCN(C2CCCC2)CC1 ZINC000277654115 267223996 /nfs/dbraw/zinc/22/39/96/267223996.db2.gz VJJZCBURLKGJRK-UHFFFAOYSA-N 0 3 347.415 2.694 20 5 EFBDHN O=[N+]([O-])c1ccc(CCN2CCC[C@@H]([C@@H](O)C(F)(F)F)C2)cc1 ZINC000277856239 267280645 /nfs/dbraw/zinc/28/06/45/267280645.db2.gz TVUSMWFVWVMRDN-TZMCWYRMSA-N 0 3 332.322 2.773 20 5 EFBDHN Cc1cc(N2CC[S@@](=O)C[C@@H](C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000278255114 267381385 /nfs/dbraw/zinc/38/13/85/267381385.db2.gz VBBMVBZYJIZTAN-BSNNYGBQSA-N 0 3 333.413 2.656 20 5 EFBDHN C[C@H](c1ccccc1)[C@H](C)NCc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000181520217 273044493 /nfs/dbraw/zinc/04/44/93/273044493.db2.gz IBHOGRJEPLPEIC-STQMWFEESA-N 0 3 327.384 2.976 20 5 EFBDHN C[C@H](NC(=O)N(C)[C@@H]1CCN(C)C[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000246164535 273074226 /nfs/dbraw/zinc/07/42/26/273074226.db2.gz FHDXWLSXEDIWIJ-DVOMOZLQSA-N 0 3 334.420 2.637 20 5 EFBDHN COc1ccc([C@@H](CNc2ncc([N+](=O)[O-])cn2)N2CCCC2)cc1 ZINC000273639196 273116070 /nfs/dbraw/zinc/11/60/70/273116070.db2.gz RPOJMAZEIWPNIW-MRXNPFEDSA-N 0 3 343.387 2.642 20 5 EFBDHN CCO[C@@H]1C[C@@H](NC/C=C/c2ccccc2[N+](=O)[O-])[C@@]12CCCO2 ZINC000273638696 273116077 /nfs/dbraw/zinc/11/60/77/273116077.db2.gz UFDQREVPNDGJAU-QQTATGOZSA-N 0 3 332.400 2.924 20 5 EFBDHN COCCN1CC[C@@H](N[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000279079937 273174398 /nfs/dbraw/zinc/17/43/98/273174398.db2.gz MMMNNNDJBZFPKX-DYVFJYSZSA-N 0 3 333.432 2.628 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2nc(CN[C@H]3CCC[C@@H]3CCO)co2)cc1 ZINC000279254127 273193653 /nfs/dbraw/zinc/19/36/53/273193653.db2.gz LKZAIKIDHZRHPG-WBMJQRKESA-N 0 3 331.372 2.891 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CNC[C@H](CO)[C@@H]2CCOC2)o1 ZINC000280150551 273296307 /nfs/dbraw/zinc/29/63/07/273296307.db2.gz AHEQVTRBULHHNX-ZIAGYGMSSA-N 0 3 346.383 2.589 20 5 EFBDHN O=C(c1cc(NCCN2CC=CCC2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000280227297 273304438 /nfs/dbraw/zinc/30/44/38/273304438.db2.gz LJQQIFAZHBALIQ-UHFFFAOYSA-N 0 3 344.415 2.505 20 5 EFBDHN Cc1ccc([C@H]2CCN(CCn3cc([N+](=O)[O-])ccc3=O)C2)c(C)c1 ZINC000280298587 273312834 /nfs/dbraw/zinc/31/28/34/273312834.db2.gz FNMXMNKQGZNQFY-INIZCTEOSA-N 0 3 341.411 2.863 20 5 EFBDHN COC(=O)C[C@@H]1CC[C@@H](NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@@H]1C ZINC000280604885 273346071 /nfs/dbraw/zinc/34/60/71/273346071.db2.gz OITDCCKTFNAGJW-NTZNESFSSA-N 0 3 346.387 2.539 20 5 EFBDHN C[C@H](CNC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N(C)C1CC1 ZINC000280733574 273360972 /nfs/dbraw/zinc/36/09/72/273360972.db2.gz VNTYZPPCHAALQV-SECBINFHSA-N 0 3 343.786 2.529 20 5 EFBDHN CCOc1ccc([C@@H](C)NCC2([S@@](C)=O)CCC2)cc1[N+](=O)[O-] ZINC000280884549 273377638 /nfs/dbraw/zinc/37/76/38/273377638.db2.gz BDHTVOAEHOVVKL-SFDCACGMSA-N 0 3 340.445 2.945 20 5 EFBDHN CNC(=O)[C@@]1(C)CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000281045843 273394915 /nfs/dbraw/zinc/39/49/15/273394915.db2.gz HGYIPOLBGXKPKG-SFHVURJKSA-N 0 3 343.383 2.813 20 5 EFBDHN CS(=O)(=O)C1(CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)CCC1 ZINC000281236520 273414311 /nfs/dbraw/zinc/41/43/11/273414311.db2.gz VAOJZOHUQREJLC-HNNXBMFYSA-N 0 3 338.429 2.529 20 5 EFBDHN CCC[C@@H](NCC1(S(C)(=O)=O)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000281318414 273423093 /nfs/dbraw/zinc/42/30/93/273423093.db2.gz ZRLDYLTUGLLALU-OAHLLOKOSA-N 0 3 340.445 2.993 20 5 EFBDHN Cc1nn(C)c(C)c1[C@H]1OCC[C@@H]1NCc1ccc([N+](=O)[O-])c(F)c1 ZINC000282471900 273567700 /nfs/dbraw/zinc/56/77/00/273567700.db2.gz KSNZEIMNUDDILG-YOEHRIQHSA-N 0 3 348.378 2.704 20 5 EFBDHN CCC(CC)(CCO)NCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000282544242 273578390 /nfs/dbraw/zinc/57/83/90/273578390.db2.gz WKMWHNZNXBXAKB-UHFFFAOYSA-N 0 3 343.811 2.718 20 5 EFBDHN COCCn1cc(CN[C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cn1 ZINC000282825797 273624299 /nfs/dbraw/zinc/62/42/99/273624299.db2.gz RZYIGGWCXGDKIU-QGZVFWFLSA-N 0 3 344.415 2.549 20 5 EFBDHN CN(C)C1(CNc2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)CC1 ZINC000419011949 273790497 /nfs/dbraw/zinc/79/04/97/273790497.db2.gz UOCGSOPTNVSEIQ-UHFFFAOYSA-N 0 3 330.363 2.724 20 5 EFBDHN CN(C)CC(C)(C)NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000457197983 273794016 /nfs/dbraw/zinc/79/40/16/273794016.db2.gz AWKQRGIURGGXRF-UHFFFAOYSA-N 0 3 348.428 2.788 20 5 EFBDHN CN(C)[C@H]1Cc2ccccc2N(C(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000067205881 273820260 /nfs/dbraw/zinc/82/02/60/273820260.db2.gz XXUZFABRYIGZEM-LBPRGKRZSA-N 0 3 331.397 2.789 20 5 EFBDHN CN(CC1CCN(C)CC1)C(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000176242872 273832177 /nfs/dbraw/zinc/83/21/77/273832177.db2.gz AUWHJKMIVOXEQP-UHFFFAOYSA-N 0 3 325.796 2.662 20 5 EFBDHN CCC[C@]1(NCC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CCOC1 ZINC000285605691 274036121 /nfs/dbraw/zinc/03/61/21/274036121.db2.gz PVKICWALOJJLHM-HNNXBMFYSA-N 0 3 341.795 2.736 20 5 EFBDHN C[C@@H]1COCC[C@H]1CNCc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000285617826 274038829 /nfs/dbraw/zinc/03/88/29/274038829.db2.gz WGUSRGAGMZTARD-MNOVXSKESA-N 0 3 330.331 2.958 20 5 EFBDHN O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)[C@H]1CCCN1C1CCCC1 ZINC000285696531 274055471 /nfs/dbraw/zinc/05/54/71/274055471.db2.gz HIGQKNKUGWUFMW-OAHLLOKOSA-N 0 3 343.387 2.817 20 5 EFBDHN CC[C@H](NCC1(S(C)(=O)=O)CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000285756357 274067903 /nfs/dbraw/zinc/06/79/03/274067903.db2.gz SJFXUMKPEOQMTJ-HNNXBMFYSA-N 0 3 340.445 2.993 20 5 EFBDHN Cc1c([C@H](C)NCC2(S(C)(=O)=O)CCCC2)cccc1[N+](=O)[O-] ZINC000285793134 274076086 /nfs/dbraw/zinc/07/60/86/274076086.db2.gz VIUCWKSHCZPVRX-ZDUSSCGKSA-N 0 3 340.445 2.911 20 5 EFBDHN C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000285985159 274112268 /nfs/dbraw/zinc/11/22/68/274112268.db2.gz XKQAOISHKHXRNW-HIFRSBDPSA-N 0 3 349.456 2.772 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1C[C@H](N2CCOCC2)C[C@@H]1C ZINC000286144399 274142178 /nfs/dbraw/zinc/14/21/78/274142178.db2.gz VQVHGFRAXOSANQ-YQQAZPJKSA-N 0 3 333.432 2.759 20 5 EFBDHN CCS[C@@H]1CCC[C@@H]1NCC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000286190538 274150836 /nfs/dbraw/zinc/15/08/36/274150836.db2.gz PQCVAUCXEJOZAC-LSDHHAIUSA-N 0 3 337.445 2.821 20 5 EFBDHN CCS[C@@H]1CCC[C@H]1NCC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000286193411 274151224 /nfs/dbraw/zinc/15/12/24/274151224.db2.gz PSUUYOGNODAYRQ-GDBMZVCRSA-N 0 3 349.456 2.748 20 5 EFBDHN C[C@@H]1C[C@@H](N2CCCC2)CN1c1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000286333982 274180266 /nfs/dbraw/zinc/18/02/66/274180266.db2.gz LQXJXZVTRRWWLF-TZMCWYRMSA-N 0 3 344.415 2.543 20 5 EFBDHN CCCN(CCN1CCCCC1)C(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000286380120 274188997 /nfs/dbraw/zinc/18/89/97/274188997.db2.gz YFOITEHGSGOBAU-UHFFFAOYSA-N 0 3 334.420 2.515 20 5 EFBDHN O=[N+]([O-])c1cc2c(ncnc2N2CC[C@@H](N3CCCCC3)C2)s1 ZINC000286412894 274195937 /nfs/dbraw/zinc/19/59/37/274195937.db2.gz AWNMZNSHTMPEID-LLVKDONJSA-N 0 3 333.417 2.664 20 5 EFBDHN C[C@@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccncc1[N+](=O)[O-] ZINC000183626418 274212982 /nfs/dbraw/zinc/21/29/82/274212982.db2.gz VMDVPTPMQGIKMY-ZDUSSCGKSA-N 0 3 343.387 2.632 20 5 EFBDHN CN1CCN(CCNc2cc(Cl)ccc2[N+](=O)[O-])CC1(C)C ZINC000286624250 274238077 /nfs/dbraw/zinc/23/80/77/274238077.db2.gz YZJZIHGVMBMIJS-UHFFFAOYSA-N 0 3 326.828 2.686 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000286671873 274247803 /nfs/dbraw/zinc/24/78/03/274247803.db2.gz KRNWKACZWYOZOU-INIZCTEOSA-N 0 3 348.447 2.653 20 5 EFBDHN CS[C@@H]1CN(c2ccc([N+](=O)[O-])c(C(C)=O)c2)C[C@H]1N1CCCC1 ZINC000286800564 274275681 /nfs/dbraw/zinc/27/56/81/274275681.db2.gz KMFWPNCXKWBSSA-IAGOWNOFSA-N 0 3 349.456 2.813 20 5 EFBDHN CS[C@H]1CN(c2ccc([N+](=O)[O-])c(C(C)=O)c2)C[C@H]1N1CCCC1 ZINC000286802353 274276027 /nfs/dbraw/zinc/27/60/27/274276027.db2.gz KMFWPNCXKWBSSA-SJORKVTESA-N 0 3 349.456 2.813 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)N1C[C@@H](N2CCCC2)C[C@H]1C ZINC000286926257 274302275 /nfs/dbraw/zinc/30/22/75/274302275.db2.gz LDSZADVGJUBYOT-OCCSQVGLSA-N 0 3 348.403 2.694 20 5 EFBDHN C[C@@H]1[C@H](N2CCCC2)CCN1C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000287000911 274319356 /nfs/dbraw/zinc/31/93/56/274319356.db2.gz HJGFTYULMNGEPV-BXUZGUMPSA-N 0 3 337.807 2.947 20 5 EFBDHN C[C@H](NC(=O)Nc1ccncc1[N+](=O)[O-])[C@H](c1ccccc1)N(C)C ZINC000287019560 274323491 /nfs/dbraw/zinc/32/34/91/274323491.db2.gz IERZLYSKMPBSBO-BLLLJJGKSA-N 0 3 343.387 2.803 20 5 EFBDHN CCCN(CCN1CCCC1)C(=O)c1cc(F)c([N+](=O)[O-])cc1F ZINC000287241297 274376234 /nfs/dbraw/zinc/37/62/34/274376234.db2.gz JMUMDQQCQAIGBW-UHFFFAOYSA-N 0 3 341.358 2.821 20 5 EFBDHN C[C@@H]1[C@@H](N2CCCC2)CCN1C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000287244600 274376779 /nfs/dbraw/zinc/37/67/79/274376779.db2.gz RFGQAMFZOKDMPZ-CJNGLKHVSA-N 0 3 349.456 2.772 20 5 EFBDHN CC(=O)c1cc([N+](=O)[O-])ccc1NC1CCN(C[C@@H]2CCOC2)CC1 ZINC000287332712 274396599 /nfs/dbraw/zinc/39/65/99/274396599.db2.gz OKMRJPZVIJUYTL-AWEZNQCLSA-N 0 3 347.415 2.710 20 5 EFBDHN CC(=O)c1cc([N+](=O)[O-])ccc1NCC1(N2CCCC2)CCOCC1 ZINC000287980863 274512016 /nfs/dbraw/zinc/51/20/16/274512016.db2.gz RIBNVSOZIKANRK-UHFFFAOYSA-N 0 3 347.415 2.854 20 5 EFBDHN C[C@H]1C[C@H](N2CCCC2)CN1C(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000288582857 274623315 /nfs/dbraw/zinc/62/33/15/274623315.db2.gz XNUFRDUVDSQIQN-RYUDHWBXSA-N 0 3 337.807 2.947 20 5 EFBDHN CCO[C@H]1C[C@@H](NCc2ccc(C(N)=O)cc2[N+](=O)[O-])C12CCCC2 ZINC000289290097 274735900 /nfs/dbraw/zinc/73/59/00/274735900.db2.gz HAXQTZQSECBZLH-CVEARBPZSA-N 0 3 347.415 2.521 20 5 EFBDHN O=[N+]([O-])c1ccc(CN2CCNC[C@@H]2c2ccncc2)c(Cl)c1 ZINC000261949917 275035291 /nfs/dbraw/zinc/03/52/91/275035291.db2.gz FVMWHGAGHFQCGX-MRXNPFEDSA-N 0 3 332.791 2.790 20 5 EFBDHN CCN(CCN1CCCCCC1)C(=O)c1cc([N+](=O)[O-])ccc1OC ZINC000345444052 276124555 /nfs/dbraw/zinc/12/45/55/276124555.db2.gz CTQOGCNKJRXCOO-UHFFFAOYSA-N 0 3 349.431 2.942 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000177350652 276234092 /nfs/dbraw/zinc/23/40/92/276234092.db2.gz SERHBKSBUUZEIH-CVEARBPZSA-N 0 3 347.415 2.520 20 5 EFBDHN CCN(C)CCNC(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000354022298 276305502 /nfs/dbraw/zinc/30/55/02/276305502.db2.gz MYJKFEWOFKVBFS-CQSZACIVSA-N 0 3 348.447 2.513 20 5 EFBDHN CN(C)C1(CN(C)C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CCC1 ZINC000188070852 276751924 /nfs/dbraw/zinc/75/19/24/276751924.db2.gz DRUSINZFNMKXAB-UHFFFAOYSA-N 0 3 325.796 2.805 20 5 EFBDHN CN(C)C[C@H]1CN(C(=O)c2csc([N+](=O)[O-])c2)c2ccccc2O1 ZINC000370504076 276805938 /nfs/dbraw/zinc/80/59/38/276805938.db2.gz CEWFTTCDJUFKSJ-LBPRGKRZSA-N 0 3 347.396 2.626 20 5 EFBDHN CN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000269120882 277181476 /nfs/dbraw/zinc/18/14/76/277181476.db2.gz SROKVPIQTJFCMU-WFASDCNBSA-N 0 3 343.383 2.897 20 5 EFBDHN CN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000119171700 277182594 /nfs/dbraw/zinc/18/25/94/277182594.db2.gz GEUIUSQJXSJESX-ABAIWWIYSA-N 0 3 337.807 2.805 20 5 EFBDHN CC(C)CN(CCN(C)C)C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000342919210 277379907 /nfs/dbraw/zinc/37/99/07/277379907.db2.gz GUUNOLLVZCJSMQ-UHFFFAOYSA-N 0 3 332.404 2.736 20 5 EFBDHN CC(C)c1ccc(CN2CCNC[C@@H]2c2nccn2C)cc1[N+](=O)[O-] ZINC000262120484 278036095 /nfs/dbraw/zinc/03/60/95/278036095.db2.gz XGJLBCLBBLKMHJ-QGZVFWFLSA-N 0 3 343.431 2.598 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)NCCN2CCCC2(C)C)c1 ZINC000457068712 278174916 /nfs/dbraw/zinc/17/49/16/278174916.db2.gz DZVZIIAKGVVISQ-UHFFFAOYSA-N 0 3 337.445 2.921 20 5 EFBDHN C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000247553225 288079092 /nfs/dbraw/zinc/07/90/92/288079092.db2.gz YXSOEODJVIRDTO-ZWNOBZJWSA-N 0 3 325.796 2.660 20 5 EFBDHN CCC[C@@H](N[C@@H](CC)C(=O)N1CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000165116930 278872791 /nfs/dbraw/zinc/87/27/91/278872791.db2.gz IASOIOUHPFBSTR-DLBZAZTESA-N 0 3 349.431 2.663 20 5 EFBDHN CC(C)[C@@H](NCCn1ccc([N+](=O)[O-])n1)c1ccc2c(c1)OCCO2 ZINC000181974131 279906099 /nfs/dbraw/zinc/90/60/99/279906099.db2.gz AGVCSMUWPGGOEA-QGZVFWFLSA-N 0 3 346.387 2.549 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCN(C2CCOCC2)CC1 ZINC000182822054 281019478 /nfs/dbraw/zinc/01/94/78/281019478.db2.gz LGVFFBOZTMIEKU-OAHLLOKOSA-N 0 3 333.432 2.761 20 5 EFBDHN CN(C)CCOc1ccc(NC(=O)c2ccc([N+](=O)[O-])s2)cc1 ZINC000079380325 292787070 /nfs/dbraw/zinc/78/70/70/292787070.db2.gz CBCGGFOHXMZTPV-UHFFFAOYSA-N 0 3 335.385 2.849 20 5 EFBDHN CCN1CCC[C@H]1CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000126597867 293044544 /nfs/dbraw/zinc/04/45/44/293044544.db2.gz VFSVMCVVMFTBNX-NSHDSACASA-N 0 3 326.784 2.854 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1cccc(OCC(N)=O)c1 ZINC000128855061 293117242 /nfs/dbraw/zinc/11/72/42/293117242.db2.gz GNZTUZKNIKJDKL-ZDUSSCGKSA-N 0 3 343.383 2.618 20 5 EFBDHN O=[N+]([O-])c1ccc(CN(C[C@H](O)COCc2ccco2)C2CC2)cc1 ZINC000130897453 293181484 /nfs/dbraw/zinc/18/14/84/293181484.db2.gz RIABZKMAZVXPAE-KRWDZBQOSA-N 0 3 346.383 2.730 20 5 EFBDHN CN(C)CCN(Cc1ccco1)C(=O)/C=C\c1cccc([N+](=O)[O-])c1 ZINC000255057739 293837763 /nfs/dbraw/zinc/83/77/63/293837763.db2.gz YEOOABIUAPVDOD-HJWRWDBZSA-N 0 3 343.383 2.791 20 5 EFBDHN CN(C)Cc1cccc(CNC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)c1 ZINC000255558522 293867840 /nfs/dbraw/zinc/86/78/40/293867840.db2.gz WDBVCSQTPLEVSG-FLIBITNWSA-N 0 3 339.395 2.986 20 5 EFBDHN Nc1ccc(-c2noc(C3CCN(C4CC4)CC3)n2)cc1[N+](=O)[O-] ZINC000290212092 294028249 /nfs/dbraw/zinc/02/82/49/294028249.db2.gz OSOBHYCFEQBKID-UHFFFAOYSA-N 0 3 329.360 2.569 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CN2CC3(CCC3)[C@@H]2C2CC2)c1 ZINC000290830676 294197686 /nfs/dbraw/zinc/19/76/86/294197686.db2.gz UNFICRGEONFRCH-RDJZCZTQSA-N 0 3 332.400 2.599 20 5 EFBDHN C[C@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H](c1ccccc1)N(C)C ZINC000290920381 294220645 /nfs/dbraw/zinc/22/06/45/294220645.db2.gz IFQKSFFSSLQBDH-YVEFUNNKSA-N 0 3 342.399 2.797 20 5 EFBDHN CC(C)[N@H+](C)C[C@@H](C)[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000290926515 294221870 /nfs/dbraw/zinc/22/18/70/294221870.db2.gz LNRXJKWIYHBILM-LLVKDONJSA-N 0 3 329.347 2.532 20 5 EFBDHN CC(C)[N@@H+](C)C[C@@H](C)[N-]C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000290926515 294221871 /nfs/dbraw/zinc/22/18/71/294221871.db2.gz LNRXJKWIYHBILM-LLVKDONJSA-N 0 3 329.347 2.532 20 5 EFBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNC[C@@H](O)C1CCOCC1 ZINC000290925973 294222263 /nfs/dbraw/zinc/22/22/63/294222263.db2.gz RDRHFOICTUKWMQ-CYBMUJFWSA-N 0 3 349.214 2.779 20 5 EFBDHN CNC(=O)CCCN(C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000293866278 295067172 /nfs/dbraw/zinc/06/71/72/295067172.db2.gz SGXYGNJFMWSOHC-UHFFFAOYSA-N 0 3 333.310 2.572 20 5 EFBDHN Cc1cccc(OC[C@H](O)CN[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000293913847 295078166 /nfs/dbraw/zinc/07/81/66/295078166.db2.gz WZYSZGBQVDXBNC-UKRRQHHQSA-N 0 3 345.399 2.576 20 5 EFBDHN C[C@H](CNC(=O)OC(C)(C)C)N[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000293975522 295091166 /nfs/dbraw/zinc/09/11/66/295091166.db2.gz AZYBUJSVVPJPHD-MNOVXSKESA-N 0 3 338.408 2.741 20 5 EFBDHN CN1CCC[C@@]2(CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])C2)C1 ZINC000294215263 295129110 /nfs/dbraw/zinc/12/91/10/295129110.db2.gz QTQCZRMTUQDEAS-LKGOPFMKSA-N 0 3 329.400 2.552 20 5 EFBDHN CN1CCC[C@@]2(CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000294324611 295147594 /nfs/dbraw/zinc/14/75/94/295147594.db2.gz XEIKCOPDEYEYAA-KRZKXXONSA-N 0 3 329.400 2.552 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@]3(C2)CCCN(C)C3)c1 ZINC000294363946 295154293 /nfs/dbraw/zinc/15/42/93/295154293.db2.gz ZBKHERXLBYSZDZ-QGZVFWFLSA-N 0 3 349.456 2.875 20 5 EFBDHN CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2NCc1cccc([N+](=O)[O-])c1 ZINC000294671310 295204598 /nfs/dbraw/zinc/20/45/98/295204598.db2.gz APDNXNBPLZCXBK-FICVDOATSA-N 0 3 333.388 2.550 20 5 EFBDHN CN(CCc1ccccc1[N+](=O)[O-])Cc1ccc2c(c1)NC(=O)CO2 ZINC000294699611 295210609 /nfs/dbraw/zinc/21/06/09/295210609.db2.gz OASADPMXPSUPHD-UHFFFAOYSA-N 0 3 341.367 2.600 20 5 EFBDHN C[C@H](NCCOc1ncccc1Cl)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294757392 295221980 /nfs/dbraw/zinc/22/19/80/295221980.db2.gz MHYSDNHHMAEDCI-JTQLQIEISA-N 0 3 336.779 2.955 20 5 EFBDHN CC(C)N1CCCN(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000294773862 295225257 /nfs/dbraw/zinc/22/52/57/295225257.db2.gz CAODRLUOQQAKKJ-UHFFFAOYSA-N 0 3 325.796 2.805 20 5 EFBDHN CCN(CC)[C@H]1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000294792860 295228537 /nfs/dbraw/zinc/22/85/37/295228537.db2.gz BMIUDUIARORULF-INIZCTEOSA-N 0 3 347.415 2.500 20 5 EFBDHN CCn1cc([C@H](C)N[C@H](C)CC(=O)Nc2cccc([N+](=O)[O-])c2)cn1 ZINC000294870360 295239165 /nfs/dbraw/zinc/23/91/65/295239165.db2.gz PEYWDIZMMQMMQV-OLZOCXBDSA-N 0 3 345.403 2.879 20 5 EFBDHN CC(C)C[C@H](CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)N(C)C ZINC000294877761 295240172 /nfs/dbraw/zinc/24/01/72/295240172.db2.gz DDHXDVXLJRPEJZ-MRXNPFEDSA-N 0 3 349.431 2.650 20 5 EFBDHN CC(C)C[C@@H](CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)N(C)C ZINC000294877755 295240191 /nfs/dbraw/zinc/24/01/91/295240191.db2.gz DDHXDVXLJRPEJZ-INIZCTEOSA-N 0 3 349.431 2.650 20 5 EFBDHN C[C@H]1CN(c2cc(C(F)(F)F)ncc2[N+](=O)[O-])CCN(C2CC2)C1 ZINC000294987964 295254473 /nfs/dbraw/zinc/25/44/73/295254473.db2.gz QFGOMBTWJYJLBW-SNVBAGLBSA-N 0 3 344.337 2.929 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)N(CCN(C)C)c1ccccc1 ZINC000069490962 295254769 /nfs/dbraw/zinc/25/47/69/295254769.db2.gz OHXZQXPJZGKUDX-UHFFFAOYSA-N 0 3 343.383 2.812 20 5 EFBDHN C[C@@H]1CN(c2ncnc3sc([N+](=O)[O-])cc32)CCN(C2CC2)C1 ZINC000295015926 295257918 /nfs/dbraw/zinc/25/79/18/295257918.db2.gz UIPVLNHRMQGHJO-JTQLQIEISA-N 0 3 333.417 2.520 20 5 EFBDHN Cc1cc(Cl)c(C(=O)N[C@H]2C[C@H](C)N(C3CC3)C2)cc1[N+](=O)[O-] ZINC000295055952 295262521 /nfs/dbraw/zinc/26/25/21/295262521.db2.gz GXEVNNVSRFVAHK-QWRGUYRKSA-N 0 3 337.807 2.912 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nc(CN[C@H]3CC[C@@H](CO)C3)cs2)c1 ZINC000295124351 295271151 /nfs/dbraw/zinc/27/11/51/295271151.db2.gz XDMHQHLVIBDULJ-YPMHNXCESA-N 0 3 333.413 2.969 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@H](O)Cc1cccc(F)c1 ZINC000295126411 295271539 /nfs/dbraw/zinc/27/15/39/295271539.db2.gz NZHSQAVDVVKJCZ-QGZVFWFLSA-N 0 3 348.374 2.826 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1CNCCc1cnc2c(Cl)cnn2c1 ZINC000295170329 295277649 /nfs/dbraw/zinc/27/76/49/295277649.db2.gz UFCZFRGYBJWUKF-UHFFFAOYSA-N 0 3 345.790 2.932 20 5 EFBDHN C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CCN(C2CC2)C1 ZINC000295417764 295316764 /nfs/dbraw/zinc/31/67/64/295316764.db2.gz SUNNQCWTZCEWLY-NSHDSACASA-N 0 3 337.807 2.805 20 5 EFBDHN Cc1c(CN2C[C@H]3C[C@@H](C2)Cn2c(=O)cccc23)cccc1[N+](=O)[O-] ZINC000295575335 295343684 /nfs/dbraw/zinc/34/36/84/295343684.db2.gz LQBVMYFAKSKIHV-GOEBONIOSA-N 0 3 339.395 2.684 20 5 EFBDHN CCN1CCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])c(C)cc1Cl ZINC000295646520 295354409 /nfs/dbraw/zinc/35/44/09/295354409.db2.gz IMDKCGBDPZAXSM-NSHDSACASA-N 0 3 325.796 2.771 20 5 EFBDHN C[C@@H]1CN(Cc2nc3cc([N+](=O)[O-])ccc3o2)CCN(C2CC2)C1 ZINC000295849713 295385619 /nfs/dbraw/zinc/38/56/19/295385619.db2.gz BYQGZSPBSBHFNT-GFCCVEGCSA-N 0 3 330.388 2.652 20 5 EFBDHN C[C@H]1CN(Cc2nc3cc([N+](=O)[O-])ccc3o2)CCN(C2CC2)C1 ZINC000295849717 295385767 /nfs/dbraw/zinc/38/57/67/295385767.db2.gz BYQGZSPBSBHFNT-LBPRGKRZSA-N 0 3 330.388 2.652 20 5 EFBDHN Cc1cc(Cl)c(C(=O)NCC2(N(C)C)CCC2)cc1[N+](=O)[O-] ZINC000295928726 295398250 /nfs/dbraw/zinc/39/82/50/295398250.db2.gz KCOHEMPGRQRRQA-UHFFFAOYSA-N 0 3 325.796 2.771 20 5 EFBDHN CC(C)O[C@@H]1C[C@H](NCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1(C)C ZINC000296183223 295437423 /nfs/dbraw/zinc/43/74/23/295437423.db2.gz LKBUZVDRKCJOKN-JKSUJKDBSA-N 0 3 349.431 2.739 20 5 EFBDHN CC(C)(C)OC(=O)NCC1(CNCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000297318023 310880199 /nfs/dbraw/zinc/88/01/99/310880199.db2.gz CBXWZZVLMZJGKT-UHFFFAOYSA-N 0 3 335.404 2.989 20 5 EFBDHN CS[C@@H]1CN(c2nccc3cc([N+](=O)[O-])ccc32)C[C@@H]1N(C)C ZINC000297557689 310908439 /nfs/dbraw/zinc/90/84/39/310908439.db2.gz RIYJGWXXJIPCBC-LSDHHAIUSA-N 0 3 332.429 2.625 20 5 EFBDHN O=C(CCCNc1ccc([N+](=O)[O-])cc1)NC1CCN(C2CC2)CC1 ZINC000298217127 310968386 /nfs/dbraw/zinc/96/83/86/310968386.db2.gz TVDBLGMJGOVAOT-UHFFFAOYSA-N 0 3 346.431 2.530 20 5 EFBDHN CCO[C@@H]1C[C@H](NCc2ccc(OC)c([N+](=O)[O-])c2)[C@H]1SC ZINC000298601698 311007033 /nfs/dbraw/zinc/00/70/33/311007033.db2.gz ZEYBRRCNDKPTIF-NILFDRSVSA-N 0 3 326.418 2.602 20 5 EFBDHN CC(C)(CCC(=O)N1C[C@@H]2CCCN2Cc2ccccc21)[N+](=O)[O-] ZINC000298615688 311008087 /nfs/dbraw/zinc/00/80/87/311008087.db2.gz RVNZWGLTSLXLKH-HNNXBMFYSA-N 0 3 331.416 2.833 20 5 EFBDHN C[C@H]1CCCN(CCNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C1 ZINC000299316691 311072056 /nfs/dbraw/zinc/07/20/56/311072056.db2.gz WWGHQHBPWAGLOH-LBPRGKRZSA-N 0 3 330.388 2.538 20 5 EFBDHN CN(C)CCN(C(=O)COc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000299415095 311082701 /nfs/dbraw/zinc/08/27/01/311082701.db2.gz LXHMIQZJLATSLW-UHFFFAOYSA-N 0 3 343.383 2.568 20 5 EFBDHN Cc1nccn1CCCNCc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000299582621 311099374 /nfs/dbraw/zinc/09/93/74/311099374.db2.gz DHOIUQHUQWBITR-UHFFFAOYSA-N 0 3 340.330 2.881 20 5 EFBDHN C[C@@H](c1ccccc1)N1CCC(Nc2ncc([N+](=O)[O-])c(N)n2)CC1 ZINC000301327060 311131629 /nfs/dbraw/zinc/13/16/29/311131629.db2.gz ZQTZWLJCUNVHIW-LBPRGKRZSA-N 0 3 342.403 2.605 20 5 EFBDHN COc1cc(N2CCN(CCc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000301330224 311131720 /nfs/dbraw/zinc/13/17/20/311131720.db2.gz APIUYSHQXVECNS-UHFFFAOYSA-N 0 3 341.411 2.968 20 5 EFBDHN CC(C)NC(=O)c1ccc(N(C)C[C@@H]2CCCN(C)C2)c([N+](=O)[O-])c1 ZINC000301373874 311134163 /nfs/dbraw/zinc/13/41/63/311134163.db2.gz UWDSGUBLSULQHV-CQSZACIVSA-N 0 3 348.447 2.511 20 5 EFBDHN O=C(NC1CC1)c1ccc(NCCN2CCCCCC2)c([N+](=O)[O-])c1 ZINC000301495635 311140753 /nfs/dbraw/zinc/14/07/53/311140753.db2.gz AUMAGVCKIMEEJP-UHFFFAOYSA-N 0 3 346.431 2.775 20 5 EFBDHN CCN1CCCN(c2cc(Br)ccc2[N+](=O)[O-])CC1 ZINC000301660711 311150562 /nfs/dbraw/zinc/15/05/62/311150562.db2.gz JIVAWUHTMXMLTL-UHFFFAOYSA-N 0 3 328.210 2.889 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CC[C@@H](N3CCCC3)C2)c(OC(F)F)c1 ZINC000302030866 311173430 /nfs/dbraw/zinc/17/34/30/311173430.db2.gz BXZVFVYCKMLLKD-GFCCVEGCSA-N 0 3 327.331 2.871 20 5 EFBDHN COC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2CCN(C3CCCC3)C2)c1 ZINC000302106343 311178222 /nfs/dbraw/zinc/17/82/22/311178222.db2.gz SCTSETHDBYGEGV-ZDUSSCGKSA-N 0 3 333.388 2.810 20 5 EFBDHN C[C@@H](C1CCN(C)CC1)N(C)C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000330750713 311332828 /nfs/dbraw/zinc/33/28/28/311332828.db2.gz WMAWFBKJUGUNMU-AWEZNQCLSA-N 0 3 333.432 2.716 20 5 EFBDHN Cc1c(NC(=O)CCN2CCN(C)C[C@@H]2C(C)C)cccc1[N+](=O)[O-] ZINC000330998978 311348170 /nfs/dbraw/zinc/34/81/70/311348170.db2.gz PRCZUYIQIFHGAO-QGZVFWFLSA-N 0 3 348.447 2.504 20 5 EFBDHN C[C@@H](C(=O)N(C)CCc1cccc([N+](=O)[O-])c1)N1CCCCCC1 ZINC000331472257 311380946 /nfs/dbraw/zinc/38/09/46/311380946.db2.gz OHTNRRUCIBXYBR-HNNXBMFYSA-N 0 3 333.432 2.860 20 5 EFBDHN CC(C)c1ccc(C(=O)N[C@@H]2CN(C3CC3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000331483977 311381627 /nfs/dbraw/zinc/38/16/27/311381627.db2.gz JVMOPTSZNZFFJL-BLLLJJGKSA-N 0 3 331.416 2.931 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[C@H](N2CCCC2)[C@@H]1C ZINC000332081279 311452186 /nfs/dbraw/zinc/45/21/86/311452186.db2.gz LPTHBNFYLYQKHD-HOCLYGCPSA-N 0 3 331.416 2.910 20 5 EFBDHN C[C@@H](C(=O)N1CC[C@H](N2CCCCC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000332655253 311531731 /nfs/dbraw/zinc/53/17/31/311531731.db2.gz JEUMJOGNKRKHPZ-HIFRSBDPSA-N 0 3 349.406 2.924 20 5 EFBDHN CN(C)CCOC1CCN(c2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413145812 312046327 /nfs/dbraw/zinc/04/63/27/312046327.db2.gz VXWHMDUDBBTJGT-UHFFFAOYSA-N 0 3 344.415 2.690 20 5 EFBDHN COc1cc(C[NH2+]CC(C)(C)c2cccnc2)c([N+](=O)[O-])cc1[O-] ZINC000414562063 312051614 /nfs/dbraw/zinc/05/16/14/312051614.db2.gz UIBHYKDQQIQQHK-UHFFFAOYSA-N 0 3 331.372 2.771 20 5 EFBDHN O=C1C[C@@H](N[C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)CN1C1CC1 ZINC000417308733 312206851 /nfs/dbraw/zinc/20/68/51/312206851.db2.gz IEOPXKQGVFFFDE-CXAGYDPISA-N 0 3 329.400 2.715 20 5 EFBDHN C[C@@H]1COCCN1CCN[C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417317975 312208369 /nfs/dbraw/zinc/20/83/69/312208369.db2.gz XTCWELBZRWJJNH-KDOFPFPSSA-N 0 3 333.432 2.673 20 5 EFBDHN COc1ccc2c(c1)ncc([N+](=O)[O-])c2N(C)C[C@@H]1CCCN1C ZINC000420640206 312377757 /nfs/dbraw/zinc/37/77/57/312377757.db2.gz SOVVJRSTLMQQFH-LBPRGKRZSA-N 0 3 330.388 2.682 20 5 EFBDHN CCCN1C[C@@H](CNc2cc(C)nc3ccc([N+](=O)[O-])cc32)CC1=O ZINC000420651011 312379281 /nfs/dbraw/zinc/37/92/81/312379281.db2.gz JAXGOXPTXMBSER-CYBMUJFWSA-N 0 3 342.399 2.544 20 5 EFBDHN C[C@H]1CN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)CN1 ZINC000423507395 312426672 /nfs/dbraw/zinc/42/66/72/312426672.db2.gz QAHZQERSNRRZMR-UWVGGRQHSA-N 0 3 343.836 2.549 20 5 EFBDHN COC(=O)COc1ccc(CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000449349026 312686948 /nfs/dbraw/zinc/68/69/48/312686948.db2.gz OABMDCOAGBGTSB-ZDUSSCGKSA-N 0 3 344.367 2.997 20 5 EFBDHN C[C@]1(CNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCC(=O)N1 ZINC000453587481 312913421 /nfs/dbraw/zinc/91/34/21/312913421.db2.gz JXNPGHCDLIHSGP-QGZVFWFLSA-N 0 3 329.356 2.613 20 5 EFBDHN C[C@H]1CC[C@@H](CNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)O1 ZINC000453635367 312922364 /nfs/dbraw/zinc/92/23/64/312922364.db2.gz USDPLRAPXISLEK-LRDDRELGSA-N 0 3 330.388 2.652 20 5 EFBDHN CC[C@@H]1C[C@@H](C)CN1Cc1ccc(OCC(=O)OC)c([N+](=O)[O-])c1 ZINC000475703714 313225172 /nfs/dbraw/zinc/22/51/72/313225172.db2.gz YAOGKIZRDZEOEM-TZMCWYRMSA-N 0 3 336.388 2.767 20 5 EFBDHN CCCCN(C)CCNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000485601110 313329065 /nfs/dbraw/zinc/32/90/65/313329065.db2.gz QPRLRJLUWRCUKQ-UHFFFAOYSA-N 0 3 345.346 2.658 20 5 EFBDHN O=[N+]([O-])c1ccn(C2CCN(CCOc3cccc(F)c3)CC2)n1 ZINC000488750143 313509201 /nfs/dbraw/zinc/50/92/01/313509201.db2.gz GGXHUSJZNRGVCQ-UHFFFAOYSA-N 0 3 334.351 2.646 20 5 EFBDHN O=C(/C=C\c1ccccc1[N+](=O)[O-])N1CC[C@H](N2CCCCC2)C1 ZINC000491562583 313765040 /nfs/dbraw/zinc/76/50/40/313765040.db2.gz OBPDLIVBRFNLBR-QWGSZXSUSA-N 0 3 329.400 2.695 20 5 EFBDHN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N1CC[C@@H](N2CCCCC2)C1 ZINC000491561134 313765258 /nfs/dbraw/zinc/76/52/58/313765258.db2.gz INUMWBIUOQZDGF-UXHZXRBQSA-N 0 3 329.400 2.695 20 5 EFBDHN C[C@@H](C1CCN(C)CC1)N(C)C(=O)/C=C\c1cccc([N+](=O)[O-])c1 ZINC000492320392 313949582 /nfs/dbraw/zinc/94/95/82/313949582.db2.gz OUBGDKALKLLBRD-DANTVBBOSA-N 0 3 331.416 2.797 20 5 EFBDHN C[C@@H]1CN(C(=O)/C=C/c2cccc([N+](=O)[O-])c2)CCN(C2CCC2)C1 ZINC000492803909 314132115 /nfs/dbraw/zinc/13/21/15/314132115.db2.gz WASZIXUZIDILLL-HVHJFMEUSA-N 0 3 343.427 2.941 20 5 EFBDHN C[C@@H]1CN(C(=O)/C=C\c2cccc([N+](=O)[O-])c2)CCN(C2CCC2)C1 ZINC000492803906 314132492 /nfs/dbraw/zinc/13/24/92/314132492.db2.gz WASZIXUZIDILLL-CDNLZTBQSA-N 0 3 343.427 2.941 20 5 EFBDHN O=C(/C=C\c1ccccc1)NCCCNCc1ccccc1[N+](=O)[O-] ZINC000492849435 314150821 /nfs/dbraw/zinc/15/08/21/314150821.db2.gz CKYDHILRLXVYSA-QXMHVHEDSA-N 0 3 339.395 2.904 20 5 EFBDHN O=C(/C=C/c1ccccc1)NCCCNCc1csc([N+](=O)[O-])c1 ZINC000492852749 314151074 /nfs/dbraw/zinc/15/10/74/314151074.db2.gz MGWGJEUTBFTUFX-BQYQJAHWSA-N 0 3 345.424 2.966 20 5 EFBDHN C[C@H]1C[C@H]1N1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000492922257 314178167 /nfs/dbraw/zinc/17/81/67/314178167.db2.gz MXXFZJISGOHCRB-VPARFWPLSA-N 0 3 343.427 2.797 20 5 EFBDHN COC(=O)N1CCC[C@@H]([C@H](C)NCc2csc([N+](=O)[O-])c2)C1 ZINC000495479602 314729301 /nfs/dbraw/zinc/72/93/01/314729301.db2.gz JAASHGRJLIHBOM-CMPLNLGQSA-N 0 3 327.406 2.613 20 5 EFBDHN CCOC(=O)c1cc(N2C[C@H](C)N(CC)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000497515449 315393338 /nfs/dbraw/zinc/39/33/38/315393338.db2.gz MVUMMAWYAPGXDS-STQMWFEESA-N 0 3 335.404 2.690 20 5 EFBDHN C[C@H](N[C@H]1CSC[C@@H]1C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000507263514 315480238 /nfs/dbraw/zinc/48/02/38/315480238.db2.gz BMIOUJVRVRVCNZ-RVBZMBCESA-N 0 3 343.836 2.916 20 5 EFBDHN CN(C)C[C@@H]1CCCCN1C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000520497811 315960911 /nfs/dbraw/zinc/96/09/11/315960911.db2.gz FTNAZJXCDHZQJX-AWEZNQCLSA-N 0 3 337.445 2.630 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@@H]1CCc2nc(C)ncc2C1 ZINC000520952306 315988705 /nfs/dbraw/zinc/98/87/05/315988705.db2.gz NUDHJZUSGVVKCE-OAHLLOKOSA-N 0 3 342.399 2.739 20 5 EFBDHN O=C(Nc1cccc([N+](=O)[O-])c1)[C@H]1CCCN(Cc2cccnc2)C1 ZINC000522175289 316077389 /nfs/dbraw/zinc/07/73/89/316077389.db2.gz FFKDNINYJHTNHB-HNNXBMFYSA-N 0 3 340.383 2.841 20 5 EFBDHN CC[C@H]1CCCCN1CCNC(=O)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000522203294 316080005 /nfs/dbraw/zinc/08/00/05/316080005.db2.gz KGZDGBFGHBNBDQ-HNNXBMFYSA-N 0 3 349.431 2.527 20 5 EFBDHN O=C(c1cc([N+](=O)[O-])c[nH]1)N(CCN1CCCC1)c1ccccc1 ZINC000523536374 316128890 /nfs/dbraw/zinc/12/88/90/316128890.db2.gz WARLRNKCHGQXMR-UHFFFAOYSA-N 0 3 328.372 2.666 20 5 EFBDHN O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CC[C@H](N2CCCC2)C1 ZINC000524040665 316145109 /nfs/dbraw/zinc/14/51/09/316145109.db2.gz OJJONJQJXHOPCD-AWEZNQCLSA-N 0 3 329.356 2.651 20 5 EFBDHN Cc1ccccc1[C@H]([C@@H](C)NC(=O)c1cc([N+](=O)[O-])cn1C)N(C)C ZINC000525959164 316263817 /nfs/dbraw/zinc/26/38/17/316263817.db2.gz SRQIPLZVXBMYJW-DYVFJYSZSA-N 0 3 344.415 2.663 20 5 EFBDHN Cc1ccccc1[C@@H]([C@@H](C)NC(=O)c1cc([N+](=O)[O-])cn1C)N(C)C ZINC000525959163 316263852 /nfs/dbraw/zinc/26/38/52/316263852.db2.gz SRQIPLZVXBMYJW-CXAGYDPISA-N 0 3 344.415 2.663 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](C)N1CCCC1 ZINC000535004184 317568571 /nfs/dbraw/zinc/56/85/71/317568571.db2.gz FKBQFZDSCBKCGS-GFCCVEGCSA-N 0 3 337.445 2.921 20 5 EFBDHN Cc1ccc([C@@H](C)NCCC(=O)Nc2ccccn2)cc1[N+](=O)[O-] ZINC000539715417 317726069 /nfs/dbraw/zinc/72/60/69/317726069.db2.gz ANYYRLXPNGFCHU-CYBMUJFWSA-N 0 3 328.372 2.978 20 5 EFBDHN COC[C@@H](NCc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])C(C)C ZINC000542526739 317815699 /nfs/dbraw/zinc/81/56/99/317815699.db2.gz PRKDPAVDRKTPTQ-LLVKDONJSA-N 0 3 348.346 2.965 20 5 EFBDHN Cc1ccc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000549152377 318167740 /nfs/dbraw/zinc/16/77/40/318167740.db2.gz QLIZKMVMWSYSJC-QGZVFWFLSA-N 0 3 330.384 2.741 20 5 EFBDHN CCc1ccc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)s1 ZINC000549193492 318168554 /nfs/dbraw/zinc/16/85/54/318168554.db2.gz KFRJQIGEOBNIBX-CYBMUJFWSA-N 0 3 336.413 2.748 20 5 EFBDHN CC1(C)c2ccccc2CCN1CCn1cc([N+](=O)[O-])ccc1=O ZINC000552663077 318260605 /nfs/dbraw/zinc/26/06/05/318260605.db2.gz BUYASTVTZYUQAA-UHFFFAOYSA-N 0 3 327.384 2.550 20 5 EFBDHN CCC1(CC)[C@H](NCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H](C)[C@@H]1OC ZINC000561466926 318604351 /nfs/dbraw/zinc/60/43/51/318604351.db2.gz ARIBFBNELKLXTK-VUCTXSBTSA-N 0 3 349.431 2.963 20 5 EFBDHN Cc1ccc2c(c1)CC[C@@H]2NC[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000563748584 318813603 /nfs/dbraw/zinc/81/36/03/318813603.db2.gz VSACKMPHKQTIBG-RDJZCZTQSA-N 0 3 342.395 2.920 20 5 EFBDHN C[C@@H](c1ccccc1)[C@H](O)CNCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000565300026 318956372 /nfs/dbraw/zinc/95/63/72/318956372.db2.gz MICMRVVSSUCYRT-YVEFUNNKSA-N 0 3 340.383 2.725 20 5 EFBDHN COC(=O)COc1ccc(CN2CC[C@@H]3CCCC[C@@H]32)cc1[N+](=O)[O-] ZINC000566247924 319052100 /nfs/dbraw/zinc/05/21/00/319052100.db2.gz BBUQZQYTFNIGLD-GJZGRUSLSA-N 0 3 348.399 2.911 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)[C@@H]2CNCc3ccccc32)cc1[N+](=O)[O-] ZINC000568390431 319279699 /nfs/dbraw/zinc/27/96/99/319279699.db2.gz MUTRUIITOKUGCE-SUMWQHHRSA-N 0 3 339.395 2.967 20 5 EFBDHN Cc1c(CNC(=O)N2CCCN(C(C)(C)C)CC2)cccc1[N+](=O)[O-] ZINC000568462049 319284765 /nfs/dbraw/zinc/28/47/65/319284765.db2.gz QTKYDOKLXUECFK-UHFFFAOYSA-N 0 3 348.447 2.919 20 5 EFBDHN Cc1ccc(C(=O)NCCN[C@@H]2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000571061354 319539233 /nfs/dbraw/zinc/53/92/33/319539233.db2.gz WFPCPYJRELDDPP-QGZVFWFLSA-N 0 3 339.395 2.910 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCC1(CS(C)(=O)=O)CCC1 ZINC000572463503 319671631 /nfs/dbraw/zinc/67/16/31/319671631.db2.gz ZHTJCFWSYBSKST-ZDUSSCGKSA-N 0 3 340.445 2.769 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCCC12CCN(C)CC2 ZINC000573107776 319734999 /nfs/dbraw/zinc/73/49/99/319734999.db2.gz FZKPDWZFRQIYAL-UHFFFAOYSA-N 0 3 331.416 2.912 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CNCc1ccc(Cl)cc1 ZINC000574429784 319862422 /nfs/dbraw/zinc/86/24/22/319862422.db2.gz RDTGOANOQYLMON-CQSZACIVSA-N 0 3 336.775 2.778 20 5 EFBDHN CCn1nc(C)c(CN[C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c1C ZINC000575127161 319927596 /nfs/dbraw/zinc/92/75/96/319927596.db2.gz WCEUNUZBLFWJLI-HZPDHXFCSA-N 0 3 346.435 2.898 20 5 EFBDHN C[C@@H](C(=O)N1[C@@H]2CC[C@H]1CCN(C)C2)c1ccc([N+](=O)[O-])cc1F ZINC000577647265 320131400 /nfs/dbraw/zinc/13/14/00/320131400.db2.gz KQANYOWVDOUROO-MBNYWOFBSA-N 0 3 335.379 2.533 20 5 EFBDHN Cn1nccc1N1CCC[C@@H](N[C@@H]2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000578247256 320188991 /nfs/dbraw/zinc/18/89/91/320188991.db2.gz PNAPVVIIEQSYJA-CZUORRHYSA-N 0 3 341.415 2.574 20 5 EFBDHN Cn1nccc1N1CCC[C@H](N[C@H]2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000578247254 320189070 /nfs/dbraw/zinc/18/90/70/320189070.db2.gz PNAPVVIIEQSYJA-BBRMVZONSA-N 0 3 341.415 2.574 20 5 EFBDHN Cc1ccc([C@H](C)NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC000182331178 323277516 /nfs/dbraw/zinc/27/75/16/323277516.db2.gz IGVUYDVNNPOHMI-YOEHRIQHSA-N 0 3 330.384 2.994 20 5 EFBDHN C[S@@](=O)C[C@H](NCCOc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000183069149 323314863 /nfs/dbraw/zinc/31/48/63/323314863.db2.gz MQPSDGHIDVHZCQ-BXKMTCNYSA-N 0 3 348.424 2.683 20 5 EFBDHN C[C@H](CN1CCCCC1)NC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000184923742 323378176 /nfs/dbraw/zinc/37/81/76/323378176.db2.gz ZLSGLFHMKIBZJB-CHWSQXEVSA-N 0 3 337.395 2.828 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000185235836 323388433 /nfs/dbraw/zinc/38/84/33/323388433.db2.gz KWWZNUAORRQJNR-GXTWGEPZSA-N 0 3 337.395 2.828 20 5 EFBDHN COC(=O)COc1ccc(CN[C@@H]2CCC[C@H](F)C2)cc1[N+](=O)[O-] ZINC000580193536 324118187 /nfs/dbraw/zinc/11/81/87/324118187.db2.gz HHVPVAFVTNKEMX-QWHCGFSZSA-N 0 3 340.351 2.517 20 5 EFBDHN O=C(CCNCc1ccc(F)c(F)c1)Nc1ccccc1[N+](=O)[O-] ZINC000580845533 324251383 /nfs/dbraw/zinc/25/13/83/324251383.db2.gz QCQIRLGRTKMZME-UHFFFAOYSA-N 0 3 335.310 2.991 20 5 EFBDHN Cn1cc([C@H]2CN(CCOc3ccccc3[N+](=O)[O-])CC2(C)C)cn1 ZINC000581407880 324369282 /nfs/dbraw/zinc/36/92/82/324369282.db2.gz NTYMSYOOKZVGRV-OAHLLOKOSA-N 0 3 344.415 2.833 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H](C)N1CCCC1 ZINC000581462530 324382175 /nfs/dbraw/zinc/38/21/75/324382175.db2.gz IRQVPSCYUBTHGZ-ZBFHGGJFSA-N 0 3 333.432 2.764 20 5 EFBDHN O=[N+]([O-])c1cncc(Br)c1NC1CCN(C2CC2)CC1 ZINC000095980546 473239879 /nfs/dbraw/zinc/23/98/79/473239879.db2.gz BAYVLYMQQFAEAZ-UHFFFAOYSA-N 0 3 341.209 2.791 20 5 EFBDHN CCOc1ccc([C@@H](C)N[C@H]2CCc3nc(C)nn3C2)cc1[N+](=O)[O-] ZINC000095982159 473241227 /nfs/dbraw/zinc/24/12/27/473241227.db2.gz XKQQNPDYCCUQJA-RISCZKNCSA-N 0 3 345.403 2.559 20 5 EFBDHN CCCCN(C)CCNC(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000112311368 473255692 /nfs/dbraw/zinc/25/56/92/473255692.db2.gz OOKUDVUAZPJJAW-UHFFFAOYSA-N 0 3 325.434 2.778 20 5 EFBDHN CN(C)Cc1ccccc1NC(=O)CNc1ccccc1[N+](=O)[O-] ZINC000144854234 473289553 /nfs/dbraw/zinc/28/95/53/473289553.db2.gz NQAOCLIYGSABLF-UHFFFAOYSA-N 0 3 328.372 2.707 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCN(CCO)CCc2ccccc2)cc1 ZINC000112698345 473296359 /nfs/dbraw/zinc/29/63/59/473296359.db2.gz CNQVGFMZCLESMS-UHFFFAOYSA-N 0 3 330.384 2.511 20 5 EFBDHN C[C@H](CNC(=O)NCCc1ccc([N+](=O)[O-])cc1)N1CCC(C)CC1 ZINC000171167719 473308663 /nfs/dbraw/zinc/30/86/63/473308663.db2.gz SWEPRSYYMWOKSH-OAHLLOKOSA-N 0 3 348.447 2.557 20 5 EFBDHN Cc1ccc(C(=O)NCCCCN2C[C@@H](C)O[C@H](C)C2)cc1[N+](=O)[O-] ZINC000083026339 473313539 /nfs/dbraw/zinc/31/35/39/473313539.db2.gz FUTDPFISTPECFV-HUUCEWRRSA-N 0 3 349.431 2.522 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2C[C@@H](C)N(C3CC3)C2)c1 ZINC000177159227 473319973 /nfs/dbraw/zinc/31/99/73/473319973.db2.gz AYZYIXVBBIJQOT-MNOVXSKESA-N 0 3 335.429 2.672 20 5 EFBDHN C[C@@H](C(=O)N1CCC[C@@H]1CN1CCCC1)c1ccc([N+](=O)[O-])cc1F ZINC000185128886 473337374 /nfs/dbraw/zinc/33/73/74/473337374.db2.gz IPKKPKPLUVNXAX-UKRRQHHQSA-N 0 3 349.406 2.924 20 5 EFBDHN CCN(Cc1ccc(Br)cc1[N+](=O)[O-])CC(C)(C)O ZINC000162456031 473341951 /nfs/dbraw/zinc/34/19/51/473341951.db2.gz ANTYIVLYRCRCRK-UHFFFAOYSA-N 0 3 331.210 2.950 20 5 EFBDHN C[C@H](C(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@@H](N)c1ccccc1 ZINC000150845209 473365601 /nfs/dbraw/zinc/36/56/01/473365601.db2.gz DUWHQDSAAKHFDK-YVEFUNNKSA-N 0 3 325.368 2.820 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H](N2CCCC2)C1 ZINC000171448053 473391406 /nfs/dbraw/zinc/39/14/06/473391406.db2.gz PVFRZGKALOVDPS-ZFWWWQNUSA-N 0 3 349.456 2.772 20 5 EFBDHN CO[C@H](CN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000338545720 476000194 /nfs/dbraw/zinc/00/01/94/476000194.db2.gz IXMFQDVAKXYRSU-NVXWUHKLSA-N 0 3 342.399 2.864 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1N1CCN(C2CCN(C)CC2)[C@@H](C)C1 ZINC000505704864 478879196 /nfs/dbraw/zinc/87/91/96/478879196.db2.gz GHUATRKUMWPOAI-HNNXBMFYSA-N 0 3 332.448 2.508 20 5 EFBDHN CO[C@]1(CNCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCOC1 ZINC000602638127 479441749 /nfs/dbraw/zinc/44/17/49/479441749.db2.gz CRTDELWBPZLOTP-ZDUSSCGKSA-N 0 3 334.294 2.509 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccccc1CN(C)C ZINC000007064809 471590705 /nfs/dbraw/zinc/59/07/05/471590705.db2.gz RZPWMWCHGBRAMU-UHFFFAOYSA-N 0 3 343.383 2.595 20 5 EFBDHN CN(C)Cc1ccccc1CNC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000009917242 471724198 /nfs/dbraw/zinc/72/41/98/471724198.db2.gz NMZOLSHAARVPCT-UHFFFAOYSA-N 0 3 327.384 2.515 20 5 EFBDHN Cc1c(C(=O)NCc2ccc(CN(C)C)cc2)cccc1[N+](=O)[O-] ZINC000015140323 471891731 /nfs/dbraw/zinc/89/17/31/471891731.db2.gz UBCWQMCXQGRCQY-UHFFFAOYSA-N 0 3 327.384 2.895 20 5 EFBDHN CNc1ccc(C(=O)NC[C@@H](c2ccccc2)N(C)C)cc1[N+](=O)[O-] ZINC000016599203 471943104 /nfs/dbraw/zinc/94/31/04/471943104.db2.gz KDJVYZOAGXPQPX-KRWDZBQOSA-N 0 3 342.399 2.669 20 5 EFBDHN Cc1cc(C(=O)NC[C@H](Cc2ccccc2)N(C)C)ccc1[N+](=O)[O-] ZINC000017794042 471964172 /nfs/dbraw/zinc/96/41/72/471964172.db2.gz GHBWYLIXBMHYPN-KRWDZBQOSA-N 0 3 341.411 2.806 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccccc1CN(C)C ZINC000067139245 471996472 /nfs/dbraw/zinc/99/64/72/471996472.db2.gz FEUQDMNIIDGXSO-UHFFFAOYSA-N 0 3 327.384 2.895 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)NCCN(C)Cc1ccccc1 ZINC000067232355 472008760 /nfs/dbraw/zinc/00/87/60/472008760.db2.gz FEBOGBOZFAXELY-UHFFFAOYSA-N 0 3 327.384 2.765 20 5 EFBDHN CCN(CC)[C@@H](CNc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccco1 ZINC000067383278 472026548 /nfs/dbraw/zinc/02/65/48/472026548.db2.gz AOBQZYPPAGCCHS-HNNXBMFYSA-N 0 3 346.387 2.782 20 5 EFBDHN CNc1ccc(C(=O)Nc2ccccc2CN(C)C)cc1[N+](=O)[O-] ZINC000024812710 472069161 /nfs/dbraw/zinc/06/91/61/472069161.db2.gz XPHDISWKZUBXLN-UHFFFAOYSA-N 0 3 328.372 2.950 20 5 EFBDHN Cc1cc(C(=O)NCCN(C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000054281586 472071531 /nfs/dbraw/zinc/07/15/31/472071531.db2.gz ANPLPDDJMAVTTL-UHFFFAOYSA-N 0 3 327.384 2.765 20 5 EFBDHN CCN(CC)[C@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]1)c1ccsc1 ZINC000042075234 472110945 /nfs/dbraw/zinc/11/09/45/472110945.db2.gz HNRIYEFRTPVSBE-CQSZACIVSA-N 0 3 336.417 2.797 20 5 EFBDHN CN(CCNC(=O)NCc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000054761051 472112816 /nfs/dbraw/zinc/11/28/16/472112816.db2.gz HDWPIKPOIJBCEO-UHFFFAOYSA-N 0 3 342.399 2.526 20 5 EFBDHN O=C(c1cc(F)ccc1[N+](=O)[O-])N1CCC[C@H]1CN1CCCCC1 ZINC000068131952 472139872 /nfs/dbraw/zinc/13/98/72/472139872.db2.gz FFEHXGLVCFFPHX-AWEZNQCLSA-N 0 3 335.379 2.824 20 5 EFBDHN COc1ccc(C(=O)N2CCC[C@H]2CN2CCCCC2)cc1[N+](=O)[O-] ZINC000068134758 472140614 /nfs/dbraw/zinc/14/06/14/472140614.db2.gz YIVNCHSTHMFSFK-HNNXBMFYSA-N 0 3 347.415 2.694 20 5 EFBDHN COc1cc(C(=O)N2CCC[C@@H]2CN2CCCCC2)ccc1[N+](=O)[O-] ZINC000075505659 472146506 /nfs/dbraw/zinc/14/65/06/472146506.db2.gz KMBSOHRZMOTLKA-OAHLLOKOSA-N 0 3 347.415 2.694 20 5 EFBDHN O=C(c1ccc([N+](=O)[O-])o1)N1C[C@@H]2CCCN2Cc2ccccc21 ZINC000075607020 472166802 /nfs/dbraw/zinc/16/68/02/472166802.db2.gz QKAWSPGWKDMCKY-ZDUSSCGKSA-N 0 3 327.340 2.813 20 5 EFBDHN O=C(c1ccc([N+](=O)[O-])o1)N1C[C@H]2CCCN2Cc2ccccc21 ZINC000075607015 472167210 /nfs/dbraw/zinc/16/72/10/472167210.db2.gz QKAWSPGWKDMCKY-CYBMUJFWSA-N 0 3 327.340 2.813 20 5 EFBDHN CN(C)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])s1)Cc1ccccc1 ZINC000027583171 472184533 /nfs/dbraw/zinc/18/45/33/472184533.db2.gz DFBHKQOARLWVOR-CYBMUJFWSA-N 0 3 333.413 2.559 20 5 EFBDHN Cc1ccc(CNCc2ccc(Cn3cncn3)cc2)cc1[N+](=O)[O-] ZINC000075756525 472193631 /nfs/dbraw/zinc/19/36/31/472193631.db2.gz JWZNLPXVIZKSPT-UHFFFAOYSA-N 0 3 337.383 2.833 20 5 EFBDHN C[C@H](CN1CCCCC1)NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000027752983 472194160 /nfs/dbraw/zinc/19/41/60/472194160.db2.gz KWYFEWKTAPXPRT-LLVKDONJSA-N 0 3 325.796 2.852 20 5 EFBDHN CC(C)N1CCCN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000068798934 472245166 /nfs/dbraw/zinc/24/51/66/472245166.db2.gz KJAQKSHQRWEGIJ-UHFFFAOYSA-N 0 3 325.796 2.805 20 5 EFBDHN CC(C)N1CCCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC1 ZINC000068801094 472246738 /nfs/dbraw/zinc/24/67/38/472246738.db2.gz MZOJCSXSCJEVSP-UHFFFAOYSA-N 0 3 346.431 2.725 20 5 EFBDHN Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H](CN1CCCC1)c1ccccc1 ZINC000029179162 472257506 /nfs/dbraw/zinc/25/75/06/472257506.db2.gz BKRRQUBTWMMEAW-MRXNPFEDSA-N 0 3 342.399 2.500 20 5 EFBDHN Cc1nn(C)c(N(C)C[C@H]2CCN(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000076065074 472257704 /nfs/dbraw/zinc/25/77/04/472257704.db2.gz UDYBDWJUSMKPGW-MRXNPFEDSA-N 0 3 343.431 2.595 20 5 EFBDHN CCN1CCN(c2ccc(Nc3c([N+](=O)[O-])ncn3C)c(C)c2)CC1 ZINC000029842919 472298773 /nfs/dbraw/zinc/29/87/73/472298773.db2.gz FPKYPZIBWZFDPC-UHFFFAOYSA-N 0 3 344.419 2.522 20 5 EFBDHN CC(C)(CNC(=O)NCc1ccc([N+](=O)[O-])cc1)N1CCCCC1 ZINC000056465503 472324105 /nfs/dbraw/zinc/32/41/05/472324105.db2.gz NSQVVRVJKITLAE-UHFFFAOYSA-N 0 3 334.420 2.659 20 5 EFBDHN C[C@H](CN1CCC[C@H](C)C1)NC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000056786855 472351404 /nfs/dbraw/zinc/35/14/04/472351404.db2.gz YTLXWRKEWCMIQA-UONOGXRCSA-N 0 3 334.420 2.514 20 5 EFBDHN C[C@H](CN1CCC[C@H](C)C1)NC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000056787829 472351664 /nfs/dbraw/zinc/35/16/64/472351664.db2.gz DOGNFRHJNUSRNZ-LSDHHAIUSA-N 0 3 348.447 2.857 20 5 EFBDHN CN(C)CCN(Cc1ccco1)C(=O)/C=C/c1cccc([N+](=O)[O-])c1 ZINC000088250678 472352550 /nfs/dbraw/zinc/35/25/50/472352550.db2.gz YEOOABIUAPVDOD-CMDGGOBGSA-N 0 3 343.383 2.791 20 5 EFBDHN C[C@H](CN1CCCCC1)NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000031229907 472368077 /nfs/dbraw/zinc/36/80/77/472368077.db2.gz JIFFBMRCNMBEJR-CYBMUJFWSA-N 0 3 346.431 2.773 20 5 EFBDHN CN(C)Cc1ccccc1NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000031231184 472368444 /nfs/dbraw/zinc/36/84/44/472368444.db2.gz UKMRAAJHSOAJAI-UHFFFAOYSA-N 0 3 329.356 2.674 20 5 EFBDHN O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CC[C@H](N2CCCCC2)C1 ZINC000076694167 472385741 /nfs/dbraw/zinc/38/57/41/472385741.db2.gz VXERQBNWPUCWBH-ZDUSSCGKSA-N 0 3 337.807 2.949 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)CN([C@H](C)C1CC1)C1CC1 ZINC000031654275 472386378 /nfs/dbraw/zinc/38/63/78/472386378.db2.gz NLDPXCVYDDZPBT-LLVKDONJSA-N 0 3 333.388 2.805 20 5 EFBDHN CN(C)CCNC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000154218391 472403248 /nfs/dbraw/zinc/40/32/48/472403248.db2.gz KEKLDKYXDVLGCD-UHFFFAOYSA-N 0 3 337.445 2.921 20 5 EFBDHN COc1cc(CN[C@H](CO)[C@@H](C)c2ccccc2)c([N+](=O)[O-])cc1F ZINC000613389998 479985854 /nfs/dbraw/zinc/98/58/54/479985854.db2.gz PNAFICCZFIYTSS-BLLLJJGKSA-N 0 3 348.374 2.997 20 5 EFBDHN C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000077140399 472458345 /nfs/dbraw/zinc/45/83/45/472458345.db2.gz UCUXREDVWAYJNL-AWEZNQCLSA-N 0 3 342.399 2.660 20 5 EFBDHN CCc1ccc([C@@H](CNC(=O)c2cc([N+](=O)[O-])cn2C)N(C)C)cc1 ZINC000032734195 472461215 /nfs/dbraw/zinc/46/12/15/472461215.db2.gz AHIGRWGCQUZYPT-QGZVFWFLSA-N 0 3 344.415 2.528 20 5 EFBDHN CCN(Cc1ccccc1)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000032758302 472463753 /nfs/dbraw/zinc/46/37/53/472463753.db2.gz SKNNAUZSTLXCNR-KRWDZBQOSA-N 0 3 330.384 2.857 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC[C@@H]1C[C@@H](O)CN1Cc1ccccc1 ZINC000089643952 472475873 /nfs/dbraw/zinc/47/58/73/472475873.db2.gz QOEUEVYLKMTLPS-ZWKOTPCHSA-N 0 3 341.411 2.951 20 5 EFBDHN Cc1ccc([C@@H](CNc2c([N+](=O)[O-])ncn2C)N2CCCC2)cc1 ZINC000057829767 472481245 /nfs/dbraw/zinc/48/12/45/472481245.db2.gz PDNCEWDHPMHFNY-OAHLLOKOSA-N 0 3 329.404 2.886 20 5 EFBDHN CN(C)Cc1cccc(CNC(=O)/C=C/c2cccc([N+](=O)[O-])c2)c1 ZINC000033083801 472495726 /nfs/dbraw/zinc/49/57/26/472495726.db2.gz WOBKQBGBMURKTC-MDZDMXLPSA-N 0 3 339.395 2.986 20 5 EFBDHN CNc1ccc(C(=O)NCc2cccc(CN(C)C)c2)cc1[N+](=O)[O-] ZINC000033084217 472496051 /nfs/dbraw/zinc/49/60/51/472496051.db2.gz NBIMRFZDUQEVTL-UHFFFAOYSA-N 0 3 342.399 2.628 20 5 EFBDHN Cc1c([C@@H](C)NCc2cccc(OCC(N)=O)c2)cccc1[N+](=O)[O-] ZINC000128855667 472504988 /nfs/dbraw/zinc/50/49/88/472504988.db2.gz OHBOWIXAWIAGJB-CYBMUJFWSA-N 0 3 343.383 2.618 20 5 EFBDHN C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)CCN1CCCC1 ZINC000089899840 472540028 /nfs/dbraw/zinc/54/00/28/472540028.db2.gz INIONGAWPMXIKT-CYBMUJFWSA-N 0 3 345.403 2.733 20 5 EFBDHN C[C@]1(CNCc2cc3c(cc2[N+](=O)[O-])OCCO3)CCO[C@@H]1C1CC1 ZINC000613426160 479994977 /nfs/dbraw/zinc/99/49/77/479994977.db2.gz SVQOHEZTRKRCBV-QZTJIDSGSA-N 0 3 348.399 2.661 20 5 EFBDHN C[C@@H](CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-])N1CCC[C@H](C)C1 ZINC000046365913 472548050 /nfs/dbraw/zinc/54/80/50/472548050.db2.gz UFVLEKFZAGSIAF-GJZGRUSLSA-N 0 3 348.447 2.857 20 5 EFBDHN C[C@@]1(CNCc2cc3c(cc2[N+](=O)[O-])OCCO3)CCO[C@H]1C1CC1 ZINC000613426163 479995793 /nfs/dbraw/zinc/99/57/93/479995793.db2.gz SVQOHEZTRKRCBV-ROUUACIJSA-N 0 3 348.399 2.661 20 5 EFBDHN C[C@H](NCCC(=O)Nc1cc([N+](=O)[O-])ccc1F)c1ccccn1 ZINC000130186235 472588155 /nfs/dbraw/zinc/58/81/55/472588155.db2.gz GZQVZNAMKFJGJP-NSHDSACASA-N 0 3 332.335 2.808 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCN(CCCc3ccccc3)CC2)cn1 ZINC000046778039 472598541 /nfs/dbraw/zinc/59/85/41/472598541.db2.gz CDYKSDWMCTZXSK-UHFFFAOYSA-N 0 3 326.400 2.745 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCCN(CCO)Cc2ccccc2)cc1 ZINC000103140209 472612928 /nfs/dbraw/zinc/61/29/28/472612928.db2.gz UGRXYTNIOANKCY-UHFFFAOYSA-N 0 3 330.384 2.858 20 5 EFBDHN CN(CCN1CCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000103175607 472615674 /nfs/dbraw/zinc/61/56/74/472615674.db2.gz CLOXQXVHDDEJBB-UHFFFAOYSA-N 0 3 326.784 2.808 20 5 EFBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CN2CCN(CC3CC3)CC2)c1 ZINC000130687516 472622100 /nfs/dbraw/zinc/62/21/00/472622100.db2.gz RLGXAFIQXLFMHO-UHFFFAOYSA-N 0 3 341.358 2.724 20 5 EFBDHN CCN1CCC(NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000120104534 472631691 /nfs/dbraw/zinc/63/16/91/472631691.db2.gz DVUBYPFRQXPZQC-UHFFFAOYSA-N 0 3 346.431 2.753 20 5 EFBDHN C[C@@H]1CN(CCn2cc([N+](=O)[O-])ccc2=O)CC[C@@H]1c1ccccc1 ZINC000090550747 472633599 /nfs/dbraw/zinc/63/35/99/472633599.db2.gz MJSQNKNSHXRRLP-QAPCUYQASA-N 0 3 341.411 2.882 20 5 EFBDHN C[C@H]1C[C@H](c2cccc(F)c2)N(CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000090550816 472633750 /nfs/dbraw/zinc/63/37/50/472633750.db2.gz DZVIKGWUYNTIDO-SUMWQHHRSA-N 0 3 345.374 2.979 20 5 EFBDHN C[C@@H]1CN(CC2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)C[C@@H](C)O1 ZINC000060368498 472648459 /nfs/dbraw/zinc/64/84/59/472648459.db2.gz VRJSEEURAVPPPU-HZPDHXFCSA-N 0 3 347.459 2.916 20 5 EFBDHN Cc1ccc(CN(CCN(C)C)C(=O)c2cccc([N+](=O)[O-])c2)o1 ZINC000060407259 472653561 /nfs/dbraw/zinc/65/35/61/472653561.db2.gz UYSQBBVKSILIMI-UHFFFAOYSA-N 0 3 331.372 2.700 20 5 EFBDHN CCN(CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)[C@H](C)C(C)C ZINC000120239246 472655142 /nfs/dbraw/zinc/65/51/42/472655142.db2.gz WCSKASNQMXPLFO-LLVKDONJSA-N 0 3 337.376 2.628 20 5 EFBDHN C[C@@H]1C[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])c3cccnc23)CCN1C ZINC000156036592 472658600 /nfs/dbraw/zinc/65/86/00/472658600.db2.gz SBIOYGJSWGXHGL-CHWSQXEVSA-N 0 3 342.399 2.698 20 5 EFBDHN C[C@@H]1CCCN(CCNC(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000047145595 472661338 /nfs/dbraw/zinc/66/13/38/472661338.db2.gz CFVFQXUPRVDELY-LLVKDONJSA-N 0 3 325.796 2.710 20 5 EFBDHN C[C@@H]1CCCN(CCNC(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000047146266 472661675 /nfs/dbraw/zinc/66/16/75/472661675.db2.gz BUSUYDYDOMBXOE-CYBMUJFWSA-N 0 3 337.445 2.535 20 5 EFBDHN C[C@@H](NCc1ccnc(OCCN(C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000090937014 472665597 /nfs/dbraw/zinc/66/55/97/472665597.db2.gz VHGKGMHTANPSCO-CQSZACIVSA-N 0 3 344.415 2.781 20 5 EFBDHN CN(C)C[C@H]1CCCCN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000104412410 472670457 /nfs/dbraw/zinc/67/04/57/472670457.db2.gz FYYNABXVMLNBOF-OAHLLOKOSA-N 0 3 346.431 2.725 20 5 EFBDHN CN(CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C[C@@H]1CCCO1 ZINC000104683387 472684613 /nfs/dbraw/zinc/68/46/13/472684613.db2.gz CGJLDKAEKGRHMB-HNNXBMFYSA-N 0 3 331.372 2.903 20 5 EFBDHN CN(C)CCN(Cc1ccccc1)C(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000078429063 472714248 /nfs/dbraw/zinc/71/42/48/472714248.db2.gz MKFZEONNOCOKEZ-UHFFFAOYSA-N 0 3 341.411 2.728 20 5 EFBDHN O=[N+]([O-])c1ccc(CCN2CCC(OC[C@H]3CCOC3)CC2)cc1 ZINC000132179240 472718830 /nfs/dbraw/zinc/71/88/30/472718830.db2.gz OFDBWDHUWOCYDE-INIZCTEOSA-N 0 3 334.416 2.655 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCCN[C@@]2(CO)CCc3ccccc32)cc1 ZINC000132524372 472739555 /nfs/dbraw/zinc/73/95/55/472739555.db2.gz OHGYHZMPYFHIIZ-LJQANCHMSA-N 0 3 342.395 2.787 20 5 EFBDHN COc1cc(CNC[C@@H](C)Cn2ccnc2C)c([N+](=O)[O-])cc1OC ZINC000105442947 472752219 /nfs/dbraw/zinc/75/22/19/472752219.db2.gz AZRKSHFSLNFBMA-GFCCVEGCSA-N 0 3 348.403 2.543 20 5 EFBDHN C[C@@H]1CN(CC2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C[C@H](C)O1 ZINC000091478884 472771252 /nfs/dbraw/zinc/77/12/52/472771252.db2.gz VZINTOXJBNXSKZ-GASCZTMLSA-N 0 3 333.432 2.920 20 5 EFBDHN CN(Cc1ccc(Br)c([N+](=O)[O-])c1)C[C@@H]1CCC[C@@H]1O ZINC000091899062 472823285 /nfs/dbraw/zinc/82/32/85/472823285.db2.gz CGCLJSKNKYQSLR-FZMZJTMJSA-N 0 3 343.221 2.950 20 5 EFBDHN COC[C@H](NCc1ccc(Br)c([N+](=O)[O-])c1)C1CC1 ZINC000121361452 472842253 /nfs/dbraw/zinc/84/22/53/472842253.db2.gz IOCTUOHFJLQCRC-LBPRGKRZSA-N 0 3 329.194 2.872 20 5 EFBDHN COc1ccc(NC(=O)CN(C2CC2)C2CCCC2)c([N+](=O)[O-])c1 ZINC000064808015 472878573 /nfs/dbraw/zinc/87/85/73/472878573.db2.gz LOJIRNIFYSLINI-UHFFFAOYSA-N 0 3 333.388 2.949 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)CN(C1CC1)C1CCCC1 ZINC000064808027 472878775 /nfs/dbraw/zinc/87/87/75/472878775.db2.gz WMUGSFLKTNPKON-UHFFFAOYSA-N 0 3 333.388 2.949 20 5 EFBDHN C[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)CCN1Cc1ccccc1 ZINC000079553992 472885287 /nfs/dbraw/zinc/88/52/87/472885287.db2.gz WVHFTCFDAAJSHB-HIFRSBDPSA-N 0 3 342.399 2.706 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CCCCC[C@@H]2C[C@@H](O)c2ccco2)n1 ZINC000121841840 472928096 /nfs/dbraw/zinc/92/80/96/472928096.db2.gz PKLIWKHQQAJDEI-HUUCEWRRSA-N 0 3 348.403 2.753 20 5 EFBDHN Cc1nn(C)c(NCC(C)(C)N2CCc3ccccc3C2)c1[N+](=O)[O-] ZINC000079871873 472934273 /nfs/dbraw/zinc/93/42/73/472934273.db2.gz IYRTUSAKTPITHG-UHFFFAOYSA-N 0 3 343.431 2.886 20 5 EFBDHN Cc1cc(NC[C@@H](O)CN2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000079872514 472934640 /nfs/dbraw/zinc/93/46/40/472934640.db2.gz XZSUEAGLKOQFLQ-GOSISDBHSA-N 0 3 341.411 2.734 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)N(CCN(C)C)Cc1ccccn1 ZINC000107262594 472936084 /nfs/dbraw/zinc/93/60/84/472936084.db2.gz JJWIKACJJRFHRR-UHFFFAOYSA-N 0 3 342.399 2.502 20 5 EFBDHN CC(C)CN(C(=O)COc1ccc([N+](=O)[O-])cc1)C1CCN(C)CC1 ZINC000074139380 472948988 /nfs/dbraw/zinc/94/89/88/472948988.db2.gz VWWGLNAJLPXRBY-UHFFFAOYSA-N 0 3 349.431 2.552 20 5 EFBDHN CC(C)CN(C(=O)Cc1ccc([N+](=O)[O-])cc1)C1CCN(C)CC1 ZINC000074139414 472949027 /nfs/dbraw/zinc/94/90/27/472949027.db2.gz WYNRTFUEHABRNZ-UHFFFAOYSA-N 0 3 333.432 2.716 20 5 EFBDHN C[C@@H](CN1CCCCC1)NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000079985112 472953863 /nfs/dbraw/zinc/95/38/63/472953863.db2.gz XHPIRSVEHAEHAI-KBPBESRZSA-N 0 3 334.420 2.829 20 5 EFBDHN CC(C)[C@H]1CN(C)CCN1c1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000092656374 472954936 /nfs/dbraw/zinc/95/49/36/472954936.db2.gz HKIKILCLYSEBIO-CYBMUJFWSA-N 0 3 329.347 2.973 20 5 EFBDHN Cn1nccc1[C@H]1CCCN(CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000065535661 472969735 /nfs/dbraw/zinc/96/97/35/472969735.db2.gz JWSDXMYOPYIBIY-AWEZNQCLSA-N 0 3 330.388 2.587 20 5 EFBDHN CC(C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)C(F)(F)F ZINC000074238418 472970028 /nfs/dbraw/zinc/97/00/28/472970028.db2.gz COAMWZCUGCLYOL-ZETCQYMHSA-N 0 3 334.250 2.893 20 5 EFBDHN CCCNC(=O)[C@H]1CCCN(C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000092733856 472973327 /nfs/dbraw/zinc/97/33/27/472973327.db2.gz UKYABIPMSAQKHH-WHWKNOJMSA-N 0 3 331.416 2.846 20 5 EFBDHN O=C(N[C@@H]1CCN(C2CCCC2)C1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000134865817 472978322 /nfs/dbraw/zinc/97/83/22/472978322.db2.gz MNNUZQGVTNNEJN-CYBMUJFWSA-N 0 3 337.807 2.995 20 5 EFBDHN CN(Cc1ccccc1)C[C@H](O)CSc1ccc([N+](=O)[O-])cn1 ZINC000159192638 473007193 /nfs/dbraw/zinc/00/71/93/473007193.db2.gz NDGSOFDBWYRWRD-HNNXBMFYSA-N 0 3 333.413 2.575 20 5 EFBDHN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1CCN(CC2CC2)C1 ZINC000108432018 473026777 /nfs/dbraw/zinc/02/67/77/473026777.db2.gz LGDZFEOBMQJNFV-LLVKDONJSA-N 0 3 338.795 2.854 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1NCc1ccnc(OCCN(C)C)c1 ZINC000135375467 473064321 /nfs/dbraw/zinc/06/43/21/473064321.db2.gz ABGGXVHSQTTXLY-UHFFFAOYSA-N 0 3 330.388 2.851 20 5 EFBDHN COc1cc(NCc2ccnc(OCCN(C)C)c2)ccc1[N+](=O)[O-] ZINC000135384949 473064685 /nfs/dbraw/zinc/06/46/85/473064685.db2.gz UDWOUZSJIIZXSE-UHFFFAOYSA-N 0 3 346.387 2.551 20 5 EFBDHN CCc1cc(N(C)CCN(C)C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000080684913 473069499 /nfs/dbraw/zinc/06/94/99/473069499.db2.gz ZFGRMRDJUYGCNX-UHFFFAOYSA-N 0 3 329.404 2.612 20 5 EFBDHN COc1ccc(OCCN2CCC[C@H]2CSC)c([N+](=O)[O-])c1 ZINC000135449429 473074765 /nfs/dbraw/zinc/07/47/65/473074765.db2.gz FDCPQKGHDJZUIO-LBPRGKRZSA-N 0 3 326.418 2.810 20 5 EFBDHN C[C@@H]1CN(C[C@@H]2CCCN2Cc2cccc([N+](=O)[O-])c2)C[C@@H](C)O1 ZINC000066377616 473084439 /nfs/dbraw/zinc/08/44/39/473084439.db2.gz GKKAZPXVMQDRIG-RKVPGOIHSA-N 0 3 333.432 2.668 20 5 EFBDHN C[C@@H]1CN(C[C@@H]2CCCN2CCc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000066377611 473084764 /nfs/dbraw/zinc/08/47/64/473084764.db2.gz WHQCLXPZWFAFCB-FCEWJHQRSA-N 0 3 347.459 2.711 20 5 EFBDHN C[C@@H]1CN(C[C@@H]2CCCN2Cc2cccc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000066377614 473085034 /nfs/dbraw/zinc/08/50/34/473085034.db2.gz GKKAZPXVMQDRIG-DAYGRLMNSA-N 0 3 333.432 2.668 20 5 EFBDHN Cc1cc(C(=O)NCc2ccc(CN(C)C)cc2)cc([N+](=O)[O-])c1 ZINC000123080584 473095661 /nfs/dbraw/zinc/09/56/61/473095661.db2.gz AVUWXUNACJCRKH-UHFFFAOYSA-N 0 3 327.384 2.895 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H](C)CN1CCCCC1 ZINC000123130587 473102292 /nfs/dbraw/zinc/10/22/92/473102292.db2.gz MSRLKFCYZYHUSL-LBPRGKRZSA-N 0 3 336.392 2.599 20 5 EFBDHN COc1ccc(-c2ccc(CNCC(C)(C)CO)o2)c([N+](=O)[O-])c1 ZINC000136084728 473134179 /nfs/dbraw/zinc/13/41/79/473134179.db2.gz HYCQUGPYRWBEFF-UHFFFAOYSA-N 0 3 334.372 2.972 20 5 EFBDHN CN(Cc1ccccc1)[C@@H]1CCN(C(=O)c2ccccc2[N+](=O)[O-])C1 ZINC000081124984 473151647 /nfs/dbraw/zinc/15/16/47/473151647.db2.gz QOVLQMKGSXRRGP-MRXNPFEDSA-N 0 3 339.395 2.941 20 5 EFBDHN C[C@@H]1C[C@H](Nc2ncc([N+](=O)[O-])cc2Br)CCN1C ZINC000094007923 473167366 /nfs/dbraw/zinc/16/73/66/473167366.db2.gz RQYRVQVSIAMTQP-RKDXNWHRSA-N 0 3 329.198 2.647 20 5 EFBDHN COc1cc(C[NH2+][C@H]2CCOC3(CCCC3)C2)c([N+](=O)[O-])cc1[O-] ZINC000136702502 473172731 /nfs/dbraw/zinc/17/27/31/473172731.db2.gz LEBHJNRPDBQWCB-ZDUSSCGKSA-N 0 3 336.388 2.890 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@H]1CCN(CC2CC2)C1 ZINC000094125259 473178889 /nfs/dbraw/zinc/17/88/89/473178889.db2.gz NJILKMVRKRJQSF-HNNXBMFYSA-N 0 3 331.416 2.734 20 5 EFBDHN CCOc1ccc(C(=O)N2CCCC[C@@H]2CN(C)C)cc1[N+](=O)[O-] ZINC000066948232 473183178 /nfs/dbraw/zinc/18/31/78/473183178.db2.gz RRLKEYKMCJQYGY-CQSZACIVSA-N 0 3 335.404 2.550 20 5 EFBDHN O=C1CC[C@@H]2CN(CCc3ccc([N+](=O)[O-])cc3)CC[C@@H]2N1C1CC1 ZINC000125382883 473402001 /nfs/dbraw/zinc/40/20/01/473402001.db2.gz RUHKNSIRJNKLDX-QAPCUYQASA-N 0 3 343.427 2.613 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCN2CCN(C3CCCCC3)CC2)c1 ZINC000163016628 473406323 /nfs/dbraw/zinc/40/63/23/473406323.db2.gz LGVPKOCJLHNUKM-UHFFFAOYSA-N 0 3 333.432 2.924 20 5 EFBDHN CCc1ccc(C(=O)N2[C@@H]3CC[C@H]2CN(CC)CC3)cc1[N+](=O)[O-] ZINC000177762082 473430032 /nfs/dbraw/zinc/43/00/32/473430032.db2.gz YMFBOICUOKEMRO-CVEARBPZSA-N 0 3 331.416 2.856 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000177800302 473438094 /nfs/dbraw/zinc/43/80/94/473438094.db2.gz WYJMHNYRYFSPPD-YPMHNXCESA-N 0 3 337.807 2.947 20 5 EFBDHN COc1cccc(NCc2ccnc(OCCN(C)C)c2)c1[N+](=O)[O-] ZINC000185647772 473477257 /nfs/dbraw/zinc/47/72/57/473477257.db2.gz SFIVICQXZNZAAM-UHFFFAOYSA-N 0 3 346.387 2.551 20 5 EFBDHN COc1cc(CNC[C@](C)(O)c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000114508294 473477254 /nfs/dbraw/zinc/47/72/54/473477254.db2.gz LRGWVZDFRYGPHW-SFHVURJKSA-N 0 3 346.383 2.609 20 5 EFBDHN O=C(NC[C@H]1CCCN1Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000114643907 473488867 /nfs/dbraw/zinc/48/88/67/473488867.db2.gz NJRIBBBHMLKYSQ-GOSISDBHSA-N 0 3 339.395 2.989 20 5 EFBDHN O=[N+]([O-])c1ccccc1CNC1CCC(O)(c2cccnc2)CC1 ZINC000185693127 473490036 /nfs/dbraw/zinc/49/00/36/473490036.db2.gz IYZNOBXMKRFSJR-UHFFFAOYSA-N 0 3 327.384 2.910 20 5 EFBDHN CC[C@H](NC[C@@H]1CN(CC(C)C)CCO1)c1cccc([N+](=O)[O-])c1 ZINC000178331134 473492595 /nfs/dbraw/zinc/49/25/95/473492595.db2.gz PCUDECDIVNUQEI-MSOLQXFVSA-N 0 3 335.448 2.992 20 5 EFBDHN Cc1c(Br)c(NC[C@@H]2CCCN(C)C2)ncc1[N+](=O)[O-] ZINC000165749894 473515811 /nfs/dbraw/zinc/51/58/11/473515811.db2.gz NAOIZQAFRZYHQA-JTQLQIEISA-N 0 3 343.225 2.814 20 5 EFBDHN CN(C[C@@H]1CCCN(C)C1)C(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000115442287 473569757 /nfs/dbraw/zinc/56/97/57/473569757.db2.gz UAYFWHQAJMOHPT-LLVKDONJSA-N 0 3 325.796 2.662 20 5 EFBDHN CN(C[C@H]1CCCN(C)C1)C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000115442277 473570022 /nfs/dbraw/zinc/57/00/22/473570022.db2.gz OOUVFDBLCHRDBQ-NSHDSACASA-N 0 3 325.796 2.662 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N(C)C[C@H]2CCCN(C)C2)c1 ZINC000115440551 473570748 /nfs/dbraw/zinc/57/07/48/473570748.db2.gz QBDLPUZBSPQTDR-LBPRGKRZSA-N 0 3 337.445 2.731 20 5 EFBDHN CN(C[C@@H]1CCCN(C)C1)C(=O)/C=C/c1ccc(F)cc1[N+](=O)[O-] ZINC000115439912 473571160 /nfs/dbraw/zinc/57/11/60/473571160.db2.gz WQRMXQNVQIRNRO-STMXVASLSA-N 0 3 335.379 2.547 20 5 EFBDHN C[C@@H](O)CN(CC(=O)Nc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000170691614 473589144 /nfs/dbraw/zinc/58/91/44/473589144.db2.gz XPIIBIGKEXYNEC-CYBMUJFWSA-N 0 3 335.404 2.549 20 5 EFBDHN Cc1cc(C(=O)N2CCCN(C3CCCC3)CC2)cc([N+](=O)[O-])c1 ZINC000172415798 473604634 /nfs/dbraw/zinc/60/46/34/473604634.db2.gz VRFARQMSRRIBNP-UHFFFAOYSA-N 0 3 331.416 2.994 20 5 EFBDHN COc1ccc(C(=O)N2CCCN(C3CCCC3)CC2)cc1[N+](=O)[O-] ZINC000172421080 473606656 /nfs/dbraw/zinc/60/66/56/473606656.db2.gz ZTCJCUIMENKRSM-UHFFFAOYSA-N 0 3 347.415 2.694 20 5 EFBDHN O=C1C[C@H](CNCc2ccccc2[N+](=O)[O-])CN1Cc1ccccc1 ZINC000179050882 473618542 /nfs/dbraw/zinc/61/85/42/473618542.db2.gz MHFFHCRGTKVTSX-MRXNPFEDSA-N 0 3 339.395 2.733 20 5 EFBDHN CN1CCC[C@@H](CNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000172489001 473623332 /nfs/dbraw/zinc/62/33/32/473623332.db2.gz HVJAMEWYSRRENM-INIZCTEOSA-N 0 3 348.447 2.559 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@H](CCO)CSC)cc1[N+](=O)[O-] ZINC000153940802 473652777 /nfs/dbraw/zinc/65/27/77/473652777.db2.gz WAWKJYWDRKUKDI-WCQYABFASA-N 0 3 328.434 2.758 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@@H](CCO)CSC)cc1[N+](=O)[O-] ZINC000153940639 473652928 /nfs/dbraw/zinc/65/29/28/473652928.db2.gz WAWKJYWDRKUKDI-AAEUAGOBSA-N 0 3 328.434 2.758 20 5 EFBDHN Cc1c(OC[C@@H](O)CN(C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000154025777 473660754 /nfs/dbraw/zinc/66/07/54/473660754.db2.gz ZSMBVZUORZIZHU-INIZCTEOSA-N 0 3 330.384 2.775 20 5 EFBDHN Cc1ccc(CN2CCC[C@@H](C(=O)NCC3CC3)C2)cc1[N+](=O)[O-] ZINC000179341740 473677073 /nfs/dbraw/zinc/67/70/73/473677073.db2.gz CQEOXERKUPCGRG-MRXNPFEDSA-N 0 3 331.416 2.641 20 5 EFBDHN CCn1nc(C)c([N+](=O)[O-])c1NC[C@H](c1ccc(F)cc1)N(C)C ZINC000192513926 473687345 /nfs/dbraw/zinc/68/73/45/473687345.db2.gz ITTFGCMCOUKGPS-CQSZACIVSA-N 0 3 335.383 2.974 20 5 EFBDHN CCCN1CCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000179495093 473691237 /nfs/dbraw/zinc/69/12/37/473691237.db2.gz BXRLRNHOVRAGMG-UHFFFAOYSA-N 0 3 343.431 2.523 20 5 EFBDHN CC(C)CN1CCO[C@H](CN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000192610922 473696301 /nfs/dbraw/zinc/69/63/01/473696301.db2.gz PKWKVCIVIAJYOG-IEBWSBKVSA-N 0 3 347.459 2.919 20 5 EFBDHN CC1(C)CCC[C@@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000186607531 473698311 /nfs/dbraw/zinc/69/83/11/473698311.db2.gz ORJKSXWRRIWJNJ-AWEZNQCLSA-N 0 3 326.418 2.537 20 5 EFBDHN O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)C1CCN(C2CC2)CC1 ZINC000192692416 473706125 /nfs/dbraw/zinc/70/61/25/473706125.db2.gz RGJRVKSONGUBEM-UHFFFAOYSA-N 0 3 340.383 2.956 20 5 EFBDHN CC(C)(C(=O)NC[C@H](N)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000269173560 473718316 /nfs/dbraw/zinc/71/83/16/473718316.db2.gz KMDVYJCIMKTODF-INIZCTEOSA-N 0 3 327.384 2.689 20 5 EFBDHN CN(C)[C@@H]1CCCN(C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000173015181 473727082 /nfs/dbraw/zinc/72/70/82/473727082.db2.gz BNFJMJWCAKYRNX-LLVKDONJSA-N 0 3 345.321 2.780 20 5 EFBDHN CNC(=O)C1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000179823533 473735473 /nfs/dbraw/zinc/73/54/73/473735473.db2.gz RFQCAVDOWWHOSD-UHFFFAOYSA-N 0 3 343.383 2.813 20 5 EFBDHN CN1CCC[C@H](CNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000173138334 473753835 /nfs/dbraw/zinc/75/38/35/473753835.db2.gz BKYINNRLGNMZGJ-SNVBAGLBSA-N 0 3 345.321 2.685 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCN1CCC(c2ccsc2)CC1 ZINC000186928763 473782950 /nfs/dbraw/zinc/78/29/50/473782950.db2.gz ATROEEHELRIXEG-UHFFFAOYSA-N 0 3 333.413 2.698 20 5 EFBDHN CN1CCC(N(Cc2ccco2)C(=O)c2csc([N+](=O)[O-])c2)CC1 ZINC000193389105 473785605 /nfs/dbraw/zinc/78/56/05/473785605.db2.gz KEMZCGXZBBSGIP-UHFFFAOYSA-N 0 3 349.412 2.986 20 5 EFBDHN CC(C)N(CCN(C)C)c1ncc([N+](=O)[O-])cc1Br ZINC000274380511 473801237 /nfs/dbraw/zinc/80/12/37/473801237.db2.gz SNGPLMQQHIFGTE-UHFFFAOYSA-N 0 3 331.214 2.529 20 5 EFBDHN CC(C)c1[nH]nc(C(=O)Nc2ccc(CN(C)C)cc2)c1[N+](=O)[O-] ZINC000269419634 473806375 /nfs/dbraw/zinc/80/63/75/473806375.db2.gz XDXCHAYACAFNCX-UHFFFAOYSA-N 0 3 331.376 2.755 20 5 EFBDHN CC(C)N1CCC[C@H](NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000274415421 473813056 /nfs/dbraw/zinc/81/30/56/473813056.db2.gz CPDDRJIKCAWFIF-LBPRGKRZSA-N 0 3 325.796 2.851 20 5 EFBDHN C[C@@H](NC[C@H](O)COCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000173382984 473820815 /nfs/dbraw/zinc/82/08/15/473820815.db2.gz XNEIQMOCCVGWML-KDOFPFPSSA-N 0 3 330.384 2.823 20 5 EFBDHN C[C@H](NCCNC(=O)c1c(F)cccc1F)c1cccc([N+](=O)[O-])c1 ZINC000173410772 473830259 /nfs/dbraw/zinc/83/02/59/473830259.db2.gz NXWHIGQKSMMIDY-NSHDSACASA-N 0 3 349.337 2.954 20 5 EFBDHN CCn1c(C)nc([N+](=O)[O-])c1N[C@H]1CCN(Cc2ccccc2)C1 ZINC000288041657 473832109 /nfs/dbraw/zinc/83/21/09/473832109.db2.gz DLQMMJWXINAXPR-HNNXBMFYSA-N 0 3 329.404 2.806 20 5 EFBDHN CN1C[C@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1=O ZINC000263754281 473834656 /nfs/dbraw/zinc/83/46/56/473834656.db2.gz PVBFFASXMUIBBC-GFCCVEGCSA-N 0 3 331.397 2.644 20 5 EFBDHN COCCCN1CCC(Nc2ccc(C(C)=O)cc2[N+](=O)[O-])CC1 ZINC000263776760 473844692 /nfs/dbraw/zinc/84/46/92/473844692.db2.gz KXIQWAOLNQUIHJ-UHFFFAOYSA-N 0 3 335.404 2.710 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)C1CCN(C)CC1 ZINC000194118504 473845830 /nfs/dbraw/zinc/84/58/30/473845830.db2.gz JVGOFCVHWIUYMC-LBPRGKRZSA-N 0 3 337.445 2.628 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN(CCCO)Cc2ccccc2)c1 ZINC000269631470 473848353 /nfs/dbraw/zinc/84/83/53/473848353.db2.gz FPPCRJYEHVGWQS-GOSISDBHSA-N 0 3 330.384 2.513 20 5 EFBDHN CC(C)N(CCN(C)C)C(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000269684448 473860385 /nfs/dbraw/zinc/86/03/85/473860385.db2.gz NIQHEPQYFHSLKZ-UHFFFAOYSA-N 0 3 342.827 2.730 20 5 EFBDHN C[C@H](NC[C@H](O)COc1ccccc1F)c1cccc([N+](=O)[O-])c1 ZINC000180393110 473866411 /nfs/dbraw/zinc/86/64/11/473866411.db2.gz AFGAAVKLGMIZLN-WFASDCNBSA-N 0 3 334.347 2.824 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@H]2CCN(C)C[C@H]21 ZINC000281880959 473869823 /nfs/dbraw/zinc/86/98/23/473869823.db2.gz GFTWLGNJWDVLDS-SWLSCSKDSA-N 0 3 348.403 2.551 20 5 EFBDHN Cc1nn(C)c(N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)c1[N+](=O)[O-] ZINC000288208583 473876204 /nfs/dbraw/zinc/87/62/04/473876204.db2.gz LKLYFIUVSHQXPC-UKRRQHHQSA-N 0 3 329.404 2.712 20 5 EFBDHN Cc1ccccc1OC[C@H](O)CN[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180435935 473876511 /nfs/dbraw/zinc/87/65/11/473876511.db2.gz KIFOWHMDYUPPDD-RHSMWYFYSA-N 0 3 330.384 2.994 20 5 EFBDHN C[C@H](NC[C@H](O)COCc1cccs1)c1cccc([N+](=O)[O-])c1 ZINC000180435974 473877013 /nfs/dbraw/zinc/87/70/13/473877013.db2.gz DHZXIQHSQZDTDR-WFASDCNBSA-N 0 3 336.413 2.885 20 5 EFBDHN C[C@H](NCc1ccc(NS(C)(=O)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000263861356 473881072 /nfs/dbraw/zinc/88/10/72/473881072.db2.gz VXKYZLZKGQWMCS-LBPRGKRZSA-N 0 3 349.412 2.817 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCN1CC[C@@H]2[C@@H](CCCN2C2CC2)C1 ZINC000246499930 473881187 /nfs/dbraw/zinc/88/11/87/473881187.db2.gz HODWYJOKSHEMQQ-DOTOQJQBSA-N 0 3 345.443 2.922 20 5 EFBDHN C[C@H](NCc1ccc([N+](=O)[O-])cc1Cl)C1CCS(=O)(=O)CC1 ZINC000187560843 473884441 /nfs/dbraw/zinc/88/44/41/473884441.db2.gz FBOWZVPEYBUTOW-JTQLQIEISA-N 0 3 346.836 2.551 20 5 EFBDHN C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000288485869 473956799 /nfs/dbraw/zinc/95/67/99/473956799.db2.gz RFVLSGUNIYLELI-GXTWGEPZSA-N 0 3 342.399 2.775 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)N1C[C@H](N2CCCC2)C[C@H]1C ZINC000288489764 473957168 /nfs/dbraw/zinc/95/71/68/473957168.db2.gz RLWVWKWAXUDZGZ-ZIAGYGMSSA-N 0 3 347.415 2.692 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N(C)CC2(N(C)C)CCC2)c1 ZINC000188077807 473973928 /nfs/dbraw/zinc/97/39/28/473973928.db2.gz BLSMGYCVHDIOBY-UHFFFAOYSA-N 0 3 349.431 2.615 20 5 EFBDHN O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CC[C@H](N2CCCCC2)C1 ZINC000264462253 474001521 /nfs/dbraw/zinc/00/15/21/474001521.db2.gz JEFQTYIMJWJVGW-ZDUSSCGKSA-N 0 3 337.807 2.949 20 5 EFBDHN CSc1cccc(C(=O)N(C)C[C@H]2CCCN(C)C2)c1[N+](=O)[O-] ZINC000188164368 474004836 /nfs/dbraw/zinc/00/48/36/474004836.db2.gz SIQNTHXIYJOGMB-LBPRGKRZSA-N 0 3 337.445 2.731 20 5 EFBDHN C[C@H](NCCC(=O)Nc1ccccc1[N+](=O)[O-])c1cccc(O)c1 ZINC000181582710 474049856 /nfs/dbraw/zinc/04/98/56/474049856.db2.gz TYDZXEXGTFLVDQ-LBPRGKRZSA-N 0 3 329.356 2.980 20 5 EFBDHN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CC[C@H](N2CCCCC2)C1 ZINC000264590560 474050419 /nfs/dbraw/zinc/05/04/19/474050419.db2.gz WCLIBUZNQUGAHA-HNNXBMFYSA-N 0 3 349.456 2.774 20 5 EFBDHN CS[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2F)C[C@H]1N1CCCC1 ZINC000275055058 474056311 /nfs/dbraw/zinc/05/63/11/474056311.db2.gz IWWMLFOTLUMNAT-HZPDHXFCSA-N 0 3 339.436 2.746 20 5 EFBDHN O=C(c1c[nH]c2cc([N+](=O)[O-])ccc12)N1CC[C@H](N2CCCCC2)C1 ZINC000264623458 474064611 /nfs/dbraw/zinc/06/46/11/474064611.db2.gz SCMIGOGDZBWYMU-AWEZNQCLSA-N 0 3 342.399 2.777 20 5 EFBDHN CS[C@H]1CN(C(=O)c2cc(C)cc([N+](=O)[O-])c2)C[C@H]1N1CCCC1 ZINC000275164899 474091238 /nfs/dbraw/zinc/09/12/38/474091238.db2.gz VKRHCKJJMKJKEF-CVEARBPZSA-N 0 3 349.456 2.555 20 5 EFBDHN C[C@@H](CN(C)Cc1ccccc1)NC(=O)c1csc([N+](=O)[O-])c1 ZINC000182069711 474092150 /nfs/dbraw/zinc/09/21/50/474092150.db2.gz LFPACCWOLFEKRG-LBPRGKRZSA-N 0 3 333.413 2.907 20 5 EFBDHN C[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000182066307 474092234 /nfs/dbraw/zinc/09/22/34/474092234.db2.gz QVYBEXIIZWVTKM-GFCCVEGCSA-N 0 3 333.413 2.907 20 5 EFBDHN C[C@H](CN(C)Cc1ccccc1)NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000182090250 474097205 /nfs/dbraw/zinc/09/72/05/474097205.db2.gz VLOSSLVKIQMNIM-OAHLLOKOSA-N 0 3 341.411 2.774 20 5 EFBDHN CN(CCc1cccc([N+](=O)[O-])c1)C[C@@H](O)COc1ccccc1 ZINC000282549199 474106986 /nfs/dbraw/zinc/10/69/86/474106986.db2.gz XAUFUNMASSBYCQ-QGZVFWFLSA-N 0 3 330.384 2.509 20 5 EFBDHN C[C@@H](O)C1CCN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000264766393 474120292 /nfs/dbraw/zinc/12/02/92/474120292.db2.gz ZNBJEPISMUSHLG-CYBMUJFWSA-N 0 3 345.399 2.885 20 5 EFBDHN CN(CCc1ccccc1)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182214461 474124611 /nfs/dbraw/zinc/12/46/11/474124611.db2.gz OQIKYCBTPAOWDG-INIZCTEOSA-N 0 3 330.384 2.509 20 5 EFBDHN CN(C)C(=O)CC1CCN(CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000182245774 474132391 /nfs/dbraw/zinc/13/23/91/474132391.db2.gz VIOFRHBWRIHDAL-UHFFFAOYSA-N 0 3 349.431 2.554 20 5 EFBDHN CC[C@@H](c1ccncc1)N(C)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182292062 474142204 /nfs/dbraw/zinc/14/22/04/474142204.db2.gz IOHKXDGPZSCPAL-HOTGVXAUSA-N 0 3 345.399 2.813 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(N2CCC(N3CCN(C(C)C)CC3)CC2)c1 ZINC000270509326 474147365 /nfs/dbraw/zinc/14/73/65/474147365.db2.gz WFZHTMXHYVARNP-UHFFFAOYSA-N 0 3 346.475 2.898 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@@H]2CCCN2C[C@@H]1C ZINC000247474395 474156472 /nfs/dbraw/zinc/15/64/72/474156472.db2.gz RZZCWYXMSBROOI-YDHLFZDLSA-N 0 3 349.456 2.771 20 5 EFBDHN Cc1ccccc1[C@H]1CCN(CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000270579553 474175134 /nfs/dbraw/zinc/17/51/34/474175134.db2.gz QGOHJFVZAYLYOR-HNNXBMFYSA-N 0 3 327.384 2.554 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c1 ZINC000282793386 474197997 /nfs/dbraw/zinc/19/79/97/474197997.db2.gz HMGWFIYVHWAMJP-OLZOCXBDSA-N 0 3 335.404 2.548 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(N2C[C@H](SC)[C@@H](N3CCCC3)C2)c1 ZINC000275516056 474218814 /nfs/dbraw/zinc/21/88/14/474218814.db2.gz VUIHYPOVNWYZFA-HOTGVXAUSA-N 0 3 337.445 2.619 20 5 EFBDHN CCN(CCOCCO)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000282877315 474226843 /nfs/dbraw/zinc/22/68/43/474226843.db2.gz YIVVGPSSLOWLNA-UHFFFAOYSA-N 0 3 334.372 2.686 20 5 EFBDHN C[C@H](NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000182695444 474235700 /nfs/dbraw/zinc/23/57/00/474235700.db2.gz PHSCTFFULSVICE-ZDUSSCGKSA-N 0 3 340.445 2.927 20 5 EFBDHN CC1CCN(CCNC(=O)c2cccc(Cl)c2[N+](=O)[O-])CC1 ZINC000175500718 474237488 /nfs/dbraw/zinc/23/74/88/474237488.db2.gz NWGNNLCWNHIUCS-UHFFFAOYSA-N 0 3 325.796 2.710 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CCCN2CC(C)C)c1 ZINC000282946890 474249901 /nfs/dbraw/zinc/24/99/01/474249901.db2.gz YVAQTTKHGQUORT-CQSZACIVSA-N 0 3 349.431 2.844 20 5 EFBDHN Cc1c(NC(=O)CCN[C@H](C)c2cccnc2)cccc1[N+](=O)[O-] ZINC000182885380 474277139 /nfs/dbraw/zinc/27/71/39/474277139.db2.gz ZTPIXDLOCXCLFK-CYBMUJFWSA-N 0 3 328.372 2.978 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN[C@H](CO)c1ccccc1 ZINC000182902808 474282489 /nfs/dbraw/zinc/28/24/89/474282489.db2.gz FEXSHRIXRCLBOY-QGZVFWFLSA-N 0 3 343.383 2.555 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC(Cn2ccnn2)CC1 ZINC000182929586 474290333 /nfs/dbraw/zinc/29/03/33/474290333.db2.gz BVUAPAMOWUFBFB-AWEZNQCLSA-N 0 3 329.404 2.968 20 5 EFBDHN COc1cc(CNC[C@@H](O)c2cc(C)cc(C)c2)c([N+](=O)[O-])cc1O ZINC000283124824 474311621 /nfs/dbraw/zinc/31/16/21/474311621.db2.gz ZGHYKNJXMNXJQU-QGZVFWFLSA-N 0 3 346.383 2.749 20 5 EFBDHN CN(CC1CCN(C)CC1)C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000265751010 474322410 /nfs/dbraw/zinc/32/24/10/474322410.db2.gz DYVAVJOLRZFSJF-UHFFFAOYSA-N 0 3 333.432 2.673 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CN1CC[C@H](c2ccccc2)C1 ZINC000248437826 474323031 /nfs/dbraw/zinc/32/30/31/474323031.db2.gz BOOAMFKYYFRZGR-DLBZAZTESA-N 0 3 342.395 2.824 20 5 EFBDHN CS[C@H]1CCCCN(C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000248469524 474335788 /nfs/dbraw/zinc/33/57/88/474335788.db2.gz URRMXYFKQQLPKR-KGLIPLIRSA-N 0 3 340.445 2.552 20 5 EFBDHN O=[N+]([O-])c1cc(CN[C@@H](CO)C2CCCC2)ccc1Br ZINC000289624434 474351101 /nfs/dbraw/zinc/35/11/01/474351101.db2.gz SZXYRKLOVWXAEJ-ZDUSSCGKSA-N 0 3 343.221 2.998 20 5 EFBDHN C[C@H]1CCCN(CCNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000265825743 474352223 /nfs/dbraw/zinc/35/22/23/474352223.db2.gz RYCWOHKUMPNHRS-AWEZNQCLSA-N 0 3 333.432 2.721 20 5 EFBDHN COc1cc(CN(C)CCc2ccccc2[N+](=O)[O-])cc(OC)c1O ZINC000289660211 474366537 /nfs/dbraw/zinc/36/65/37/474366537.db2.gz YLYSXKRONCXDBU-UHFFFAOYSA-N 0 3 346.383 2.992 20 5 EFBDHN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)C1(N)CCCCC1 ZINC000237255559 474368719 /nfs/dbraw/zinc/36/87/19/474368719.db2.gz YPOWXCGFULYXGG-UHFFFAOYSA-N 0 3 325.796 2.868 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])NCCNC(=O)C1CC1 ZINC000271022543 474371627 /nfs/dbraw/zinc/37/16/27/474371627.db2.gz ARLCFZRDZNCTDZ-CYBMUJFWSA-N 0 3 337.445 2.581 20 5 EFBDHN C[C@@H](C(=O)NCCN1CCC[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1F ZINC000248615489 474377455 /nfs/dbraw/zinc/37/74/55/474377455.db2.gz YVIIXTMWADLRPL-CHWSQXEVSA-N 0 3 337.395 2.686 20 5 EFBDHN C[C@H](C1CCN(C)CC1)N(C)C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000271040187 474380440 /nfs/dbraw/zinc/38/04/40/474380440.db2.gz QVVIJZIHGLXJFU-CQSZACIVSA-N 0 3 348.447 2.586 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)CN2CCC[C@H](C)C2)c1 ZINC000283390099 474389542 /nfs/dbraw/zinc/38/95/42/474389542.db2.gz GJOMEPXRLVZORZ-UONOGXRCSA-N 0 3 349.431 2.844 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)CN2CCC[C@@H](C)C2)c1 ZINC000283390102 474389709 /nfs/dbraw/zinc/38/97/09/474389709.db2.gz GJOMEPXRLVZORZ-ZIAGYGMSSA-N 0 3 349.431 2.844 20 5 EFBDHN CCOc1ccc([C@H](C)NCCN2CCSCC2)cc1[N+](=O)[O-] ZINC000271064015 474391547 /nfs/dbraw/zinc/39/15/47/474391547.db2.gz CPQJUFYYZXOHEN-ZDUSSCGKSA-N 0 3 339.461 2.693 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)NC[C@@H](C)N(C)C2CC2)cc1[N+](=O)[O-] ZINC000176137746 474391818 /nfs/dbraw/zinc/39/18/18/474391818.db2.gz KMOGZVPTXSYSJV-CHWSQXEVSA-N 0 3 334.420 2.746 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CNCCc1cccnc1OC ZINC000289727596 474398357 /nfs/dbraw/zinc/39/83/57/474398357.db2.gz GOLURTQUXJINFN-UHFFFAOYSA-N 0 3 331.372 2.729 20 5 EFBDHN CC1CCC(N2CCN(C(=O)Nc3ccncc3[N+](=O)[O-])CC2)CC1 ZINC000183633698 474404480 /nfs/dbraw/zinc/40/44/80/474404480.db2.gz HTIJUEXDZAQTCJ-UHFFFAOYSA-N 0 3 347.419 2.718 20 5 EFBDHN CCc1ccc([N+](=O)[O-])cc1NC(=O)N(C)C[C@@H]1CCCN(C)C1 ZINC000289752191 474409481 /nfs/dbraw/zinc/40/94/81/474409481.db2.gz KAHDYSMBRAFPOR-CYBMUJFWSA-N 0 3 334.420 2.963 20 5 EFBDHN Nc1ccc(N2CCCN(Cc3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000283461655 474410678 /nfs/dbraw/zinc/41/06/78/474410678.db2.gz FLDAUPJYONFWHK-UHFFFAOYSA-N 0 3 326.400 2.889 20 5 EFBDHN COc1cccc(C2CCN(CCn3ccc([N+](=O)[O-])n3)CC2)c1 ZINC000176221731 474414386 /nfs/dbraw/zinc/41/43/86/474414386.db2.gz SDCMPOXUNHAMHD-UHFFFAOYSA-N 0 3 330.388 2.680 20 5 EFBDHN CN(C)c1cccc([C@H]2CCCN2CCn2ccc([N+](=O)[O-])n2)c1 ZINC000176248575 474420185 /nfs/dbraw/zinc/42/01/85/474420185.db2.gz DDQHUPMVWRHVQF-MRXNPFEDSA-N 0 3 329.404 2.694 20 5 EFBDHN CCOc1ccc(C(=O)NC[C@H](C)N2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000248750465 474425515 /nfs/dbraw/zinc/42/55/15/474425515.db2.gz GJRJROKHUMNAOK-KGLIPLIRSA-N 0 3 349.431 2.844 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CC[C@H](CSc3ccccc3)C2)n1 ZINC000176270810 474426819 /nfs/dbraw/zinc/42/68/19/474426819.db2.gz HYXGEPCFAZNNTJ-AWEZNQCLSA-N 0 3 332.429 2.906 20 5 EFBDHN CN(C)C1(CN(C)C(=O)CCCNc2ccc([N+](=O)[O-])cc2)CCC1 ZINC000189519921 474429702 /nfs/dbraw/zinc/42/97/02/474429702.db2.gz GXPYEOQJFWNTCD-UHFFFAOYSA-N 0 3 348.447 2.730 20 5 EFBDHN CC(C)c1ccc(C(=O)N2CC[C@@H]3CCN(C)C[C@H]32)cc1[N+](=O)[O-] ZINC000276166804 474438110 /nfs/dbraw/zinc/43/81/10/474438110.db2.gz RNPZPQKPPVXHOT-SUMWQHHRSA-N 0 3 331.416 2.884 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](C)N2CCC[C@@H](C)C2)c1 ZINC000283578864 474441340 /nfs/dbraw/zinc/44/13/40/474441340.db2.gz WHUAWSSTYZMCOG-KGLIPLIRSA-N 0 3 349.431 2.844 20 5 EFBDHN CCN(CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@H]1CCOC(C)(C)C1 ZINC000289821908 474442715 /nfs/dbraw/zinc/44/27/15/474442715.db2.gz OEKVVYZMSQJIQK-INIZCTEOSA-N 0 3 349.431 2.837 20 5 EFBDHN Cc1cc(F)c(NC(=O)N2CC[C@H]3CC[C@@H](C2)N3C)cc1[N+](=O)[O-] ZINC000283617089 474449846 /nfs/dbraw/zinc/44/98/46/474449846.db2.gz AKDJZGQLBHCLBJ-NEPJUHHUSA-N 0 3 336.367 2.743 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@@H]1CN(C2CC2)C[C@H]1C ZINC000271230144 474453273 /nfs/dbraw/zinc/45/32/73/474453273.db2.gz CYONAWOCDOGREQ-IUODEOHRSA-N 0 3 331.416 2.733 20 5 EFBDHN CC(C)C[C@H](CNC(=O)c1cccc(Cl)c1[N+](=O)[O-])N(C)C ZINC000176483949 474486574 /nfs/dbraw/zinc/48/65/74/474486574.db2.gz DAWVNOCZFHHIPL-LLVKDONJSA-N 0 3 327.812 2.954 20 5 EFBDHN CN(C[C@@H]1CCCN(C)C1)C(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000176587066 474503312 /nfs/dbraw/zinc/50/33/12/474503312.db2.gz AHTMXZHRYHAADO-LLVKDONJSA-N 0 3 325.796 2.662 20 5 EFBDHN Cn1cc(CNC[C@H]2CCCCO2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000237928848 474506078 /nfs/dbraw/zinc/50/60/78/474506078.db2.gz VGWOVOQSMPDULR-MRXNPFEDSA-N 0 3 330.388 2.654 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H](N3CCCCC3)C2)c1 ZINC000283890748 474520837 /nfs/dbraw/zinc/52/08/37/474520837.db2.gz IUKBXYWLQJGLDW-AWEZNQCLSA-N 0 3 347.415 2.694 20 5 EFBDHN Cc1cccc(C(=O)NCCN[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000266900556 474522031 /nfs/dbraw/zinc/52/20/31/474522031.db2.gz UDGWDEGKGXOTEF-CQSZACIVSA-N 0 3 327.384 2.984 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CNC[C@]3(O)CCSC3)o2)cc1 ZINC000176754077 474527067 /nfs/dbraw/zinc/52/70/67/474527067.db2.gz GQQTYDLOBYJFIK-MRXNPFEDSA-N 0 3 334.397 2.812 20 5 EFBDHN COC(=O)C1CCN(CCCNc2ccc(C)cc2[N+](=O)[O-])CC1 ZINC000266955645 474545502 /nfs/dbraw/zinc/54/55/02/474545502.db2.gz GKCOAAVJINNAKC-UHFFFAOYSA-N 0 3 335.404 2.590 20 5 EFBDHN C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)N[C@@H]1CCCc2c[nH]nc21 ZINC000271432795 474545711 /nfs/dbraw/zinc/54/57/11/474545711.db2.gz BHINKUBQSLWRKM-XHDPSFHLSA-N 0 3 343.387 2.702 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@H](C)CC[S@](C)=O)cc1[N+](=O)[O-] ZINC000271449108 474551771 /nfs/dbraw/zinc/55/17/71/474551771.db2.gz FLGBRRXBZQDYEG-DMDKVIGKSA-N 0 3 328.434 2.801 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@@H](C)CC[S@](C)=O)cc1[N+](=O)[O-] ZINC000271449116 474552230 /nfs/dbraw/zinc/55/22/30/474552230.db2.gz FLGBRRXBZQDYEG-IBILFNBTSA-N 0 3 328.434 2.801 20 5 EFBDHN Cc1cc(F)c(NC(=O)N2C[C@H]3CCCN3C[C@H]2C)cc1[N+](=O)[O-] ZINC000284081537 474567697 /nfs/dbraw/zinc/56/76/97/474567697.db2.gz RMAVHXWCLLWXFM-VXGBXAGGSA-N 0 3 336.367 2.743 20 5 EFBDHN COc1cccc([C@@H](O)CN[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000284100750 474572140 /nfs/dbraw/zinc/57/21/40/474572140.db2.gz MUKYKKWYLOZJFY-DIFFPNOSSA-N 0 3 331.372 2.570 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000184673680 474581138 /nfs/dbraw/zinc/58/11/38/474581138.db2.gz LDVAODMGIOLPIT-GUTXKFCHSA-N 0 3 349.406 2.923 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H](C)N(C)C1CC1 ZINC000184733583 474597594 /nfs/dbraw/zinc/59/75/94/474597594.db2.gz DHLPMDQDVKZJAR-UKRRQHHQSA-N 0 3 333.432 2.762 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCN(CC)C1CC1 ZINC000184755124 474600679 /nfs/dbraw/zinc/60/06/79/474600679.db2.gz VCOOFXQIDPBNAF-HNNXBMFYSA-N 0 3 333.432 2.764 20 5 EFBDHN C[C@@H](NC(=O)NCCN1CCC[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000249692176 474605014 /nfs/dbraw/zinc/60/50/14/474605014.db2.gz VJVGGQPYNGYXLE-ZIAGYGMSSA-N 0 3 334.420 2.687 20 5 EFBDHN C[C@@H](CN1CCC[C@H](C)C1)NC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000249800917 474617172 /nfs/dbraw/zinc/61/71/72/474617172.db2.gz YTLXWRKEWCMIQA-KBPBESRZSA-N 0 3 334.420 2.514 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1 ZINC000184846165 474618852 /nfs/dbraw/zinc/61/88/52/474618852.db2.gz BSTKBIWUBHPLFN-NUEKZKHPSA-N 0 3 345.443 2.905 20 5 EFBDHN C[C@H](CNC(=O)NCc1cccc([N+](=O)[O-])c1)N1CCC[C@H](C)C1 ZINC000250032117 474626930 /nfs/dbraw/zinc/62/69/30/474626930.db2.gz DZBCVDRMUOIHDV-UONOGXRCSA-N 0 3 334.420 2.514 20 5 EFBDHN Cc1cc(C2CCN(CCOc3ccc([N+](=O)[O-])cc3)CC2)n[nH]1 ZINC000272886869 474634222 /nfs/dbraw/zinc/63/42/22/474634222.db2.gz DEOIPYWGFJVTKS-UHFFFAOYSA-N 0 3 330.388 2.885 20 5 EFBDHN Cc1cc(C2CCN(CCOc3ccc([N+](=O)[O-])cc3)CC2)[nH]n1 ZINC000272886869 474634227 /nfs/dbraw/zinc/63/42/27/474634227.db2.gz DEOIPYWGFJVTKS-UHFFFAOYSA-N 0 3 330.388 2.885 20 5 EFBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNC[C@H](CO)[C@H]1CCOC1 ZINC000291679311 474648181 /nfs/dbraw/zinc/64/81/81/474648181.db2.gz XDOHQYNQNOUBAL-GXSJLCMTSA-N 0 3 349.214 2.636 20 5 EFBDHN O=[N+]([O-])c1ccc(S(=O)(=O)CCNCC2CCCCC2)cc1 ZINC000272966240 474653571 /nfs/dbraw/zinc/65/35/71/474653571.db2.gz UGTBJDXHWDPDBL-UHFFFAOYSA-N 0 3 326.418 2.538 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCCN2CCC[C@@H](c3ncc[nH]3)C2)cc1 ZINC000267477630 474671069 /nfs/dbraw/zinc/67/10/69/474671069.db2.gz ZTIAXMWVZPMVHQ-CQSZACIVSA-N 0 3 330.388 2.966 20 5 EFBDHN Cc1cccc([C@H]2CCN(Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C2)c1 ZINC000273036891 474685628 /nfs/dbraw/zinc/68/56/28/474685628.db2.gz DCPNMRLWQKSSRE-INIZCTEOSA-N 0 3 339.395 2.992 20 5 EFBDHN CC(C)[C@@H]1N(C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC12CCC2 ZINC000291796118 474691983 /nfs/dbraw/zinc/69/19/83/474691983.db2.gz AHDBNTHIBFNIJI-PBHICJAKSA-N 0 3 334.416 2.845 20 5 EFBDHN CO[C@]1(C)C[C@H](N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1(C)C ZINC000340830572 474697987 /nfs/dbraw/zinc/69/79/87/474697987.db2.gz ZKSNUBGOHUIWSK-PZSREKOKSA-N 0 3 335.404 2.715 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCCN2CCC[C@@H](C)C2)c1 ZINC000344389095 474712800 /nfs/dbraw/zinc/71/28/00/474712800.db2.gz IJJYHXVDAMNVIX-OAHLLOKOSA-N 0 3 349.431 2.520 20 5 EFBDHN CO[C@]1(C)C[C@H](N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1(C)C ZINC000340847920 474712756 /nfs/dbraw/zinc/71/27/56/474712756.db2.gz HWKPBJIOFDFAIX-PZSREKOKSA-N 0 3 335.404 2.715 20 5 EFBDHN CO[C@]1(C)C[C@@H](N[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1(C)C ZINC000340854696 474718254 /nfs/dbraw/zinc/71/82/54/474718254.db2.gz WHAXNXMMJCGWDO-FABXCBLPSA-N 0 3 335.404 2.715 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(OC[C@H](O)CN(C)Cc2ccccc2)c1 ZINC000305277300 474725041 /nfs/dbraw/zinc/72/50/41/474725041.db2.gz BHQZYSFDBRXRAL-MRXNPFEDSA-N 0 3 330.384 2.775 20 5 EFBDHN CN(Cc1ccccc1)C[C@@H](O)COc1cc(F)cc([N+](=O)[O-])c1 ZINC000305325096 474731838 /nfs/dbraw/zinc/73/18/38/474731838.db2.gz OXRMKZJQRSOQSE-MRXNPFEDSA-N 0 3 334.347 2.606 20 5 EFBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCN(C2CCOCC2)C[C@H]1C ZINC000278633801 474746892 /nfs/dbraw/zinc/74/68/92/474746892.db2.gz LCLBJMLUKBBZDB-CABCVRRESA-N 0 3 333.432 2.841 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCN(C2CCOCC2)C[C@H]1C ZINC000278633803 474746976 /nfs/dbraw/zinc/74/69/76/474746976.db2.gz LCLBJMLUKBBZDB-HUUCEWRRSA-N 0 3 333.432 2.841 20 5 EFBDHN NC(=O)c1ccc(CN2CC[C@@H](c3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000268029657 474759475 /nfs/dbraw/zinc/75/94/75/474759475.db2.gz MDGREYIHEJWLTF-CQSZACIVSA-N 0 3 343.358 2.822 20 5 EFBDHN COc1ccc(OCCN2CCCO[C@H](C(C)C)C2)c([N+](=O)[O-])c1 ZINC000293008259 474762948 /nfs/dbraw/zinc/76/29/48/474762948.db2.gz DIOZRTTUDWPXAJ-KRWDZBQOSA-N 0 3 338.404 2.729 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N[C@@H]2CN(C3CC3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000268096319 474795384 /nfs/dbraw/zinc/79/53/84/474795384.db2.gz CQKUPOYSXXTXBE-HEHGZKQESA-N 0 3 346.431 2.746 20 5 EFBDHN O=[N+]([O-])c1ccccc1NCc1ccccc1CN1CC[C@@H](O)C1 ZINC000273242893 474797474 /nfs/dbraw/zinc/79/74/74/474797474.db2.gz UDBOPGPCMIVGOG-MRXNPFEDSA-N 0 3 327.384 2.774 20 5 EFBDHN C[C@@H](CNC(=O)NCCc1ccccc1[N+](=O)[O-])N1CCCC[C@H]1C ZINC000340942984 474802528 /nfs/dbraw/zinc/80/25/28/474802528.db2.gz XMVWTPIKNLTWFJ-CABCVRRESA-N 0 3 348.447 2.699 20 5 EFBDHN CCN1CCC[C@@H]1CNC(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000268144975 474824622 /nfs/dbraw/zinc/82/46/22/474824622.db2.gz GDOPPGYFRUKRHY-CYBMUJFWSA-N 0 3 340.811 2.532 20 5 EFBDHN COCC[C@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccc(C)o1 ZINC000273295423 474827381 /nfs/dbraw/zinc/82/73/81/474827381.db2.gz NEHNKMPLGSDIGM-JKSUJKDBSA-N 0 3 334.372 2.897 20 5 EFBDHN COCC[C@@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccc(C)o1 ZINC000273295415 474827958 /nfs/dbraw/zinc/82/79/58/474827958.db2.gz NEHNKMPLGSDIGM-CVEARBPZSA-N 0 3 334.372 2.897 20 5 EFBDHN C[C@@H](N[C@@H]1CCN(c2ccccn2)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000284977878 474850646 /nfs/dbraw/zinc/85/06/46/474850646.db2.gz GAHZFDGZMVKSMJ-TZMCWYRMSA-N 0 3 327.388 2.502 20 5 EFBDHN CS[C@H]1CN(c2cc(C)nc3c2cccc3[N+](=O)[O-])C[C@@H]1N(C)C ZINC000345077546 474869958 /nfs/dbraw/zinc/86/99/58/474869958.db2.gz USTYADXNGCMUMB-HOTGVXAUSA-N 0 3 346.456 2.933 20 5 EFBDHN C[C@@H](NCCC(=O)NC1CCCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000293228451 474879860 /nfs/dbraw/zinc/87/98/60/474879860.db2.gz AQSPJPXXRCJTEW-GFCCVEGCSA-N 0 3 334.420 2.667 20 5 EFBDHN C[C@H](N[C@H]1CCCN(C(=O)N2CCCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000285142078 474904501 /nfs/dbraw/zinc/90/45/01/474904501.db2.gz OSNVQJFRAFZTJX-HOCLYGCPSA-N 0 3 346.431 2.926 20 5 EFBDHN CS[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2C)C[C@@H]1N1CCCC1 ZINC000273451892 474905737 /nfs/dbraw/zinc/90/57/37/474905737.db2.gz CVBNGTJTOLGCII-JKSUJKDBSA-N 0 3 349.456 2.555 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CN(C3CC3)C[C@H]2C)c1 ZINC000268285174 474907125 /nfs/dbraw/zinc/90/71/25/474907125.db2.gz XYAIOKZBTPYHTO-QMTHXVAHSA-N 0 3 335.429 2.529 20 5 EFBDHN CN(C(=O)/C=C\c1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CCCN(C)C1 ZINC000255846074 474907371 /nfs/dbraw/zinc/90/73/71/474907371.db2.gz PQUWCNDQQQOETP-FWPCIQOSSA-N 0 3 337.807 2.814 20 5 EFBDHN C[C@@H](Cn1cccn1)NCc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000293305937 474917555 /nfs/dbraw/zinc/91/75/55/474917555.db2.gz ZVLQNRKOLCIJGP-JTQLQIEISA-N 0 3 328.294 2.988 20 5 EFBDHN C[C@H]1CN(C(=O)c2ccc(F)cc2[N+](=O)[O-])CCN(C2CCC2)C1 ZINC000292237531 474917934 /nfs/dbraw/zinc/91/79/34/474917934.db2.gz CUXCUQXGBQNDSU-GFCCVEGCSA-N 0 3 335.379 2.680 20 5 EFBDHN CN(C)CCN(Cc1ccc(F)c(F)c1)c1ncccc1[N+](=O)[O-] ZINC000268317437 474920252 /nfs/dbraw/zinc/92/02/52/474920252.db2.gz LYGHTPRMOLCHBF-UHFFFAOYSA-N 0 3 336.342 2.836 20 5 EFBDHN CC[C@H]1CCC[C@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000273484192 474924341 /nfs/dbraw/zinc/92/43/41/474924341.db2.gz VDNZAYJWHAPYEQ-SWLSCSKDSA-N 0 3 326.418 2.537 20 5 EFBDHN CC[C@@H]1CCC[C@@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000273484188 474924395 /nfs/dbraw/zinc/92/43/95/474924395.db2.gz VDNZAYJWHAPYEQ-DOMZBBRYSA-N 0 3 326.418 2.537 20 5 EFBDHN C[C@H](C1CCN(C)CC1)N(C)C(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000273545940 474956966 /nfs/dbraw/zinc/95/69/66/474956966.db2.gz UXPDMKAWLLRTKL-CQSZACIVSA-N 0 3 348.447 2.509 20 5 EFBDHN CS[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2C)C[C@H]1N1CCCC1 ZINC000273549659 474958412 /nfs/dbraw/zinc/95/84/12/474958412.db2.gz VFVDPABRXALRPE-HZPDHXFCSA-N 0 3 349.456 2.555 20 5 EFBDHN Cc1ccc(C)c(OC[C@@H](O)CNCc2cccc([N+](=O)[O-])c2)c1 ZINC000324478739 474968803 /nfs/dbraw/zinc/96/88/03/474968803.db2.gz CJQGLJKLBKLTMN-KRWDZBQOSA-N 0 3 330.384 2.741 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN1CCC[C@H](c2n[nH]c(C)n2)C1 ZINC000268423782 474970036 /nfs/dbraw/zinc/97/00/36/474970036.db2.gz DDVWLPWIMUVLAJ-ZDUSSCGKSA-N 0 3 345.403 2.800 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN1CCC[C@H](c2nc(C)n[nH]2)C1 ZINC000268423782 474970041 /nfs/dbraw/zinc/97/00/41/474970041.db2.gz DDVWLPWIMUVLAJ-ZDUSSCGKSA-N 0 3 345.403 2.800 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN1CCC[C@H](c2nnc(C)[nH]2)C1 ZINC000268423782 474970047 /nfs/dbraw/zinc/97/00/47/474970047.db2.gz DDVWLPWIMUVLAJ-ZDUSSCGKSA-N 0 3 345.403 2.800 20 5 EFBDHN CCc1cccc(OC[C@H](O)CNCc2cccc([N+](=O)[O-])c2)c1 ZINC000324572771 474971137 /nfs/dbraw/zinc/97/11/37/474971137.db2.gz XCLYQLWVEZGWSL-QGZVFWFLSA-N 0 3 330.384 2.687 20 5 EFBDHN Cc1cccc(C[C@@H](CO)N[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000285324089 474972878 /nfs/dbraw/zinc/97/28/78/474972878.db2.gz TZSGTMOSNJHMSH-BBRMVZONSA-N 0 3 329.400 2.740 20 5 EFBDHN Cc1cccc(C[C@H](CO)N[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000285324101 474972931 /nfs/dbraw/zinc/97/29/31/474972931.db2.gz TZSGTMOSNJHMSH-CZUORRHYSA-N 0 3 329.400 2.740 20 5 EFBDHN C[C@H]1C[C@H](N(C)c2ncc([N+](=O)[O-])cn2)CCN1Cc1ccccc1 ZINC000273590468 474978943 /nfs/dbraw/zinc/97/89/43/474978943.db2.gz HFOIUFPBBMVILM-GOEBONIOSA-N 0 3 341.415 2.874 20 5 EFBDHN CN(CCc1ccccc1[N+](=O)[O-])C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000285345489 474980717 /nfs/dbraw/zinc/98/07/17/474980717.db2.gz PEFJYTZXBCYCRF-QGZVFWFLSA-N 0 3 345.355 2.711 20 5 EFBDHN CC(C)(CNc1ncc([N+](=O)[O-])cn1)N1CCc2ccccc2C1 ZINC000273598130 474983196 /nfs/dbraw/zinc/98/31/96/474983196.db2.gz IVWYSWODIXJQKL-UHFFFAOYSA-N 0 3 327.388 2.634 20 5 EFBDHN C[C@H]1C[C@H](N2CCCC2)CN1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000285355121 474986082 /nfs/dbraw/zinc/98/60/82/474986082.db2.gz ABOPNSMAMFVKOB-JSGCOSHPSA-N 0 3 330.388 2.795 20 5 EFBDHN C[C@@H]1C[C@@H](N2CCCC2)CN1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000285355134 474987598 /nfs/dbraw/zinc/98/75/98/474987598.db2.gz ABOPNSMAMFVKOB-TZMCWYRMSA-N 0 3 330.388 2.795 20 5 EFBDHN O=C(CN[C@@H]1CCCC[C@@H]1OC(F)F)Nc1ccccc1[N+](=O)[O-] ZINC000337414672 474991329 /nfs/dbraw/zinc/99/13/29/474991329.db2.gz OXHJPPIFFMXPKG-YPMHNXCESA-N 0 3 343.330 2.673 20 5 EFBDHN O=[N+]([O-])c1cnc(NCC2(N3CCSCC3)CCCCC2)nc1 ZINC000273614264 474991727 /nfs/dbraw/zinc/99/17/27/474991727.db2.gz MSLSGPKRLDRLTP-UHFFFAOYSA-N 0 3 337.449 2.548 20 5 EFBDHN CN(Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCC(CO)CC1 ZINC000268461371 474993444 /nfs/dbraw/zinc/99/34/44/474993444.db2.gz PIEYUVJJVTYVPO-UHFFFAOYSA-N 0 3 346.387 2.628 20 5 EFBDHN O=[N+]([O-])c1ccc(NC[C@@H]2CN3CCC[C@H]3CO2)c(C(F)(F)F)c1 ZINC000325837848 474995086 /nfs/dbraw/zinc/99/50/86/474995086.db2.gz QYFCKMWKONAHRT-NWDGAFQWSA-N 0 3 345.321 2.889 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1cccc2c1CCNC2 ZINC000325799001 474995228 /nfs/dbraw/zinc/99/52/28/474995228.db2.gz NWZKHPVDAXLYGY-UHFFFAOYSA-N 0 3 325.368 2.513 20 5 EFBDHN Cc1cc(C(=O)NC[C@H]2NCCc3ccccc32)ccc1[N+](=O)[O-] ZINC000261613028 474996955 /nfs/dbraw/zinc/99/69/55/474996955.db2.gz DZNIDCCAFVERLD-MRXNPFEDSA-N 0 3 325.368 2.520 20 5 EFBDHN C[C@@H](NC(=O)c1cccc2c1CCNC2)c1cccc([N+](=O)[O-])c1 ZINC000326040698 474998615 /nfs/dbraw/zinc/99/86/15/474998615.db2.gz WUVAGIIXVNSLHP-GFCCVEGCSA-N 0 3 325.368 2.732 20 5 EFBDHN Cc1c(CNC(=O)[C@H](C)[C@H](N)c2ccccc2)cccc1[N+](=O)[O-] ZINC000261626396 475001523 /nfs/dbraw/zinc/00/15/23/475001523.db2.gz GUHVAVIFGKVRRL-DYVFJYSZSA-N 0 3 327.384 2.856 20 5 EFBDHN CN(C[C@H]1CCCN(C)C1)c1ncc(Br)cc1[N+](=O)[O-] ZINC000268485393 475008048 /nfs/dbraw/zinc/00/80/48/475008048.db2.gz MNADRRXTAZJGFH-JTQLQIEISA-N 0 3 343.225 2.530 20 5 EFBDHN Cc1cc(NC[C@H]2CN3CCC[C@H]3CO2)c2cc([N+](=O)[O-])ccc2n1 ZINC000326872085 475012143 /nfs/dbraw/zinc/01/21/43/475012143.db2.gz AXRNFOWXZSDQQH-GJZGRUSLSA-N 0 3 342.399 2.727 20 5 EFBDHN Cc1cc(NC[C@@H]2CN3CCC[C@@H]3CO2)c2cc([N+](=O)[O-])ccc2n1 ZINC000326872086 475012913 /nfs/dbraw/zinc/01/29/13/475012913.db2.gz AXRNFOWXZSDQQH-HUUCEWRRSA-N 0 3 342.399 2.727 20 5 EFBDHN Cc1cc(NC[C@H]2CN3CCC[C@@H]3CO2)c2cc([N+](=O)[O-])ccc2n1 ZINC000326872084 475013268 /nfs/dbraw/zinc/01/32/68/475013268.db2.gz AXRNFOWXZSDQQH-CABCVRRESA-N 0 3 342.399 2.727 20 5 EFBDHN CN(CCc1ccccc1[N+](=O)[O-])C[C@H](O)COc1ccccc1F ZINC000285431569 475019506 /nfs/dbraw/zinc/01/95/06/475019506.db2.gz WTGJTQZVFQOPMS-HNNXBMFYSA-N 0 3 348.374 2.648 20 5 EFBDHN CCC[C@]1(NCC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CCOC1 ZINC000285435368 475022116 /nfs/dbraw/zinc/02/21/16/475022116.db2.gz FKHWNELMNRHIJU-HNNXBMFYSA-N 0 3 341.795 2.736 20 5 EFBDHN CCOc1cc(CN2C[C@H](C)[C@@](C)(C(=O)OC)C2)ccc1[N+](=O)[O-] ZINC000337479057 475054747 /nfs/dbraw/zinc/05/47/47/475054747.db2.gz ZTBJPMMFHANZKA-SJCJKPOMSA-N 0 3 336.388 2.625 20 5 EFBDHN C[C@@H]1C[C@H](NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)CN1C1CC1 ZINC000273889487 475103447 /nfs/dbraw/zinc/10/34/47/475103447.db2.gz VDDNCWGDTLQAOY-NEPJUHHUSA-N 0 3 349.406 2.753 20 5 EFBDHN COc1cc(C[NH2+]C[C@@H](CO)CC2CCCC2)c([N+](=O)[O-])cc1[O-] ZINC000341513194 475104499 /nfs/dbraw/zinc/10/44/99/475104499.db2.gz PQHGUSDWQJVTCQ-ZDUSSCGKSA-N 0 3 338.404 2.587 20 5 EFBDHN CCc1ccc(C(=O)N2CC[C@H](N3CCCC3)[C@@H]2C)cc1[N+](=O)[O-] ZINC000287356073 475111093 /nfs/dbraw/zinc/11/10/93/475111093.db2.gz WMYDJAPBPNABIR-BBRMVZONSA-N 0 3 331.416 2.856 20 5 EFBDHN CC[C@@H]1CN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CCCO1 ZINC000281271285 475146273 /nfs/dbraw/zinc/14/62/73/475146273.db2.gz NVJNSJBDQSDGPE-QGZVFWFLSA-N 0 3 344.415 2.996 20 5 EFBDHN CCCN(CCN1CCCC1)C(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000287438667 475147621 /nfs/dbraw/zinc/14/76/21/475147621.db2.gz QZISOPQXDKLDDA-UHFFFAOYSA-N 0 3 349.431 2.860 20 5 EFBDHN CCc1nnc(CN[C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])[nH]1 ZINC000296035789 475173617 /nfs/dbraw/zinc/17/36/17/475173617.db2.gz NPWRQTBZKIYGRZ-JSGCOSHPSA-N 0 3 329.404 2.776 20 5 EFBDHN CCc1nnc(C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])[n-]1 ZINC000296035789 475173624 /nfs/dbraw/zinc/17/36/24/475173624.db2.gz NPWRQTBZKIYGRZ-JSGCOSHPSA-N 0 3 329.404 2.776 20 5 EFBDHN CN1CC[C@@H]2[C@@H](CCCN2C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C1 ZINC000269115740 475177720 /nfs/dbraw/zinc/17/77/20/475177720.db2.gz NGGKYAMNTZQLSU-YVEFUNNKSA-N 0 3 342.399 2.632 20 5 EFBDHN CN1CC[C@H]2[C@@H](CCCN2C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C1 ZINC000269115734 475177915 /nfs/dbraw/zinc/17/79/15/475177915.db2.gz NGGKYAMNTZQLSU-SJCJKPOMSA-N 0 3 342.399 2.632 20 5 EFBDHN CCn1cc([C@@H](C)NCCC(=O)Nc2cc([N+](=O)[O-])ccc2F)cn1 ZINC000296116936 475201164 /nfs/dbraw/zinc/20/11/64/475201164.db2.gz QTBUUILCTJLVQZ-LLVKDONJSA-N 0 3 349.366 2.630 20 5 EFBDHN CCOC(=O)c1cc(N2CC[C@@]3(C2)CCCN(C)C3)ccc1[N+](=O)[O-] ZINC000292816869 475206661 /nfs/dbraw/zinc/20/66/61/475206661.db2.gz OOGWCXWEONNSEE-SFHVURJKSA-N 0 3 347.415 2.694 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@]2(C1)CCCN(C)C2 ZINC000296159820 475211985 /nfs/dbraw/zinc/21/19/85/475211985.db2.gz KJVQJIQIOVIQAZ-KRWDZBQOSA-N 0 3 332.404 2.853 20 5 EFBDHN CC(C)O[C@H]1C[C@@H](NCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1(C)C ZINC000296183180 475217253 /nfs/dbraw/zinc/21/72/53/475217253.db2.gz LKBUZVDRKCJOKN-CVEARBPZSA-N 0 3 349.431 2.739 20 5 EFBDHN CN(C)C[C@@H](NC(=O)CCC(C)(C)[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000296182207 475217670 /nfs/dbraw/zinc/21/76/70/475217670.db2.gz VIFJOIPCEVONLX-CQSZACIVSA-N 0 3 341.839 2.894 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CNC2(c3ccc(F)cc3)CC2)c1 ZINC000341693798 475226674 /nfs/dbraw/zinc/22/66/74/475226674.db2.gz MGTCCBHGSJNODT-MRXNPFEDSA-N 0 3 346.358 2.753 20 5 EFBDHN Cc1ccc(NC(=O)N2CC[C@@]3(C2)CCCN(C)C3)cc1[N+](=O)[O-] ZINC000296229203 475230813 /nfs/dbraw/zinc/23/08/13/475230813.db2.gz PFYWBWMUTGZHDM-KRWDZBQOSA-N 0 3 332.404 2.853 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCN(CC2CC2)C1 ZINC000609382424 480154660 /nfs/dbraw/zinc/15/46/60/480154660.db2.gz AWSBIALNBKPBQA-OCCSQVGLSA-N 0 3 349.456 2.676 20 5 EFBDHN CC(=O)NC[C@@H]1CCCN(C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000347337130 475242980 /nfs/dbraw/zinc/24/29/80/475242980.db2.gz MCIIRPDZLGTNOS-DZXKJOIRSA-N 0 3 331.416 2.846 20 5 EFBDHN COc1c(C(=O)NC[C@@H](C)N2CCCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000354566215 475258311 /nfs/dbraw/zinc/25/83/11/475258311.db2.gz LLQCALJGIUYRPB-CHWSQXEVSA-N 0 3 335.404 2.596 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)C[C@H]1CCCN(C)C1 ZINC000361202555 475265975 /nfs/dbraw/zinc/26/59/75/475265975.db2.gz QKDVYFVQTZPUCC-IRXDYDNUSA-N 0 3 347.459 2.964 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)C[C@@H]1CCCN(C)C1 ZINC000361202556 475266560 /nfs/dbraw/zinc/26/65/60/475266560.db2.gz QKDVYFVQTZPUCC-SJORKVTESA-N 0 3 347.459 2.964 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC[C@@]2(CNC(=O)C2)C1 ZINC000347367812 475271367 /nfs/dbraw/zinc/27/13/67/475271367.db2.gz MSSFVIMAYXHZCY-DVNIYVAHSA-N 0 3 329.400 2.600 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCN(C)[C@H](C)C1 ZINC000361213220 475273553 /nfs/dbraw/zinc/27/35/53/475273553.db2.gz QEPJPUGYMNXEEY-FVQBIDKESA-N 0 3 333.432 2.762 20 5 EFBDHN NC(=O)C[C@@H](NC/C=C\c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000339529941 475276559 /nfs/dbraw/zinc/27/65/59/475276559.db2.gz FDNGKSCDXZDXJK-CXSQMQJXSA-N 0 3 325.368 2.814 20 5 EFBDHN CCCN(CCCN(C)C)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000296368738 475286353 /nfs/dbraw/zinc/28/63/53/475286353.db2.gz RHPVAEGBLHXVDG-UHFFFAOYSA-N 0 3 349.431 2.748 20 5 EFBDHN CC(C)c1nnc(CN[C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)[nH]1 ZINC000296427125 475311089 /nfs/dbraw/zinc/31/10/89/475311089.db2.gz LRHQYBARKOZYTP-CQSZACIVSA-N 0 3 329.404 2.947 20 5 EFBDHN CC(C)c1nnc(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)[n-]1 ZINC000296427125 475311098 /nfs/dbraw/zinc/31/10/98/475311098.db2.gz LRHQYBARKOZYTP-CQSZACIVSA-N 0 3 329.404 2.947 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(N2CCN(C3CCN(C)CC3)[C@@H](C)C2)c1 ZINC000354711464 475354079 /nfs/dbraw/zinc/35/40/79/475354079.db2.gz HOWQFSGBERVJCK-HNNXBMFYSA-N 0 3 332.448 2.508 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C/CN[C@H](C1CC1)[C@]1(CO)CCCO1 ZINC000354720724 475357831 /nfs/dbraw/zinc/35/78/31/475357831.db2.gz PATFTTHRZKYALK-YNDRMARASA-N 0 3 332.400 2.518 20 5 EFBDHN COCC[C@@H](N[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)C(C)(C)C ZINC000337836726 475365408 /nfs/dbraw/zinc/36/54/08/475365408.db2.gz CMRLEIRAUOAGCT-HZPDHXFCSA-N 0 3 349.431 2.741 20 5 EFBDHN CCN(C(=O)c1ccc([N+](=O)[O-])[nH]1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000354763566 475390809 /nfs/dbraw/zinc/39/08/09/475390809.db2.gz BRFBGNDJRCTNRI-OAHLLOKOSA-N 0 3 342.399 2.660 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CN[C@H]1CCO[C@H](C(F)(F)F)C1 ZINC000348103482 475392093 /nfs/dbraw/zinc/39/20/93/475392093.db2.gz CFZZMDRKGCUUNE-GWCFXTLKSA-N 0 3 334.294 2.803 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CN[C@@H]1CCO[C@H](C(F)(F)F)C1 ZINC000348103484 475392559 /nfs/dbraw/zinc/39/25/59/475392559.db2.gz CFZZMDRKGCUUNE-MFKMUULPSA-N 0 3 334.294 2.803 20 5 EFBDHN CN(CCc1ccccc1[N+](=O)[O-])Cc1ccc2c(c1)nnn2C ZINC000352559248 475410894 /nfs/dbraw/zinc/41/08/94/475410894.db2.gz CMPDGFGZWIYJRM-UHFFFAOYSA-N 0 3 325.372 2.551 20 5 EFBDHN Cc1cc(F)c(NC(=O)N[C@@H](C)C2=CCN(C)CC2)cc1[N+](=O)[O-] ZINC000296662049 475417521 /nfs/dbraw/zinc/41/75/21/475417521.db2.gz GOKKFZZWMYUJFO-NSHDSACASA-N 0 3 336.367 2.814 20 5 EFBDHN CCN(CC)[C@@H](CNc1cccc(C(N)=O)c1[N+](=O)[O-])c1ccco1 ZINC000341932256 475424697 /nfs/dbraw/zinc/42/46/97/475424697.db2.gz SBVHJVCUIFVMSG-AWEZNQCLSA-N 0 3 346.387 2.782 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@]2(CCN(C)C2)C1 ZINC000296685652 475428724 /nfs/dbraw/zinc/42/87/24/475428724.db2.gz IZJNTIOGYSVMRQ-QGZVFWFLSA-N 0 3 348.403 2.553 20 5 EFBDHN CN(CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@H]1CCC(C)(C)C1 ZINC000361469856 475475139 /nfs/dbraw/zinc/47/51/39/475475139.db2.gz OPVLVLBJTDHCLZ-HNNXBMFYSA-N 0 3 331.416 2.994 20 5 EFBDHN CNC(=O)[C@H]1CCC[C@@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000345834985 475492602 /nfs/dbraw/zinc/49/26/02/475492602.db2.gz BZCDSUAGZMJYTF-HOTGVXAUSA-N 0 3 343.383 2.859 20 5 EFBDHN C[C@H](NC[C@@H](O)COCc1cccs1)c1ccc([N+](=O)[O-])cc1 ZINC000296842415 475500198 /nfs/dbraw/zinc/50/01/98/475500198.db2.gz XHTZMMQSEZGVOL-SWLSCSKDSA-N 0 3 336.413 2.885 20 5 EFBDHN C[C@H](NC[C@H](O)COCc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000296846311 475503923 /nfs/dbraw/zinc/50/39/23/475503923.db2.gz XPPVQVXUNKGKCE-KSSFIOAISA-N 0 3 330.384 2.823 20 5 EFBDHN CC[C@H]1[C@H](C)CCN1Cc1ccc(OCC(=O)OC)c([N+](=O)[O-])c1 ZINC000354914542 475515639 /nfs/dbraw/zinc/51/56/39/475515639.db2.gz DPCQUNFLUKXTJP-OCCSQVGLSA-N 0 3 336.388 2.767 20 5 EFBDHN COc1cc(C(=O)Nc2ccc(CN(C)C)cc2)ccc1[N+](=O)[O-] ZINC000338036447 475530852 /nfs/dbraw/zinc/53/08/52/475530852.db2.gz KJPISEDVNCXOQP-UHFFFAOYSA-N 0 3 329.356 2.917 20 5 EFBDHN Cc1cc(F)c(NC(=O)N[C@H]2CN(C(C)C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000296926871 475538822 /nfs/dbraw/zinc/53/88/22/475538822.db2.gz ZNHDSRREFHZXSQ-RISCZKNCSA-N 0 3 338.383 2.893 20 5 EFBDHN O=C(CN(CC1CC1)CC1CCC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000361555463 475545006 /nfs/dbraw/zinc/54/50/06/475545006.db2.gz YMMNNJSRWCRUNH-UHFFFAOYSA-N 0 3 343.427 2.996 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21 ZINC000332184049 475546536 /nfs/dbraw/zinc/54/65/36/475546536.db2.gz ATXJKJVFTFAMPI-HOCLYGCPSA-N 0 3 331.416 2.768 20 5 EFBDHN CN1CC[C@H]2[C@@H](CCCN2C(=O)CSc2ccccc2[N+](=O)[O-])C1 ZINC000332182537 475546773 /nfs/dbraw/zinc/54/67/73/475546773.db2.gz VFVCTYQZYAQAFK-KBPBESRZSA-N 0 3 349.456 2.630 20 5 EFBDHN CC(C)c1ccc(CNC[C@H]2CCCS(=O)(=O)C2)cc1[N+](=O)[O-] ZINC000342218428 475575107 /nfs/dbraw/zinc/57/51/07/475575107.db2.gz IMRIVEUAQUYYJO-CQSZACIVSA-N 0 3 340.445 2.633 20 5 EFBDHN COC(=O)[C@H]1CSCCN([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000332258411 475577139 /nfs/dbraw/zinc/57/71/39/475577139.db2.gz ZZQDZDRCTWRTHQ-CHWSQXEVSA-N 0 3 338.429 2.802 20 5 EFBDHN CC(C)c1ccc(CN2CCO[C@H]3CCN(C)C[C@H]32)cc1[N+](=O)[O-] ZINC000332320511 475599528 /nfs/dbraw/zinc/59/95/28/475599528.db2.gz RFLFLQZZCZOJGR-MSOLQXFVSA-N 0 3 333.432 2.623 20 5 EFBDHN CC1=C(C)CN(CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)CC1 ZINC000361618006 475602123 /nfs/dbraw/zinc/60/21/23/475602123.db2.gz GYNLULHWGVASBX-UHFFFAOYSA-N 0 3 331.372 2.935 20 5 EFBDHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000346464291 475605351 /nfs/dbraw/zinc/60/53/51/475605351.db2.gz SZDXHBVATOCKCU-MRXNPFEDSA-N 0 3 344.415 2.809 20 5 EFBDHN C[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)C1=CCN(C)CC1 ZINC000358370485 475626387 /nfs/dbraw/zinc/62/63/87/475626387.db2.gz CPVFAPQBCNEJGU-NSHDSACASA-N 0 3 337.807 2.557 20 5 EFBDHN C[C@@H]1CCC[C@H](C)N1CCNC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000358416586 475662446 /nfs/dbraw/zinc/66/24/46/475662446.db2.gz CTQHFZVSSOMEEV-BETUJISGSA-N 0 3 337.395 2.656 20 5 EFBDHN CC[C@H]1CN2CCC[C@@H]2CN1C(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000332592763 475681176 /nfs/dbraw/zinc/68/11/76/475681176.db2.gz NWOSJGTVEYSTCA-LSDHHAIUSA-N 0 3 331.416 2.910 20 5 EFBDHN CCN1CCCN(c2c3ccc(OC)cc3ncc2[N+](=O)[O-])CC1 ZINC000297276667 475687310 /nfs/dbraw/zinc/68/73/10/475687310.db2.gz XDPZMBMPNVZJEV-UHFFFAOYSA-N 0 3 330.388 2.684 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN[C@@H]1CCC[C@@H]1OC(F)F ZINC000348519498 475719397 /nfs/dbraw/zinc/71/93/97/475719397.db2.gz DBGNPFAOJNQFMB-PWSUYJOCSA-N 0 3 343.330 2.592 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN[C@@H]1CCC[C@H]1OC(F)F ZINC000348519499 475720341 /nfs/dbraw/zinc/72/03/41/475720341.db2.gz DBGNPFAOJNQFMB-ZYHUDNBSSA-N 0 3 343.330 2.592 20 5 EFBDHN CO[C@@H]1CCCC[C@@H]1N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000361755441 475722942 /nfs/dbraw/zinc/72/29/42/475722942.db2.gz QRWWSEWGNJIFPX-DUVNUKRYSA-N 0 3 335.404 2.777 20 5 EFBDHN C[C@H](N[C@@H]1CCC[C@H]1OC(F)F)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000348538572 475737531 /nfs/dbraw/zinc/73/75/31/475737531.db2.gz UBYYALIDHHSYEB-ZWKOPEQDSA-N 0 3 343.330 2.672 20 5 EFBDHN O=C(CN[C@H]1CCc2ccccc2OC1)Nc1ccccc1[N+](=O)[O-] ZINC000338316277 475779130 /nfs/dbraw/zinc/77/91/30/475779130.db2.gz PWDFBJWVTCMACI-AWEZNQCLSA-N 0 3 341.367 2.517 20 5 EFBDHN C[C@@H](NC(=O)N1CC[C@]2(C1)CCCN(C)C2)c1ccccc1[N+](=O)[O-] ZINC000297509779 475788912 /nfs/dbraw/zinc/78/89/12/475788912.db2.gz YVVWUDBEASEGBF-RDTXWAMCSA-N 0 3 346.431 2.783 20 5 EFBDHN C[C@H](NC(=O)N1CC[C@]2(C1)CCCN(C)C2)c1ccccc1[N+](=O)[O-] ZINC000297509773 475789267 /nfs/dbraw/zinc/78/92/67/475789267.db2.gz YVVWUDBEASEGBF-KBXCAEBGSA-N 0 3 346.431 2.783 20 5 EFBDHN C[C@H](NC(=O)N(C)C[C@@H]1CCCN(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000297593287 475820719 /nfs/dbraw/zinc/82/07/19/475820719.db2.gz MWDPMLXFVGMNTJ-UONOGXRCSA-N 0 3 334.420 2.639 20 5 EFBDHN COc1cccc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000340173591 475823828 /nfs/dbraw/zinc/82/38/28/475823828.db2.gz SIVOQTFWTHIPPM-AWEZNQCLSA-N 0 3 328.372 2.685 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CNCC1(S(C)(=O)=O)CCC1 ZINC000355413062 475914527 /nfs/dbraw/zinc/91/45/27/475914527.db2.gz CFWOIZJQFIVVPT-UKTHLTGXSA-N 0 3 338.429 2.555 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCN(C)[C@@H](C)C1 ZINC000343286305 475921585 /nfs/dbraw/zinc/92/15/85/475921585.db2.gz XTXKCHNLZKQBRS-NWDGAFQWSA-N 0 3 337.445 2.919 20 5 EFBDHN CN(C)CCOc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000340294396 475924562 /nfs/dbraw/zinc/92/45/62/475924562.db2.gz CELQAEBLYDPPJL-UHFFFAOYSA-N 0 3 347.346 2.927 20 5 EFBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCN(CC2CC2)CC1 ZINC000355438507 475938264 /nfs/dbraw/zinc/93/82/64/475938264.db2.gz OJKJWLPHBWBHPT-UHFFFAOYSA-N 0 3 333.432 2.910 20 5 EFBDHN O=[N+]([O-])c1cccc(CCN[C@H](c2cccs2)c2nnc[nH]2)c1 ZINC000340317250 475942510 /nfs/dbraw/zinc/94/25/10/475942510.db2.gz VQOTWEBIQKMDNR-CQSZACIVSA-N 0 3 329.385 2.696 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)[C@@H](CN)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000358813938 475959818 /nfs/dbraw/zinc/95/98/18/475959818.db2.gz OFLCNRTYNVPQMA-LRDDRELGSA-N 0 3 345.374 2.962 20 5 EFBDHN Cc1nn(C)c(N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c1[N+](=O)[O-] ZINC000358881179 476008658 /nfs/dbraw/zinc/00/86/58/476008658.db2.gz NJCQUGLZUCGIAV-DZGCQCFKSA-N 0 3 329.404 2.884 20 5 EFBDHN CC(C)n1nccc1[C@@H]1OCC[C@@H]1NCc1cccc([N+](=O)[O-])c1 ZINC000343391324 476013641 /nfs/dbraw/zinc/01/36/41/476013641.db2.gz CLKWYXSMVXSWGH-DOTOQJQBSA-N 0 3 330.388 2.992 20 5 EFBDHN CC[C@H](NCc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CCOCC1 ZINC000343400608 476027880 /nfs/dbraw/zinc/02/78/80/476027880.db2.gz IBBHYBOKTSDQQJ-HNNXBMFYSA-N 0 3 346.387 2.940 20 5 EFBDHN C[C@H]1[C@@H](Nc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CCCN1C ZINC000343451722 476073483 /nfs/dbraw/zinc/07/34/83/476073483.db2.gz GDIJWKNILMVXEB-ZFWWWQNUSA-N 0 3 326.400 2.973 20 5 EFBDHN C[C@@H]1[C@H](Nc2ncc(Br)cc2[N+](=O)[O-])CCCN1C ZINC000343614389 476093385 /nfs/dbraw/zinc/09/33/85/476093385.db2.gz YFEDLUSPTMIOFQ-PSASIEDQSA-N 0 3 329.198 2.647 20 5 EFBDHN CC(C)CN(CCN(C)C)C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000340558444 476105291 /nfs/dbraw/zinc/10/52/91/476105291.db2.gz SRZQBQMSQQVJBP-UHFFFAOYSA-N 0 3 346.431 2.596 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(NC[C@H]2C[C@@H](O)CN2Cc2ccccc2)c1 ZINC000340573718 476115283 /nfs/dbraw/zinc/11/52/83/476115283.db2.gz MTFJCZTXIFVUSB-IAGOWNOFSA-N 0 3 341.411 2.951 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CNC[C@H]3COCCO3)s2)cc1 ZINC000338716216 476128921 /nfs/dbraw/zinc/12/89/21/476128921.db2.gz NYXQKAUBHHLEAF-AWEZNQCLSA-N 0 3 334.397 2.828 20 5 EFBDHN Cc1cc(N2C[C@@H](C)N(C)[C@@H](C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000338784459 476183488 /nfs/dbraw/zinc/18/34/88/476183488.db2.gz KAYRGOUHUSWMFL-OKILXGFUSA-N 0 3 341.415 2.889 20 5 EFBDHN CN(C)c1nccc(CN[C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)n1 ZINC000344293704 476224262 /nfs/dbraw/zinc/22/42/62/476224262.db2.gz IKBPUMGQDXLIII-MRXNPFEDSA-N 0 3 341.415 2.562 20 5 EFBDHN O=[N+]([O-])c1cccc(CN[C@H](Cc2ccccc2)[C@H](O)C(F)F)c1 ZINC000344316954 476245364 /nfs/dbraw/zinc/24/53/64/476245364.db2.gz KQKBRVMIGVVVEY-CVEARBPZSA-N 0 3 336.338 2.922 20 5 EFBDHN O=[N+]([O-])c1cccc(CN[C@@H](Cc2ccccc2)[C@H](O)C(F)F)c1 ZINC000344316955 476245614 /nfs/dbraw/zinc/24/56/14/476245614.db2.gz KQKBRVMIGVVVEY-HOTGVXAUSA-N 0 3 336.338 2.922 20 5 EFBDHN C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CCN1Cc1ccccc1 ZINC000362487384 476278386 /nfs/dbraw/zinc/27/83/86/476278386.db2.gz UOORWGDMCXHYTQ-CQSZACIVSA-N 0 3 342.399 2.660 20 5 EFBDHN CN(C)[C@@H](CNc1ncnc2cccc([N+](=O)[O-])c21)c1cccs1 ZINC000357324321 476331543 /nfs/dbraw/zinc/33/15/43/476331543.db2.gz PTRCETXGLPMLTH-ZDUSSCGKSA-N 0 3 343.412 2.736 20 5 EFBDHN CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)c1ccc([N+](=O)[O-])nc1 ZINC000362677256 476348413 /nfs/dbraw/zinc/34/84/13/476348413.db2.gz XLXJKBSNVUCTGF-YOEHRIQHSA-N 0 3 327.388 2.514 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2ccc(CNC[C@@H](CO)[C@H]3CCOC3)o2)c1 ZINC000360761711 476371266 /nfs/dbraw/zinc/37/12/66/476371266.db2.gz CLJFRZNGHZNBBV-GJZGRUSLSA-N 0 3 346.383 2.589 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2ccc(CNC[C@H](CO)[C@@H]3CCOC3)o2)c1 ZINC000360761712 476371346 /nfs/dbraw/zinc/37/13/46/476371346.db2.gz CLJFRZNGHZNBBV-HUUCEWRRSA-N 0 3 346.383 2.589 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCCN(C)[C@@H]1C ZINC000360800574 476396194 /nfs/dbraw/zinc/39/61/94/476396194.db2.gz OFJKIOZRJCQXGS-UNEWFSDZSA-N 0 3 333.432 2.762 20 5 EFBDHN CC(C)[C@@H](C(=O)NCCNc1ccc([N+](=O)[O-])cc1)N1CCCCC1 ZINC000354068263 476403120 /nfs/dbraw/zinc/40/31/20/476403120.db2.gz MZVOFCXDKMSNRG-KRWDZBQOSA-N 0 3 348.447 2.633 20 5 EFBDHN CC1(C)CN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CCCO1 ZINC000369597674 476430791 /nfs/dbraw/zinc/43/07/91/476430791.db2.gz POTJAIPESXRXJZ-UHFFFAOYSA-N 0 3 339.367 2.563 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000360940530 476491278 /nfs/dbraw/zinc/49/12/78/476491278.db2.gz ZWMSDMLNMZELFJ-ZBFHGGJFSA-N 0 3 345.443 2.930 20 5 EFBDHN COC(=O)[C@@H]1CN(Cc2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000369721897 476494746 /nfs/dbraw/zinc/49/47/46/476494746.db2.gz PCODKBHPIURJIR-DLBZAZTESA-N 0 3 340.379 2.983 20 5 EFBDHN C[C@@H]1CCC[C@@H](C)N(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000357737934 476568717 /nfs/dbraw/zinc/56/87/17/476568717.db2.gz GCJZBWIWWSUBIM-ZIAGYGMSSA-N 0 3 331.416 2.994 20 5 EFBDHN CCCN(CC)C[C@@H](C)Nc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000357777021 476595754 /nfs/dbraw/zinc/59/57/54/476595754.db2.gz XVNZZOMCNGMQCZ-GFCCVEGCSA-N 0 3 343.449 2.531 20 5 EFBDHN C[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)CCN1C ZINC000361113567 476609218 /nfs/dbraw/zinc/60/92/18/476609218.db2.gz ZNZRZJSLUOIBOC-HIFRSBDPSA-N 0 3 346.431 2.725 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(CN(C)C)cc2)c1 ZINC000354373699 476618537 /nfs/dbraw/zinc/61/85/37/476618537.db2.gz CJEKNMQAIQSFDR-UHFFFAOYSA-N 0 3 329.356 2.917 20 5 EFBDHN CCCN1CCC[C@@H]1CNC(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000354379129 476623616 /nfs/dbraw/zinc/62/36/16/476623616.db2.gz GPTMHRDYYRDSQT-CQSZACIVSA-N 0 3 333.432 2.863 20 5 EFBDHN C[C@H](NCCC(=O)Nc1ccccc1[N+](=O)[O-])c1cncc(F)c1 ZINC000361136799 476628981 /nfs/dbraw/zinc/62/89/81/476628981.db2.gz SDVAOWDHJQLUSL-NSHDSACASA-N 0 3 332.335 2.808 20 5 EFBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])N[C@H](C)C(=O)N(C)C ZINC000357835490 476638871 /nfs/dbraw/zinc/63/88/71/476638871.db2.gz PBLNMMYPCXIFKN-NEPJUHHUSA-N 0 3 325.434 2.532 20 5 EFBDHN Cn1ccnc1[C@@H]1CCCN(CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000365658233 476665495 /nfs/dbraw/zinc/66/54/95/476665495.db2.gz DOFSGHFVIRWBMO-CQSZACIVSA-N 0 3 330.388 2.587 20 5 EFBDHN COC(=O)COc1ccc(CN2CC[C@@H](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000354524332 476707937 /nfs/dbraw/zinc/70/79/37/476707937.db2.gz GIDVSXRONXOBFQ-HNNXBMFYSA-N 0 3 348.399 2.769 20 5 EFBDHN Cc1c([C@H](C)N[C@H]2CCCN(c3ccnn3C)C2)cccc1[N+](=O)[O-] ZINC000365804875 476709097 /nfs/dbraw/zinc/70/90/97/476709097.db2.gz HGMNVZNZMMEUOT-GJZGRUSLSA-N 0 3 343.431 2.956 20 5 EFBDHN C[C@H](N(C)Cc1ccc(Br)cc1[N+](=O)[O-])C(C)(C)O ZINC000382809714 476748194 /nfs/dbraw/zinc/74/81/94/476748194.db2.gz OXMUXCQWTKRQPV-VIFPVBQESA-N 0 3 331.210 2.949 20 5 EFBDHN CC1(C)CCCN1CCNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413870213 476771416 /nfs/dbraw/zinc/77/14/16/476771416.db2.gz YMTTVPWCWVDVKB-JKSUJKDBSA-N 0 3 331.416 2.689 20 5 EFBDHN O=C(CCN1CCC[C@H](OCC2CC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000375316649 476774571 /nfs/dbraw/zinc/77/45/71/476774571.db2.gz YJTWFTTZMYYDMN-KRWDZBQOSA-N 0 3 347.415 2.814 20 5 EFBDHN CN(C)C1(CNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CCC1 ZINC000445853293 476780408 /nfs/dbraw/zinc/78/04/08/476780408.db2.gz FNGHLMZXHVNBAX-UHFFFAOYSA-N 0 3 340.811 2.532 20 5 EFBDHN C[C@]12CN(Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C[C@H]1[C@@H]1CC[C@H]2C1 ZINC000452053916 476797773 /nfs/dbraw/zinc/79/77/73/476797773.db2.gz PUEDZFLTGSLSJX-WHTWZSQMSA-N 0 3 329.400 2.562 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc3c(c2)CNCC3)c1 ZINC000422830281 476799676 /nfs/dbraw/zinc/79/96/76/476799676.db2.gz CKBZALFNMCFJGS-UHFFFAOYSA-N 0 3 341.367 2.892 20 5 EFBDHN Cc1n[nH]cc1C1CCN(CCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000375372213 476801458 /nfs/dbraw/zinc/80/14/58/476801458.db2.gz ACZHYDQWXXBGQO-UHFFFAOYSA-N 0 3 330.388 2.885 20 5 EFBDHN CC(C)N1CC[C@H](N(C)C(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000457094565 476871367 /nfs/dbraw/zinc/87/13/67/476871367.db2.gz ZQXZRTMRKUBVMC-AWEZNQCLSA-N 0 3 337.445 2.628 20 5 EFBDHN CC(C)N1CC[C@H](N(C)C(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000457096609 476873321 /nfs/dbraw/zinc/87/33/21/476873321.db2.gz RAXDLLGTTCJGDC-JSGCOSHPSA-N 0 3 337.395 2.779 20 5 EFBDHN CC(C)N1CC[C@H](N(C)C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000457113184 476884013 /nfs/dbraw/zinc/88/40/13/476884013.db2.gz JWCVCNHTVUJGSW-ZDUSSCGKSA-N 0 3 325.796 2.803 20 5 EFBDHN CC(C)N1CC[C@@H](N(C)C(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000457124376 476889111 /nfs/dbraw/zinc/88/91/11/476889111.db2.gz PSEZKAFIIPLIGR-QGZVFWFLSA-N 0 3 348.447 2.728 20 5 EFBDHN C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000370636280 476907350 /nfs/dbraw/zinc/90/73/50/476907350.db2.gz SJHAMXRBVKHXDC-YPMHNXCESA-N 0 3 337.807 2.947 20 5 EFBDHN COc1ccc(C(=O)N[C@@H](CC(C)C)CN2CCCC2)cc1[N+](=O)[O-] ZINC000452341128 476922965 /nfs/dbraw/zinc/92/29/65/476922965.db2.gz GGQWHOBNWVXSTH-HNNXBMFYSA-N 0 3 349.431 2.844 20 5 EFBDHN COc1cc(C(=O)N[C@@H](CC(C)C)CN2CCCC2)ccc1[N+](=O)[O-] ZINC000452344361 476925398 /nfs/dbraw/zinc/92/53/98/476925398.db2.gz NPUYCKAVHCFFSQ-HNNXBMFYSA-N 0 3 349.431 2.844 20 5 EFBDHN CN(C)c1cccc(CN[C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)n1 ZINC000447589644 477017948 /nfs/dbraw/zinc/01/79/48/477017948.db2.gz YTHOYUSLKGSGBH-HUUCEWRRSA-N 0 3 344.419 2.526 20 5 EFBDHN CN(C)[C@@H](CC(=O)NCCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000416183904 477059002 /nfs/dbraw/zinc/05/90/02/477059002.db2.gz LWFMTNYYKTXXML-SFHVURJKSA-N 0 3 341.411 2.947 20 5 EFBDHN CC(C)N1CCN([C@@H]2CCN([C@@H](C)c3cccc([N+](=O)[O-])c3)C2)CC1 ZINC000375892990 477066984 /nfs/dbraw/zinc/06/69/84/477066984.db2.gz WSPWVNSMMUYCFA-QFBILLFUSA-N 0 3 346.475 2.756 20 5 EFBDHN CN1CCCC(C)(C)[C@@H]1CNC(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000447898930 477088304 /nfs/dbraw/zinc/08/83/04/477088304.db2.gz ZZGXYZUQHOBDMW-AWEZNQCLSA-N 0 3 338.383 2.976 20 5 EFBDHN Cc1c(CC(=O)Nc2ccc3c(c2F)CCNC3)cccc1[N+](=O)[O-] ZINC000423627363 477093303 /nfs/dbraw/zinc/09/33/03/477093303.db2.gz HHHJPKZSGBDMCI-UHFFFAOYSA-N 0 3 343.358 2.869 20 5 EFBDHN O=C([C@@H]1CCCN1C1CC1)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452833892 477101223 /nfs/dbraw/zinc/10/12/23/477101223.db2.gz BJANNKGWLAVXRA-YJBOKZPZSA-N 0 3 343.427 2.928 20 5 EFBDHN CC(C)[C@H](C(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)N(C)C ZINC000452850640 477106948 /nfs/dbraw/zinc/10/69/48/477106948.db2.gz MQZPVKZNTFSXBM-NVXWUHKLSA-N 0 3 333.432 2.887 20 5 EFBDHN CCNc1ccc(C(=O)N(C)[C@@H]2CCN(C(C)C)C2)cc1[N+](=O)[O-] ZINC000411086729 477110044 /nfs/dbraw/zinc/11/00/44/477110044.db2.gz PGPUBBZQPZICSG-CQSZACIVSA-N 0 3 334.420 2.581 20 5 EFBDHN CN1CCCC(C)(C)[C@H]1CNC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000447982658 477110000 /nfs/dbraw/zinc/11/00/00/477110000.db2.gz MHABJLJHYWNQOG-MRXNPFEDSA-N 0 3 348.447 2.557 20 5 EFBDHN CN(C)C1(CNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000416301582 477114197 /nfs/dbraw/zinc/11/41/97/477114197.db2.gz LNBABNYSPBOHBM-UHFFFAOYSA-N 0 3 346.412 2.542 20 5 EFBDHN CCNc1ccc(C(=O)NC[C@@H]2N(C)CCCC2(C)C)cc1[N+](=O)[O-] ZINC000448056825 477123622 /nfs/dbraw/zinc/12/36/22/477123622.db2.gz RTZPKHODHHAATF-INIZCTEOSA-N 0 3 348.447 2.877 20 5 EFBDHN CCN1CCC(NC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)CC1 ZINC000411236291 477164517 /nfs/dbraw/zinc/16/45/17/477164517.db2.gz HTOORSAPQUAQGI-UHFFFAOYSA-N 0 3 335.404 2.596 20 5 EFBDHN C[C@H](CCN1CCN(C)CC1)Nc1ccnc2c1cccc2[N+](=O)[O-] ZINC000432142059 477166980 /nfs/dbraw/zinc/16/69/80/477166980.db2.gz XSLFDUNDZOEPSC-CQSZACIVSA-N 0 3 343.431 2.581 20 5 EFBDHN CN(C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C1CCN(C)CC1 ZINC000448556491 477192022 /nfs/dbraw/zinc/19/20/22/477192022.db2.gz NIKZBSKITIVPIV-UHFFFAOYSA-N 0 3 345.321 2.780 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@H]1CC(=O)N(CC)C1 ZINC000453352631 477212340 /nfs/dbraw/zinc/21/23/40/477212340.db2.gz JYHWDFNRXLWJJH-OLZOCXBDSA-N 0 3 337.445 2.676 20 5 EFBDHN CCC[C@@H](NCCN1C[C@H]2CC[C@@H](C1)O2)c1cccc([N+](=O)[O-])c1 ZINC000453359692 477212974 /nfs/dbraw/zinc/21/29/74/477212974.db2.gz UQIYTEBPZRRMJX-FGTMMUONSA-N 0 3 333.432 2.889 20 5 EFBDHN CCc1ccccc1[C@H](N)CNC(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000423982377 477244616 /nfs/dbraw/zinc/24/46/16/477244616.db2.gz RNOFZDBMFRNXLL-OAHLLOKOSA-N 0 3 343.383 2.596 20 5 EFBDHN CCc1ccc(C(=O)N2C[C@@H](N)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000424070554 477281168 /nfs/dbraw/zinc/28/11/68/477281168.db2.gz CQPIXTYJJODZHG-HNNXBMFYSA-N 0 3 325.368 2.687 20 5 EFBDHN Cn1ccnc1[C@H]1OCCC[C@@H]1NC/C=C\c1ccccc1[N+](=O)[O-] ZINC000433946739 477329420 /nfs/dbraw/zinc/32/94/20/477329420.db2.gz VYLXBJLWRVWPQY-VLMYMSAOSA-N 0 3 342.399 2.851 20 5 EFBDHN Cc1cc(NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)ccc1CN(C)C ZINC000458284714 477335084 /nfs/dbraw/zinc/33/50/84/477335084.db2.gz NMZSXYREPAFGKG-UHFFFAOYSA-N 0 3 345.403 2.535 20 5 EFBDHN O=C(NC[C@H]1CCCCN1C1CC1)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000434427302 477335657 /nfs/dbraw/zinc/33/56/57/477335657.db2.gz ZWGCUSSNFSBJDO-CYBMUJFWSA-N 0 3 342.399 2.823 20 5 EFBDHN CCCN(CCN1CCCC1)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000411720886 477344995 /nfs/dbraw/zinc/34/49/95/477344995.db2.gz QYOPVXLSFJLCIS-OAHLLOKOSA-N 0 3 348.447 2.730 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000448953973 477357131 /nfs/dbraw/zinc/35/71/31/477357131.db2.gz ITNXNHJQOCAPCE-INIZCTEOSA-N 0 3 347.415 2.548 20 5 EFBDHN O=C(CCN1CCSC[C@@H]1C1CC1)Nc1ccccc1[N+](=O)[O-] ZINC000411793411 477371049 /nfs/dbraw/zinc/37/10/49/477371049.db2.gz RXNOEWOFCBRYQG-OAHLLOKOSA-N 0 3 335.429 2.751 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@@](C(N)=O)(c2ccccc2)C1 ZINC000411971583 477401348 /nfs/dbraw/zinc/40/13/48/477401348.db2.gz UERVPZCZIXDMGY-KUHUBIRLSA-N 0 3 339.395 2.785 20 5 EFBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[C@](C(N)=O)(c2ccccc2)C1 ZINC000411971582 477402050 /nfs/dbraw/zinc/40/20/50/477402050.db2.gz UERVPZCZIXDMGY-IFXJQAMLSA-N 0 3 339.395 2.785 20 5 EFBDHN Cc1cc(CN)cc(NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000424433306 477405232 /nfs/dbraw/zinc/40/52/32/477405232.db2.gz IHYDTFJXICXTSR-UHFFFAOYSA-N 0 3 340.383 2.952 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])NCCS(=O)(=O)c1ccccc1 ZINC000449094419 477435985 /nfs/dbraw/zinc/43/59/85/477435985.db2.gz RUBOLGVRZNWCCM-AWEZNQCLSA-N 0 3 348.424 2.589 20 5 EFBDHN COc1cccc([C@H]2C[C@H](C)CN2CCn2ccc([N+](=O)[O-])n2)c1 ZINC000371716036 477461387 /nfs/dbraw/zinc/46/13/87/477461387.db2.gz MRPOCXPGKYTKEQ-XJKSGUPXSA-N 0 3 330.388 2.883 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])NCC(=O)N(C)C1CCCCC1 ZINC000449175849 477471766 /nfs/dbraw/zinc/47/17/66/477471766.db2.gz LFDRHRADKDFNAY-CQSZACIVSA-N 0 3 333.432 2.907 20 5 EFBDHN COCCN1CCC[C@H]1CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000436402878 477476222 /nfs/dbraw/zinc/47/62/22/477476222.db2.gz CHBKBKUQVNNESD-JTQLQIEISA-N 0 3 348.325 2.531 20 5 EFBDHN C[C@H](NC(=O)N1CC[C@@H](N2CCCCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000455094720 477497149 /nfs/dbraw/zinc/49/71/49/477497149.db2.gz PJUOFBPCEHLAKT-WMLDXEAASA-N 0 3 346.431 2.926 20 5 EFBDHN CC(=O)Nc1ccc(CN[C@@H](C)Cc2ccccc2[N+](=O)[O-])cn1 ZINC000449293822 477529127 /nfs/dbraw/zinc/52/91/27/477529127.db2.gz WSVSGPCJNULBIH-LBPRGKRZSA-N 0 3 328.372 2.669 20 5 EFBDHN CNC(=O)C[C@@H](N[C@@H](C)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000449303320 477534836 /nfs/dbraw/zinc/53/48/36/477534836.db2.gz XVJXLWJGYUJGMA-WMLDXEAASA-N 0 3 341.411 2.993 20 5 EFBDHN CN1CCN(CCNc2ccc([N+](=O)[O-])c3ncccc23)CC1(C)C ZINC000413281381 477608366 /nfs/dbraw/zinc/60/83/66/477608366.db2.gz KJTXJCRWOZLEQY-UHFFFAOYSA-N 0 3 343.431 2.581 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H]2CN(C)C[C@H]21 ZINC000425043001 477615251 /nfs/dbraw/zinc/61/52/51/477615251.db2.gz FFUGKPBMOWWPCA-HEHGZKQESA-N 0 3 349.456 2.628 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]2CN(C)C[C@H]21 ZINC000425061068 477623244 /nfs/dbraw/zinc/62/32/44/477623244.db2.gz XUJQNXRZRVXXMM-SWLSCSKDSA-N 0 3 349.456 2.873 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H]2CN(C)C[C@H]21 ZINC000425065056 477626672 /nfs/dbraw/zinc/62/66/72/477626672.db2.gz JVWCRMBVPXGXKJ-XYJFISCASA-N 0 3 345.443 2.716 20 5 EFBDHN O=[N+]([O-])c1ccc(NC[C@@H]2CCCN2CCCO)cc1C(F)(F)F ZINC000450590920 477644706 /nfs/dbraw/zinc/64/47/06/477644706.db2.gz FEOBBDNAOPGZGE-LBPRGKRZSA-N 0 3 347.337 2.872 20 5 EFBDHN CN1CC[C@@H]2CN(c3ccc([N+](=O)[O-])c(-c4ccc(F)cc4)n3)C[C@@H]21 ZINC000450780682 477713549 /nfs/dbraw/zinc/71/35/49/477713549.db2.gz QVOWTMZQFJXSNX-CJNGLKHVSA-N 0 3 342.374 2.936 20 5 EFBDHN CN1CC[C@@H]2CN(c3nc(-c4ccc([N+](=O)[O-])cc4)cs3)C[C@@H]21 ZINC000450782568 477715113 /nfs/dbraw/zinc/71/51/13/477715113.db2.gz YHAOEFXGIFTPRC-DOMZBBRYSA-N 0 3 330.413 2.859 20 5 EFBDHN Cc1cc(N2C[C@H]3CCN(C)[C@H]3C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000450798629 477720195 /nfs/dbraw/zinc/72/01/95/477720195.db2.gz VUOKLVCNOSUJDF-ZBFHGGJFSA-N 0 3 339.399 2.501 20 5 EFBDHN Cc1nc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)ncc1[N+](=O)[O-] ZINC000450806665 477723870 /nfs/dbraw/zinc/72/38/70/477723870.db2.gz FIPBLELWSALRLR-CQSZACIVSA-N 0 3 341.415 2.652 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCN2CCNC[C@@H]2c2ccccc2)cc1 ZINC000420406377 477752006 /nfs/dbraw/zinc/75/20/06/477752006.db2.gz NUYPHNKTZJHZDE-GOSISDBHSA-N 0 3 327.384 2.620 20 5 EFBDHN O=C(N[C@H]1CCN(C2CC2)C1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000437967615 477781106 /nfs/dbraw/zinc/78/11/06/477781106.db2.gz BYIKHHDYCDGTAN-AWEZNQCLSA-N 0 3 344.415 2.506 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@@H]2CCn3ccnc3C2)cc1[N+](=O)[O-] ZINC000427881900 477783639 /nfs/dbraw/zinc/78/36/39/477783639.db2.gz KJAIQKKBFHBWRZ-GXTWGEPZSA-N 0 3 330.388 2.856 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@H]2CCn3ccnc3C2)cc1[N+](=O)[O-] ZINC000427881901 477784317 /nfs/dbraw/zinc/78/43/17/477784317.db2.gz KJAIQKKBFHBWRZ-JSGCOSHPSA-N 0 3 330.388 2.856 20 5 EFBDHN C[C@@H]1CN(C(=O)/C=C\c2ccc(F)cc2[N+](=O)[O-])CCN(C2CC2)C1 ZINC000493790332 477825277 /nfs/dbraw/zinc/82/52/77/477825277.db2.gz YEVLRYUBVPKANI-QTEJZOKPSA-N 0 3 347.390 2.690 20 5 EFBDHN C[C@H]1CN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)CCN(C2CC2)C1 ZINC000493823614 477843016 /nfs/dbraw/zinc/84/30/16/477843016.db2.gz NVTYYPBNMFDSRQ-RXTQTKKPSA-N 0 3 329.400 2.551 20 5 EFBDHN CN(C)CCc1ccccc1NC(=O)CNc1ccccc1[N+](=O)[O-] ZINC000438565404 477866352 /nfs/dbraw/zinc/86/63/52/477866352.db2.gz CPGOHTDSZMFDFD-UHFFFAOYSA-N 0 3 342.399 2.750 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@@H]2CCN(CCOCC3CCCC3)C2)nc1 ZINC000459377343 477874151 /nfs/dbraw/zinc/87/41/51/477874151.db2.gz MIEWUOOUOSEHSA-OAHLLOKOSA-N 0 3 334.420 2.683 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2cnc(CCN3CC[C@@]34CCOC4)o2)c1 ZINC000421011316 477900486 /nfs/dbraw/zinc/90/04/86/477900486.db2.gz DKNVSWPNOVNPJJ-KRWDZBQOSA-N 0 3 329.356 2.657 20 5 EFBDHN Cc1c(CC(=O)NC[C@H](C)N2CCCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000438903070 477902900 /nfs/dbraw/zinc/90/29/00/477902900.db2.gz PQWZGTJPVIHERJ-KGLIPLIRSA-N 0 3 333.432 2.825 20 5 EFBDHN O=[N+]([O-])c1ccccc1CNC[C@]1(CO)C[C@H]1c1ccc(F)cc1 ZINC000428533370 477920738 /nfs/dbraw/zinc/92/07/38/477920738.db2.gz GXDSZEFHRFVDDF-WMZOPIPTSA-N 0 3 330.359 2.990 20 5 EFBDHN O=[N+]([O-])c1cccc(CNC[C@]2(CO)C[C@@H]2c2ccc(F)cc2)c1 ZINC000428542745 477926247 /nfs/dbraw/zinc/92/62/47/477926247.db2.gz YFNKFXPMMMOIOL-MSOLQXFVSA-N 0 3 330.359 2.990 20 5 EFBDHN C[C@H]1CCN(CCNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000532625209 477959325 /nfs/dbraw/zinc/95/93/25/477959325.db2.gz VAGYJDCLESLGBL-JTQLQIEISA-N 0 3 345.321 2.685 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)C[C@@H]1CCCN1C ZINC000421110194 477966383 /nfs/dbraw/zinc/96/63/83/477966383.db2.gz AWPHPRMBZKEGCD-ZDUSSCGKSA-N 0 3 336.392 2.551 20 5 EFBDHN CC(C)[C@@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])C1(CO)CCCC1 ZINC000459548319 477966411 /nfs/dbraw/zinc/96/64/11/477966411.db2.gz XSPHTHBYQMADQA-QGZVFWFLSA-N 0 3 349.431 2.700 20 5 EFBDHN C[C@H]1C[C@H]1N1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000494373417 477973314 /nfs/dbraw/zinc/97/33/14/477973314.db2.gz XZSJQZZFHMUTDP-HEHGZKQESA-N 0 3 332.404 2.789 20 5 EFBDHN C[C@H]1C[C@@H]1N1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000494375876 477974620 /nfs/dbraw/zinc/97/46/20/477974620.db2.gz RWLHADYJXPFMBE-XEZPLFJOSA-N 0 3 332.404 2.789 20 5 EFBDHN CO[C@@H]1C[C@H](N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1(C)C ZINC000439510610 477994907 /nfs/dbraw/zinc/99/49/07/477994907.db2.gz GZKIURKRTJNTKG-TUKIKUTGSA-N 0 3 335.404 2.633 20 5 EFBDHN O=[N+]([O-])c1ccc2oc(CN3CCC[C@@H]3[C@H]3CCC[C@@H]3O)nc2c1 ZINC000451415777 478002419 /nfs/dbraw/zinc/00/24/19/478002419.db2.gz JUCMIFVLHFOJMY-YUELXQCFSA-N 0 3 331.372 2.861 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)CCN1C ZINC000494543264 478006002 /nfs/dbraw/zinc/00/60/02/478006002.db2.gz AUMRIONKHJMOBE-ZFWWWQNUSA-N 0 3 346.431 2.752 20 5 EFBDHN CC1(C)CCCN(CCNc2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])C1 ZINC000517009156 478033577 /nfs/dbraw/zinc/03/35/77/478033577.db2.gz WNHHCIGQLYBSEI-UHFFFAOYSA-N 0 3 345.403 2.778 20 5 EFBDHN CCO[C@H]1C[C@H](NCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C12CCC2 ZINC000451481508 478041247 /nfs/dbraw/zinc/04/12/47/478041247.db2.gz RHHGYGYSEZBQRY-HOTGVXAUSA-N 0 3 347.415 2.779 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1CCN(C2CCCC2)CC1 ZINC000429200747 478077652 /nfs/dbraw/zinc/07/76/52/478077652.db2.gz RGHBZGXBUKTTIO-UHFFFAOYSA-N 0 3 347.415 2.754 20 5 EFBDHN C[C@@H]1CCCN(CCNC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])C1 ZINC000487861898 478079325 /nfs/dbraw/zinc/07/93/25/478079325.db2.gz TWUUKUANGVVRFQ-CQSZACIVSA-N 0 3 348.447 2.861 20 5 EFBDHN CN(Cc1cc([N+](=O)[O-])ccc1OC(F)F)C[C@H]1CCCN1C ZINC000421412268 478079675 /nfs/dbraw/zinc/07/96/75/478079675.db2.gz SDXXGUULHXFNCN-CYBMUJFWSA-N 0 3 329.347 2.722 20 5 EFBDHN CN(C)Cc1ccccc1C(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000487940690 478089347 /nfs/dbraw/zinc/08/93/47/478089347.db2.gz BQIINBXPUYCSJL-UHFFFAOYSA-N 0 3 341.411 2.971 20 5 EFBDHN C[C@@H](CN(C)CCOc1ccccc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000459786123 478090404 /nfs/dbraw/zinc/09/04/04/478090404.db2.gz BDHBPUVHZJPULA-ZDUSSCGKSA-N 0 3 338.404 2.883 20 5 EFBDHN Cc1c(NC(=O)[C@@H](C)N2CCN(C)[C@@H](C(C)C)C2)cccc1[N+](=O)[O-] ZINC000487987736 478099712 /nfs/dbraw/zinc/09/97/12/478099712.db2.gz KWEFRTPKMYFSEM-RHSMWYFYSA-N 0 3 348.447 2.502 20 5 EFBDHN COC(=O)[C@H]1CCN(Cc2ccc([N+](=O)[O-])c(OC)c2)[C@H]1C(C)C ZINC000429359139 478120387 /nfs/dbraw/zinc/12/03/87/478120387.db2.gz AWAKBWXDQSJGKF-BBRMVZONSA-N 0 3 336.388 2.623 20 5 EFBDHN CNc1ccc(C(=O)N2CCCN(CC3CCC3)CC2)cc1[N+](=O)[O-] ZINC000560739424 478129240 /nfs/dbraw/zinc/12/92/40/478129240.db2.gz BDMOJWQATKFNJG-UHFFFAOYSA-N 0 3 346.431 2.585 20 5 EFBDHN CNc1ccc(C(=O)NC[C@@H](C)N2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000518224904 478152866 /nfs/dbraw/zinc/15/28/66/478152866.db2.gz JCOWBRAXYZPMKJ-CHWSQXEVSA-N 0 3 334.420 2.629 20 5 EFBDHN C[C@H]1C[C@@H]1N1CCN(c2c3c(ccc2[N+](=O)[O-])NCC3)C[C@@H](C)C1 ZINC000488747163 478178699 /nfs/dbraw/zinc/17/86/99/478178699.db2.gz IJVGZISGKPGFIN-DCGLDWPTSA-N 0 3 330.432 2.729 20 5 EFBDHN COC(=O)c1ccc([N+](=O)[O-])c(N2CCN([C@@H]3C[C@H]3C)C[C@H](C)C2)c1 ZINC000488763653 478179906 /nfs/dbraw/zinc/17/99/06/478179906.db2.gz JSXKSTKVZSRSFZ-WOSRLPQWSA-N 0 3 347.415 2.548 20 5 EFBDHN CC(=O)NCC[C@H]1CCCN(C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000561982502 478211655 /nfs/dbraw/zinc/21/16/55/478211655.db2.gz HMYSWGNCMQRPBW-CDVVCGDMSA-N 0 3 331.416 2.846 20 5 EFBDHN Cc1c([C@H](C)NCCC(=O)Nc2ccccn2)cccc1[N+](=O)[O-] ZINC000562018608 478213280 /nfs/dbraw/zinc/21/32/80/478213280.db2.gz BCRYZBYLQOSSOB-ZDUSSCGKSA-N 0 3 328.372 2.978 20 5 EFBDHN C[C@@H](C(=O)N1CC[C@@H](N2CCCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000562300323 478229371 /nfs/dbraw/zinc/22/93/71/478229371.db2.gz KFEWPJKDSSJQKI-RHSMWYFYSA-N 0 3 331.416 2.785 20 5 EFBDHN C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)N[C@H]1CCCc2c[nH]nc21 ZINC000536843462 478276026 /nfs/dbraw/zinc/27/60/26/478276026.db2.gz CXOPJDGZGPJUMZ-ABAIWWIYSA-N 0 3 343.387 2.702 20 5 EFBDHN COc1ccc(-c2ccc(CN3CC[C@@H](O)[C@H]3C)o2)c([N+](=O)[O-])c1 ZINC000590661481 478279465 /nfs/dbraw/zinc/27/94/65/478279465.db2.gz WKFUNCXHFGGSHU-BDJLRTHQSA-N 0 3 332.356 2.819 20 5 EFBDHN CCC(C)(C)N1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 ZINC000594389109 478357237 /nfs/dbraw/zinc/35/72/37/478357237.db2.gz FJQMDTKSGJQVJR-UHFFFAOYSA-N 0 3 333.432 2.860 20 5 EFBDHN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CC[C@@]2(CCN(C)C2)C1 ZINC000590830516 478360122 /nfs/dbraw/zinc/36/01/22/478360122.db2.gz MGNOQXUPGGYQMQ-QGZVFWFLSA-N 0 3 332.404 2.771 20 5 EFBDHN C[C@H](NC(=O)N1CCCC12CCN(C)CC2)c1ccc([N+](=O)[O-])cc1 ZINC000590942923 478409600 /nfs/dbraw/zinc/40/96/00/478409600.db2.gz RAJOOYWAPCHVPX-AWEZNQCLSA-N 0 3 346.431 2.926 20 5 EFBDHN CC[C@@H]1CN(C)CCN1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000563022652 478421030 /nfs/dbraw/zinc/42/10/30/478421030.db2.gz CAYXIOOTHIQASZ-OAHLLOKOSA-N 0 3 344.415 2.818 20 5 EFBDHN C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1nnc([C@@H]2CCCO2)[n-]1 ZINC000594514461 478421387 /nfs/dbraw/zinc/42/13/87/478421387.db2.gz YFKWYUXQHXDJGZ-WFASDCNBSA-N 0 3 345.403 2.675 20 5 EFBDHN O=C1[C@@H](N2CC[C@H](C3CCC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000591062985 478446731 /nfs/dbraw/zinc/44/67/31/478446731.db2.gz DSZANTDWTBOAMK-YOEHRIQHSA-N 0 3 329.400 2.822 20 5 EFBDHN CCC(C)(C)N1CCN(c2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])CC1 ZINC000594593813 478454358 /nfs/dbraw/zinc/45/43/58/478454358.db2.gz DIQMXTNIFBGMFE-UHFFFAOYSA-N 0 3 345.403 2.554 20 5 EFBDHN COC(=O)c1cc(C)nc(N[C@H]2CCCN3CCCC[C@H]23)c1[N+](=O)[O-] ZINC000594603781 478462178 /nfs/dbraw/zinc/46/21/78/478462178.db2.gz VTRMBSLUVKXXTK-UONOGXRCSA-N 0 3 348.403 2.514 20 5 EFBDHN COCCN1CCC[C@H](Nc2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000591146504 478474337 /nfs/dbraw/zinc/47/43/37/478474337.db2.gz FUHMOEBRBPQDBW-AWEZNQCLSA-N 0 3 330.388 2.666 20 5 EFBDHN CN(Cc1ccccc1)[C@H]1CCN(c2ncc([N+](=O)[O-])cc2F)C1 ZINC000591148850 478475493 /nfs/dbraw/zinc/47/54/93/478475493.db2.gz FLWNRSIAPLIQJU-AWEZNQCLSA-N 0 3 330.363 2.840 20 5 EFBDHN CCc1ccc(C(=O)N2CCC[C@@]3(CCN(C)C3)C2)cc1[N+](=O)[O-] ZINC000597713068 478476196 /nfs/dbraw/zinc/47/61/96/478476196.db2.gz BMNZULDXFBXZEX-SFHVURJKSA-N 0 3 331.416 2.715 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@@]3(CCN(C)C3)C2)c1 ZINC000597717051 478477850 /nfs/dbraw/zinc/47/78/50/478477850.db2.gz XNIWPMQPVUXRPA-KRWDZBQOSA-N 0 3 349.456 2.875 20 5 EFBDHN CC(C)Oc1nc(N2CCC[C@@H]3CN(C)CC[C@@H]32)ccc1[N+](=O)[O-] ZINC000582013860 478492819 /nfs/dbraw/zinc/49/28/19/478492819.db2.gz ZECATHXHKKOSGO-KGLIPLIRSA-N 0 3 334.420 2.698 20 5 EFBDHN CC(C)(C)N1CCCN(C(=O)/C=C\c2cccc([N+](=O)[O-])c2)CC1 ZINC000491290163 478500189 /nfs/dbraw/zinc/50/01/89/478500189.db2.gz AGIXCXDFZJXGBE-HJWRWDBZSA-N 0 3 331.416 2.941 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nc(CNC[C@@H]3C[C@H](F)CN3)cs2)c1 ZINC000591281893 478508712 /nfs/dbraw/zinc/50/87/12/478508712.db2.gz SILNYTPRPWVJJS-RYUDHWBXSA-N 0 3 336.392 2.508 20 5 EFBDHN Cc1c(NC(=O)N2CC[C@]3(C2)CCCN(C)C3)cccc1[N+](=O)[O-] ZINC000582104829 478511412 /nfs/dbraw/zinc/51/14/12/478511412.db2.gz ZJVWNPRWRKEFBZ-QGZVFWFLSA-N 0 3 332.404 2.853 20 5 EFBDHN O=[N+]([O-])c1ccc(S(=O)(=O)CCNCCCC2CCC2)cc1 ZINC000594733514 478520296 /nfs/dbraw/zinc/52/02/96/478520296.db2.gz XAAYZBWGKPDSAA-UHFFFAOYSA-N 0 3 326.418 2.538 20 5 EFBDHN CN1CCC[C@]2(CCN(c3ncc([N+](=O)[O-])cc3C(F)(F)F)C2)C1 ZINC000571174066 478537031 /nfs/dbraw/zinc/53/70/31/478537031.db2.gz ORDMJXMUCOKPJM-AWEZNQCLSA-N 0 3 344.337 2.931 20 5 EFBDHN CN(CCCNC(=O)C1CCC1)[C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000571179188 478538330 /nfs/dbraw/zinc/53/83/30/478538330.db2.gz WWTJRUNTGMSMIT-INIZCTEOSA-N 0 3 331.416 2.820 20 5 EFBDHN CN(CCCNC(=O)C1CCC1)[C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000571179189 478538804 /nfs/dbraw/zinc/53/88/04/478538804.db2.gz WWTJRUNTGMSMIT-MRXNPFEDSA-N 0 3 331.416 2.820 20 5 EFBDHN O=C1[C@@H](NCCc2ccc([N+](=O)[O-])cc2)CCN1c1ccc(F)cc1 ZINC000591372950 478538893 /nfs/dbraw/zinc/53/88/93/478538893.db2.gz CVRVSYUOAYZJEF-KRWDZBQOSA-N 0 3 343.358 2.672 20 5 EFBDHN CC(COC(=O)C[C@H]1CCCC[C@H]1NC(=O)OC(C)(C)C)[N+](=O)[O-] ZINC000496106634 478541910 /nfs/dbraw/zinc/54/19/10/478541910.db2.gz YFSWTCLKDIUAPQ-JHJVBQTASA-N 0 3 344.408 2.668 20 5 EFBDHN CC(C)N1CCCN(C(=O)/C=C\c2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000491464650 478556128 /nfs/dbraw/zinc/55/61/28/478556128.db2.gz OLXXLYDQVXLOKG-ALCCZGGFSA-N 0 3 335.379 2.690 20 5 EFBDHN O=C(CCN1CC[C@H](c2ccncc2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000571294846 478565418 /nfs/dbraw/zinc/56/54/18/478565418.db2.gz HHGADYIOCMLNDI-HNNXBMFYSA-N 0 3 340.383 2.808 20 5 EFBDHN COc1ccc(CNCCC(=O)Nc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000563463064 478566291 /nfs/dbraw/zinc/56/62/91/478566291.db2.gz RZXCRBGZXDLMPN-UHFFFAOYSA-N 0 3 347.346 2.861 20 5 EFBDHN Cc1ccc(CN2CC[C@H](CN(C)c3ncc([N+](=O)[O-])cn3)C2)s1 ZINC000594873634 478570376 /nfs/dbraw/zinc/57/03/76/478570376.db2.gz DQOSZHPWWRVUIO-CYBMUJFWSA-N 0 3 347.444 2.713 20 5 EFBDHN C[C@@H](C(=O)N[C@@H]1CCN(C(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1F ZINC000597920378 478574967 /nfs/dbraw/zinc/57/49/67/478574967.db2.gz ASNIATBAQPTNDI-VXGBXAGGSA-N 0 3 337.395 2.826 20 5 EFBDHN CC(C)(C)N1CC[C@H](NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000597922512 478575403 /nfs/dbraw/zinc/57/54/03/478575403.db2.gz FEWSKZFOWIWQLC-NSHDSACASA-N 0 3 325.796 2.851 20 5 EFBDHN CSc1ccc(C(=O)N[C@H]2CCN(C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000597924962 478579196 /nfs/dbraw/zinc/57/91/96/478579196.db2.gz LGNLDHNSXFYIFM-LBPRGKRZSA-N 0 3 337.445 2.919 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@H]2C[C@@H]2c2cccc(F)c2)c1 ZINC000591728968 478613321 /nfs/dbraw/zinc/61/33/21/478613321.db2.gz LUIWXBFYUGFEON-NXHRZFHOSA-N 0 3 346.358 2.619 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@@H]2C[C@@H]2c2cccc(F)c2)c1 ZINC000591728966 478614405 /nfs/dbraw/zinc/61/44/05/478614405.db2.gz LUIWXBFYUGFEON-KBAYOESNSA-N 0 3 346.358 2.619 20 5 EFBDHN CC(C)(C)N1C[C@@H](CNCc2ccc([N+](=O)[O-])cc2Cl)CC1=O ZINC000594994362 478622711 /nfs/dbraw/zinc/62/27/11/478622711.db2.gz TXDOFOOGIHHSFP-LLVKDONJSA-N 0 3 339.823 2.985 20 5 EFBDHN CC(C)(CCNCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000591767778 478625540 /nfs/dbraw/zinc/62/55/40/478625540.db2.gz JHQWPEZYDOBIBH-UHFFFAOYSA-N 0 3 340.445 2.784 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NCCCOC[C@@H]1CCCO1 ZINC000595003153 478625829 /nfs/dbraw/zinc/62/58/29/478625829.db2.gz FHEUHIIZXPMQOM-ZFWWWQNUSA-N 0 3 338.404 2.840 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NCCCN1CCCCC1=O ZINC000595010805 478628086 /nfs/dbraw/zinc/62/80/86/478628086.db2.gz ILKRRIOSTXZJDD-ZDUSSCGKSA-N 0 3 335.404 2.657 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@H]1CCN(CC(F)(F)F)C1 ZINC000595017520 478629529 /nfs/dbraw/zinc/62/95/29/478629529.db2.gz WGXJANGATDKZNA-QWRGUYRKSA-N 0 3 347.337 2.891 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@H](CO)Cc1ccco1 ZINC000595018405 478631605 /nfs/dbraw/zinc/63/16/05/478631605.db2.gz NNWWCUHZJNDOOA-QWHCGFSZSA-N 0 3 334.372 2.698 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NCC1([S@@](C)=O)CCC1 ZINC000595040322 478638249 /nfs/dbraw/zinc/63/82/49/478638249.db2.gz UAVOQQYZYJJIIZ-KPWVOAKYSA-N 0 3 326.418 2.555 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)N[C@H](C)C1(OC)CCOCC1 ZINC000595044279 478638870 /nfs/dbraw/zinc/63/88/70/478638870.db2.gz KSHZSBWMOWKGHT-CHWSQXEVSA-N 0 3 338.404 2.838 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@H]1CCN(CC(F)F)C1 ZINC000595044157 478639245 /nfs/dbraw/zinc/63/92/45/478639245.db2.gz IXWGBIUHSPKMNQ-QWRGUYRKSA-N 0 3 329.347 2.593 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@]2(O)CCN(Cc3ccccc3)C2)c1 ZINC000601069300 478639277 /nfs/dbraw/zinc/63/92/77/478639277.db2.gz LFUPWFMJYZKVRA-GOSISDBHSA-N 0 3 328.368 2.611 20 5 EFBDHN CC(C)(CN[C@H]1CCc2c1cccc2[N+](=O)[O-])[C@]1(O)CCCOC1 ZINC000595095647 478658444 /nfs/dbraw/zinc/65/84/44/478658444.db2.gz SCVLXYAPDJUTEU-YJBOKZPZSA-N 0 3 334.416 2.739 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC1CCN([C@@H]2CCOC2)CC1 ZINC000595100806 478660777 /nfs/dbraw/zinc/66/07/77/478660777.db2.gz JAOFEKWVYUNTRG-CZUORRHYSA-N 0 3 349.431 2.507 20 5 EFBDHN C[C@H](CNC(=O)c1c(F)cccc1[N+](=O)[O-])N(C)Cc1ccccc1 ZINC000601150198 478690005 /nfs/dbraw/zinc/69/00/05/478690005.db2.gz XZFMVYSRCQWULH-CYBMUJFWSA-N 0 3 345.374 2.984 20 5 EFBDHN CCOC(=O)Cc1ccc(N[C@@H]2CCN(C)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000591914925 478701284 /nfs/dbraw/zinc/70/12/84/478701284.db2.gz LNMKBSOCZIQERL-TZMCWYRMSA-N 0 3 335.404 2.595 20 5 EFBDHN CCCN(C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)[C@H]1CCN(C)C1 ZINC000591925653 478710165 /nfs/dbraw/zinc/71/01/65/478710165.db2.gz KEZMBJZSDAKINS-BBRMVZONSA-N 0 3 334.420 2.782 20 5 EFBDHN Cc1noc(CN2CCCN(Cc3ccccc3C)CC2)c1[N+](=O)[O-] ZINC000595291661 478717826 /nfs/dbraw/zinc/71/78/26/478717826.db2.gz LPEYVHBDAQLBQH-UHFFFAOYSA-N 0 3 344.415 2.908 20 5 EFBDHN O=C(c1c(F)cccc1[N+](=O)[O-])N1CCCN(C2CCCC2)CC1 ZINC000601209048 478723681 /nfs/dbraw/zinc/72/36/81/478723681.db2.gz AIJOOIOQDNBPCG-UHFFFAOYSA-N 0 3 335.379 2.824 20 5 EFBDHN C[C@]1(NC(=O)c2cccc([N+](=O)[O-])c2)CCN(Cc2ccccc2)C1 ZINC000564338450 478727858 /nfs/dbraw/zinc/72/78/58/478727858.db2.gz VNPCIMPJIWTSHF-IBGZPJMESA-N 0 3 339.395 2.989 20 5 EFBDHN Cc1cc(OCC(=O)N[C@H](C)CN2CCC(C)CC2)ccc1[N+](=O)[O-] ZINC000598259984 478729445 /nfs/dbraw/zinc/72/94/45/478729445.db2.gz HXPMLVVHIPCWEL-OAHLLOKOSA-N 0 3 349.431 2.519 20 5 EFBDHN CN(C)Cc1ccccc1NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000572028101 478735179 /nfs/dbraw/zinc/73/51/79/478735179.db2.gz NOTVFCFAPVPKOY-UHFFFAOYSA-N 0 3 343.339 2.637 20 5 EFBDHN Cc1noc(CN(C)[C@@H]2CCCN(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000595336537 478737296 /nfs/dbraw/zinc/73/72/96/478737296.db2.gz IBSNWOFHPIFHKM-MRXNPFEDSA-N 0 3 344.415 2.988 20 5 EFBDHN Cc1noc(CN(C)[C@H]2CCCN(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000595336536 478737550 /nfs/dbraw/zinc/73/75/50/478737550.db2.gz IBSNWOFHPIFHKM-INIZCTEOSA-N 0 3 344.415 2.988 20 5 EFBDHN Cc1nn(C)c(N[C@H]2CCN(Cc3ccc(C)cc3)C2)c1[N+](=O)[O-] ZINC000601250342 478746806 /nfs/dbraw/zinc/74/68/06/478746806.db2.gz LWUBBMDBZZPYDU-HNNXBMFYSA-N 0 3 329.404 2.632 20 5 EFBDHN CN1CC[C@@H]2CN(C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)C[C@@H]2C1 ZINC000601253096 478748726 /nfs/dbraw/zinc/74/87/26/478748726.db2.gz DSDZSOLHIAYQDF-MNOVXSKESA-N 0 3 338.795 2.664 20 5 EFBDHN Cc1noc(CNC(C)(C)CN(C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000595387174 478757491 /nfs/dbraw/zinc/75/74/91/478757491.db2.gz ANKHIYYBMFTJIK-UHFFFAOYSA-N 0 3 332.404 2.891 20 5 EFBDHN CCCN1CC[C@@H](NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000598343164 478776623 /nfs/dbraw/zinc/77/66/23/478776623.db2.gz TWRSLWPDHPZJFA-GFCCVEGCSA-N 0 3 337.395 2.612 20 5 EFBDHN C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@H]1C(F)(F)F ZINC000601306115 478776681 /nfs/dbraw/zinc/77/66/81/478776681.db2.gz APZKTPAHHFCSHR-XXILOJSOSA-N 0 3 331.294 2.852 20 5 EFBDHN CCCN1CC[C@@H](NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000598342477 478776952 /nfs/dbraw/zinc/77/69/52/478776952.db2.gz IZRZJEFIDMEYJX-QWHCGFSZSA-N 0 3 337.445 2.676 20 5 EFBDHN Cc1noc(CN[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000595441070 478784181 /nfs/dbraw/zinc/78/41/81/478784181.db2.gz ULRWTBXJNYRQDS-BBRMVZONSA-N 0 3 344.415 2.891 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)N1C[C@H](N)Cc2ccccc21 ZINC000583258426 478804683 /nfs/dbraw/zinc/80/46/83/478804683.db2.gz UHPPNAVGGQSOLP-CYBMUJFWSA-N 0 3 341.367 2.524 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@@H]2CCc3ccc(F)cc32)c1 ZINC000564792527 478811855 /nfs/dbraw/zinc/81/18/55/478811855.db2.gz JTGNEGZWEVFIJS-CRAIPNDOSA-N 0 3 346.358 2.751 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@H]2CCc3ccc(F)cc32)c1 ZINC000564792529 478812451 /nfs/dbraw/zinc/81/24/51/478812451.db2.gz JTGNEGZWEVFIJS-QAPCUYQASA-N 0 3 346.358 2.751 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])NCC(=O)NC(C)(C)C ZINC000504911222 478856905 /nfs/dbraw/zinc/85/69/05/478856905.db2.gz CFZICLCERODIHR-GFCCVEGCSA-N 0 3 339.461 2.970 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1NC[C@@H]1CCCN(C)C1 ZINC000583480205 478859080 /nfs/dbraw/zinc/85/90/80/478859080.db2.gz VJRSFMAMEWKWSO-JTQLQIEISA-N 0 3 341.795 2.789 20 5 EFBDHN CN(CCOc1ccc([N+](=O)[O-])cc1)[C@@H](CO)Cc1ccccc1 ZINC000595595169 478874705 /nfs/dbraw/zinc/87/47/05/478874705.db2.gz HQIUVPQIOMWCFR-QGZVFWFLSA-N 0 3 330.384 2.509 20 5 EFBDHN COc1cc(CN(C)C)ccc1NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000601621542 478911968 /nfs/dbraw/zinc/91/19/68/478911968.db2.gz NSQHHXHBKMVAJI-UHFFFAOYSA-N 0 3 335.385 2.979 20 5 EFBDHN COC[C@@H](NCCOc1ccccc1[N+](=O)[O-])c1cccc(OC)c1 ZINC000595683362 478934597 /nfs/dbraw/zinc/93/45/97/478934597.db2.gz HXSQDKXWIJXZQH-MRXNPFEDSA-N 0 3 346.383 2.960 20 5 EFBDHN COC[C@@H](NCCOc1cccc([N+](=O)[O-])c1)c1cccc(OC)c1 ZINC000595684913 478935327 /nfs/dbraw/zinc/93/53/27/478935327.db2.gz SEERCIPGLOMRFL-GOSISDBHSA-N 0 3 346.383 2.960 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1CCN(C(C)(C)C)C1 ZINC000595702033 478946955 /nfs/dbraw/zinc/94/69/55/478946955.db2.gz JEXAYTZPAUESQV-AWEZNQCLSA-N 0 3 334.420 2.609 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CCC3(CCc4ccccc4O3)CC2)c1 ZINC000595827186 479020305 /nfs/dbraw/zinc/02/03/05/479020305.db2.gz BIFMIAWEWZCLIC-UHFFFAOYSA-N 0 3 342.399 2.651 20 5 EFBDHN CSC1(CNC(=O)/C=C/c2cccc([N+](=O)[O-])c2)CCN(C)CC1 ZINC000493559623 479056270 /nfs/dbraw/zinc/05/62/70/479056270.db2.gz WMAYHRGFCFIILO-VOTSOKGWSA-N 0 3 349.456 2.552 20 5 EFBDHN CCCN(C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)[C@@H]1CCN(C)C1 ZINC000592830323 479065261 /nfs/dbraw/zinc/06/52/61/479065261.db2.gz CVQQNBSCWWCMHC-OAHLLOKOSA-N 0 3 346.431 2.725 20 5 EFBDHN CCCN(C(=O)CCCNc1ccc([N+](=O)[O-])cc1)[C@H]1CCN(C)C1 ZINC000592833220 479066266 /nfs/dbraw/zinc/06/62/66/479066266.db2.gz WTEDXGWNCJUQTP-KRWDZBQOSA-N 0 3 348.447 2.730 20 5 EFBDHN O=[N+]([O-])c1ccc(SC[C@@]2(O)CCN(Cc3ccccc3)C2)nc1 ZINC000601957284 479093376 /nfs/dbraw/zinc/09/33/76/479093376.db2.gz IIYVCAVEUBAYIF-QGZVFWFLSA-N 0 3 345.424 2.719 20 5 EFBDHN COc1ccc(-c2ccc(CN3C[C@@H]4COC[C@@H]4C3)o2)c([N+](=O)[O-])c1 ZINC000601977661 479106484 /nfs/dbraw/zinc/10/64/84/479106484.db2.gz VVCUGLXDDJSABE-BETUJISGSA-N 0 3 344.367 2.942 20 5 EFBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC(N2CCOC[C@@H]2C)CC1 ZINC000573664532 479115215 /nfs/dbraw/zinc/11/52/15/479115215.db2.gz FCDABZKMQZGEFX-GJZGRUSLSA-N 0 3 333.432 2.841 20 5 EFBDHN CN(C)[C@@H](CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-])c1ccccc1 ZINC000593003603 479120670 /nfs/dbraw/zinc/12/06/70/479120670.db2.gz TVLAFTYGUDMNIQ-KRWDZBQOSA-N 0 3 345.374 2.696 20 5 EFBDHN CCN1CCN(CCNc2c(C)cc([N+](=O)[O-])cc2Cl)CC1 ZINC000596073127 479121615 /nfs/dbraw/zinc/12/16/15/479121615.db2.gz GJMNMUPOKIXNTA-UHFFFAOYSA-N 0 3 326.828 2.606 20 5 EFBDHN CCN1CCN(CCNc2cc(C)nc3c2cccc3[N+](=O)[O-])CC1 ZINC000596073513 479122282 /nfs/dbraw/zinc/12/22/82/479122282.db2.gz LXCBLEFIFQVLDZ-UHFFFAOYSA-N 0 3 343.431 2.501 20 5 EFBDHN COC(=O)CC1CCC(NCc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000599028110 479132844 /nfs/dbraw/zinc/13/28/44/479132844.db2.gz UKOQYBRSBWLBPQ-UHFFFAOYSA-N 0 3 336.388 2.815 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@H]1CCCN1CC(F)F ZINC000599066076 479146153 /nfs/dbraw/zinc/14/61/53/479146153.db2.gz ONMLWCILKBSXNV-DGCLKSJQSA-N 0 3 343.374 2.984 20 5 EFBDHN C[C@@H](CCc1ccccc1[N+](=O)[O-])N[C@@H]1CCN(C(C)(C)C)C1=O ZINC000573844804 479157580 /nfs/dbraw/zinc/15/75/80/479157580.db2.gz LQJZGWGRVFHAAG-DZGCQCFKSA-N 0 3 333.432 2.905 20 5 EFBDHN CN1CCN(CCc2ccc([N+](=O)[O-])cc2)[C@H](Cc2ccccc2)C1 ZINC000593088589 479166556 /nfs/dbraw/zinc/16/65/56/479166556.db2.gz IBLZEVNMVQXINS-HXUWFJFHSA-N 0 3 339.439 2.996 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)N(C)[C@@H](C)C1CCN(C)CC1 ZINC000584532136 479168057 /nfs/dbraw/zinc/16/80/57/479168057.db2.gz ZVCCZWFEGRZFEP-ZDUSSCGKSA-N 0 3 349.431 2.796 20 5 EFBDHN CC(C)[C@H]1CN(c2c([N+](=O)[O-])ncn2C)CCN1Cc1ccccc1 ZINC000599143037 479178659 /nfs/dbraw/zinc/17/86/59/479178659.db2.gz NXFIWCWACKNXFW-MRXNPFEDSA-N 0 3 343.431 2.675 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCSc2ccccc2)c1 ZINC000556750339 479194289 /nfs/dbraw/zinc/19/42/89/479194289.db2.gz IHPPOMIIMIIKPO-HNNXBMFYSA-N 0 3 348.424 2.716 20 5 EFBDHN CN1CC[C@]2(CCN(c3c(Br)cccc3[N+](=O)[O-])C2)C1 ZINC000596242144 479219069 /nfs/dbraw/zinc/21/90/69/479219069.db2.gz NHEPYOJCTULKJU-AWEZNQCLSA-N 0 3 340.221 2.889 20 5 EFBDHN C[NH+](C)C1CCC2(CC1)CCN(c1cc[n-]c(=O)c1[N+](=O)[O-])CC2 ZINC000596255759 479227419 /nfs/dbraw/zinc/22/74/19/479227419.db2.gz TUEYENQNTLWFIK-UHFFFAOYSA-N 0 3 334.420 2.786 20 5 EFBDHN CC(C)N1CCCC[C@@H]1Cn1cnc2sc([N+](=O)[O-])cc2c1=O ZINC000596280317 479236694 /nfs/dbraw/zinc/23/66/94/479236694.db2.gz CBXJJXZKOUYSSJ-LLVKDONJSA-N 0 3 336.417 2.629 20 5 EFBDHN C[C@H]1CC[C@H](C)N1CC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000610965067 479245260 /nfs/dbraw/zinc/24/52/60/479245260.db2.gz SKJXTDODTGXYSG-KBPBESRZSA-N 0 3 331.416 2.959 20 5 EFBDHN C[C@H](C(=O)N1C[C@H](N2CCCC2)C[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000557118332 479257024 /nfs/dbraw/zinc/25/70/24/479257024.db2.gz YHCJSZLGQNHUJH-GRDNDAEWSA-N 0 3 331.416 2.784 20 5 EFBDHN COC(=O)Cc1ccc(N[C@@H]2CCN(C(C)(C)C)C2)c([N+](=O)[O-])c1 ZINC000596335729 479258979 /nfs/dbraw/zinc/25/89/79/479258979.db2.gz HREDFWHTDXYAIA-CYBMUJFWSA-N 0 3 335.404 2.595 20 5 EFBDHN C[C@H](CN1CCC(C)CC1)NC(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000596477383 479310807 /nfs/dbraw/zinc/31/08/07/479310807.db2.gz YSRZFEJMLWRLLZ-GFCCVEGCSA-N 0 3 338.383 2.976 20 5 EFBDHN CCCN1CC[C@@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000596483223 479313658 /nfs/dbraw/zinc/31/36/58/479313658.db2.gz XQSREGHVUBGWFQ-SNVBAGLBSA-N 0 3 326.784 2.854 20 5 EFBDHN C[C@H]1CC[C@H](C)N1CC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000611218321 479314238 /nfs/dbraw/zinc/31/42/38/479314238.db2.gz GIFKSCYCMHYHKI-KBPBESRZSA-N 0 3 331.416 2.959 20 5 EFBDHN C[C@@H]1CC[C@@H](C)N1CC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000611218323 479314368 /nfs/dbraw/zinc/31/43/68/479314368.db2.gz GIFKSCYCMHYHKI-ZIAGYGMSSA-N 0 3 331.416 2.959 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1Cn1cc(CNC2CCCCC2)nn1 ZINC000603244262 479318240 /nfs/dbraw/zinc/31/82/40/479318240.db2.gz QWZJIPWDRJHXPH-UHFFFAOYSA-N 0 3 345.403 2.666 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1CN1CCc3ccccc3CC1)OCCO2 ZINC000611271720 479332804 /nfs/dbraw/zinc/33/28/04/479332804.db2.gz FAJWVJFABUFEBA-UHFFFAOYSA-N 0 3 340.379 2.967 20 5 EFBDHN C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000593419316 479332930 /nfs/dbraw/zinc/33/29/30/479332930.db2.gz FKLZBYLQFUZMGS-OLZOCXBDSA-N 0 3 337.395 2.513 20 5 EFBDHN Cn1cc(CN2CC[C@@H]3OCC[C@@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000574757395 479342496 /nfs/dbraw/zinc/34/24/96/479342496.db2.gz GNPLWLWJDZEZIR-PBHICJAKSA-N 0 3 342.399 2.606 20 5 EFBDHN O=C(Cc1ccc(F)cc1[N+](=O)[O-])N1CCC[C@H]1CN1CCCCC1 ZINC000593448655 479344851 /nfs/dbraw/zinc/34/48/51/479344851.db2.gz UWBDVBKMSJAFMQ-INIZCTEOSA-N 0 3 349.406 2.753 20 5 EFBDHN CC(C)[C@H]1C[C@H](NCc2cc3c(cc2[N+](=O)[O-])OCCO3)CCO1 ZINC000611314637 479346757 /nfs/dbraw/zinc/34/67/57/479346757.db2.gz WRNNQMVGFVLYHD-UKRRQHHQSA-N 0 3 336.388 2.659 20 5 EFBDHN Cc1cccc(CCCNCc2cc3c(cc2[N+](=O)[O-])OCCO3)n1 ZINC000586780864 479351183 /nfs/dbraw/zinc/35/11/83/479351183.db2.gz RXPRJTYIXFOAIG-UHFFFAOYSA-N 0 3 343.383 2.792 20 5 EFBDHN O=C1[C@H](NCCc2ccc([N+](=O)[O-])cc2)CCN1Cc1ccccc1 ZINC000611409667 479370197 /nfs/dbraw/zinc/37/01/97/479370197.db2.gz JNBWOZWAVPVUHQ-GOSISDBHSA-N 0 3 339.395 2.528 20 5 EFBDHN O=C1[C@@H](NCCc2ccc([N+](=O)[O-])cc2)CCN1Cc1ccccc1 ZINC000611409672 479370421 /nfs/dbraw/zinc/37/04/21/479370421.db2.gz JNBWOZWAVPVUHQ-SFHVURJKSA-N 0 3 339.395 2.528 20 5 EFBDHN O=[N+]([O-])c1ccsc1NC1CCN([C@H]2CCCC[C@@H]2O)CC1 ZINC000611413618 479371850 /nfs/dbraw/zinc/37/18/50/479371850.db2.gz IILGMQMRIXFYOS-JSGCOSHPSA-N 0 3 325.434 2.836 20 5 EFBDHN COCC(=O)Nc1cccc(CNCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000602509572 479375372 /nfs/dbraw/zinc/37/53/72/479375372.db2.gz DCBTWVNMTMUMDZ-UHFFFAOYSA-N 0 3 343.383 2.512 20 5 EFBDHN C[C@@H](CNCc1nc2cc([N+](=O)[O-])ccc2o1)N1CCC[C@H](C)C1 ZINC000602513182 479376099 /nfs/dbraw/zinc/37/60/99/479376099.db2.gz AGSBLIIREBCEIC-STQMWFEESA-N 0 3 332.404 2.946 20 5 EFBDHN CN(CCNCc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccccc1 ZINC000602524738 479381240 /nfs/dbraw/zinc/38/12/40/479381240.db2.gz DNHASYGHLXNFEE-UHFFFAOYSA-N 0 3 340.383 2.958 20 5 EFBDHN CC(C)C[C@@H](CO)NCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602526523 479381751 /nfs/dbraw/zinc/38/17/51/479381751.db2.gz ORKRKXVSEJYCJE-QMMMGPOBSA-N 0 3 337.239 2.915 20 5 EFBDHN C[C@H](CNCc1cc(Br)c([N+](=O)[O-])s1)N(C)C1CC1 ZINC000602545797 479391492 /nfs/dbraw/zinc/39/14/92/479391492.db2.gz WEHDMFWELFICLM-MRVPVSSYSA-N 0 3 348.266 2.991 20 5 EFBDHN C[C@@H](NCc1cc(Br)c([N+](=O)[O-])s1)[C@H]1CCOC1 ZINC000602558991 479397215 /nfs/dbraw/zinc/39/72/15/479397215.db2.gz RQZDBAZRVGUVSI-SFYZADRCSA-N 0 3 335.223 2.933 20 5 EFBDHN CCOc1ccc(NC(=O)CNCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000602586044 479410928 /nfs/dbraw/zinc/41/09/28/479410928.db2.gz NUQCOZVSWVZEPS-UHFFFAOYSA-N 0 3 343.383 2.764 20 5 EFBDHN COc1ccc2c(c1)nc(CNCCc1ccc([N+](=O)[O-])cc1)n2C ZINC000602619791 479426834 /nfs/dbraw/zinc/42/68/34/479426834.db2.gz RSQWBWRRLGNSKF-UHFFFAOYSA-N 0 3 340.383 2.822 20 5 EFBDHN COC(=O)[C@@H]1CN(C/C=C\c2ccccc2[N+](=O)[O-])C[C@H]1C1CC1 ZINC000593698186 479427714 /nfs/dbraw/zinc/42/77/14/479427714.db2.gz ZJIVIEBVLHVKTP-ANIZGFEYSA-N 0 3 330.384 2.739 20 5 EFBDHN COc1cc(CN(C)CCN2CCCCC2)c([N+](=O)[O-])cc1OC ZINC000593703456 479429561 /nfs/dbraw/zinc/42/95/61/479429561.db2.gz VQVUTHWFTYJJBZ-UHFFFAOYSA-N 0 3 337.420 2.530 20 5 EFBDHN O=[N+]([O-])c1ccsc1NCc1ccccc1CN1CC[C@H](O)C1 ZINC000611617955 479430490 /nfs/dbraw/zinc/43/04/90/479430490.db2.gz IHEDQEWQGYDDDM-AWEZNQCLSA-N 0 3 333.413 2.835 20 5 EFBDHN O=[N+]([O-])c1ccc(NCc2ccccc2CN2CC[C@@H](O)C2)s1 ZINC000611618000 479431007 /nfs/dbraw/zinc/43/10/07/479431007.db2.gz XHDUKOFLMSOPSJ-CQSZACIVSA-N 0 3 333.413 2.835 20 5 EFBDHN CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)c1sccc1[N+](=O)[O-] ZINC000614533716 479438039 /nfs/dbraw/zinc/43/80/39/479438039.db2.gz KQCQBAIFISJTGX-KRWDZBQOSA-N 0 3 347.440 2.730 20 5 EFBDHN CC(C)(C)[C@H](CO)NCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602636095 479438967 /nfs/dbraw/zinc/43/89/67/479438967.db2.gz FWWCGULVKUHJGK-VIFPVBQESA-N 0 3 337.239 2.915 20 5 EFBDHN CN(C)Cc1ccccc1C(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000575415502 479442507 /nfs/dbraw/zinc/44/25/07/479442507.db2.gz SHWUKJYNQHDRDV-UHFFFAOYSA-N 0 3 339.395 2.855 20 5 EFBDHN O=[N+]([O-])c1sc(CNC[C@@H]2CC[C@H](O)C2)cc1Br ZINC000602647095 479446350 /nfs/dbraw/zinc/44/63/50/479446350.db2.gz SSMBOTJYXYCGMA-SFYZADRCSA-N 0 3 335.223 2.669 20 5 EFBDHN COCC(C)(C)CCCNCc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000588928753 479459248 /nfs/dbraw/zinc/45/92/48/479459248.db2.gz BSIVLSSNYLJEGO-UHFFFAOYSA-N 0 3 338.404 2.908 20 5 EFBDHN Cc1c(CN[C@H]([C@H]2CCCO2)C2(CO)CCC2)cccc1[N+](=O)[O-] ZINC000602668365 479461564 /nfs/dbraw/zinc/46/15/64/479461564.db2.gz WOXKTJDKAUWICO-IAGOWNOFSA-N 0 3 334.416 2.703 20 5 EFBDHN CCn1cc([C@H](C)NC2CCN(c3ccc([N+](=O)[O-])nc3)CC2)cn1 ZINC000602680202 479470408 /nfs/dbraw/zinc/47/04/08/479470408.db2.gz KAGFZQZBAJUSPM-ZDUSSCGKSA-N 0 3 344.419 2.526 20 5 EFBDHN CCCN1CC[C@@H](NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)C1 ZINC000596882730 479471273 /nfs/dbraw/zinc/47/12/73/479471273.db2.gz VZJWTVCIBHUVIT-MRXNPFEDSA-N 0 3 348.447 2.999 20 5 EFBDHN CCCN1CC[C@H](NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000596882371 479471537 /nfs/dbraw/zinc/47/15/37/479471537.db2.gz QMSIVOJKUWWBQP-HNNXBMFYSA-N 0 3 346.431 2.753 20 5 EFBDHN CN1CC[C@@H]2CN(Cc3cc(Br)c([N+](=O)[O-])s3)C[C@@H]21 ZINC000602685908 479475434 /nfs/dbraw/zinc/47/54/34/479475434.db2.gz SXIQGZYHNZPAPG-KCJUWKMLSA-N 0 3 346.250 2.555 20 5 EFBDHN CN(C)[C@@H](CNc1c(Cl)cncc1[N+](=O)[O-])c1cccs1 ZINC000589104254 479477843 /nfs/dbraw/zinc/47/78/43/479477843.db2.gz YJGQOGKTSDHIHG-JTQLQIEISA-N 0 3 326.809 2.841 20 5 EFBDHN CCN(C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)C1CCN(C)CC1 ZINC000599985788 479487246 /nfs/dbraw/zinc/48/72/46/479487246.db2.gz IRWHOXSYYQYWAI-UHFFFAOYSA-N 0 3 346.431 2.725 20 5 EFBDHN C[C@H](NCc1cc(Br)c([N+](=O)[O-])s1)C1(CO)CC1 ZINC000602709362 479493543 /nfs/dbraw/zinc/49/35/43/479493543.db2.gz RBYBLXWSBZFBNF-ZETCQYMHSA-N 0 3 335.223 2.669 20 5 EFBDHN Cc1c([C@H](C)NCc2ccc(CC(N)=O)cc2)cccc1[N+](=O)[O-] ZINC000589344826 479516179 /nfs/dbraw/zinc/51/61/79/479516179.db2.gz MRZMJYYPCJVRPY-ZDUSSCGKSA-N 0 3 327.384 2.782 20 5 EFBDHN CCc1ccc([N+](=O)[O-])cc1NC(=O)Nc1cnn(CCN(C)C)c1 ZINC000589372651 479519449 /nfs/dbraw/zinc/51/94/49/479519449.db2.gz YZWJJDPLXAFQSO-UHFFFAOYSA-N 0 3 346.391 2.559 20 5 EFBDHN Cn1ccnc1[C@H]1CCN(CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000593967958 479525072 /nfs/dbraw/zinc/52/50/72/479525072.db2.gz CCVNQTVQQLHVFA-AWEZNQCLSA-N 0 3 330.388 2.587 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN1CCC2(CC1)OCc1ccccc12 ZINC000602784648 479550330 /nfs/dbraw/zinc/55/03/30/479550330.db2.gz IKBHVNMTLLEXIR-UHFFFAOYSA-N 0 3 342.399 2.621 20 5 EFBDHN CCC(C)(C)N1CCN([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000594019910 479551960 /nfs/dbraw/zinc/55/19/60/479551960.db2.gz CMWBTDWWSCTXME-AWEZNQCLSA-N 0 3 348.447 2.728 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN1CC[C@@H](COCc2ccccc2)C1 ZINC000602785361 479552349 /nfs/dbraw/zinc/55/23/49/479552349.db2.gz TVBHNFKPFPCTEW-QGZVFWFLSA-N 0 3 344.415 2.638 20 5 EFBDHN CCC(C)(C)N1CCN([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000594019911 479552906 /nfs/dbraw/zinc/55/29/06/479552906.db2.gz CMWBTDWWSCTXME-CQSZACIVSA-N 0 3 348.447 2.728 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCCN2CCCC[C@@H]12 ZINC000594056127 479570370 /nfs/dbraw/zinc/57/03/70/479570370.db2.gz RCBQSDSWSGSVFF-HIFRSBDPSA-N 0 3 348.403 2.742 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN1CC(Cc2ccccc2)C1 ZINC000612110412 479586917 /nfs/dbraw/zinc/58/69/17/479586917.db2.gz NPOCYURSGMWAOA-KRWDZBQOSA-N 0 3 342.395 2.509 20 5 EFBDHN C[C@@H]1CCN(C[C@H](O)COc2ccccc2[N+](=O)[O-])CC12CCC2 ZINC000612113920 479587745 /nfs/dbraw/zinc/58/77/45/479587745.db2.gz ZOTKLJDLUZZBJV-CABCVRRESA-N 0 3 334.416 2.847 20 5 EFBDHN CC(C)c1ccc(CN2CCN(CCO)C(C)(C)C2)cc1[N+](=O)[O-] ZINC000615140535 479614147 /nfs/dbraw/zinc/61/41/47/479614147.db2.gz VHDFJKXJKNWPGN-UHFFFAOYSA-N 0 3 335.448 2.607 20 5 EFBDHN CC1(C)CN(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)[C@H]2CCC[C@@H]21 ZINC000590204428 479617962 /nfs/dbraw/zinc/61/79/62/479617962.db2.gz LBRBZAOLDQYNAU-HOTGVXAUSA-N 0 3 343.427 2.994 20 5 EFBDHN C[C@H](C(=O)N[C@H]1CCCN2CCCC[C@H]12)c1ccc([N+](=O)[O-])cc1F ZINC000594196048 479626821 /nfs/dbraw/zinc/62/68/21/479626821.db2.gz KMYKXGFMCBRJPV-AFAVFJNCSA-N 0 3 349.406 2.971 20 5 EFBDHN Cc1c(CC(=O)N[C@H]2CCCN3CCCC[C@@H]23)cccc1[N+](=O)[O-] ZINC000594198683 479629525 /nfs/dbraw/zinc/62/95/25/479629525.db2.gz UVMJNBQPILKCGB-RDJZCZTQSA-N 0 3 331.416 2.579 20 5 EFBDHN CCOc1ccc(C(=O)N[C@@H]2CCCN3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000594201734 479630825 /nfs/dbraw/zinc/63/08/25/479630825.db2.gz QOIFEEXYDVHFAX-CABCVRRESA-N 0 3 347.415 2.740 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)N1CCCN(CC2CCC2)CC1 ZINC000590347953 479633283 /nfs/dbraw/zinc/63/32/83/479633283.db2.gz WCTOZBGEJOYNSV-UHFFFAOYSA-N 0 3 347.415 2.551 20 5 EFBDHN CN(C)C1(CNC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000602932892 479638545 /nfs/dbraw/zinc/63/85/45/479638545.db2.gz PFQZCYCHSMBXGN-UHFFFAOYSA-N 0 3 346.309 2.829 20 5 EFBDHN COC(=O)[C@H]1C[C@H](NCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000597242449 479639231 /nfs/dbraw/zinc/63/92/31/479639231.db2.gz LRGXECNEWOSNIS-JOCQHMNTSA-N 0 3 330.340 2.896 20 5 EFBDHN COC(=O)COc1ccc(CN(C)C[C@@H]2CC2(C)C)cc1[N+](=O)[O-] ZINC000597255779 479646516 /nfs/dbraw/zinc/64/65/16/479646516.db2.gz ZHPQJULNPBWBJW-ZDUSSCGKSA-N 0 3 336.388 2.625 20 5 EFBDHN CC(C)(NC(=O)[C@H](C1CC1)N1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000612652834 479723363 /nfs/dbraw/zinc/72/33/63/479723363.db2.gz WINUYIIEKSPSLR-INIZCTEOSA-N 0 3 331.416 2.821 20 5 EFBDHN COc1cc(C[NH2+]C[C@@H](c2ccnn2C)C(C)C)c([N+](=O)[O-])cc1[O-] ZINC000615943154 479788796 /nfs/dbraw/zinc/78/87/96/479788796.db2.gz IEMBCGNULLKZRH-CYBMUJFWSA-N 0 3 348.403 2.572 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)ccc1N1CCCN(C[C@H]2CCCO2)CC1 ZINC000615941695 479789265 /nfs/dbraw/zinc/78/92/65/479789265.db2.gz IWSZLVSJGICODW-CQSZACIVSA-N 0 3 339.823 2.939 20 5 EFBDHN O=C(CN(CC1CC1)C1CCC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000619516968 479817176 /nfs/dbraw/zinc/81/71/76/479817176.db2.gz MOSASYGQWBVOKJ-UHFFFAOYSA-N 0 3 329.400 2.748 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1CNC[C@H]1CCC(F)(F)C1)OCCO2 ZINC000619530064 479819732 /nfs/dbraw/zinc/81/97/32/479819732.db2.gz WTGPTPVERXQQKH-JTQLQIEISA-N 0 3 328.315 2.891 20 5 EFBDHN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@H]1CCN(CC2CC2)C1 ZINC000616121607 479830778 /nfs/dbraw/zinc/83/07/78/479830778.db2.gz PNNIOQAXTWRTOT-AWEZNQCLSA-N 0 3 332.404 2.817 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCN(CC2CC2)C1 ZINC000619639156 479845925 /nfs/dbraw/zinc/84/59/25/479845925.db2.gz QPEMIGCTVXMXFT-ZDUSSCGKSA-N 0 3 348.403 2.599 20 5 EFBDHN O=C1[C@H](NCCc2ccc([N+](=O)[O-])cc2)CCN1c1ccccc1F ZINC000609571891 480177430 /nfs/dbraw/zinc/17/74/30/480177430.db2.gz KTWGYILYCZVZAT-MRXNPFEDSA-N 0 3 343.358 2.672 20 5 EFBDHN CSCCCCCNCc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000614109083 480195937 /nfs/dbraw/zinc/19/59/37/480195937.db2.gz JEVPCNPYQYVTIO-UHFFFAOYSA-N 0 3 326.418 2.989 20 5 EFBDHN CC[C@@H](CN1CCCC1)NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000609833676 480211107 /nfs/dbraw/zinc/21/11/07/480211107.db2.gz SWXXOOIROGETQV-HNNXBMFYSA-N 0 3 344.415 2.540 20 5 EFBDHN CC[C@H](CN1CCCC1)NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000609833865 480211176 /nfs/dbraw/zinc/21/11/76/480211176.db2.gz ZCLTWKWEQOWJEM-CYBMUJFWSA-N 0 3 330.388 2.680 20 5 EFBDHN O=C(CCN1CCOCC2(CCCC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000614222803 480232333 /nfs/dbraw/zinc/23/23/33/480232333.db2.gz DSOQNUANJSBLTM-UHFFFAOYSA-N 0 3 347.415 2.816 20 5 EFBDHN CC[C@@H](CN1CCCC1)Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000610575758 480340310 /nfs/dbraw/zinc/34/03/10/480340310.db2.gz MGDKXCKIAFHPJU-ZDUSSCGKSA-N 0 3 332.404 2.766 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)N[C@@H]2CCN(CC3CC3)C2)cc1[N+](=O)[O-] ZINC000610595837 480347054 /nfs/dbraw/zinc/34/70/54/480347054.db2.gz MSPQCYJOFUIQGF-CZUORRHYSA-N 0 3 346.431 2.748 20 5 EFBDHN CC(C)[C@H]1CN(C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CCN1 ZINC000621156695 480364606 /nfs/dbraw/zinc/36/46/06/480364606.db2.gz GGOSENTURXBMNI-LJQANCHMSA-N 0 3 349.434 2.751 20 5 EFBDHN C[C@H](NCCn1ccc([N+](=O)[O-])n1)c1ccc(OC(F)F)cc1 ZINC000179600133 533876736 /nfs/dbraw/zinc/87/67/36/533876736.db2.gz OAEOWXCXOZOUPY-JTQLQIEISA-N 0 3 326.303 2.744 20 5 EFBDHN C[C@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])s1)C(=O)N(C)C ZINC000191737806 533911539 /nfs/dbraw/zinc/91/15/39/533911539.db2.gz DFMJLGOYGBGGCL-NSHDSACASA-N 0 3 333.413 2.890 20 5 EFBDHN CC(C)C[C@H](CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-])N(C)C ZINC000074136697 519350470 /nfs/dbraw/zinc/35/04/70/519350470.db2.gz WBASWEBMMMRJIS-GFCCVEGCSA-N 0 3 327.812 2.954 20 5 EFBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C[C@@H](O)COCc1ccco1 ZINC000065512405 519655983 /nfs/dbraw/zinc/65/59/83/519655983.db2.gz BGYKOBGOLTZXNN-QGZVFWFLSA-N 0 3 348.399 2.976 20 5 EFBDHN NC(=O)[C@H]1CCCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000154996499 534449945 /nfs/dbraw/zinc/44/99/45/534449945.db2.gz HXEKMVDGFTURLX-ZDUSSCGKSA-N 0 3 329.356 2.552 20 5 EFBDHN CCS[C@H]1CC[C@@H](N(C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000072837678 521732608 /nfs/dbraw/zinc/73/26/08/521732608.db2.gz JPOGONFEMULYRM-KGLIPLIRSA-N 0 3 337.445 2.800 20 5 EFBDHN CN(C)Cc1cccc(CNC(=O)Cc2cccc([N+](=O)[O-])c2)c1 ZINC000173031030 521921142 /nfs/dbraw/zinc/92/11/42/521921142.db2.gz VTGGPUDTWYIJBX-UHFFFAOYSA-N 0 3 327.384 2.515 20 5 EFBDHN CC[C@@H](C)CN(CC)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000177849361 521985764 /nfs/dbraw/zinc/98/57/64/521985764.db2.gz DECIFQDGQXUNPN-LLVKDONJSA-N 0 3 337.376 2.630 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@H](N2CCCC2)C1 ZINC000184726543 522625947 /nfs/dbraw/zinc/62/59/47/522625947.db2.gz YNUFVKBYAWQNNL-FUHWJXTLSA-N 0 3 345.443 2.860 20 5 EFBDHN CN(CCCOc1cccc(Cl)c1)CCn1cc([N+](=O)[O-])cn1 ZINC000157743388 522785005 /nfs/dbraw/zinc/78/50/05/522785005.db2.gz WXFPGHSYHWEWAY-UHFFFAOYSA-N 0 3 338.795 2.846 20 5 EFBDHN CN(CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)Cc1ccco1 ZINC000117333848 522799208 /nfs/dbraw/zinc/79/92/08/522799208.db2.gz WWNIHVSCGNMTEK-UHFFFAOYSA-N 0 3 331.328 2.618 20 5 EFBDHN CC[C@H]1CCCC[C@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000120515533 523061242 /nfs/dbraw/zinc/06/12/42/523061242.db2.gz CFZFTMOXEPFPJM-XJKSGUPXSA-N 0 3 340.445 2.927 20 5 EFBDHN COc1ccc(-c2ccc(CNCC3(O)CCC3)o2)c([N+](=O)[O-])c1 ZINC000237425119 523132984 /nfs/dbraw/zinc/13/29/84/523132984.db2.gz KCDGQOPBMGCRPE-UHFFFAOYSA-N 0 3 332.356 2.868 20 5 EFBDHN COCCNCc1ccc(OC)c(OCc2ccc([N+](=O)[O-])cc2)c1 ZINC000061002542 523951213 /nfs/dbraw/zinc/95/12/13/523951213.db2.gz ZRPPVWHCDKDGFI-UHFFFAOYSA-N 0 3 346.383 2.918 20 5 EFBDHN C[C@H](CN1CCC[C@@H](C)C1)NC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000120653468 524337538 /nfs/dbraw/zinc/33/75/38/524337538.db2.gz TYACZWGSRMVEPM-HUUCEWRRSA-N 0 3 348.447 2.557 20 5 EFBDHN C[C@H](CN1CCC[C@H](C)C1)NC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000150788870 524340004 /nfs/dbraw/zinc/34/00/04/524340004.db2.gz YWEMTTCZUQEEDS-QWHCGFSZSA-N 0 3 337.395 2.513 20 5 EFBDHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000119774202 524633377 /nfs/dbraw/zinc/63/33/77/524633377.db2.gz WMKJOHFFBRWNDZ-KSSFIOAISA-N 0 3 339.395 2.845 20 5 EFBDHN C[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1F)N1CCC(C)CC1 ZINC000150978542 524657558 /nfs/dbraw/zinc/65/75/58/524657558.db2.gz UEFOOYKYXYAEAH-ZDUSSCGKSA-N 0 3 337.395 2.513 20 5 EFBDHN Cc1cccc(OCCN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000118866838 524742518 /nfs/dbraw/zinc/74/25/18/524742518.db2.gz TVZBANOMLAOLGG-OAHLLOKOSA-N 0 3 342.399 2.863 20 5 EFBDHN C[C@@H]1CN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@@H](C)CN1 ZINC000237386164 524883475 /nfs/dbraw/zinc/88/34/75/524883475.db2.gz ANJZLDGKTZWMJI-MNOVXSKESA-N 0 3 346.412 2.541 20 5 EFBDHN COc1ccc([C@H](CO)N(C)CCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000112995841 525362395 /nfs/dbraw/zinc/36/23/95/525362395.db2.gz GWYJTVXBSJWIQJ-SFHVURJKSA-N 0 3 346.383 2.648 20 5 EFBDHN C[C@@H]1C[C@H](NC(=O)c2ccccc2[N+](=O)[O-])CN1Cc1ccccc1 ZINC000137457090 525433765 /nfs/dbraw/zinc/43/37/65/525433765.db2.gz NQYBJGQNILBBBE-ZBFHGGJFSA-N 0 3 339.395 2.988 20 5 EFBDHN Cc1c(Br)c(NC[C@@H](C)N(C)C2CC2)ncc1[N+](=O)[O-] ZINC000230581586 525523516 /nfs/dbraw/zinc/52/35/16/525523516.db2.gz YFMXZKZTHQUXDX-MRVPVSSYSA-N 0 3 343.225 2.955 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CNC[C@@]3(O)CCSC3)o2)cc1 ZINC000176754089 534881148 /nfs/dbraw/zinc/88/11/48/534881148.db2.gz GQQTYDLOBYJFIK-INIZCTEOSA-N 0 3 334.397 2.812 20 5 EFBDHN CCCN1CCC[C@H]1CNC(=O)c1c(OCC)cccc1[N+](=O)[O-] ZINC000343556280 534908523 /nfs/dbraw/zinc/90/85/23/534908523.db2.gz SAZLYFOORBDZNH-ZDUSSCGKSA-N 0 3 335.404 2.598 20 5 EFBDHN C[C@@H](C(=O)N(C)CC1(N(C)C)CCC1)c1ccc([N+](=O)[O-])cc1F ZINC000188072966 526242362 /nfs/dbraw/zinc/24/23/62/526242362.db2.gz JCKXACZODNBHRZ-GFCCVEGCSA-N 0 3 337.395 2.780 20 5 EFBDHN O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])s1 ZINC000193774408 526538838 /nfs/dbraw/zinc/53/88/38/526538838.db2.gz XRSMLUXBTVJCGO-AWEZNQCLSA-N 0 3 345.424 2.908 20 5 EFBDHN CC(C)(C)[C@H](CCO)NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000181485866 526692838 /nfs/dbraw/zinc/69/28/38/526692838.db2.gz IGKSWHYHCOZBAD-ZDUSSCGKSA-N 0 3 343.811 2.573 20 5 EFBDHN CC(C)(C)[C@H](CCO)NCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000181477300 526693169 /nfs/dbraw/zinc/69/31/69/526693169.db2.gz SLUOWHUCINHGMY-ZDUSSCGKSA-N 0 3 343.811 2.573 20 5 EFBDHN O=[N+]([O-])c1c(N2CCN(C3CCCCC3)CC2)nc2sccn21 ZINC000152433997 527321790 /nfs/dbraw/zinc/32/17/90/527321790.db2.gz LBDDPHAPVXDDQI-UHFFFAOYSA-N 0 3 335.433 2.759 20 5 EFBDHN O=C(NCCCNCc1cccnc1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000237725894 527677350 /nfs/dbraw/zinc/67/73/50/527677350.db2.gz BQGHBYUQBIOSGY-UHFFFAOYSA-N 0 3 348.790 2.553 20 5 EFBDHN CC1(C)C[C@H](NCc2cc([N+](=O)[O-])cc3c2OCOC3)C(C)(C)O1 ZINC000155159383 527744416 /nfs/dbraw/zinc/74/44/16/527744416.db2.gz RFKRJMMYXQTWMY-AWEZNQCLSA-N 0 3 336.388 2.897 20 5 EFBDHN CCO[C@H]1C[C@@H](N(C)C[C@H](O)c2cccc([N+](=O)[O-])c2)C12CCC2 ZINC000154461207 528073108 /nfs/dbraw/zinc/07/31/08/528073108.db2.gz PMLNESPOTYQMPL-BBWFWOEESA-N 0 3 334.416 2.908 20 5 EFBDHN CCOc1ccc([C@@H](C)NCCCO[C@H]2CCOC2)cc1[N+](=O)[O-] ZINC000154220352 528594922 /nfs/dbraw/zinc/59/49/22/528594922.db2.gz WPHVRXRDUJTXGI-HIFRSBDPSA-N 0 3 338.404 2.840 20 5 EFBDHN CCOc1ccc([C@@H](C)N[C@@H](C)[C@@H](CO)SC)cc1[N+](=O)[O-] ZINC000153909630 528595988 /nfs/dbraw/zinc/59/59/88/528595988.db2.gz QMKXIYZITLRQQT-JRPNMDOOSA-N 0 3 328.434 2.757 20 5 EFBDHN CCOc1ccc([C@@H](C)N[C@H](C)[C@@H](CO)SC)cc1[N+](=O)[O-] ZINC000153909845 528598214 /nfs/dbraw/zinc/59/82/14/528598214.db2.gz QMKXIYZITLRQQT-UEKVPHQBSA-N 0 3 328.434 2.757 20 5 EFBDHN CCOC[C@@H]1CCCN(CCOc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000173749703 528923594 /nfs/dbraw/zinc/92/35/94/528923594.db2.gz JADDCIOWEIJUPI-CQSZACIVSA-N 0 3 338.404 2.731 20 5 EFBDHN CC(C)[C@H](CN[C@@H](C)c1cccc([N+](=O)[O-])c1)N1CCN(C)CC1 ZINC000132351356 529013864 /nfs/dbraw/zinc/01/38/64/529013864.db2.gz DJJLJIWLMYIKRH-YJBOKZPZSA-N 0 3 334.464 2.517 20 5 EFBDHN CCC[C@@H](N[C@H](CC)C(=O)N1CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000165117179 529021996 /nfs/dbraw/zinc/02/19/96/529021996.db2.gz IASOIOUHPFBSTR-IAGOWNOFSA-N 0 3 349.431 2.663 20 5 EFBDHN CC[C@@H](NCCn1cc([N+](=O)[O-])ccc1=O)c1ccc(F)cc1F ZINC000179619221 529171783 /nfs/dbraw/zinc/17/17/83/529171783.db2.gz OCPTZMQBLQQMQY-OAHLLOKOSA-N 0 3 337.326 2.776 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](N(C)C)C1 ZINC000131467055 529248020 /nfs/dbraw/zinc/24/80/20/529248020.db2.gz REKGSRGRNPMHSE-CYBMUJFWSA-N 0 3 337.445 2.873 20 5 EFBDHN CC(C)Oc1cc(C(=O)N2CCCN(C(C)C)CC2)ccc1[N+](=O)[O-] ZINC000411975063 534943147 /nfs/dbraw/zinc/94/31/47/534943147.db2.gz XFOYMDUIZJHCGR-UHFFFAOYSA-N 0 3 349.431 2.938 20 5 EFBDHN CC(C)Oc1cc(C(=O)N2CC[C@]3(CCN(C)C3)C2)ccc1[N+](=O)[O-] ZINC000412354546 534946689 /nfs/dbraw/zinc/94/66/89/534946689.db2.gz BNKZHZDMOIUGGE-SFHVURJKSA-N 0 3 347.415 2.550 20 5 EFBDHN CC(C)Oc1cc(C(=O)N[C@@H]2CCN(C)[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000412134054 534949961 /nfs/dbraw/zinc/94/99/61/534949961.db2.gz LGWUKKMTNYQVDO-GXTWGEPZSA-N 0 3 335.404 2.595 20 5 EFBDHN CCOc1ccc([C@@H](C)N[C@@H]2CC[C@H](C(=O)OC)C2)cc1[N+](=O)[O-] ZINC000193876092 535412558 /nfs/dbraw/zinc/41/25/58/535412558.db2.gz IYKMSYWRLMAAHE-KWCYVHTRSA-N 0 3 336.388 2.986 20 5 EFBDHN CCC[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2F)CCN1CCOC ZINC000347577177 535437215 /nfs/dbraw/zinc/43/72/15/535437215.db2.gz ZQMVXLRZBKTMHI-MRXNPFEDSA-N 0 3 339.411 2.667 20 5 EFBDHN CCN1CCC[C@@H]1CNC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000246976168 535562695 /nfs/dbraw/zinc/56/26/95/535562695.db2.gz JMDAEEVBHMSQBN-UKRRQHHQSA-N 0 3 334.420 2.748 20 5 EFBDHN CCN(CCNc1ncc(Br)cc1[N+](=O)[O-])C1CC1 ZINC000230214828 535741509 /nfs/dbraw/zinc/74/15/09/535741509.db2.gz YUIZRUNCOQUMTP-UHFFFAOYSA-N 0 3 329.198 2.649 20 5 EFBDHN CCN(CCNc1ncc([N+](=O)[O-])cc1Br)C1CC1 ZINC000226357401 535741795 /nfs/dbraw/zinc/74/17/95/535741795.db2.gz IVUCWDJHXWMOCK-UHFFFAOYSA-N 0 3 329.198 2.649 20 5 EFBDHN CCC[C@H]1CN(Cc2cccc([N+](=O)[O-])c2C)CCN1CCOC ZINC000347580344 535742027 /nfs/dbraw/zinc/74/20/27/535742027.db2.gz LPZOVLNJWYVYHB-KRWDZBQOSA-N 0 3 335.448 2.836 20 5 EFBDHN CCC[C@H]1CN(Cc2ccc([N+](=O)[O-])cc2F)CCN1CCOC ZINC000347577176 535742135 /nfs/dbraw/zinc/74/21/35/535742135.db2.gz ZQMVXLRZBKTMHI-INIZCTEOSA-N 0 3 339.411 2.667 20 5 EFBDHN CC[C@H](NCC1(CS(C)(=O)=O)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000342288334 535897670 /nfs/dbraw/zinc/89/76/70/535897670.db2.gz OYDMYEXUXQKQLG-HNNXBMFYSA-N 0 3 340.445 2.850 20 5 EFBDHN CN(C)Cc1ccc(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000351250670 536015871 /nfs/dbraw/zinc/01/58/71/536015871.db2.gz KYCLNKZUFWXHTQ-UHFFFAOYSA-N 0 3 339.355 2.785 20 5 EFBDHN CC[C@H]1CCC[C@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000349660566 536077589 /nfs/dbraw/zinc/07/75/89/536077589.db2.gz CNPXUGPNXDHHLF-KBPBESRZSA-N 0 3 340.445 2.927 20 5 EFBDHN CN1CCC(Nc2ccccc2NC(=O)c2cc([N+](=O)[O-])c[nH]2)CC1 ZINC000348004498 536345460 /nfs/dbraw/zinc/34/54/60/536345460.db2.gz FBNIDXKNQNLXPW-UHFFFAOYSA-N 0 3 343.387 2.681 20 5 EFBDHN CN(CCN1CCCC1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000349077864 536371205 /nfs/dbraw/zinc/37/12/05/536371205.db2.gz QLVBIRWLKYMRIN-UHFFFAOYSA-N 0 3 329.347 2.724 20 5 EFBDHN COC(=O)[C@@]12CN(Cc3ccc(OC)c([N+](=O)[O-])c3)C[C@@H]1CCCC2 ZINC000342128079 536587509 /nfs/dbraw/zinc/58/75/09/536587509.db2.gz RLLDRNGXKOABBL-KSSFIOAISA-N 0 3 348.399 2.769 20 5 EFBDHN COC(=O)[C@@]12CN(Cc3ccc([N+](=O)[O-])c(OC)c3)C[C@@H]1CCCC2 ZINC000342149775 536587985 /nfs/dbraw/zinc/58/79/85/536587985.db2.gz GRXMWCLMYMVUGB-KSSFIOAISA-N 0 3 348.399 2.769 20 5 EFBDHN COc1ccc(CNC(=O)c2cccc(CN(C)C)c2)cc1[N+](=O)[O-] ZINC000355815481 536889885 /nfs/dbraw/zinc/88/98/85/536889885.db2.gz BDZNMKCCVRPECO-UHFFFAOYSA-N 0 3 343.383 2.595 20 5 EFBDHN COc1cccc(C(=O)N2CCN(C3CCC3)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000344767874 537082415 /nfs/dbraw/zinc/08/24/15/537082415.db2.gz FYEKIJHMLFULFL-ZDUSSCGKSA-N 0 3 347.415 2.550 20 5 EFBDHN C[C@@H](NC[C@H](O)c1ccc([N+](=O)[O-])cc1)c1cccc([N+](=O)[O-])c1 ZINC000754250516 575410662 /nfs/dbraw/zinc/41/06/62/575410662.db2.gz JBXPGHSXVIPXKU-BZNIZROVSA-N 0 3 331.328 2.887 20 5 EFBDHN O=C(CCN[C@H](CCO)c1cccs1)Nc1ccccc1[N+](=O)[O-] ZINC000754385053 575428947 /nfs/dbraw/zinc/42/89/47/575428947.db2.gz HVFZOSOAGGFBOJ-CYBMUJFWSA-N 0 3 349.412 2.698 20 5 EFBDHN COCC[C@H](NC[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(C)o1 ZINC000754547524 575450652 /nfs/dbraw/zinc/45/06/52/575450652.db2.gz WGPFKAHBNULHCG-JKSUJKDBSA-N 0 3 334.372 2.897 20 5 EFBDHN C[C@@H]1CN(CCCCNc2nc3ccccn3c2[N+](=O)[O-])C[C@@H](C)O1 ZINC000754614916 575461678 /nfs/dbraw/zinc/46/16/78/575461678.db2.gz RHKXRVPZSWJFDD-ZIAGYGMSSA-N 0 3 347.419 2.544 20 5 EFBDHN O=C(NCCN1CCCCC1)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000756778206 575786098 /nfs/dbraw/zinc/78/60/98/575786098.db2.gz QZUPGICGHXFLKB-UHFFFAOYSA-N 0 3 340.811 2.533 20 5 EFBDHN COc1ccc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(C)c1 ZINC000757661436 575848344 /nfs/dbraw/zinc/84/83/44/575848344.db2.gz MAXXZUBBDDUMJG-OAHLLOKOSA-N 0 3 342.399 2.993 20 5 EFBDHN Cc1cc(F)cc(C(=O)N2CC[C@H](N3CCCCC3)C2)c1[N+](=O)[O-] ZINC000758488004 575870793 /nfs/dbraw/zinc/87/07/93/575870793.db2.gz WHLZZCVSELOALS-AWEZNQCLSA-N 0 3 335.379 2.743 20 5 EFBDHN CS[C@@H]1CN(c2ccc([N+](=O)[O-])cc2OC(F)F)C[C@H]1N(C)C ZINC000760576869 576049127 /nfs/dbraw/zinc/04/91/27/576049127.db2.gz MXSVBVULXIPAGJ-DGCLKSJQSA-N 0 3 347.387 2.678 20 5 EFBDHN O=[N+]([O-])c1ccc(Cl)cc1CN1CCN(c2ccncc2)CC1 ZINC000760883025 576084607 /nfs/dbraw/zinc/08/46/07/576084607.db2.gz WJKDERYLZCRTCK-UHFFFAOYSA-N 0 3 332.791 2.965 20 5 EFBDHN O=C(CCN1CC[C@H](C(F)(F)F)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000761040719 576103448 /nfs/dbraw/zinc/10/34/48/576103448.db2.gz JLUFATRTCZEBCF-JTQLQIEISA-N 0 3 331.294 2.808 20 5 EFBDHN O=C(CCN1CC[C@@H](C(F)(F)F)C1)Nc1ccccc1[N+](=O)[O-] ZINC000761050506 576104850 /nfs/dbraw/zinc/10/48/50/576104850.db2.gz KNTJLQOGEWKPKN-SNVBAGLBSA-N 0 3 331.294 2.808 20 5 EFBDHN O=[N+]([O-])c1ccc(CNC2CCN(c3cccnn3)CC2)cc1Cl ZINC000763477070 576378686 /nfs/dbraw/zinc/37/86/86/576378686.db2.gz SBYGLFNXVWTTSB-UHFFFAOYSA-N 0 3 347.806 2.797 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(N[C@H]2CCN(C)[C@H](C)C2)cc1Cl ZINC000765508849 577048654 /nfs/dbraw/zinc/04/86/54/577048654.db2.gz LDCWEKXVSSKNNW-ZJUUUORDSA-N 0 3 341.795 2.929 20 5 EFBDHN Cc1cc(F)cc(C(=O)NC[C@@H]2CCCCN2C2CC2)c1[N+](=O)[O-] ZINC000765795186 577077867 /nfs/dbraw/zinc/07/78/67/577077867.db2.gz GGTWDCNRNQMAOY-AWEZNQCLSA-N 0 3 335.379 2.789 20 5 EFBDHN COc1cccc2c1CC[C@@H]2NC[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000765849339 577082620 /nfs/dbraw/zinc/08/26/20/577082620.db2.gz OQDQZLYETSIUNW-IRXDYDNUSA-N 0 3 328.368 2.914 20 5 EFBDHN Cc1ccc([C@H](O)CN[C@@H](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2)o1 ZINC000766141534 577113905 /nfs/dbraw/zinc/11/39/05/577113905.db2.gz MYBJZZHSKQKRRU-XHDPSFHLSA-N 0 3 347.371 2.537 20 5 EFBDHN CS[C@H]1CN(c2nc3ccc([N+](=O)[O-])cc3s2)C[C@@H]1N(C)C ZINC000767292984 577203034 /nfs/dbraw/zinc/20/30/34/577203034.db2.gz WHTJVWREZAJDTO-AAEUAGOBSA-N 0 3 338.458 2.686 20 5 EFBDHN CCN(CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O)C1CCCC1 ZINC000726586371 577374260 /nfs/dbraw/zinc/37/42/60/577374260.db2.gz WWRKFDFTGCHJHD-UHFFFAOYSA-N 0 3 346.387 2.585 20 5 EFBDHN CCN(CC)CCOC(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000772071863 581278290 /nfs/dbraw/zinc/27/82/90/581278290.db2.gz QEWCVJJYDVTLIY-UHFFFAOYSA-N 0 3 345.193 2.856 20 5 EFBDHN CCN(CC)CCOC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000772256047 581300446 /nfs/dbraw/zinc/30/04/46/581300446.db2.gz FSAKVHBHTOKCIW-UHFFFAOYSA-N 0 3 345.193 2.856 20 5 EFBDHN O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2NC[C@H](O)c2ccccc2F)n1 ZINC000774136103 581485073 /nfs/dbraw/zinc/48/50/73/581485073.db2.gz XMYUJJVELUDKJU-OAGGEKHMSA-N 0 3 348.378 2.737 20 5 EFBDHN O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2NC[C@@H](O)c2ccccc2F)n1 ZINC000774136094 581485078 /nfs/dbraw/zinc/48/50/78/581485078.db2.gz XMYUJJVELUDKJU-BZUAXINKSA-N 0 3 348.378 2.737 20 5 EFBDHN CCN(C[C@H]1CCOC1)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774635437 581495848 /nfs/dbraw/zinc/49/58/48/581495848.db2.gz IIEFGEHFHYIVOQ-LLVKDONJSA-N 0 3 338.795 2.914 20 5 EFBDHN O=[N+]([O-])c1cc2cnn(CN3CCN(C4CCC4)CC3)c2c(Cl)c1 ZINC000774638210 581496070 /nfs/dbraw/zinc/49/60/70/581496070.db2.gz QLOYYMKRDXGMAN-UHFFFAOYSA-N 0 3 349.822 2.726 20 5 EFBDHN CC(C)(C)N1C[C@H](CNCc2cc([N+](=O)[O-])ccc2Cl)CC1=O ZINC000850395544 1250462875 /nfs/dbraw/zinc/46/28/75/1250462875.db2.gz ALICQWQYBXPLLU-NSHDSACASA-N 0 3 339.823 2.985 20 5 EFBDHN Cc1nc(SCC(C)C)sc1CC(=O)OCC(C)[N+](=O)[O-] ZINC000851035766 1250766299 /nfs/dbraw/zinc/76/62/99/1250766299.db2.gz AKTCRRGUKRKRIE-SECBINFHSA-N 0 3 332.447 2.951 20 5 EFBDHN CC([C@@H](OC(=O)c1ccnn1C(F)F)c1ccccc1F)[N+](=O)[O-] ZINC000851108958 1250806447 /nfs/dbraw/zinc/80/64/47/1250806447.db2.gz SUQUVKLINKGWAZ-QPUJVOFHSA-N 0 3 343.261 2.981 20 5 EFBDHN O=C(C1CCC1)N1CCC(CNCc2csc([N+](=O)[O-])c2)CC1 ZINC000997463787 1257596537 /nfs/dbraw/zinc/59/65/37/1257596537.db2.gz IDEVGAUZPGBJGH-UHFFFAOYSA-N 0 3 337.445 2.785 20 5 EFBDHN CC(C)(F)C(=O)N1CCC(CNCc2csc([N+](=O)[O-])c2)CC1 ZINC000997460435 1257612127 /nfs/dbraw/zinc/61/21/27/1257612127.db2.gz FASYWWOEKFOCNQ-UHFFFAOYSA-N 0 3 343.424 2.733 20 5 EFBDHN O=C(c1cc[nH]c1)N1CCC(CNCc2csc([N+](=O)[O-])c2)CC1 ZINC000997805533 1258460613 /nfs/dbraw/zinc/46/06/13/1258460613.db2.gz YMAUJIQPGJQGSY-UHFFFAOYSA-N 0 3 348.428 2.626 20 5 EFBDHN CCCN(C)CC(=O)NCCC1(CNc2ccccc2[N+](=O)[O-])CC1 ZINC001089951064 1261142817 /nfs/dbraw/zinc/14/28/17/1261142817.db2.gz WSLKYPSBXUKXGX-UHFFFAOYSA-N 0 3 348.447 2.635 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2cnn(CN3CCN(C4CCC4)CC3)c2)cc1 ZINC000733298004 1265165848 /nfs/dbraw/zinc/16/58/48/1265165848.db2.gz OXMLKROTDQLBKI-UHFFFAOYSA-N 0 3 341.415 2.586 20 5 EFBDHN CCN1CCN(c2ccc(Nc3c([N+](=O)[O-])c(C)nn3C)cc2)CC1 ZINC000734141291 1266888844 /nfs/dbraw/zinc/88/88/44/1266888844.db2.gz HBQMAXPPVBQVMK-UHFFFAOYSA-N 0 3 344.419 2.522 20 5 EFBDHN Cc1[nH]ccc1C(=O)NC[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001086057458 1269717423 /nfs/dbraw/zinc/71/74/23/1269717423.db2.gz OCJAJHJFWBKOGZ-OTVXOJSOSA-N 0 3 342.399 2.530 20 5 EFBDHN CCOC(=O)CCN(CC1CC1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000745438013 1271475768 /nfs/dbraw/zinc/47/57/68/1271475768.db2.gz OTDVCZATHCIYSI-UHFFFAOYSA-N 0 3 346.387 2.567 20 5 EFBDHN CN(CC(F)F)C1CCN(CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000746483736 1272410431 /nfs/dbraw/zinc/41/04/31/1272410431.db2.gz ZDICWONNGWBORY-UHFFFAOYSA-N 0 3 343.374 2.635 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1NCc1ccccc1-n1cccn1)CNC2 ZINC001168966754 1272559332 /nfs/dbraw/zinc/55/93/32/1272559332.db2.gz LJERYCUCXRYYMY-UHFFFAOYSA-N 0 3 335.367 2.996 20 5 EFBDHN O=[N+]([O-])C[C@@H]1CC[C@H](NCc2cc(O)ccc2Br)C1 ZINC001168988159 1272589242 /nfs/dbraw/zinc/58/92/42/1272589242.db2.gz OOYFHHOMIOIYAG-KOLCDFICSA-N 0 3 329.194 2.690 20 5 EFBDHN CC(C)(C)OC(=O)N1CCN([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC12CC2 ZINC001169036460 1272601768 /nfs/dbraw/zinc/60/17/68/1272601768.db2.gz OLWSKCASRLIRTP-ZIAGYGMSSA-N 0 3 339.436 2.517 20 5 EFBDHN C[C@H]1CN([C@H]2CC[C@@H](C[N+](=O)[O-])C2)C[C@H](C)N1C(=O)OC(C)(C)C ZINC001169047879 1272626549 /nfs/dbraw/zinc/62/65/49/1272626549.db2.gz SEDOFOLAONWQEW-XQLPTFJDSA-N 0 3 341.452 2.762 20 5 EFBDHN NCc1ccc2c(n1)N(c1ccc3nsnc3c1[N+](=O)[O-])CCC2 ZINC001169590271 1273023710 /nfs/dbraw/zinc/02/37/10/1273023710.db2.gz CZZHZCROPPBKGC-UHFFFAOYSA-N 0 3 342.384 2.538 20 5 EFBDHN Cc1c(N2CCCc3ccc(CN)nc32)ccc([N+](=O)[O-])c1[N+](=O)[O-] ZINC001169592334 1273026024 /nfs/dbraw/zinc/02/60/24/1273026024.db2.gz NNOVEUVBXRLGMF-UHFFFAOYSA-N 0 3 343.343 2.749 20 5 EFBDHN CCN1CCN([C@H](C)CNc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000804349179 1273412911 /nfs/dbraw/zinc/41/29/11/1273412911.db2.gz JZIKFXJLPMUJPI-GFCCVEGCSA-N 0 3 326.828 2.686 20 5 EFBDHN O=C(C1CC1)N1CCC2(CCN(Cc3cccc([N+](=O)[O-])c3)C2)CC1 ZINC001035149746 1273649862 /nfs/dbraw/zinc/64/98/62/1273649862.db2.gz SYYQFQJQPCPLAG-UHFFFAOYSA-N 0 3 343.427 2.819 20 5 EFBDHN Cc1cc(NC[C@H]2CN3CCC[C@@H]3CO2)c(Cl)cc1[N+](=O)[O-] ZINC000785808008 1275193720 /nfs/dbraw/zinc/19/37/20/1275193720.db2.gz WMKCNYUQFCYMQH-NEPJUHHUSA-N 0 3 325.796 2.832 20 5 EFBDHN COc1ccc(C[C@H](C)N(C)c2nc(CN)ccc2C)c([N+](=O)[O-])c1 ZINC001170294600 1278978464 /nfs/dbraw/zinc/97/84/64/1278978464.db2.gz BSGVJKFNFYGIDY-ZDUSSCGKSA-N 0 3 344.415 2.833 20 5 EFBDHN C[C@H](NCc1ccc(NC(N)=O)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788506009 1276204722 /nfs/dbraw/zinc/20/47/22/1276204722.db2.gz IYWCHFYIUXWVAX-JTQLQIEISA-N 0 3 329.360 2.518 20 5 EFBDHN C[C@@H](CNC(=O)OC(C)(C)C)N[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788780081 1276322930 /nfs/dbraw/zinc/32/29/30/1276322930.db2.gz AZYBUJSVVPJPHD-QWRGUYRKSA-N 0 3 338.408 2.741 20 5 EFBDHN COc1ccc(C[C@H](C)N2CCN(C3CCC3)CC2)c([N+](=O)[O-])c1 ZINC001170329314 1279020030 /nfs/dbraw/zinc/02/00/30/1279020030.db2.gz OIBXITPVYVECCR-AWEZNQCLSA-N 0 3 333.432 2.705 20 5 EFBDHN O=[N+]([O-])c1cc(F)c(NC2CCN(C[C@@H]3CCCO3)CC2)c(F)c1 ZINC000749316160 1276450665 /nfs/dbraw/zinc/45/06/65/1276450665.db2.gz KXPUEWBIIUUUIA-ZDUSSCGKSA-N 0 3 341.358 2.928 20 5 EFBDHN CCN(CC)c1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cn1 ZINC000818962782 1276551625 /nfs/dbraw/zinc/55/16/25/1276551625.db2.gz YTZRIDPNWGAEOA-QGZVFWFLSA-N 0 3 344.415 2.659 20 5 EFBDHN COc1ccc2c(c1)OCC[C@H]2NC[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000819104693 1276608913 /nfs/dbraw/zinc/60/89/13/1276608913.db2.gz RYGZGJCLSFDIPN-SJORKVTESA-N 0 3 344.367 2.750 20 5 EFBDHN COc1ccc2c(c1)OCC[C@H]2NC[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819103901 1276609499 /nfs/dbraw/zinc/60/94/99/1276609499.db2.gz MIUUMNAOIUJEAO-SJORKVTESA-N 0 3 344.367 2.750 20 5 EFBDHN COc1ccc2c(c1)OCC[C@H]2NC[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819103898 1276609975 /nfs/dbraw/zinc/60/99/75/1276609975.db2.gz MIUUMNAOIUJEAO-IAGOWNOFSA-N 0 3 344.367 2.750 20 5 EFBDHN CC(C)(C)Oc1ccc(CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000819214301 1276692729 /nfs/dbraw/zinc/69/27/29/1276692729.db2.gz SKVPWBLEAUZMOI-INIZCTEOSA-N 0 3 345.399 2.990 20 5 EFBDHN Cc1c(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cccc1[N+](=O)[O-] ZINC000819259058 1276713834 /nfs/dbraw/zinc/71/38/34/1276713834.db2.gz FGCQLBGMESIMHI-INIZCTEOSA-N 0 3 331.328 2.635 20 5 EFBDHN C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)CCN(C2CC2)C1 ZINC000820874910 1277355239 /nfs/dbraw/zinc/35/52/39/1277355239.db2.gz VASLPZIQHSDXLY-DOPJRALCSA-N 0 3 343.427 2.641 20 5 EFBDHN C[C@@H](C(=O)N1[C@@H]2CC[C@H]1CN(C)CC2)c1ccc([N+](=O)[O-])cc1F ZINC000923271092 1277437176 /nfs/dbraw/zinc/43/71/76/1277437176.db2.gz KQANYOWVDOUROO-BZPMIXESSA-N 0 3 335.379 2.533 20 5 EFBDHN CCN(C(=O)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1)C1CCN(C)CC1 ZINC000821400822 1277536944 /nfs/dbraw/zinc/53/69/44/1277536944.db2.gz IENBEUIJEORPRX-SJORKVTESA-N 0 3 331.416 2.641 20 5 EFBDHN O=[N+]([O-])c1cc(F)c(Cl)cc1NC[C@@H]1CCCN1CCCO ZINC000845554228 1279722221 /nfs/dbraw/zinc/72/22/21/1279722221.db2.gz GESLVLFCYOHCSD-JTQLQIEISA-N 0 3 331.775 2.646 20 5 EFBDHN Cc1c(CCC(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])cnn1C ZINC000845873007 1279901168 /nfs/dbraw/zinc/90/11/68/1279901168.db2.gz BCZCKVITCZABOH-PXAZEXFGSA-N 0 3 349.362 2.750 20 5 EFBDHN Cc1nccc(CCC(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])n1 ZINC000845875334 1279901703 /nfs/dbraw/zinc/90/17/03/1279901703.db2.gz BIBQIBMAJGRUBZ-GTNSWQLSSA-N 0 3 347.346 2.806 20 5 EFBDHN Cc1noc(C)c1CC(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845874255 1279901835 /nfs/dbraw/zinc/90/18/35/1279901835.db2.gz YOSXERZPWDCNNL-MGPLVRAMSA-N 0 3 336.319 2.923 20 5 EFBDHN Cc1cc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])cc(=O)[nH]1 ZINC000845874003 1279902271 /nfs/dbraw/zinc/90/22/71/1279902271.db2.gz FTPIVLZANCWOBP-MEBBXXQBSA-N 0 3 334.303 2.798 20 5 EFBDHN CCn1cc(CC(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])cn1 ZINC000845876996 1279903092 /nfs/dbraw/zinc/90/30/92/1279903092.db2.gz CUBXCTDLPUDMCO-ZBEGNZNMSA-N 0 3 335.335 2.534 20 5 EFBDHN CC([C@@H](OC(=O)CC[C@@H]1CCOC1)c1ccccc1F)[N+](=O)[O-] ZINC000845878802 1279903172 /nfs/dbraw/zinc/90/31/72/1279903172.db2.gz SRZBXMUKJRZAGU-XHBSWPGZSA-N 0 3 325.336 2.892 20 5 EFBDHN CC([C@H](OC(=O)[C@@H]1CCO[C@H](C)C1)c1ccccc1F)[N+](=O)[O-] ZINC000845876734 1279903560 /nfs/dbraw/zinc/90/35/60/1279903560.db2.gz ODCDZTNAIKOYBL-ZAZJYDDPSA-N 0 3 325.336 2.890 20 5 EFBDHN CC([C@@H](OC(=O)[C@H](C)OCC1CC1)c1ccccc1F)[N+](=O)[O-] ZINC000845878742 1279903685 /nfs/dbraw/zinc/90/36/85/1279903685.db2.gz VUWHSOXXHXKDDH-JRPNMDOOSA-N 0 3 325.336 2.890 20 5 EFBDHN CC([C@@H](OC(=O)c1cc2n(n1)CCCC2)c1ccccc1F)[N+](=O)[O-] ZINC000845882318 1279904408 /nfs/dbraw/zinc/90/44/08/1279904408.db2.gz OMEXSYATBZLXTC-BDJLRTHQSA-N 0 3 347.346 2.922 20 5 EFBDHN COc1ccnc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])c1 ZINC000845882412 1279905879 /nfs/dbraw/zinc/90/58/79/1279905879.db2.gz UJYOHZWNDROKNX-MEBBXXQBSA-N 0 3 334.303 2.793 20 5 EFBDHN CC([C@@H](OC(=O)[C@@H]1CCc2n[nH]cc2C1)c1ccccc1F)[N+](=O)[O-] ZINC000845882031 1279906138 /nfs/dbraw/zinc/90/61/38/1279906138.db2.gz NMUJXVBPKQRZOH-GLKRBJQHSA-N 0 3 347.346 2.603 20 5 EFBDHN CC([C@H](OC(=O)c1cc(Cl)n(C)n1)c1ccccc1F)[N+](=O)[O-] ZINC000845882072 1279906441 /nfs/dbraw/zinc/90/64/41/1279906441.db2.gz NVAYYAXDBYGZAJ-SDBXPKJASA-N 0 3 341.726 2.776 20 5 EFBDHN CC([C@@H](OC(=O)[C@H]1C[C@H]2CC(=O)[C@@H]1C2)c1ccccc1F)[N+](=O)[O-] ZINC000845882262 1279906585 /nfs/dbraw/zinc/90/65/85/1279906585.db2.gz SBWUZVWRTFFYMI-HVVFIYQFSA-N 0 3 335.331 2.690 20 5 EFBDHN CC([C@@H](OC(=O)[C@@H]1O[C@H](C)C[C@@H]1C)c1ccccc1F)[N+](=O)[O-] ZINC000845884546 1279907557 /nfs/dbraw/zinc/90/75/57/1279907557.db2.gz ZKSYZTVNMHWDCZ-GLRJYAJPSA-N 0 3 325.336 2.889 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCCNc1cnccn1 ZINC000872042899 1287409676 /nfs/dbraw/zinc/40/96/76/1287409676.db2.gz FFDLUCFVZCUWIS-NSHDSACASA-N 0 3 333.417 2.869 20 5 EFBDHN COCCN1CC[C@@H](N[C@H](C)c2cc([N+](=O)[O-])ccc2SC)C1 ZINC000872035313 1287407858 /nfs/dbraw/zinc/40/78/58/1287407858.db2.gz LTWSQXOIKMIOAT-CHWSQXEVSA-N 0 3 339.461 2.688 20 5 EFBDHN COCCN1CC[C@H](N[C@@H](C)c2cc([N+](=O)[O-])ccc2SC)C1 ZINC000872035316 1287408010 /nfs/dbraw/zinc/40/80/10/1287408010.db2.gz LTWSQXOIKMIOAT-STQMWFEESA-N 0 3 339.461 2.688 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@]1(O)CCSC1 ZINC000872040593 1287409800 /nfs/dbraw/zinc/40/98/00/1287409800.db2.gz MJFQIWXOOBYQBY-QMTHXVAHSA-N 0 3 328.459 2.835 20 5 EFBDHN O=[N+]([O-])c1ccc(Cl)cc1CN[C@@H](C1CC1)[C@]1(CO)CCCO1 ZINC000815289269 1287413012 /nfs/dbraw/zinc/41/30/12/1287413012.db2.gz XKMMSCMSTUSFGY-JKSUJKDBSA-N 0 3 340.807 2.658 20 5 EFBDHN CNC(=O)[C@@H]1CCC[C@@H]1N[C@@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872054488 1287413153 /nfs/dbraw/zinc/41/31/53/1287413153.db2.gz XGPMFIKJTRAOBS-SUHUHFCYSA-N 0 3 337.445 2.882 20 5 EFBDHN CNC(=O)[C@@H]1CCC[C@H]1N[C@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872054486 1287413466 /nfs/dbraw/zinc/41/34/66/1287413466.db2.gz XGPMFIKJTRAOBS-MPKXVKKWSA-N 0 3 337.445 2.882 20 5 EFBDHN CN(CCN1CCCCC1)C(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000846614178 1280320631 /nfs/dbraw/zinc/32/06/31/1280320631.db2.gz KWYDCKCPUKWVIB-UHFFFAOYSA-N 0 3 325.796 2.806 20 5 EFBDHN CCCN(C)CC(=O)NC[C@H]1C[C@@H](Nc2ccc(C)cc2[N+](=O)[O-])C1 ZINC001091359292 1280429612 /nfs/dbraw/zinc/42/96/12/1280429612.db2.gz YDVZNSAKILOZGF-GASCZTMLSA-N 0 3 348.447 2.552 20 5 EFBDHN CCc1ccccc1CC(=O)NCCNCc1cccc([N+](=O)[O-])c1 ZINC001130147580 1280497776 /nfs/dbraw/zinc/49/77/76/1280497776.db2.gz FXZKZFAKRXMTLN-UHFFFAOYSA-N 0 3 341.411 2.606 20 5 EFBDHN CCCN(C)CC(=O)NC[C@H]1C[C@H](Nc2ccc(C)cc2[N+](=O)[O-])C1 ZINC001091471157 1280760998 /nfs/dbraw/zinc/76/09/98/1280760998.db2.gz YDVZNSAKILOZGF-SHTZXODSSA-N 0 3 348.447 2.552 20 5 EFBDHN CCn1c(C)cc(C(=O)NCCNCc2ccc([N+](=O)[O-])cc2)c1C ZINC001130963749 1281327391 /nfs/dbraw/zinc/32/73/91/1281327391.db2.gz FCNSJUJZALUGMQ-UHFFFAOYSA-N 0 3 344.415 2.553 20 5 EFBDHN CCc1cc(C)c(C(=O)NCCNCc2ccc([N+](=O)[O-])cc2)o1 ZINC001147958851 1281379788 /nfs/dbraw/zinc/37/97/88/1281379788.db2.gz XOAGEBSHUQVMRG-UHFFFAOYSA-N 0 3 331.372 2.578 20 5 EFBDHN CC(=O)c1ccc([N+](=O)[O-])cc1NCCCN1CCCO[C@@H](C)C1 ZINC000808048942 1281521004 /nfs/dbraw/zinc/52/10/04/1281521004.db2.gz MUURMLZSAHUCRS-ZDUSSCGKSA-N 0 3 335.404 2.710 20 5 EFBDHN Cc1nc(C(C)C)oc1C(=O)NCCNCc1ccc([N+](=O)[O-])cc1 ZINC001135014779 1287504470 /nfs/dbraw/zinc/50/44/70/1287504470.db2.gz YFWFTAFGOJCMCX-UHFFFAOYSA-N 0 3 346.387 2.534 20 5 EFBDHN CC(C)(CC(=O)NCCNCc1ccc([N+](=O)[O-])cc1)CC(F)F ZINC001131486736 1281924415 /nfs/dbraw/zinc/92/44/15/1281924415.db2.gz OTWMHKUYUDQKHR-UHFFFAOYSA-N 0 3 343.374 2.872 20 5 EFBDHN CC(=O)Nc1ccc(CN[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000815556470 1287595148 /nfs/dbraw/zinc/59/51/48/1287595148.db2.gz VYDJSQCNELGWQF-LLVKDONJSA-N 0 3 328.372 2.986 20 5 EFBDHN O=C(NCCNCc1ccc([N+](=O)[O-])cc1)c1ccoc1C1CC1 ZINC001132935585 1284462943 /nfs/dbraw/zinc/46/29/43/1284462943.db2.gz ZODSTPCHWKPDGY-UHFFFAOYSA-N 0 3 329.356 2.585 20 5 EFBDHN O=C(NCCNCc1cccc([N+](=O)[O-])c1)c1ccc2[nH]ccc2c1 ZINC001133136306 1284852496 /nfs/dbraw/zinc/85/24/96/1284852496.db2.gz PQHLHSDTTWZEJK-UHFFFAOYSA-N 0 3 338.367 2.596 20 5 EFBDHN COc1cc(-n2c(-c3ccccc3)cnc2[C@H](C)N)cnc1[N+](=O)[O-] ZINC001170683122 1285345090 /nfs/dbraw/zinc/34/50/90/1285345090.db2.gz VSTRLEKSAVSPNN-NSHDSACASA-N 0 3 339.355 2.871 20 5 EFBDHN CC(COC(=O)c1ccc(-c2noc(C(F)(F)F)n2)cc1)[N+](=O)[O-] ZINC000813104406 1285653653 /nfs/dbraw/zinc/65/36/53/1285653653.db2.gz CBZZBNWMYBWUFF-SSDOTTSWSA-N 0 3 345.233 2.577 20 5 EFBDHN Cc1ccc(C(=O)OCC(C)[N+](=O)[O-])cc1NC(=O)c1ccco1 ZINC000813105030 1285654960 /nfs/dbraw/zinc/65/49/60/1285654960.db2.gz JIVHGHRAXXTOJR-LLVKDONJSA-N 0 3 332.312 2.662 20 5 EFBDHN CC(COC(=O)c1cc2sc(N3CCCC3)nc2s1)[N+](=O)[O-] ZINC000813105945 1285656114 /nfs/dbraw/zinc/65/61/14/1285656114.db2.gz VZJCYSWLARWFRM-MRVPVSSYSA-N 0 3 341.414 2.780 20 5 EFBDHN CC(COC(=O)c1nccnc1-c1nc2ccccc2s1)[N+](=O)[O-] ZINC000813111338 1285684132 /nfs/dbraw/zinc/68/41/32/1285684132.db2.gz GQOYUQPKARWEPH-VIFPVBQESA-N 0 3 344.352 2.575 20 5 EFBDHN CC(COC(=O)[C@H]1CCCN(c2nc3ccccc3s2)C1)[N+](=O)[O-] ZINC000813111489 1285684266 /nfs/dbraw/zinc/68/42/66/1285684266.db2.gz IOBBQZWWDPOPQL-NEPJUHHUSA-N 0 3 349.412 2.721 20 5 EFBDHN COc1cccc(C(=O)NCCCNCc2ccccc2[N+](=O)[O-])c1 ZINC001171907854 1285893818 /nfs/dbraw/zinc/89/38/18/1285893818.db2.gz GFMCXFMVOANBPX-UHFFFAOYSA-N 0 3 343.383 2.513 20 5 EFBDHN CCc1oc(C(=O)NCCCNCc2ccccc2[N+](=O)[O-])cc1C ZINC001170994764 1289062222 /nfs/dbraw/zinc/06/22/22/1289062222.db2.gz LMTOMBDXPDIZEA-UHFFFAOYSA-N 0 3 345.399 2.968 20 5 EFBDHN O=C(NCCNCc1cccc([N+](=O)[O-])c1)c1cccc2[nH]ccc21 ZINC001134180787 1286424449 /nfs/dbraw/zinc/42/44/49/1286424449.db2.gz CFPWTQYAALIIRO-UHFFFAOYSA-N 0 3 338.367 2.596 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)NCc2cncs2)c1F ZINC001173177231 1286452659 /nfs/dbraw/zinc/45/26/59/1286452659.db2.gz RWRAQFQTVIBHML-VIFPVBQESA-N 0 3 325.365 2.920 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CC[C@@H](C)[C@H](O)CC2)c1F ZINC001173178932 1286453984 /nfs/dbraw/zinc/45/39/84/1286453984.db2.gz CFGTUPZVDRVQRF-TYNCELHUSA-N 0 3 340.395 2.766 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CCCC[C@](C)(O)C2)c1F ZINC001173179786 1286454944 /nfs/dbraw/zinc/45/49/44/1286454944.db2.gz GTKNPWXTRJIMNC-SJCJKPOMSA-N 0 3 340.395 2.910 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N(C)[C@@H]2CCCOC2)c1F ZINC001173193810 1286459428 /nfs/dbraw/zinc/45/94/28/1286459428.db2.gz QYBDJBKYDGAPOL-NWDGAFQWSA-N 0 3 326.368 2.784 20 5 EFBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)NCc1ccnc(OCC2CC2)n1 ZINC001173225629 1286481079 /nfs/dbraw/zinc/48/10/79/1286481079.db2.gz TWRNKSQRNITGSB-ZDUSSCGKSA-N 0 3 342.399 2.894 20 5 EFBDHN COc1ccccc1[C@@H](CO)N[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173227499 1286482109 /nfs/dbraw/zinc/48/21/09/1286482109.db2.gz GJZPKAYXMQZLBA-CXAGYDPISA-N 0 3 330.384 2.858 20 5 EFBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CCC(N2CCCOC2=O)CC1 ZINC001173233425 1286483929 /nfs/dbraw/zinc/48/39/29/1286483929.db2.gz WNMWPPACPPWBSN-CQSZACIVSA-N 0 3 347.415 2.833 20 5 EFBDHN Cc1nccnc1O[C@@H]1CCN([C@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173238360 1286496485 /nfs/dbraw/zinc/49/64/85/1286496485.db2.gz QMBWHBHPICUOOT-CXAGYDPISA-N 0 3 342.399 2.778 20 5 EFBDHN Cc1ccc(F)c(C(=O)NCCNCc2ccc([N+](=O)[O-])cc2)c1 ZINC001134357224 1286590278 /nfs/dbraw/zinc/59/02/78/1286590278.db2.gz VMMRIPCCGBPARJ-UHFFFAOYSA-N 0 3 331.347 2.562 20 5 EFBDHN CN(C)CCN(CC1CCCCC1)C(=O)CCC(C)(C)[N+](=O)[O-] ZINC000822707405 1289087556 /nfs/dbraw/zinc/08/75/56/1289087556.db2.gz VGCWIXFLIZKCEB-UHFFFAOYSA-N 0 3 327.469 2.792 20 5 EFBDHN O=C(NCCCNCc1ccccc1[N+](=O)[O-])C1CCC=CCC1 ZINC001176262016 1287934130 /nfs/dbraw/zinc/93/41/30/1287934130.db2.gz QMZDJNCSCNYHFK-UHFFFAOYSA-N 0 3 331.416 2.937 20 5 EFBDHN CCCN1C[C@@H](CNCc2cc([N+](=O)[O-])ccc2Cl)CC1=O ZINC000817411501 1288590575 /nfs/dbraw/zinc/59/05/75/1288590575.db2.gz SMWNHZILYSXDJZ-LLVKDONJSA-N 0 3 325.796 2.596 20 5 EFBDHN CN(C)C[C@@H]1CCc2ccccc2N1C(=O)CCC(C)(C)[N+](=O)[O-] ZINC000823905113 1289478928 /nfs/dbraw/zinc/47/89/28/1289478928.db2.gz DGUOCJJSJDUTNU-HNNXBMFYSA-N 0 3 333.432 2.732 20 5 EFBDHN Cc1cccc(C(=O)NCCNCc2cccc([N+](=O)[O-])c2C)c1 ZINC000873021575 1289524298 /nfs/dbraw/zinc/52/42/98/1289524298.db2.gz LMXBOCMNIJHKKX-UHFFFAOYSA-N 0 3 327.384 2.731 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1CNC[C@H](O)COc1ccc(F)cc1 ZINC000873023240 1289525653 /nfs/dbraw/zinc/52/56/53/1289525653.db2.gz WEEZYNKFDPWPFF-HNNXBMFYSA-N 0 3 348.374 2.880 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1CNCCC(=O)Nc1ccccn1 ZINC000873025857 1289527092 /nfs/dbraw/zinc/52/70/92/1289527092.db2.gz FGOIBYPLFTXEHB-UHFFFAOYSA-N 0 3 328.372 2.725 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1CNCc1ccc(CC(N)=O)cc1 ZINC000873126753 1289583435 /nfs/dbraw/zinc/58/34/35/1289583435.db2.gz CIESRJKVYYEECK-UHFFFAOYSA-N 0 3 327.384 2.529 20 5 EFBDHN COc1ccc(OC)c([C@@H](O)[C@H](C)NCc2cccc([N+](=O)[O-])c2)c1 ZINC000873196462 1289635580 /nfs/dbraw/zinc/63/55/80/1289635580.db2.gz SIFCGYSLNMEGPJ-SGTLLEGYSA-N 0 3 346.383 2.824 20 5 EFBDHN CCCC1(C(=O)NCCCNCc2csc([N+](=O)[O-])c2)CC1 ZINC001166077171 1312728150 /nfs/dbraw/zinc/72/81/50/1312728150.db2.gz ILXITCBTQGVVCT-UHFFFAOYSA-N 0 3 325.434 2.833 20 5 EFBDHN COCCN1[C@H](C)CN(C/C=C/c2ccccc2[N+](=O)[O-])C[C@@H]1C ZINC000093478775 1291149772 /nfs/dbraw/zinc/14/97/72/1291149772.db2.gz PNVBUSVIFSPJEV-JNIGEABNSA-N 0 3 333.432 2.649 20 5 EFBDHN CC(C)c1ccc(CN2CCC3(CCNC3=O)CC2)cc1[N+](=O)[O-] ZINC000877783045 1291376444 /nfs/dbraw/zinc/37/64/44/1291376444.db2.gz APIKGVHJGILAAP-UHFFFAOYSA-N 0 3 331.416 2.820 20 5 EFBDHN COc1ncc([N+](=O)[O-])c(NC[C@@H](c2ccccc2)N2CCCC2)n1 ZINC001166889141 1312861157 /nfs/dbraw/zinc/86/11/57/1312861157.db2.gz NWMCRJHJXMQOLR-AWEZNQCLSA-N 0 3 343.387 2.642 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN1CC[C@@]2(C1)CCc1ccccc1O2 ZINC000878625619 1291739955 /nfs/dbraw/zinc/73/99/55/1291739955.db2.gz YLUGCTQGZXKPJD-GOSISDBHSA-N 0 3 342.399 2.569 20 5 EFBDHN CN(CCN1CCCCC1)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878811857 1291799624 /nfs/dbraw/zinc/79/96/24/1291799624.db2.gz KPIKMAMBJAWBJS-UHFFFAOYSA-N 0 3 345.403 2.563 20 5 EFBDHN CCN(CC)CC(=O)N[C@H]1C[C@H](CNc2cc(C)ccc2[N+](=O)[O-])C1 ZINC001114773349 1291902369 /nfs/dbraw/zinc/90/23/69/1291902369.db2.gz JEZAXDDMRHSIDY-SHTZXODSSA-N 0 3 348.447 2.552 20 5 EFBDHN CCCN(C)CC(=O)N[C@H]1C[C@H](CNc2cc(C)ccc2[N+](=O)[O-])C1 ZINC001114780629 1291923892 /nfs/dbraw/zinc/92/38/92/1291923892.db2.gz JSUGNTHOGDWJDD-SHTZXODSSA-N 0 3 348.447 2.552 20 5 EFBDHN CCN(C)C(C)(C)C(=O)N[C@H]1C[C@H](CNc2ccc([N+](=O)[O-])cc2)C1 ZINC001114798222 1292007219 /nfs/dbraw/zinc/00/72/19/1292007219.db2.gz ZSAZPUVLPUKZDC-CTYIDZIISA-N 0 3 348.447 2.632 20 5 EFBDHN COc1ccc([C@@H]2CN(Cc3ccc([N+](=O)[O-])cc3)CCN2)cc1 ZINC000879519276 1292167705 /nfs/dbraw/zinc/16/77/05/1292167705.db2.gz RPJPJKLQIMVTDV-SFHVURJKSA-N 0 3 327.384 2.750 20 5 EFBDHN COc1ccc([C@@H]2CN(Cc3cc(F)ccc3[N+](=O)[O-])CCN2)cc1 ZINC000879521473 1292170235 /nfs/dbraw/zinc/17/02/35/1292170235.db2.gz NMAZTNWANBTVOU-KRWDZBQOSA-N 0 3 345.374 2.889 20 5 EFBDHN COc1cccc([C@@H]2CN(Cc3c(F)cccc3[N+](=O)[O-])CCN2)c1 ZINC000879524901 1292171502 /nfs/dbraw/zinc/17/15/02/1292171502.db2.gz DYCWRGVBBHWJAA-KRWDZBQOSA-N 0 3 345.374 2.889 20 5 EFBDHN O=[N+]([O-])c1ccc([C@@H](O)CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1 ZINC000879996943 1292327671 /nfs/dbraw/zinc/32/76/71/1292327671.db2.gz VLVGOYDVCIMGBO-ROUUACIJSA-N 0 3 346.358 2.921 20 5 EFBDHN COCCN1CCC(Oc2c3cccnc3ccc2[N+](=O)[O-])CC1 ZINC001233786109 1312992117 /nfs/dbraw/zinc/99/21/17/1312992117.db2.gz LQEYMYAGVSBMMB-UHFFFAOYSA-N 0 3 331.372 2.633 20 5 EFBDHN Cc1ccc(C(=O)NCCCN(C)Cc2ccc([N+](=O)[O-])cc2)cn1 ZINC001234010701 1313037285 /nfs/dbraw/zinc/03/72/85/1313037285.db2.gz GDOJTXVTQVSKPF-UHFFFAOYSA-N 0 3 342.399 2.550 20 5 EFBDHN CN(C)CCN(CC1CCCCC1)C(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000104314723 1294925003 /nfs/dbraw/zinc/92/50/03/1294925003.db2.gz DLCJUXBRGZGIEP-UHFFFAOYSA-N 0 3 348.447 2.761 20 5 EFBDHN Cc1ccccc1[C@@H](CO)N(C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000886439215 1294969839 /nfs/dbraw/zinc/96/98/39/1294969839.db2.gz RRCSJPALDWHZRH-MSOLQXFVSA-N 0 3 330.384 2.602 20 5 EFBDHN O=C(CCCF)N1CCC(CNCc2csc([N+](=O)[O-])c2)CC1 ZINC001205919263 1313375664 /nfs/dbraw/zinc/37/56/64/1313375664.db2.gz LPMIXPQPGHPNFF-UHFFFAOYSA-N 0 3 343.424 2.734 20 5 EFBDHN Cc1nn(C)cc1[C@H]1CCCN1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776586513 1299634486 /nfs/dbraw/zinc/63/44/86/1299634486.db2.gz OBWJYZQFTYGXIF-SJORKVTESA-N 0 3 330.388 2.507 20 5 EFBDHN O=[N+]([O-])c1ccc([C@H](O)CN2CCC(Cc3cccnc3)CC2)cc1 ZINC000776599389 1299706587 /nfs/dbraw/zinc/70/65/87/1299706587.db2.gz ZTKHMIQICBCDCA-LJQANCHMSA-N 0 3 341.411 2.978 20 5 EFBDHN Cc1n[nH]c(C)c1[C@@H]1CCCN1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776601928 1299731467 /nfs/dbraw/zinc/73/14/67/1299731467.db2.gz NNCXOUJNBYZCSK-HOTGVXAUSA-N 0 3 330.388 2.805 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CCC([C@@H]3CCCCO3)CC2)c1 ZINC000852593340 1299774981 /nfs/dbraw/zinc/77/49/81/1299774981.db2.gz FHWVELXVYOOMAX-MSOLQXFVSA-N 0 3 334.416 2.909 20 5 EFBDHN O=[N+]([O-])c1cc(NC[C@@H]2CN3CCC[C@H]3CO2)ccc1C(F)(F)F ZINC000853241467 1300062476 /nfs/dbraw/zinc/06/24/76/1300062476.db2.gz KBKIKTXLEVBQCC-NWDGAFQWSA-N 0 3 345.321 2.889 20 5 EFBDHN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N[C@H](C)CN1CCC(C)CC1 ZINC000855900357 1301164958 /nfs/dbraw/zinc/16/49/58/1301164958.db2.gz AMXAKMKHAQGJOQ-GFCCVEGCSA-N 0 3 337.395 2.893 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCN2CCC[C@@](O)(c3ccccc3)C2)c1 ZINC000859583155 1301496298 /nfs/dbraw/zinc/49/62/98/1301496298.db2.gz BNUBWVXHGJUDOC-IBGZPJMESA-N 0 3 342.395 2.957 20 5 EFBDHN CCO[C@H](C(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-])C1CC1 ZINC000860854845 1301943053 /nfs/dbraw/zinc/94/30/53/1301943053.db2.gz KPEZVZFDEKODEO-KMUNFCNLSA-N 0 3 325.336 2.890 20 5 EFBDHN CCN(C)C(C)(C)C(=O)N[C@H]1C[C@H](Nc2ccc(C)cc2[N+](=O)[O-])C1 ZINC001097078649 1313840791 /nfs/dbraw/zinc/84/07/91/1313840791.db2.gz VKABOTGKPLSWPW-HDJSIYSDSA-N 0 3 348.447 2.693 20 5 EFBDHN CN(CC(=O)N[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])cc2)C1)CC(C)(C)C ZINC001097103868 1313854450 /nfs/dbraw/zinc/85/44/50/1313854450.db2.gz WFFNXBAQBZNUKV-SHTZXODSSA-N 0 3 348.447 2.632 20 5 EFBDHN O=[N+]([O-])c1ccc(F)cc1OC[C@]1(O)CCN(Cc2ccccc2)C1 ZINC000865344349 1303223549 /nfs/dbraw/zinc/22/35/49/1303223549.db2.gz GJDDSHNZFFAAJL-SFHVURJKSA-N 0 3 346.358 2.750 20 5 EFBDHN O=[N+]([O-])c1ccc(OC[C@@]2(O)CCN(Cc3ccccc3)C2)cc1F ZINC000865345167 1303223882 /nfs/dbraw/zinc/22/38/82/1303223882.db2.gz WBUVACJVLWPLIC-GOSISDBHSA-N 0 3 346.358 2.750 20 5 EFBDHN COc1ccccc1[C@@H](CO)N[C@@H](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000866298166 1303593843 /nfs/dbraw/zinc/59/38/43/1303593843.db2.gz UIYSAKGVESSQIG-BLLLJJGKSA-N 0 3 348.374 2.997 20 5 EFBDHN CN1CCCC(C)(C)[C@H]1CNC(=O)Cc1cccc(F)c1[N+](=O)[O-] ZINC000867910629 1304014222 /nfs/dbraw/zinc/01/42/22/1304014222.db2.gz NGTAYDZXTWFEEJ-CQSZACIVSA-N 0 3 337.395 2.513 20 5 EFBDHN CC(COC(=O)Cc1ccc(Br)cc1Cl)[N+](=O)[O-] ZINC000870376108 1305291729 /nfs/dbraw/zinc/29/17/29/1305291729.db2.gz ASSBYFIVSOTCOC-SSDOTTSWSA-N 0 3 336.569 2.853 20 5 EFBDHN Cc1ccn(C[C@H](C)C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])n1 ZINC000870455374 1305331575 /nfs/dbraw/zinc/33/15/75/1305331575.db2.gz YJSGHEKWZQBBFS-DETPVDSQSA-N 0 3 349.362 2.916 20 5 EFBDHN O=[N+]([O-])c1ccc(C(F)(F)F)cc1O[C@@H]1CNCCC1(F)F ZINC001218448124 1315197485 /nfs/dbraw/zinc/19/74/85/1315197485.db2.gz LRNACBLTIAIHPF-SNVBAGLBSA-N 0 3 326.221 2.990 20 5 EFBDHN CCN1CCC[C@@H]1CNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC000900009427 1307595761 /nfs/dbraw/zinc/59/57/61/1307595761.db2.gz HXLCPIZJBAGPJL-SNVBAGLBSA-N 0 3 329.759 2.601 20 5 EFBDHN CN(C)Cc1ccccc1NC(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000801814255 1310960777 /nfs/dbraw/zinc/96/07/77/1310960777.db2.gz HBAPQLSYTUWBJC-UHFFFAOYSA-N 0 3 332.335 2.630 20 5 EFBDHN CCOC(=O)c1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000749692856 1311038133 /nfs/dbraw/zinc/03/81/33/1311038133.db2.gz SZDLOSUUQGMNQE-KRWDZBQOSA-N 0 3 344.367 2.595 20 5 EFBDHN O=C(OCCCOc1ccc([N+](=O)[O-])cc1)C1CCN(C2CC2)CC1 ZINC000801874994 1311043056 /nfs/dbraw/zinc/04/30/56/1311043056.db2.gz HJJZXYIIPXEASM-UHFFFAOYSA-N 0 3 348.399 2.781 20 5 EFBDHN O=C(/C=C\C1CC1)NCC1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001222730901 1311177484 /nfs/dbraw/zinc/17/74/84/1311177484.db2.gz KKGOMOJBFSOFOW-YVMONPNESA-N 0 3 343.427 2.889 20 5 EFBDHN C/C=C(/C)C(=O)NCC1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001222756936 1311180510 /nfs/dbraw/zinc/18/05/10/1311180510.db2.gz VLXLWRUSDAQDFD-BNNQUZSASA-N 0 3 331.416 2.889 20 5 EFBDHN CC(C)(C)C(=O)NCC1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001225221269 1311491307 /nfs/dbraw/zinc/49/13/07/1311491307.db2.gz JJKXVZZIUCKVEA-UHFFFAOYSA-N 0 3 333.432 2.969 20 5 EFBDHN C[C@H](Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)[C@@H]1CNCCO1 ZINC001159499512 1311527442 /nfs/dbraw/zinc/52/74/42/1311527442.db2.gz ANLMGNIVUKBSFX-NHYWBVRUSA-N 0 3 346.362 2.585 20 5 EFBDHN C[C@H](Nc1nc2ccccc2c(Cl)c1[N+](=O)[O-])[C@H]1CNCCO1 ZINC001159501078 1311528628 /nfs/dbraw/zinc/52/86/28/1311528628.db2.gz YESHNSCFFFWBAS-JOYOIKCWSA-N 0 3 336.779 2.585 20 5 EFBDHN Cc1cc([N+](=O)[O-])c(-n2nc(-c3ccncc3)cc2CN)nc1Cl ZINC001160338160 1311692216 /nfs/dbraw/zinc/69/22/16/1311692216.db2.gz SNGXFNVJCDTWST-UHFFFAOYSA-N 0 3 344.762 2.658 20 5 EFBDHN NCc1cc(-c2ccncc2)nn1-c1ccc2cccc([N+](=O)[O-])c2n1 ZINC001160338666 1311693436 /nfs/dbraw/zinc/69/34/36/1311693436.db2.gz FJYLSYBOZPSZRS-UHFFFAOYSA-N 0 3 346.350 2.849 20 5 EFBDHN O=C(NCCCNCc1csc([N+](=O)[O-])c1)C1(F)CCCC1 ZINC001161524197 1311906765 /nfs/dbraw/zinc/90/67/65/1311906765.db2.gz HIHOGFLSKLXUIY-UHFFFAOYSA-N 0 3 329.397 2.535 20 5 EFBDHN CN1CCN(CCCNc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1 ZINC001161708231 1311956631 /nfs/dbraw/zinc/95/66/31/1311956631.db2.gz DJEXWWULFOYEDA-UHFFFAOYSA-N 0 3 346.353 2.663 20 5 EFBDHN CN1CCC(Oc2cc([N+](=O)[O-])c(Br)cc2F)CC1 ZINC001228939737 1312024029 /nfs/dbraw/zinc/02/40/29/1312024029.db2.gz WXOVZCUZEQTTAM-UHFFFAOYSA-N 0 3 333.157 2.969 20 5 EFBDHN CCN1CCC(Oc2c(C(=O)OC)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC001228965093 1312028271 /nfs/dbraw/zinc/02/82/71/1312028271.db2.gz ZNOJTJDIIFYFAR-UHFFFAOYSA-N 0 3 342.779 2.898 20 5 EFBDHN C[C@@H](c1ccccn1)[N@@H+]1CC[C@@H](Oc2cc([N+](=O)[O-])ccc2[O-])C1 ZINC001229396393 1312089053 /nfs/dbraw/zinc/08/90/53/1312089053.db2.gz SSULXIXVOGVQHR-GXTWGEPZSA-N 0 3 329.356 2.910 20 5 EFBDHN C[C@@H](c1ccccn1)[N@H+]1CC[C@@H](Oc2cc([N+](=O)[O-])ccc2[O-])C1 ZINC001229396393 1312089057 /nfs/dbraw/zinc/08/90/57/1312089057.db2.gz SSULXIXVOGVQHR-GXTWGEPZSA-N 0 3 329.356 2.910 20 5 EFBDHN O=C(CC1CCC1)N1C[C@H]2CN(Cc3ccccc3[N+](=O)[O-])C[C@H]2C1 ZINC001048742582 1312092942 /nfs/dbraw/zinc/09/29/42/1312092942.db2.gz ZNGLIQRXXNHAQW-CALCHBBNSA-N 0 3 343.427 2.675 20 5 EFBDHN CN(C)Cc1ccccc1O[C@H](C[N+](=O)[O-])c1ccc2c(c1)OCO2 ZINC001229700921 1312125164 /nfs/dbraw/zinc/12/51/64/1312125164.db2.gz DVXWDXHTXPQQFX-GOSISDBHSA-N 0 3 344.367 2.874 20 5 EFBDHN NCc1ccnn1-c1cc([N+](=O)[O-])cc2cc(Br)cnc21 ZINC001162598193 1312132466 /nfs/dbraw/zinc/13/24/66/1312132466.db2.gz SCGLMWLEARSQNC-UHFFFAOYSA-N 0 3 348.160 2.550 20 5 EFBDHN C[C@@H](N)c1nc2ccccc2n1-c1ccc2nsnc2c1[N+](=O)[O-] ZINC001162777559 1312173820 /nfs/dbraw/zinc/17/38/20/1312173820.db2.gz UJSDUBOWSYNJCK-MRVPVSSYSA-N 0 3 340.368 2.958 20 5 EFBDHN CC(C)(F)C(=O)NCCC1(CNCc2csc([N+](=O)[O-])c2)CC1 ZINC001163133443 1312248151 /nfs/dbraw/zinc/24/81/51/1312248151.db2.gz TZQFQBFSUHGXQT-UHFFFAOYSA-N 0 3 343.424 2.781 20 5 EFBDHN CC(C)(F)C(=O)NCCC1(CNCc2ccccc2[N+](=O)[O-])CC1 ZINC001163132767 1312248273 /nfs/dbraw/zinc/24/82/73/1312248273.db2.gz GLMXCCMDQSTJPO-UHFFFAOYSA-N 0 3 337.395 2.719 20 5 EFBDHN CN1Cc2cc(N[C@@H]3CNCc4ccsc43)cc([N+](=O)[O-])c2N1 ZINC001163239853 1312272733 /nfs/dbraw/zinc/27/27/33/1312272733.db2.gz SLEMQKRAKUWOJJ-GFCCVEGCSA-N 0 3 331.401 2.685 20 5 EFBDHN CC(C)=CC(=O)NCCC1(CNCc2ccccc2[N+](=O)[O-])CC1 ZINC001163275708 1312280035 /nfs/dbraw/zinc/28/00/35/1312280035.db2.gz JTIRCBVHTXGVLK-UHFFFAOYSA-N 0 3 331.416 2.937 20 5 EFBDHN CC1(CC(=O)N2C[C@H]3CN(Cc4ccc([N+](=O)[O-])cc4)C[C@H]3C2)CC1 ZINC001048940833 1312282681 /nfs/dbraw/zinc/28/26/81/1312282681.db2.gz AMQQYUWXMYESKC-IYBDPMFKSA-N 0 3 343.427 2.675 20 5 EFBDHN CC1(CC(=O)N2C[C@H]3CN(Cc4ccccc4[N+](=O)[O-])C[C@H]3C2)CC1 ZINC001048942956 1312284532 /nfs/dbraw/zinc/28/45/32/1312284532.db2.gz PHRFNWLEKCFIAJ-IYBDPMFKSA-N 0 3 343.427 2.675 20 5 EFBDHN O=[N+]([O-])c1cc(N[C@H]2CCCC[C@@]23CNCCO3)cc2cccnc21 ZINC001163650536 1312354350 /nfs/dbraw/zinc/35/43/50/1312354350.db2.gz RIXWVWVLVIPVLY-FUHWJXTLSA-N 0 3 342.399 2.856 20 5 EFBDHN CCOc1cc(N[C@H]2CCCC[C@@]23CNCCO3)ccc1[N+](=O)[O-] ZINC001163654153 1312355000 /nfs/dbraw/zinc/35/50/00/1312355000.db2.gz VVAHZFZEGUFWOZ-DLBZAZTESA-N 0 3 335.404 2.707 20 5 EFBDHN COc1ccc(CCNc2cc3c(cc2[N+](=O)[O-])CNC3)cc1O ZINC001163728736 1312373481 /nfs/dbraw/zinc/37/34/81/1312373481.db2.gz ROXRNDCLJHQBHP-UHFFFAOYSA-N 0 3 329.356 2.567 20 5 EFBDHN Cc1nc(O[C@H]2CCN(C(C)C)C2)c([N+](=O)[O-])cc1Br ZINC001231120180 1312436320 /nfs/dbraw/zinc/43/63/20/1312436320.db2.gz JQNHOVVNZZINKU-JTQLQIEISA-N 0 3 344.209 2.922 20 5 EFBDHN CN(CCCNC(=O)c1ccc(F)cc1)Cc1cccc([N+](=O)[O-])c1 ZINC001231217228 1312455220 /nfs/dbraw/zinc/45/52/20/1312455220.db2.gz KMTVQBQOFPRWBP-UHFFFAOYSA-N 0 3 345.374 2.986 20 5 EFBDHN CCC1(C(=O)NCCCNCc2csc([N+](=O)[O-])c2)CCC1 ZINC001164234459 1312474374 /nfs/dbraw/zinc/47/43/74/1312474374.db2.gz XYWGAMAVGFCJNU-UHFFFAOYSA-N 0 3 325.434 2.833 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCCN1CCCOCC1 ZINC000903229244 1312481514 /nfs/dbraw/zinc/48/15/14/1312481514.db2.gz VXLPPWAEXXKPJT-ZDUSSCGKSA-N 0 3 339.461 2.690 20 5 EFBDHN O=C(NCCCNCc1csc([N+](=O)[O-])c1)C1(C(F)F)CCC1 ZINC001164503837 1312528484 /nfs/dbraw/zinc/52/84/84/1312528484.db2.gz WTIIFKCITYEBHU-UHFFFAOYSA-N 0 3 347.387 2.688 20 5 EFBDHN O=C(NCCCNCc1ccccc1[N+](=O)[O-])c1ccoc1C1CC1 ZINC001164604720 1312548583 /nfs/dbraw/zinc/54/85/83/1312548583.db2.gz QXBFPVIPCSYKTG-UHFFFAOYSA-N 0 3 343.383 2.975 20 5 EFBDHN CC(C)(C)C(=O)N1C[C@H]2CN(Cc3ccccc3[N+](=O)[O-])C[C@H]2C1 ZINC001049184452 1312551825 /nfs/dbraw/zinc/55/18/25/1312551825.db2.gz CQNGYLWUXLLJOH-GASCZTMLSA-N 0 3 331.416 2.531 20 5 EFBDHN O=C(N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1)c1ccoc1Cl ZINC001020109105 1314613609 /nfs/dbraw/zinc/61/36/09/1314613609.db2.gz FYBFBPWYFDNHQN-HAQNSBGRSA-N 0 3 349.774 2.892 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1-c1nc(-c2ccc3c(n2)CCNC3)no1 ZINC001216476287 1314960611 /nfs/dbraw/zinc/96/06/11/1314960611.db2.gz RNBFRXBSEQVDJG-UHFFFAOYSA-N 0 3 337.339 2.661 20 5 EFBDHN Cc1cc(O[C@@H]2CCNC[C@H]2F)c([N+](=O)[O-])cc1Br ZINC001218065410 1315141512 /nfs/dbraw/zinc/14/15/12/1315141512.db2.gz FNDZZFRYKULDGT-MWLCHTKSSA-N 0 3 333.157 2.745 20 5 EFBDHN Cc1cc(O[C@@H]2CCNC[C@@H]2F)c([N+](=O)[O-])cc1Br ZINC001218065407 1315141697 /nfs/dbraw/zinc/14/16/97/1315141697.db2.gz FNDZZFRYKULDGT-GXSJLCMTSA-N 0 3 333.157 2.745 20 5 EFBDHN O=[N+]([O-])c1cc(O[C@@H]2CNCCC2(F)F)ccc1Br ZINC001218447885 1315197272 /nfs/dbraw/zinc/19/72/72/1315197272.db2.gz KAUBXNVUQLXJCP-SNVBAGLBSA-N 0 3 337.120 2.733 20 5 EFBDHN COC(=O)c1cc(O[C@H]2CNCc3ccccc32)cc([N+](=O)[O-])c1 ZINC001218486263 1315204007 /nfs/dbraw/zinc/20/40/07/1315204007.db2.gz IUAJUHYPWXNKLS-INIZCTEOSA-N 0 3 328.324 2.605 20 5 EFBDHN O=C(NC1CC1)[C@@H]1CCCN(C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC001254004019 1315664912 /nfs/dbraw/zinc/66/49/12/1315664912.db2.gz FGFZDSGSADATHR-OMVNSRBRSA-N 0 3 329.400 2.599 20 5 EFBDHN CC(C)[C@H]1CN(C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CCO1 ZINC001254480509 1315707904 /nfs/dbraw/zinc/70/79/04/1315707904.db2.gz ICKOOWUFDDYFOG-GOSISDBHSA-N 0 3 333.432 2.920 20 5 EFBDHN COC(=O)C[C@@H](N[C@H](C)Cc1ccccc1[N+](=O)[O-])c1cccnc1 ZINC001254542536 1315721727 /nfs/dbraw/zinc/72/17/27/1315721727.db2.gz OUSMKQNKRGRAII-CZUORRHYSA-N 0 3 343.383 2.815 20 5 EFBDHN COC(=O)C[C@H](N[C@@H](C)Cc1ccccc1[N+](=O)[O-])c1cccnc1 ZINC001254542533 1315721767 /nfs/dbraw/zinc/72/17/67/1315721767.db2.gz OUSMKQNKRGRAII-BBRMVZONSA-N 0 3 343.383 2.815 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])NCC(=O)Nc1ccc(F)cc1 ZINC001254547047 1315722245 /nfs/dbraw/zinc/72/22/45/1315722245.db2.gz UMDVKUNMDUWSHD-GFCCVEGCSA-N 0 3 331.347 2.893 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N1C[C@H](CO)[C@@H](C(F)(F)F)C1 ZINC001254552978 1315722807 /nfs/dbraw/zinc/72/28/07/1315722807.db2.gz QAENRACGICSUPK-RTXFEEFZSA-N 0 3 332.322 2.628 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N1CCC[C@]2(CCCC(=O)N2)C1 ZINC001254557681 1315723192 /nfs/dbraw/zinc/72/31/92/1315723192.db2.gz QSILTBIWXPETHI-KBXCAEBGSA-N 0 3 331.416 2.661 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N1CCC(N2CC(F)(F)C2)CC1 ZINC001254558438 1315723318 /nfs/dbraw/zinc/72/33/18/1315723318.db2.gz FVHFSBJUGROINE-ZDUSSCGKSA-N 0 3 339.386 2.941 20 5 EFBDHN Cc1cnc(O[C@@H]2CCN([C@H](C)Cc3ccccc3[N+](=O)[O-])C2)nc1 ZINC001254569823 1315725158 /nfs/dbraw/zinc/72/51/58/1315725158.db2.gz LFQCPOIIWRHRMD-GDBMZVCRSA-N 0 3 342.399 2.778 20 5 EFBDHN Cc1ccnc(O[C@@H]2CCN([C@H](C)Cc3ccccc3[N+](=O)[O-])C2)n1 ZINC001254571521 1315725321 /nfs/dbraw/zinc/72/53/21/1315725321.db2.gz XCNRQFAYVHOPCB-GDBMZVCRSA-N 0 3 342.399 2.778 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N1CCC[C@H](Oc2cnccn2)C1 ZINC001254569094 1315725418 /nfs/dbraw/zinc/72/54/18/1315725418.db2.gz HTGKSGBHCDTQCK-HOCLYGCPSA-N 0 3 342.399 2.859 20 5 EFBDHN N[C@H]([C@@H]1CCCN([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1)C(F)(F)F ZINC001254587790 1315727866 /nfs/dbraw/zinc/72/78/66/1315727866.db2.gz BAQIGYIIKPTHNE-KCPJHIHWSA-N 0 3 343.349 2.664 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@H](NCc1cn(CC3CCC3)cn1)C2 ZINC001254586495 1315727895 /nfs/dbraw/zinc/72/78/95/1315727895.db2.gz KKSGZIPZUCTFNP-MRXNPFEDSA-N 0 3 326.400 2.848 20 5 EFBDHN CCOC(=O)C1(C)CCN([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254602062 1315729831 /nfs/dbraw/zinc/72/98/31/1315729831.db2.gz AEDYJBUEGFIOJK-INIZCTEOSA-N 0 3 332.400 2.727 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@@H](N1CCN3CCc4ccccc4[C@@H]3C1)C2 ZINC001254607979 1315730130 /nfs/dbraw/zinc/73/01/30/1315730130.db2.gz OAKDVANVMFYJJG-FPOVZHCZSA-N 0 3 349.434 2.977 20 5 EFBDHN Cc1noc(C2CCN([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)CC2)n1 ZINC001254605515 1315730165 /nfs/dbraw/zinc/73/01/65/1315730165.db2.gz AXRVQLUEOAMEKE-INIZCTEOSA-N 0 3 328.372 2.633 20 5 EFBDHN CCc1nc(C2CCN([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)CC2)no1 ZINC001254608352 1315731204 /nfs/dbraw/zinc/73/12/04/1315731204.db2.gz QVZCBGOXPJIFGF-INIZCTEOSA-N 0 3 342.399 2.887 20 5 EFBDHN O=C(C1CC1)N1CCC2(C1)CCN(Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001040567999 1316325194 /nfs/dbraw/zinc/32/51/94/1316325194.db2.gz OAKSHKXPUOKKTP-UHFFFAOYSA-N 0 3 343.427 2.819 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN1CCC(Nc2ccccc2)CC1 ZINC001262014064 1316443512 /nfs/dbraw/zinc/44/35/12/1316443512.db2.gz VUQIVJNCTXKKSK-UHFFFAOYSA-N 0 3 329.404 2.676 20 5 EFBDHN CS[C@H]1CC[C@H](N(C)Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C1 ZINC001319404371 1328874335 /nfs/dbraw/zinc/87/43/35/1328874335.db2.gz NGSRCEXEUGVIKP-AAEUAGOBSA-N 0 3 335.433 2.821 20 5 EFBDHN Cc1cncc([N+](=O)[O-])c1NC[C@@H]1CCCN1Cc1ccccc1 ZINC001322706197 1329481311 /nfs/dbraw/zinc/48/13/11/1329481311.db2.gz ODYRYYJQNQZKAS-INIZCTEOSA-N 0 3 326.400 2.797 20 5 EFBDHN CN(C)[C@H]1CCCC[C@H]1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC001324400789 1329623940 /nfs/dbraw/zinc/62/39/40/1329623940.db2.gz VZKBZIRIPQXQCV-CVEARBPZSA-N 0 3 347.415 2.547 20 5 EFBDHN CCN1CCN(c2ccc(Nc3ncc([N+](=O)[O-])c(C)n3)cc2)CC1 ZINC001324706975 1329652905 /nfs/dbraw/zinc/65/29/05/1329652905.db2.gz AIQGSRBWUVQAJK-UHFFFAOYSA-N 0 3 342.403 2.579 20 5 EFBDHN CC(C)(C)N1CCN(Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)CC1 ZINC001326795844 1330365449 /nfs/dbraw/zinc/36/54/49/1330365449.db2.gz MGGRXWLUPNWDMZ-UHFFFAOYSA-N 0 3 343.431 2.832 20 5 EFBDHN C[C@H]1CCCN(C(=O)CCN[C@H]2CCc3c2cccc3[N+](=O)[O-])C1 ZINC001326845694 1330372992 /nfs/dbraw/zinc/37/29/92/1330372992.db2.gz WYVDMDXIXFZTRB-BBRMVZONSA-N 0 3 331.416 2.820 20 5 EFBDHN CN1CCN(C(C)(C)CNc2nccc3c2cccc3[N+](=O)[O-])CC1 ZINC001327983765 1330538210 /nfs/dbraw/zinc/53/82/10/1330538210.db2.gz XCTUYCPCMQKDMU-UHFFFAOYSA-N 0 3 343.431 2.581 20 5 EFBDHN Cc1cc2c(cc1[N+](=O)[O-])N(C(=O)c1ccc3c(c1)CNCC3)CC2 ZINC001329519715 1330714873 /nfs/dbraw/zinc/71/48/73/1330714873.db2.gz GZSLVFYIJFQSNV-UHFFFAOYSA-N 0 3 337.379 2.752 20 5 EFBDHN CN1CCCC[C@@H]1CNC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC001336222596 1331448185 /nfs/dbraw/zinc/44/81/85/1331448185.db2.gz ALWQWZRCFWRGRO-LLVKDONJSA-N 0 3 343.786 2.530 20 5 EFBDHN CC(C)[C@H](NC[C@@H](O)COc1ccccc1[N+](=O)[O-])c1ccccn1 ZINC001336722645 1331496201 /nfs/dbraw/zinc/49/62/01/1331496201.db2.gz LGENTQZBGBTHTD-KDOFPFPSSA-N 0 3 345.399 2.716 20 5 EFBDHN CC(C)NC(=O)c1ccc(N[C@H]2CN(C3CC3)C[C@H]2C)c([N+](=O)[O-])c1 ZINC001339608440 1331911448 /nfs/dbraw/zinc/91/14/48/1331911448.db2.gz BEXKIHNNONVDMX-WBMJQRKESA-N 0 3 346.431 2.628 20 5 EFBDHN Cc1nn(C)cc1CCC(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC001343829408 1332384419 /nfs/dbraw/zinc/38/44/19/1332384419.db2.gz HLHZOXDSFVBAQN-PXAZEXFGSA-N 0 3 349.362 2.750 20 5 EFBDHN N[C@H](C(=O)NCc1cc([N+](=O)[O-])ccc1Cl)C1CCCCC1 ZINC001346046506 1332594670 /nfs/dbraw/zinc/59/46/70/1332594670.db2.gz KOAOMFJUWHDOTP-AWEZNQCLSA-N 0 3 325.796 2.772 20 5 EFBDHN Cc1cn2c(CNC[C@@H](O)c3ccc([N+](=O)[O-])cc3)c(C)nc2s1 ZINC001346110953 1332600445 /nfs/dbraw/zinc/60/04/45/1332600445.db2.gz WHRQTLGKECWHBA-OAHLLOKOSA-N 0 3 346.412 2.744 20 5 EFBDHN COc1ncccc1C(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC001348939657 1332886779 /nfs/dbraw/zinc/88/67/79/1332886779.db2.gz LISLPWCBZZBHEA-QMTHXVAHSA-N 0 3 334.303 2.793 20 5 EFBDHN O=C(N[C@@H]1CCCN2CCCC[C@@H]12)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000847253405 1333447953 /nfs/dbraw/zinc/44/79/53/1333447953.db2.gz DESIUWQQWXLIHP-HIFRSBDPSA-N 0 3 337.807 2.995 20 5 EFBDHN O=C(N[C@@H]1CCCN2CCCC[C@@H]12)c1cccc(Cl)c1[N+](=O)[O-] ZINC000847254933 1333448832 /nfs/dbraw/zinc/44/88/32/1333448832.db2.gz HXUKAIDLRVLMMB-KGLIPLIRSA-N 0 3 337.807 2.995 20 5 EFBDHN O=C(N[C@@H]1CCCN2CCCC[C@H]12)c1cc(F)c([N+](=O)[O-])cc1F ZINC000847255365 1333450457 /nfs/dbraw/zinc/45/04/57/1333450457.db2.gz KOZFYRKVVKXGNC-ZIAGYGMSSA-N 0 3 339.342 2.620 20 5 EFBDHN CN1CCN(Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)CC1(C)C ZINC001353198770 1334004541 /nfs/dbraw/zinc/00/45/41/1334004541.db2.gz LBKJZNPPOIXDTF-UHFFFAOYSA-N 0 3 337.811 2.581 20 5 EFBDHN CC(C)[C@H]1CN(C)CCN1Cn1cc(-c2ccccc2[N+](=O)[O-])cn1 ZINC000848479530 1334737849 /nfs/dbraw/zinc/73/78/49/1334737849.db2.gz DMHYXQGOGLXPNA-GOSISDBHSA-N 0 3 343.431 2.688 20 5 EFBDHN C[C@H](O)C[C@@H]1CCCN1Cn1cc(-c2ccccc2[N+](=O)[O-])cn1 ZINC000848483117 1334739492 /nfs/dbraw/zinc/73/94/92/1334739492.db2.gz YRQCAVSNCZNPSY-ZFWWWQNUSA-N 0 3 330.388 2.651 20 5 EFBDHN COc1cccc2c1OCC[C@H]2NC[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001356534367 1335049812 /nfs/dbraw/zinc/04/98/12/1335049812.db2.gz LZVSSLDQXZEKCA-CVEARBPZSA-N 0 3 344.367 2.750 20 5 EFBDHN COc1cccc2c1OCC[C@@H]2NC[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001356534370 1335050229 /nfs/dbraw/zinc/05/02/29/1335050229.db2.gz LZVSSLDQXZEKCA-JKSUJKDBSA-N 0 3 344.367 2.750 20 5 EFBDHN CC(C)(C(=O)N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1)C1CC1 ZINC001020488892 713071140 /nfs/dbraw/zinc/07/11/40/713071140.db2.gz OGBFZAJSOYKKNY-SHTZXODSSA-N 0 3 331.416 2.768 20 5 EFBDHN C[C@H](NCc1cccc([N+](=O)[O-])c1Br)[C@@H]1CCOC1 ZINC000235525175 717915583 /nfs/dbraw/zinc/91/55/83/717915583.db2.gz AFIRBHHHQOLKSW-GXSJLCMTSA-N 0 3 329.194 2.872 20 5 EFBDHN Cc1cccc(C(=O)N[C@H]2C[C@@H](NCc3ccccc3[N+](=O)[O-])C2)c1 ZINC001021800853 714489658 /nfs/dbraw/zinc/48/96/58/714489658.db2.gz JULINJFOYFHWFF-CALCHBBNSA-N 0 3 339.395 2.954 20 5 EFBDHN Cc1ccc(C(=O)N[C@H]2C[C@@H](NCc3ccccc3[N+](=O)[O-])C2)o1 ZINC001021804922 714494645 /nfs/dbraw/zinc/49/46/45/714494645.db2.gz NUXSARJWWWKVCO-OKILXGFUSA-N 0 3 329.356 2.547 20 5 EFBDHN O=C(N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1)c1ccoc1Cl ZINC001022011329 714646905 /nfs/dbraw/zinc/64/69/05/714646905.db2.gz FYBFBPWYFDNHQN-TXEJJXNPSA-N 0 3 349.774 2.892 20 5 EFBDHN CC(C(=O)N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1)=C1CCC1 ZINC001022057635 714705978 /nfs/dbraw/zinc/70/59/78/714705978.db2.gz RNKHTPVORNWIKF-IYBDPMFKSA-N 0 3 329.400 2.832 20 5 EFBDHN COc1cccc([C@@H](CNc2ncc([N+](=O)[O-])cc2OC)N(C)C)c1 ZINC000891502411 714789063 /nfs/dbraw/zinc/78/90/63/714789063.db2.gz WLCPESFVNAAKOP-OAHLLOKOSA-N 0 3 346.387 2.722 20 5 EFBDHN C[C@@H](CN1CCCCC1)Nc1c2ccccc2n(C)c(=O)c1[N+](=O)[O-] ZINC000891792368 715021653 /nfs/dbraw/zinc/02/16/53/715021653.db2.gz HHJIYGGRRSWQOB-ZDUSSCGKSA-N 0 3 344.415 2.733 20 5 EFBDHN O=C(N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1)C1(C2CC2)CCC1 ZINC001022502415 715190364 /nfs/dbraw/zinc/19/03/64/715190364.db2.gz QFIQYYVNZUSMKF-IYBDPMFKSA-N 0 3 343.427 2.912 20 5 EFBDHN COc1c([O-])ccc(C[N@@H+]2CC[C@@H](C3CCOCC3)C2)c1[N+](=O)[O-] ZINC000892144444 715272593 /nfs/dbraw/zinc/27/25/93/715272593.db2.gz DDFJAFLHKGINHX-CYBMUJFWSA-N 0 3 336.388 2.558 20 5 EFBDHN COc1c([O-])ccc(C[N@H+]2CC[C@@H](C3CCOCC3)C2)c1[N+](=O)[O-] ZINC000892144444 715272595 /nfs/dbraw/zinc/27/25/95/715272595.db2.gz DDFJAFLHKGINHX-CYBMUJFWSA-N 0 3 336.388 2.558 20 5 EFBDHN C[C@@H](Cc1cccnc1)NCc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000934240255 715275601 /nfs/dbraw/zinc/27/56/01/715275601.db2.gz TURMYFNPSNLQTD-LBPRGKRZSA-N 0 3 329.356 2.577 20 5 EFBDHN CC1(C(=O)N[C@H]2C[C@@H](NCc3ccccc3[N+](=O)[O-])C2)CC=CC1 ZINC001022652960 715276042 /nfs/dbraw/zinc/27/60/42/715276042.db2.gz BWBOIDBDFXMDMV-GASCZTMLSA-N 0 3 329.400 2.688 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])CC1CCN(C(=O)C(F)F)CC1 ZINC001029924575 724574478 /nfs/dbraw/zinc/57/44/78/724574478.db2.gz PZCQQVJHGKZLFV-UHFFFAOYSA-N 0 3 341.358 2.530 20 5 EFBDHN Cc1cccc(C(=O)N[C@H]2C[C@H](NCc3ccccc3[N+](=O)[O-])C2)c1 ZINC001019963691 719418076 /nfs/dbraw/zinc/41/80/76/719418076.db2.gz JULINJFOYFHWFF-QAQDUYKDSA-N 0 3 339.395 2.954 20 5 EFBDHN CN(C)Cc1cccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c1 ZINC000047452669 721112733 /nfs/dbraw/zinc/11/27/33/721112733.db2.gz XZCOYHCUGQMLGJ-UHFFFAOYSA-N 0 3 344.327 2.817 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C1CCN(C(=O)C2(CF)CC2)CC1 ZINC000985638392 724740798 /nfs/dbraw/zinc/74/07/98/724740798.db2.gz ULIJVXPBSYDTSF-UHFFFAOYSA-N 0 3 349.406 2.767 20 5 EFBDHN O=C(N[C@H]1C[C@H](CNCc2csc([N+](=O)[O-])c2)C1)c1ccccc1 ZINC000983037292 721774584 /nfs/dbraw/zinc/77/45/84/721774584.db2.gz OXFQMQGPNDWCMA-NNUKFRKNSA-N 0 3 345.424 2.955 20 5 EFBDHN O=[N+]([O-])c1ccc2nc(N3CCN(C4CCCC4)CC3)cnc2c1 ZINC001165029894 721853850 /nfs/dbraw/zinc/85/38/50/721853850.db2.gz PTGMLXAXWZUDCS-UHFFFAOYSA-N 0 3 327.388 2.603 20 5 EFBDHN Cc1[nH]ccc1C(=O)N[C@H]1C[C@H](CNCc2csc([N+](=O)[O-])c2)C1 ZINC000983436786 722625104 /nfs/dbraw/zinc/62/51/04/722625104.db2.gz KAAUXEIIDGIHAN-AULYBMBSSA-N 0 3 348.428 2.591 20 5 EFBDHN O=C(N[C@H]1C[C@H](CNCc2csc([N+](=O)[O-])c2)C1)C1=CCCC1 ZINC000983461200 722647851 /nfs/dbraw/zinc/64/78/51/722647851.db2.gz JJWNJSIKQBUBNQ-YEORSEQZSA-N 0 3 335.429 2.751 20 5 EFBDHN Cc1cc[nH]c1C(=O)N[C@H]1C[C@H](CNCc2csc([N+](=O)[O-])c2)C1 ZINC000983578625 722731019 /nfs/dbraw/zinc/73/10/19/722731019.db2.gz FOVVFOTTYIWNMV-AULYBMBSSA-N 0 3 348.428 2.591 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]CC(C)(C)c2cccnc2)c1[N+](=O)[O-] ZINC000894936803 723033323 /nfs/dbraw/zinc/03/33/23/723033323.db2.gz JVVHGHBYYWFSNE-UHFFFAOYSA-N 0 3 331.372 2.771 20 5 EFBDHN C[C@@H](CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-])N1CCCCC1 ZINC000918373856 728871682 /nfs/dbraw/zinc/87/16/82/728871682.db2.gz MUSNGPCGUZNWTP-NSHDSACASA-N 0 3 325.796 2.852 20 5 EFBDHN Cn1cc(CN2CCN(C)C(C)(C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000895565135 724203113 /nfs/dbraw/zinc/20/31/13/724203113.db2.gz UWEVOUGENZJJPK-UHFFFAOYSA-N 0 3 343.431 2.521 20 5 EFBDHN O=[N+]([O-])c1ccc([C@H](O)CNCc2cccc3c2OCCCO3)cc1 ZINC000731678173 726916707 /nfs/dbraw/zinc/91/67/07/726916707.db2.gz HPVPITRXARIGNU-MRXNPFEDSA-N 0 3 344.367 2.579 20 5 EFBDHN CCN1CCCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)[C@H](C)C1 ZINC000910282792 727427103 /nfs/dbraw/zinc/42/71/03/727427103.db2.gz IWGYHMNLZNCOFP-CYBMUJFWSA-N 0 3 342.399 2.699 20 5 EFBDHN CC[C@H](C)C[C@@H](N)C(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000912149986 727664536 /nfs/dbraw/zinc/66/45/36/727664536.db2.gz HMMBTQULXSWQTG-IINYFYTJSA-N 0 3 327.812 2.970 20 5 EFBDHN COc1ccc(OC)c([C@@H](O)CN[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173307966 728622174 /nfs/dbraw/zinc/62/21/74/728622174.db2.gz VPXDWNZCTFIJDM-PXAZEXFGSA-N 0 3 346.383 2.996 20 5 EFBDHN CCC[C@H]1CN(Cc2cc(F)ccc2[N+](=O)[O-])CCN1CCOC ZINC000179673331 729607610 /nfs/dbraw/zinc/60/76/10/729607610.db2.gz QZCCPGIOHYCIHH-INIZCTEOSA-N 0 3 339.411 2.667 20 5 EFBDHN COc1ccccc1C[C@](C)(CO)NCc1ccccc1[N+](=O)[O-] ZINC000931606194 1126137213 /nfs/dbraw/zinc/13/72/13/1126137213.db2.gz YXRRWRLWWJOZFY-GOSISDBHSA-N 0 3 330.384 2.687 20 5 EFBDHN C[C@@H](C(=O)NC[C@H]1Cc2ccccc2CN1)c1cccc([N+](=O)[O-])c1 ZINC001575069782 1088226492 /nfs/dbraw/zinc/22/64/92/1088226492.db2.gz NCYZGGZVUREXLI-CXAGYDPISA-N 0 3 339.395 2.529 20 5 EFBDHN C[C@@H]1[C@H](C)NC[C@H](C)N1C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC001576881465 1089505871 /nfs/dbraw/zinc/50/58/71/1089505871.db2.gz VKSUQHOVKRBGAT-XHNCKOQMSA-N 0 3 329.759 2.598 20 5 EFBDHN CCN[C@H](C)C(=O)Nc1nc(-c2ccc(C)c([N+](=O)[O-])c2)cs1 ZINC001577814344 1090193928 /nfs/dbraw/zinc/19/39/28/1090193928.db2.gz XHSKYLWCQOWTIY-SNVBAGLBSA-N 0 3 334.401 2.963 20 5 EFBDHN CC[C@@H](NCc1nc2c(s1)CNCC2)c1cccc([N+](=O)[O-])c1 ZINC001578225599 1090313786 /nfs/dbraw/zinc/31/37/86/1090313786.db2.gz HABKXQSJFOVPLQ-CYBMUJFWSA-N 0 3 332.429 2.938 20 5 EFBDHN CN(C)c1cc(F)c(C(=O)Nc2cccc3c2CNC3)cc1[N+](=O)[O-] ZINC001578423124 1090368233 /nfs/dbraw/zinc/36/82/33/1090368233.db2.gz PRDWZIFLQRXRRN-UHFFFAOYSA-N 0 3 344.346 2.655 20 5 EFBDHN CN(CCc1ccccc1[N+](=O)[O-])C(=O)c1cc2c(s1)CCNC2 ZINC001578480872 1090382444 /nfs/dbraw/zinc/38/24/44/1090382444.db2.gz NDGJBZKMCHEIJI-UHFFFAOYSA-N 0 3 345.424 2.617 20 5 EFBDHN C[C@@H]1CNC[C@H](C)N1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC001579494052 1090622873 /nfs/dbraw/zinc/62/28/73/1090622873.db2.gz FUNBOVHDDIVMAX-AOOOYVTPSA-N 0 3 343.836 2.549 20 5 EFBDHN O=[N+]([O-])c1cc(Br)ccc1N[C@@H]1CNCCC1(F)F ZINC001580874860 1091031149 /nfs/dbraw/zinc/03/11/49/1091031149.db2.gz MHSRCDGZUNUYHI-SNVBAGLBSA-N 0 3 336.136 2.766 20 5 EFBDHN CCCN(C)CC(=O)NCC1(Nc2ccccc2[N+](=O)[O-])CCCC1 ZINC001104400909 1092632591 /nfs/dbraw/zinc/63/25/91/1092632591.db2.gz HJFFPFFICJNOLU-UHFFFAOYSA-N 0 3 348.447 2.778 20 5 EFBDHN Cc1cc(Cl)c(C(=O)NCCN2CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000828834939 1092811849 /nfs/dbraw/zinc/81/18/49/1092811849.db2.gz ZDNUVOYLCZPSIW-NSHDSACASA-N 0 3 325.796 2.771 20 5 EFBDHN CC(C)C[NH+](Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])CC(C)C ZINC001589626463 1093118228 /nfs/dbraw/zinc/11/82/28/1093118228.db2.gz WBYYQUODAYBHRR-UHFFFAOYSA-N 0 3 332.408 2.889 20 5 EFBDHN CC(C)C[NH+](Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])CC(C)C ZINC001589626463 1093118231 /nfs/dbraw/zinc/11/82/31/1093118231.db2.gz WBYYQUODAYBHRR-UHFFFAOYSA-N 0 3 332.408 2.889 20 5 EFBDHN C[C@@H](C[NH2+]Cc1ccc(-c2nnn[n-]2)cc1)c1ccccc1[N+](=O)[O-] ZINC001589871813 1093162105 /nfs/dbraw/zinc/16/21/05/1093162105.db2.gz CCRXBDRNAJTLQV-LBPRGKRZSA-N 0 3 338.371 2.668 20 5 EFBDHN C[C@@H](C[NH2+]Cc1ccc(-c2nn[n-]n2)cc1)c1ccccc1[N+](=O)[O-] ZINC001589871813 1093162108 /nfs/dbraw/zinc/16/21/08/1093162108.db2.gz CCRXBDRNAJTLQV-LBPRGKRZSA-N 0 3 338.371 2.668 20 5 EFBDHN C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001590238476 1093324849 /nfs/dbraw/zinc/32/48/49/1093324849.db2.gz HJINBKFPLSRLGZ-HBYGRHMLSA-N 0 3 330.392 2.689 20 5 EFBDHN C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001590238476 1093324858 /nfs/dbraw/zinc/32/48/58/1093324858.db2.gz HJINBKFPLSRLGZ-HBYGRHMLSA-N 0 3 330.392 2.689 20 5 EFBDHN C[C@H]1CCC[C@H](C)C1[NH2+]Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001590238477 1093325488 /nfs/dbraw/zinc/32/54/88/1093325488.db2.gz HJINBKFPLSRLGZ-QWRGUYRKSA-N 0 3 330.392 2.689 20 5 EFBDHN C[C@H]1CCC[C@H](C)C1[NH2+]Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001590238477 1093325497 /nfs/dbraw/zinc/32/54/97/1093325497.db2.gz HJINBKFPLSRLGZ-QWRGUYRKSA-N 0 3 330.392 2.689 20 5 EFBDHN C[C@@H]1CCC[C@@H](C)[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590245015 1093335834 /nfs/dbraw/zinc/33/58/34/1093335834.db2.gz XPOZKQKWBORAAL-VXGBXAGGSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@@H](C)[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590245015 1093335839 /nfs/dbraw/zinc/33/58/39/1093335839.db2.gz XPOZKQKWBORAAL-VXGBXAGGSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@@H](C)[N@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590245015 1093335845 /nfs/dbraw/zinc/33/58/45/1093335845.db2.gz XPOZKQKWBORAAL-VXGBXAGGSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@@H](C)[N@@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590245015 1093335853 /nfs/dbraw/zinc/33/58/53/1093335853.db2.gz XPOZKQKWBORAAL-VXGBXAGGSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CC[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])CC1(C)C ZINC001590272350 1093354629 /nfs/dbraw/zinc/35/46/29/1093354629.db2.gz QVULXVRYCQPDGJ-LLVKDONJSA-N 0 3 330.392 2.643 20 5 EFBDHN C[C@@H]1CC[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])CC1(C)C ZINC001590272350 1093354633 /nfs/dbraw/zinc/35/46/33/1093354633.db2.gz QVULXVRYCQPDGJ-LLVKDONJSA-N 0 3 330.392 2.643 20 5 EFBDHN CC[C@@H]1CCC[C@H](C)[N@@H+]1Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001590857484 1093603406 /nfs/dbraw/zinc/60/34/06/1093603406.db2.gz UTNWXNSZCSXNFL-NWDGAFQWSA-N 0 3 330.392 2.928 20 5 EFBDHN CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001590857484 1093603409 /nfs/dbraw/zinc/60/34/09/1093603409.db2.gz UTNWXNSZCSXNFL-NWDGAFQWSA-N 0 3 330.392 2.928 20 5 EFBDHN CC[C@@H]1CCC[C@H](C)[N@@H+]1Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001590857484 1093603413 /nfs/dbraw/zinc/60/34/13/1093603413.db2.gz UTNWXNSZCSXNFL-NWDGAFQWSA-N 0 3 330.392 2.928 20 5 EFBDHN CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001590857484 1093603418 /nfs/dbraw/zinc/60/34/18/1093603418.db2.gz UTNWXNSZCSXNFL-NWDGAFQWSA-N 0 3 330.392 2.928 20 5 EFBDHN C[C@@H]([NH2+]Cc1ccc(-c2nnn[n-]2)s1)c1ccc([N+](=O)[O-])cc1 ZINC001591730216 1093846371 /nfs/dbraw/zinc/84/63/71/1093846371.db2.gz AFMVLSKPCLRHCR-SECBINFHSA-N 0 3 330.373 2.687 20 5 EFBDHN C[C@@H]1C[C@H](C)CC[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001591735056 1093850593 /nfs/dbraw/zinc/85/05/93/1093850593.db2.gz OIVPZTJKZWSICL-VXGBXAGGSA-N 0 3 330.392 2.643 20 5 EFBDHN C[C@@H]1C[C@H](C)CC[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001591735056 1093850602 /nfs/dbraw/zinc/85/06/02/1093850602.db2.gz OIVPZTJKZWSICL-VXGBXAGGSA-N 0 3 330.392 2.643 20 5 EFBDHN C[C@@H]1C[C@H](C)CC[N@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001591735056 1093850605 /nfs/dbraw/zinc/85/06/05/1093850605.db2.gz OIVPZTJKZWSICL-VXGBXAGGSA-N 0 3 330.392 2.643 20 5 EFBDHN C[C@@H]1C[C@H](C)CC[N@@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001591735056 1093850610 /nfs/dbraw/zinc/85/06/10/1093850610.db2.gz OIVPZTJKZWSICL-VXGBXAGGSA-N 0 3 330.392 2.643 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[N@@H+]1CCC[C@H](C2CCC2)C1 ZINC001593467362 1094312135 /nfs/dbraw/zinc/31/21/35/1094312135.db2.gz PKEYOVZQNUSZQU-AWEZNQCLSA-N 0 3 342.403 2.787 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[N@H+]1CCC[C@H](C2CCC2)C1 ZINC001593467362 1094312145 /nfs/dbraw/zinc/31/21/45/1094312145.db2.gz PKEYOVZQNUSZQU-AWEZNQCLSA-N 0 3 342.403 2.787 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1C[N@@H+]1CCC[C@H](C2CCC2)C1 ZINC001593467362 1094312153 /nfs/dbraw/zinc/31/21/53/1094312153.db2.gz PKEYOVZQNUSZQU-AWEZNQCLSA-N 0 3 342.403 2.787 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1C[N@H+]1CCC[C@H](C2CCC2)C1 ZINC001593467362 1094312164 /nfs/dbraw/zinc/31/21/64/1094312164.db2.gz PKEYOVZQNUSZQU-AWEZNQCLSA-N 0 3 342.403 2.787 20 5 EFBDHN C/C(=C\c1ccccc1)CN[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000588619398 1094463941 /nfs/dbraw/zinc/46/39/41/1094463941.db2.gz LSTAWHMHTDVCGO-UPQQSIJHSA-N 0 3 342.395 2.682 20 5 EFBDHN NCc1nn(-c2ncc([N+](=O)[O-])cc2C(F)(F)F)c2ccccc12 ZINC001167698455 1095994273 /nfs/dbraw/zinc/99/42/73/1095994273.db2.gz YBMVBLWXHABVSZ-UHFFFAOYSA-N 0 3 337.261 2.806 20 5 EFBDHN C[C@H]1CCC[C@H](C)C1[NH2+]Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001603884209 1096657700 /nfs/dbraw/zinc/65/77/00/1096657700.db2.gz JKNKZMDGLPRXTH-QWRGUYRKSA-N 0 3 330.392 2.689 20 5 EFBDHN C[C@H]1CCC[C@H](C)C1[NH2+]Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001603884209 1096657704 /nfs/dbraw/zinc/65/77/04/1096657704.db2.gz JKNKZMDGLPRXTH-QWRGUYRKSA-N 0 3 330.392 2.689 20 5 EFBDHN CCC1(CC)CCC[N@@H+]1Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001604086050 1096726452 /nfs/dbraw/zinc/72/64/52/1096726452.db2.gz NVEQSAFSCBNAHW-UHFFFAOYSA-N 0 3 330.392 2.930 20 5 EFBDHN CCC1(CC)CCC[N@H+]1Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001604086050 1096726459 /nfs/dbraw/zinc/72/64/59/1096726459.db2.gz NVEQSAFSCBNAHW-UHFFFAOYSA-N 0 3 330.392 2.930 20 5 EFBDHN CCC1(CC)CCC[N@@H+]1Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001604086050 1096726464 /nfs/dbraw/zinc/72/64/64/1096726464.db2.gz NVEQSAFSCBNAHW-UHFFFAOYSA-N 0 3 330.392 2.930 20 5 EFBDHN CCC1(CC)CCC[N@H+]1Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001604086050 1096726465 /nfs/dbraw/zinc/72/64/65/1096726465.db2.gz NVEQSAFSCBNAHW-UHFFFAOYSA-N 0 3 330.392 2.930 20 5 EFBDHN CC[C@@H]1CCCCC[N@@H+]1Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001604103232 1096738289 /nfs/dbraw/zinc/73/82/89/1096738289.db2.gz SIJDTSOIJINWBD-GFCCVEGCSA-N 0 3 330.392 2.930 20 5 EFBDHN CC[C@@H]1CCCCC[N@H+]1Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001604103232 1096738296 /nfs/dbraw/zinc/73/82/96/1096738296.db2.gz SIJDTSOIJINWBD-GFCCVEGCSA-N 0 3 330.392 2.930 20 5 EFBDHN CC[C@@H]1CCCCC[N@@H+]1Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001604103232 1096738302 /nfs/dbraw/zinc/73/83/02/1096738302.db2.gz SIJDTSOIJINWBD-GFCCVEGCSA-N 0 3 330.392 2.930 20 5 EFBDHN CC[C@@H]1CCCCC[N@H+]1Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001604103232 1096738308 /nfs/dbraw/zinc/73/83/08/1096738308.db2.gz SIJDTSOIJINWBD-GFCCVEGCSA-N 0 3 330.392 2.930 20 5 EFBDHN C[C@@H]1CCC[C@H](C)C[N@H+]1Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001609162710 1098176706 /nfs/dbraw/zinc/17/67/06/1098176706.db2.gz IJSQQQNKDFWBKZ-NWDGAFQWSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@H](C)C[N@@H+]1Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001609162710 1098176710 /nfs/dbraw/zinc/17/67/10/1098176710.db2.gz IJSQQQNKDFWBKZ-NWDGAFQWSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@H](C)C[N@H+]1Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001609162710 1098176716 /nfs/dbraw/zinc/17/67/16/1098176716.db2.gz IJSQQQNKDFWBKZ-NWDGAFQWSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@H](C)C[N@@H+]1Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001609162710 1098176720 /nfs/dbraw/zinc/17/67/20/1098176720.db2.gz IJSQQQNKDFWBKZ-NWDGAFQWSA-N 0 3 330.392 2.785 20 5 EFBDHN CN1CCC2(CN(C(=O)c3ccc4oc5ccccc5c(=O)c4c3)C2)C1 ZINC001270369058 1099016996 /nfs/dbraw/zinc/01/69/96/1099016996.db2.gz OFEHFMJNAFRECQ-UHFFFAOYSA-N 0 3 348.402 2.724 20 5 EFBDHN Cc1nn(C)c(N2CCN(Cc3ccccc3)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000450808774 282270758 /nfs/dbraw/zinc/27/07/58/282270758.db2.gz JDIWXXJNFZOADY-AWEZNQCLSA-N 0 3 343.431 2.595 20 5 EFBDHN CN(CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CCN(C)C1CC1 ZINC000186788074 529938787 /nfs/dbraw/zinc/93/87/87/529938787.db2.gz WXADASYUQMVXFO-UHFFFAOYSA-N 0 3 344.415 2.818 20 5 EFBDHN C[C@@H](C(=O)NC(C)(C)CN1CCCC1)c1ccc([N+](=O)[O-])cc1F ZINC000457058029 295766214 /nfs/dbraw/zinc/76/62/14/295766214.db2.gz VIDAHIJCLVSPFC-GFCCVEGCSA-N 0 3 337.395 2.828 20 5 EFBDHN Cc1cc(NC(=O)CCN[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)no1 ZINC000181811693 234332576 /nfs/dbraw/zinc/33/25/76/234332576.db2.gz VQLBIRXSSSFWEW-GFCCVEGCSA-N 0 3 332.360 2.879 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN1CCCc2ccccc2C1 ZINC000181860615 234356588 /nfs/dbraw/zinc/35/65/88/234356588.db2.gz RZJCJZRBIGYPQR-KRWDZBQOSA-N 0 3 342.395 2.783 20 5 EFBDHN CN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000164169034 283099435 /nfs/dbraw/zinc/09/94/35/283099435.db2.gz XJDIDEVFIJGYAJ-BXUZGUMPSA-N 0 3 337.807 2.805 20 5 EFBDHN NC(=O)c1ccc(CN2CCC[C@H]2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000025441590 202130826 /nfs/dbraw/zinc/13/08/26/202130826.db2.gz MQNVZNMJPNMKPI-KRWDZBQOSA-N 0 3 339.395 2.901 20 5 EFBDHN CCCN(CCN(C)C)C(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000347605439 283227700 /nfs/dbraw/zinc/22/77/00/283227700.db2.gz WNULSRVHSVUQGR-LBPRGKRZSA-N 0 3 325.384 2.638 20 5 EFBDHN Cc1c(NC(=O)[C@H](C)N(C)CC2(N(C)C)CCC2)cccc1[N+](=O)[O-] ZINC000186940649 236072056 /nfs/dbraw/zinc/07/20/56/236072056.db2.gz SJJHNKVTEFGOKE-AWEZNQCLSA-N 0 3 348.447 2.646 20 5 EFBDHN C[C@H](NC(=O)Cc1cccc([N+](=O)[O-])c1)[C@@H](c1ccccc1)N(C)C ZINC000187165271 236134974 /nfs/dbraw/zinc/13/49/74/236134974.db2.gz FZWCPSKPYLOVEG-LIRRHRJNSA-N 0 3 341.411 2.945 20 5 EFBDHN C[C@H](NC(=O)Cc1ccccc1[N+](=O)[O-])[C@@H](c1ccccc1)N(C)C ZINC000187180849 236139247 /nfs/dbraw/zinc/13/92/47/236139247.db2.gz JXBGKTMZCLWULU-LIRRHRJNSA-N 0 3 341.411 2.945 20 5 EFBDHN CN(C)C1(CN(C)C(=O)c2ccc([N+](=O)[O-])c3cccnc23)CCC1 ZINC000188015374 236384407 /nfs/dbraw/zinc/38/44/07/236384407.db2.gz IVHLULBTUDZGEY-UHFFFAOYSA-N 0 3 342.399 2.699 20 5 EFBDHN Cc1nn(C)c(NC[C@@H]2CCCN2Cc2ccccc2)c1[N+](=O)[O-] ZINC000265091811 201213433 /nfs/dbraw/zinc/21/34/33/201213433.db2.gz AORCXRHYCCECOI-HNNXBMFYSA-N 0 3 329.404 2.713 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CCC(c3ccncc3)CC2)c1 ZINC000191676681 239246257 /nfs/dbraw/zinc/24/62/57/239246257.db2.gz VGZMDXNJBUUSTB-GOSISDBHSA-N 0 3 327.384 2.903 20 5 EFBDHN COc1cccc(C(=O)NC[C@H](c2ccccc2)N(C)C)c1[N+](=O)[O-] ZINC000193819046 240127555 /nfs/dbraw/zinc/12/75/55/240127555.db2.gz PUVQVJRKNNYHAN-OAHLLOKOSA-N 0 3 343.383 2.636 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCN1C[C@@H](O)C[C@H]1c1ccccc1 ZINC000411919672 243026238 /nfs/dbraw/zinc/02/62/38/243026238.db2.gz BIPLAZXHQOWPJB-RDJZCZTQSA-N 0 3 328.368 2.782 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCN2C[C@@H](O)C[C@H]2c2ccccc2)cc1 ZINC000411934062 243033031 /nfs/dbraw/zinc/03/30/31/243033031.db2.gz HCHDPELRGZOEAZ-WMZOPIPTSA-N 0 3 328.368 2.782 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCN2C[C@H](O)C[C@@H]2c2ccccc2)cc1 ZINC000411934060 243034791 /nfs/dbraw/zinc/03/47/91/243034791.db2.gz HCHDPELRGZOEAZ-SJLPKXTDSA-N 0 3 328.368 2.782 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCN2C[C@@H](O)C[C@H]2c2ccccc2)c1 ZINC000411943024 243036816 /nfs/dbraw/zinc/03/68/16/243036816.db2.gz MLMJDRPXTDTTGO-WMZOPIPTSA-N 0 3 328.368 2.782 20 5 EFBDHN CO[C@](C)([C@H](C)NCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000411978507 243055284 /nfs/dbraw/zinc/05/52/84/243055284.db2.gz ZCEIWMZVRANCFS-YVEFUNNKSA-N 0 3 335.404 2.635 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000412103412 243142260 /nfs/dbraw/zinc/14/22/60/243142260.db2.gz ZYENZQAEISJRHN-HNNXBMFYSA-N 0 3 349.431 2.986 20 5 EFBDHN CN1CCC[C@H](CNc2c(Br)cncc2[N+](=O)[O-])C1 ZINC000091483084 203074971 /nfs/dbraw/zinc/07/49/71/203074971.db2.gz GKPIXLJMHSSZOE-SECBINFHSA-N 0 3 329.198 2.506 20 5 EFBDHN CCN(Cc1cccs1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000253610746 244037175 /nfs/dbraw/zinc/03/71/75/244037175.db2.gz BDDVHXFAAXOPEL-CQSZACIVSA-N 0 3 336.413 2.918 20 5 EFBDHN Cc1ccc([C@@H](C)NCCC(C)(C)S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000414272464 244070860 /nfs/dbraw/zinc/07/08/60/244070860.db2.gz XEQZIECULNSBHC-GFCCVEGCSA-N 0 3 328.434 2.767 20 5 EFBDHN Cc1c([C@H](C)NCC2(CS(C)(=O)=O)CCC2)cccc1[N+](=O)[O-] ZINC000414320158 244085900 /nfs/dbraw/zinc/08/59/00/244085900.db2.gz ADMBVAFENUUOTK-ZDUSSCGKSA-N 0 3 340.445 2.769 20 5 EFBDHN CCn1cc([C@@H]2OCC[C@H]2CNCc2ccc([N+](=O)[O-])cc2F)cn1 ZINC000414508738 244203329 /nfs/dbraw/zinc/20/33/29/244203329.db2.gz YEQCKCQYEUVHCP-SUMWQHHRSA-N 0 3 348.378 2.818 20 5 EFBDHN CC(C)[C@H]1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CCS1 ZINC000072837237 203247445 /nfs/dbraw/zinc/24/74/45/203247445.db2.gz FFXHUOJCKYOULL-OAHLLOKOSA-N 0 3 337.445 2.997 20 5 EFBDHN C[C@@]1(F)CNCCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000414764878 244334456 /nfs/dbraw/zinc/33/44/56/244334456.db2.gz DUYGPAQHJXVZOX-QGZVFWFLSA-N 0 3 333.363 2.988 20 5 EFBDHN CCCNC(=O)CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000102419999 204037997 /nfs/dbraw/zinc/03/79/97/204037997.db2.gz XNJJNXMNTFSGDT-UHFFFAOYSA-N 0 3 333.413 2.939 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1NCC1(N(C)C)CC1 ZINC000419010479 245327829 /nfs/dbraw/zinc/32/78/29/245327829.db2.gz PTMAXSMDFQOFPT-UHFFFAOYSA-N 0 3 327.768 2.541 20 5 EFBDHN COc1cc(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)c([N+](=O)[O-])cc1[O-] ZINC000105448200 204146947 /nfs/dbraw/zinc/14/69/47/204146947.db2.gz TZERWSOXDWPERH-UHFFFAOYSA-N 0 3 347.327 2.550 20 5 EFBDHN CC1CCN(CCNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CC1 ZINC000108687339 204269414 /nfs/dbraw/zinc/26/94/14/204269414.db2.gz NTVYWBJNBGODLZ-UHFFFAOYSA-N 0 3 330.388 2.538 20 5 EFBDHN C[C@H](CNC(=O)c1ccccc1[N+](=O)[O-])N(C)Cc1ccccc1 ZINC000110349679 204309380 /nfs/dbraw/zinc/30/93/80/204309380.db2.gz XZAZVPFNIUCDRQ-CQSZACIVSA-N 0 3 327.384 2.845 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000110993089 204330658 /nfs/dbraw/zinc/33/06/58/204330658.db2.gz YMIHKLNLWUJCMQ-LBPRGKRZSA-N 0 3 325.796 2.852 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCCN2CCC[C@@H]2[C@H](O)C(F)(F)F)cc1 ZINC000111231942 204342869 /nfs/dbraw/zinc/34/28/69/204342869.db2.gz CALYOCMJOBBPPS-KGLIPLIRSA-N 0 3 348.321 2.751 20 5 EFBDHN O=[N+]([O-])c1cc(CN[C@H](CO)Cc2c[nH]c3ccccc23)cs1 ZINC000116350668 204530337 /nfs/dbraw/zinc/53/03/37/204530337.db2.gz VBXFONHOCJCJOE-ZDUSSCGKSA-N 0 3 331.397 2.831 20 5 EFBDHN CN(CCNC(=O)CCc1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000125782929 205025599 /nfs/dbraw/zinc/02/55/99/205025599.db2.gz ZFFWJBFSBPBQIX-UHFFFAOYSA-N 0 3 341.411 2.776 20 5 EFBDHN CC[C@H]1CCCN(C(C)(C)CNC(=O)c2cc([N+](=O)[O-])cnc2C)C1 ZINC000110976589 220086110 /nfs/dbraw/zinc/08/61/10/220086110.db2.gz DEYVWVUHLMMOFA-AWEZNQCLSA-N 0 3 348.447 2.929 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC[C@@H](Cn2ccnn2)C1 ZINC000245538507 205139581 /nfs/dbraw/zinc/13/95/81/205139581.db2.gz ZEAOYNJBTRHQQN-LSDHHAIUSA-N 0 3 329.404 2.968 20 5 EFBDHN C[C@H]1SCCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)[C@H]1C ZINC000128672344 205156710 /nfs/dbraw/zinc/15/67/10/205156710.db2.gz SYLIHKHDKAIUQF-WDEREUQCSA-N 0 3 341.408 2.888 20 5 EFBDHN C[C@@H]1CCC[C@@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@@H]1C ZINC000129243905 205186415 /nfs/dbraw/zinc/18/64/15/205186415.db2.gz JRBJHKFHOJKZIW-XJKCOSOUSA-N 0 3 340.445 2.783 20 5 EFBDHN C[C@@H]1CCC[C@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@@H]1C ZINC000129243417 205186424 /nfs/dbraw/zinc/18/64/24/205186424.db2.gz JRBJHKFHOJKZIW-IOASZLSFSA-N 0 3 340.445 2.783 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000128831909 205166510 /nfs/dbraw/zinc/16/65/10/205166510.db2.gz YOHKQYWSJVGKLJ-CVEARBPZSA-N 0 3 331.416 2.531 20 5 EFBDHN C[C@H]1CCCC[C@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000129245035 205185678 /nfs/dbraw/zinc/18/56/78/205185678.db2.gz MWYKRKLPWCODJW-SWLSCSKDSA-N 0 3 326.418 2.537 20 5 EFBDHN CN(CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)CCc1ccccn1 ZINC000129486188 205198465 /nfs/dbraw/zinc/19/84/65/205198465.db2.gz YZXUBGRBJVSURB-UHFFFAOYSA-N 0 3 346.362 2.632 20 5 EFBDHN CN(Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)[C@@H]1CCSC1 ZINC000130487879 205241640 /nfs/dbraw/zinc/24/16/40/205241640.db2.gz WNSIWBXMILYRNF-OAHLLOKOSA-N 0 3 332.429 2.933 20 5 EFBDHN C[C@H]1C[C@@H](c2ccccc2)CN1CCn1cc([N+](=O)[O-])ccc1=O ZINC000132070172 205312889 /nfs/dbraw/zinc/31/28/89/205312889.db2.gz VVVWNQZUEFBRMX-GOEBONIOSA-N 0 3 327.384 2.635 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@H](C)[C@@H](CO)SC)cc1[N+](=O)[O-] ZINC000153909962 205892391 /nfs/dbraw/zinc/89/23/91/205892391.db2.gz QMKXIYZITLRQQT-FIXISWKDSA-N 0 3 328.434 2.757 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@@H]1CCCN1C ZINC000421709829 246074267 /nfs/dbraw/zinc/07/42/67/246074267.db2.gz HJBJIEFERKZFHO-ZDUSSCGKSA-N 0 3 337.445 2.873 20 5 EFBDHN CN(C)CCN(Cc1cccc(O)c1)C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000157279517 206127160 /nfs/dbraw/zinc/12/71/60/206127160.db2.gz JVQUVHFTLQBQMS-UHFFFAOYSA-N 0 3 343.383 2.504 20 5 EFBDHN CN(CCn1cc([N+](=O)[O-])cn1)Cc1ccc(OC(F)(F)F)cc1 ZINC000157596765 206145411 /nfs/dbraw/zinc/14/54/11/206145411.db2.gz USXMNJDZJKBFQG-UHFFFAOYSA-N 0 3 344.293 2.822 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCN1CCC(Cc2ccccc2)CC1 ZINC000159699179 206259067 /nfs/dbraw/zinc/25/90/67/206259067.db2.gz CPPHJFMWXGUZKR-UHFFFAOYSA-N 0 3 341.411 2.711 20 5 EFBDHN C[C@@H](Cc1ccc(Cl)cc1)N(C)CCn1cc([N+](=O)[O-])ccc1=O ZINC000159835983 206264812 /nfs/dbraw/zinc/26/48/12/206264812.db2.gz YNLGRAPPZVCDBX-ZDUSSCGKSA-N 0 3 349.818 2.973 20 5 EFBDHN CCN1CCCN(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000159950446 206272080 /nfs/dbraw/zinc/27/20/80/206272080.db2.gz JKNCXLGIJBSQTJ-AWEZNQCLSA-N 0 3 334.420 2.701 20 5 EFBDHN O=C(Nc1cccc(CN2CCCCC2)c1)c1n[nH]cc1[N+](=O)[O-] ZINC000159948903 206271623 /nfs/dbraw/zinc/27/16/23/206271623.db2.gz RQJVHPOIJPFZCM-UHFFFAOYSA-N 0 3 329.360 2.556 20 5 EFBDHN COCC(C)(C)N1CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)CC1 ZINC000425273591 247025290 /nfs/dbraw/zinc/02/52/90/247025290.db2.gz BLNHNKYWPJTDEC-UHFFFAOYSA-N 0 3 344.415 2.690 20 5 EFBDHN CC[C@H]1CCCCN1CCNC(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000264994710 247121016 /nfs/dbraw/zinc/12/10/16/247121016.db2.gz RPOAOKJEWRYBCE-AWEZNQCLSA-N 0 3 335.404 2.598 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@@](C)(O)c1ccccc1 ZINC000265142198 247242264 /nfs/dbraw/zinc/24/22/64/247242264.db2.gz MDAAEDGMUHSVCW-GOSISDBHSA-N 0 3 330.384 2.991 20 5 EFBDHN O=C(N[C@@H]1CCN(C2CC2)C1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000426468852 247283021 /nfs/dbraw/zinc/28/30/21/247283021.db2.gz OHEHVNICNCYAKD-CQSZACIVSA-N 0 3 344.415 2.506 20 5 EFBDHN CCc1nc(C)c(CN[C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)o1 ZINC000426321367 247261451 /nfs/dbraw/zinc/26/14/51/247261451.db2.gz CHXAOAVRXOEYEK-STQMWFEESA-N 0 3 333.392 2.924 20 5 EFBDHN CC(C)N1C[C@H](NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)[C@@H](C)C1 ZINC000161398988 206345838 /nfs/dbraw/zinc/34/58/38/206345838.db2.gz AVCSVBALQNRZQN-ZBEGNZNMSA-N 0 3 330.388 2.535 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCN(CC(C)(C)O)[C@@H](C)C1 ZINC000249361744 206354751 /nfs/dbraw/zinc/35/47/51/206354751.db2.gz LRVSCAJQRGLQRT-LSDHHAIUSA-N 0 3 335.448 2.741 20 5 EFBDHN C[C@@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000249760308 206366594 /nfs/dbraw/zinc/36/65/94/206366594.db2.gz XFZANVFTLJAGIJ-XQQFMLRXSA-N 0 3 337.395 2.830 20 5 EFBDHN CN(C)[C@H](CC(=O)NCCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000433309919 248044040 /nfs/dbraw/zinc/04/40/40/248044040.db2.gz FJJAMFJJKLSAMU-GOSISDBHSA-N 0 3 341.411 2.947 20 5 EFBDHN CN(CCOc1cccc([N+](=O)[O-])c1)C[C@@H](O)Cc1ccccc1 ZINC000433071204 248011510 /nfs/dbraw/zinc/01/15/10/248011510.db2.gz XLVCKAKEVNOGLK-KRWDZBQOSA-N 0 3 330.384 2.509 20 5 EFBDHN C[C@@H](NC(=O)NC[C@H]1CCCCN1C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000433566142 248072516 /nfs/dbraw/zinc/07/25/16/248072516.db2.gz YJHNFAVZKYAXNH-CXAGYDPISA-N 0 3 346.431 2.972 20 5 EFBDHN C[C@@H]1CCCCN1CCNc1ccc([N+](=O)[O-])cc1N1CCOC1=O ZINC000266189057 248159100 /nfs/dbraw/zinc/15/91/00/248159100.db2.gz BOTPTMYPYPWSSA-CYBMUJFWSA-N 0 3 348.403 2.838 20 5 EFBDHN Cc1cnc(NCc2ccccc2OCCN(C)C)c([N+](=O)[O-])c1 ZINC000266192766 248161963 /nfs/dbraw/zinc/16/19/63/248161963.db2.gz GPXHQMXFZCOJMU-UHFFFAOYSA-N 0 3 330.388 2.851 20 5 EFBDHN C[C@@H](N[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[C@H]1CCOC1 ZINC000266292589 248228920 /nfs/dbraw/zinc/22/89/20/248228920.db2.gz KGTRMOALSJVZIG-VWYCJHECSA-N 0 3 341.795 2.590 20 5 EFBDHN O=[N+]([O-])c1cccnc1NCc1ccccc1CN1CCC(O)CC1 ZINC000266301056 248234862 /nfs/dbraw/zinc/23/48/62/248234862.db2.gz YORSUBTVQKJJAW-UHFFFAOYSA-N 0 3 342.399 2.559 20 5 EFBDHN O=C(c1cccc(Cl)c1[N+](=O)[O-])N1CC[C@@H](N2CCCCC2)C1 ZINC000267361266 296250452 /nfs/dbraw/zinc/25/04/52/296250452.db2.gz HBBWDGRBCJTATF-GFCCVEGCSA-N 0 3 337.807 2.949 20 5 EFBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CN2CCN3CCCC[C@@H]3C2)c1 ZINC000092616253 218154677 /nfs/dbraw/zinc/15/46/77/218154677.db2.gz MQZTULBICIIESJ-CQSZACIVSA-N 0 3 341.358 2.866 20 5 EFBDHN C[C@@H](NCCn1ccc([N+](=O)[O-])n1)c1ccc(Br)s1 ZINC000443340407 250185427 /nfs/dbraw/zinc/18/54/27/250185427.db2.gz GFAINKKAICBDHS-MRVPVSSYSA-N 0 3 345.222 2.966 20 5 EFBDHN CC(C)N(C)CCNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000444019666 250249071 /nfs/dbraw/zinc/24/90/71/250249071.db2.gz INIQBJXTMKRCTG-UHFFFAOYSA-N 0 3 337.423 2.751 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN3CCC[C@H]3C3CCOCC3)nc2c1 ZINC000444684749 250328491 /nfs/dbraw/zinc/32/84/91/250328491.db2.gz NSTQABLVEABAJL-INIZCTEOSA-N 0 3 330.388 2.862 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN[C@@H]3CCCC[C@@H]3n3cccn3)nc2c1 ZINC000444685649 250327094 /nfs/dbraw/zinc/32/70/94/250327094.db2.gz OWKJZKDMMMIMNU-ZBFHGGJFSA-N 0 3 340.387 2.941 20 5 EFBDHN CCOC(=O)C[C@](C)(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(C)C ZINC000444677381 250329034 /nfs/dbraw/zinc/32/90/34/250329034.db2.gz UEAYIMDFCDHRHL-KRWDZBQOSA-N 0 3 348.403 2.929 20 5 EFBDHN CC1(C)CCCN(CCNC(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000445260440 250399757 /nfs/dbraw/zinc/39/97/57/250399757.db2.gz FKIQMCWDTXZXNL-UHFFFAOYSA-N 0 3 348.447 2.559 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN[C@@H]3[C@H]4CCO[C@@H]4C34CCC4)nc2c1 ZINC000446854534 250536759 /nfs/dbraw/zinc/53/67/59/250536759.db2.gz ZTIFIHPZTSTCSV-LYRGGWFBSA-N 0 3 328.372 2.518 20 5 EFBDHN COCCN1CCC(Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000174700566 207047334 /nfs/dbraw/zinc/04/73/34/207047334.db2.gz GAOQRGLHSXXZGR-UHFFFAOYSA-N 0 3 345.346 2.719 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H]3CC[C@H](C2)N3C)c1 ZINC000174636066 207041194 /nfs/dbraw/zinc/04/11/94/207041194.db2.gz SGODWXSPQCUBOL-NWDGAFQWSA-N 0 3 335.429 2.625 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CC[C@H](CSc3ccccc3)C2)c1 ZINC000174879131 207068879 /nfs/dbraw/zinc/06/88/79/207068879.db2.gz CJQCEFMHUNWZSM-AWEZNQCLSA-N 0 3 332.429 2.906 20 5 EFBDHN CO[C@@H]1CCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000449503765 251044888 /nfs/dbraw/zinc/04/48/88/251044888.db2.gz PWYSGEURZSYZCN-CXAGYDPISA-N 0 3 344.415 2.852 20 5 EFBDHN COC[C@@]1(CO)CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000449694129 251119926 /nfs/dbraw/zinc/11/99/26/251119926.db2.gz GACLUKXBNSUHQT-SFHVURJKSA-N 0 3 346.383 2.686 20 5 EFBDHN COC[C@]1(CO)CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000449694128 251120171 /nfs/dbraw/zinc/12/01/71/251120171.db2.gz GACLUKXBNSUHQT-GOSISDBHSA-N 0 3 346.383 2.686 20 5 EFBDHN CCN1CCCC[C@@H]1CNc1ccc([N+](=O)[O-])cc1N1CCOC1=O ZINC000267525667 251128011 /nfs/dbraw/zinc/12/80/11/251128011.db2.gz NXNHLOUTGOBIOW-CQSZACIVSA-N 0 3 348.403 2.838 20 5 EFBDHN COC(=O)[C@H]1CN(Cc2cccc([N+](=O)[O-])c2)C[C@H]1c1ccccc1 ZINC000449754165 251142861 /nfs/dbraw/zinc/14/28/61/251142861.db2.gz KYYCRNQAJXCLDC-ROUUACIJSA-N 0 3 340.379 2.983 20 5 EFBDHN COc1cc(CNCCN2CCCC2(C)C)c([N+](=O)[O-])cc1OC ZINC000449782878 251154925 /nfs/dbraw/zinc/15/49/25/251154925.db2.gz MLEZHTGANUJAGP-UHFFFAOYSA-N 0 3 337.420 2.576 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)NC[C@H](C)N(C)C2CC2)cc1[N+](=O)[O-] ZINC000176137778 207193229 /nfs/dbraw/zinc/19/32/29/207193229.db2.gz KMOGZVPTXSYSJV-QWHCGFSZSA-N 0 3 334.420 2.746 20 5 EFBDHN COC(=O)Cc1ccc(NCCN2CCCCCC2)c([N+](=O)[O-])c1 ZINC000450243353 251312564 /nfs/dbraw/zinc/31/25/64/251312564.db2.gz RMAFJTTZKDBKBT-UHFFFAOYSA-N 0 3 335.404 2.598 20 5 EFBDHN COC(=O)Cc1ccc(N[C@H](C)CN2CCCCC2)c([N+](=O)[O-])c1 ZINC000450250599 251315949 /nfs/dbraw/zinc/31/59/49/251315949.db2.gz LVMQAKBRHNDWDO-CYBMUJFWSA-N 0 3 335.404 2.597 20 5 EFBDHN Cc1nc(NC[C@@H](c2ccccc2)N2CCCC2)ncc1[N+](=O)[O-] ZINC000450217575 251302642 /nfs/dbraw/zinc/30/26/42/251302642.db2.gz UJRNTWLSIIFCAU-INIZCTEOSA-N 0 3 327.388 2.942 20 5 EFBDHN Cc1cccc(C(=O)NCCCCN2C[C@@H](C)O[C@@H](C)C2)c1[N+](=O)[O-] ZINC000176694183 207251613 /nfs/dbraw/zinc/25/16/13/207251613.db2.gz ISDHOFIFGRCUQO-GASCZTMLSA-N 0 3 349.431 2.522 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N(C)C[C@@H]2CCCN(C)C2)cc1[N+](=O)[O-] ZINC000176720404 207252611 /nfs/dbraw/zinc/25/26/11/207252611.db2.gz YTAUULFGDGJPEX-LSDHHAIUSA-N 0 3 348.447 2.947 20 5 EFBDHN O=[N+]([O-])c1ccc(OC2CCN(CCC3OCCCO3)CC2)cc1 ZINC000267939349 251470237 /nfs/dbraw/zinc/47/02/37/251470237.db2.gz NNVVQRQJVDPTBS-UHFFFAOYSA-N 0 3 336.388 2.591 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2ccc(CNC[C@@]3(O)CCSC3)o2)c1 ZINC000176752937 207258532 /nfs/dbraw/zinc/25/85/32/207258532.db2.gz CDFCJTXRAXPTDW-INIZCTEOSA-N 0 3 334.397 2.812 20 5 EFBDHN C[C@@H]1C[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CN1C1CC1 ZINC000177100471 207293695 /nfs/dbraw/zinc/29/36/95/207293695.db2.gz GFPGHHXJIFDSQC-PWSUYJOCSA-N 0 3 337.807 2.532 20 5 EFBDHN Cc1ccc(CN(C)C)cc1NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000177301909 207318472 /nfs/dbraw/zinc/31/84/72/207318472.db2.gz SOYNYWIKGUFUTI-UHFFFAOYSA-N 0 3 343.383 2.982 20 5 EFBDHN CCCc1[nH]nc(C(=O)Nc2cc(CN(C)C)ccc2C)c1[N+](=O)[O-] ZINC000177349182 207325317 /nfs/dbraw/zinc/32/53/17/207325317.db2.gz ZOFJZDSTGAYJQI-UHFFFAOYSA-N 0 3 345.403 2.893 20 5 EFBDHN CCc1ccc(C(=O)N2[C@@H]3CC[C@H]2CCN(CC)C3)cc1[N+](=O)[O-] ZINC000177762065 207391283 /nfs/dbraw/zinc/39/12/83/207391283.db2.gz YMFBOICUOKEMRO-JKSUJKDBSA-N 0 3 331.416 2.856 20 5 EFBDHN C[C@@H](NC[C@@H](O)COc1ccccc1F)c1cccc([N+](=O)[O-])c1 ZINC000180393165 207772713 /nfs/dbraw/zinc/77/27/13/207772713.db2.gz AFGAAVKLGMIZLN-IUODEOHRSA-N 0 3 334.347 2.824 20 5 EFBDHN O=[N+]([O-])c1cc(CN2CCN(C3CCOCC3)CC2)ccc1Cl ZINC000154126569 224207423 /nfs/dbraw/zinc/20/74/23/224207423.db2.gz UAWREOFCSYEVDF-UHFFFAOYSA-N 0 3 339.823 2.545 20 5 EFBDHN C[C@@H]1CC[C@H](NCC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)[C@H](C)C1 ZINC000119247052 221276198 /nfs/dbraw/zinc/27/61/98/221276198.db2.gz DBVDDQMJXQPIEP-UTUOFQBUSA-N 0 3 349.387 2.676 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)CCN[C@H](C)c1cccnc1 ZINC000181665603 533223763 /nfs/dbraw/zinc/22/37/63/533223763.db2.gz NGOVFWVPSPJYRM-GFCCVEGCSA-N 0 3 344.371 2.678 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN(C)[C@H](C)CN1CCOCC1 ZINC000435056646 533406885 /nfs/dbraw/zinc/40/68/85/533406885.db2.gz NAUGUSUIENBJQG-RBFDBLARSA-N 0 3 333.432 2.651 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC[C@@H](n2ccnn2)C1 ZINC000425346697 533407612 /nfs/dbraw/zinc/40/76/12/533407612.db2.gz GIAMJWBTTCWNMF-IDKBZEPQSA-N 0 3 327.388 2.927 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC[C@H](n2ccnn2)C1 ZINC000425346704 533407694 /nfs/dbraw/zinc/40/76/94/533407694.db2.gz GIAMJWBTTCWNMF-SHRNQRGKSA-N 0 3 327.388 2.927 20 5 EFBDHN COc1ccc(CNCC[C@](C)(O)c2ccccc2)cc1[N+](=O)[O-] ZINC000189819789 533663632 /nfs/dbraw/zinc/66/36/32/533663632.db2.gz IIHKEJJXCINEAA-SFHVURJKSA-N 0 3 330.384 2.991 20 5 EFBDHN CC(C)CN(C(=O)c1cc(F)cc([N+](=O)[O-])c1)C1CCN(C)CC1 ZINC000344561668 142040763 /nfs/dbraw/zinc/04/07/63/142040763.db2.gz SPQKIJQETJJGIM-UHFFFAOYSA-N 0 3 337.395 2.926 20 5 EFBDHN CCOC[C@H](O)CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000344575773 142042765 /nfs/dbraw/zinc/04/27/65/142042765.db2.gz CACQHXSFWRDZFO-CQSZACIVSA-N 0 3 336.413 2.810 20 5 EFBDHN CN1CCCC(C)(C)[C@@H]1CNC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000344721273 142066990 /nfs/dbraw/zinc/06/69/90/142066990.db2.gz SAFMFKZQVBQGQY-HNNXBMFYSA-N 0 3 337.395 2.513 20 5 EFBDHN CCCN(CCN1CCCC1)C(=O)c1cc(OC)ccc1[N+](=O)[O-] ZINC000344751334 142072307 /nfs/dbraw/zinc/07/23/07/142072307.db2.gz OZHIAFXRBSDYGL-UHFFFAOYSA-N 0 3 335.404 2.551 20 5 EFBDHN C[C@@H]1C[C@@H]1N1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000346152995 142156357 /nfs/dbraw/zinc/15/63/57/142156357.db2.gz FKUFKWURNFBULZ-OZVIIMIRSA-N 0 3 335.379 2.536 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCN([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000346165839 142158708 /nfs/dbraw/zinc/15/87/08/142158708.db2.gz RHIPCYWWIWVWKC-DXCKQFNASA-N 0 3 331.416 2.706 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@H](C)C2)c1 ZINC000346253132 142176903 /nfs/dbraw/zinc/17/69/03/142176903.db2.gz ZTOLBCMLXKUKEX-GRDNDAEWSA-N 0 3 331.416 2.706 20 5 EFBDHN CCc1ccc(C(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000346260401 142178246 /nfs/dbraw/zinc/17/82/46/142178246.db2.gz LHGIEJLCNMAVMT-GRDNDAEWSA-N 0 3 345.443 2.960 20 5 EFBDHN COc1cc(C(=O)NCCN2CCCC(C)(C)C2)cc([N+](=O)[O-])c1C ZINC000347419882 142213383 /nfs/dbraw/zinc/21/33/83/142213383.db2.gz BQTMCRRZTXONID-UHFFFAOYSA-N 0 3 349.431 2.764 20 5 EFBDHN C[C@@H](CN1CCC[C@H](C)C1)NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000347426572 142214412 /nfs/dbraw/zinc/21/44/12/142214412.db2.gz BUOQVRGWQBAWGY-STQMWFEESA-N 0 3 344.415 2.926 20 5 EFBDHN CN(CCn1cc([N+](=O)[O-])cn1)[C@H]1C[C@H](Oc2ccccc2)C1(C)C ZINC000347490097 142225552 /nfs/dbraw/zinc/22/55/52/142225552.db2.gz ZEOXFMNPTJKWDB-IRXDYDNUSA-N 0 3 344.415 2.969 20 5 EFBDHN COc1cc([C@H](C)NCCC(=O)Nc2ccccc2[N+](=O)[O-])ccn1 ZINC000347664033 142253604 /nfs/dbraw/zinc/25/36/04/142253604.db2.gz OQRQNFWIHYYADC-LBPRGKRZSA-N 0 3 344.371 2.678 20 5 EFBDHN CS[C@@H]1CN(c2ccc3ncccc3c2[N+](=O)[O-])C[C@@H]1N(C)C ZINC000347772883 142269439 /nfs/dbraw/zinc/26/94/39/142269439.db2.gz YLOXCQXHKWPUQF-LSDHHAIUSA-N 0 3 332.429 2.625 20 5 EFBDHN CS[C@H]1CN(c2ccc3ncccc3c2[N+](=O)[O-])C[C@H]1N(C)C ZINC000347772869 142269717 /nfs/dbraw/zinc/26/97/17/142269717.db2.gz YLOXCQXHKWPUQF-CABCVRRESA-N 0 3 332.429 2.625 20 5 EFBDHN CCCCN(C)CCNC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000347923660 142293944 /nfs/dbraw/zinc/29/39/44/142293944.db2.gz PMPAYCQEADAMAK-LBPRGKRZSA-N 0 3 325.384 2.686 20 5 EFBDHN C[C@H](NC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)C1=CCN(C)CC1 ZINC000347987134 142304559 /nfs/dbraw/zinc/30/45/59/142304559.db2.gz BAHUSWIZYDIZKE-RYUDHWBXSA-N 0 3 335.379 2.604 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)CCN1C ZINC000341166985 145004859 /nfs/dbraw/zinc/00/48/59/145004859.db2.gz OEDYRMUFYHRYBM-HOCLYGCPSA-N 0 3 348.447 2.699 20 5 EFBDHN COC1CCN(C(C)(C)CNC(=O)c2cccc([N+](=O)[O-])c2C)CC1 ZINC000341287751 145026985 /nfs/dbraw/zinc/02/69/85/145026985.db2.gz MWERMRQTDUVASU-UHFFFAOYSA-N 0 3 349.431 2.522 20 5 EFBDHN CN(C)C(=O)C[C@@H](NCCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000341446694 145053383 /nfs/dbraw/zinc/05/33/83/145053383.db2.gz BPKBBEQJVNWRHC-GOSISDBHSA-N 0 3 341.411 2.947 20 5 EFBDHN COC(=O)[C@]12CN(Cc3ccc([N+](=O)[O-])c(OC)c3)C[C@H]1CCCC2 ZINC000342149777 145071287 /nfs/dbraw/zinc/07/12/87/145071287.db2.gz GRXMWCLMYMVUGB-RDTXWAMCSA-N 0 3 348.399 2.769 20 5 EFBDHN COc1ccc(-c2ccc(CN[C@@H](C)CN(C)C)o2)c([N+](=O)[O-])c1 ZINC000342204295 145080051 /nfs/dbraw/zinc/08/00/51/145080051.db2.gz PAURDXPOSYNBIX-LBPRGKRZSA-N 0 3 333.388 2.903 20 5 EFBDHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000342361678 145108744 /nfs/dbraw/zinc/10/87/44/145108744.db2.gz LRWJQUMSDWSMKB-MLGOLLRUSA-N 0 3 346.431 2.612 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])CN1C1CC1 ZINC000342592930 145155408 /nfs/dbraw/zinc/15/54/08/145155408.db2.gz JMBXWHOKXQPQKH-STQMWFEESA-N 0 3 331.416 2.614 20 5 EFBDHN CCCN(CCN1CCCCC1)C(=O)c1cc([N+](=O)[O-])ccc1OC ZINC000342789557 145193851 /nfs/dbraw/zinc/19/38/51/145193851.db2.gz QPZFANIEVIBMJV-UHFFFAOYSA-N 0 3 349.431 2.942 20 5 EFBDHN CCCN(CCN1CCCCC1)C(=O)c1cc(OC)ccc1[N+](=O)[O-] ZINC000342789478 145193910 /nfs/dbraw/zinc/19/39/10/145193910.db2.gz BVQQDTSXLLDVKE-UHFFFAOYSA-N 0 3 349.431 2.942 20 5 EFBDHN CCCN1CCC[C@H]1CNC(=O)c1cccc(SC)c1[N+](=O)[O-] ZINC000343541562 145233527 /nfs/dbraw/zinc/23/35/27/145233527.db2.gz HFKUTKLHGPQKRQ-LBPRGKRZSA-N 0 3 337.445 2.921 20 5 EFBDHN CCCN1CCC[C@H]1CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000343556190 145237328 /nfs/dbraw/zinc/23/73/28/145237328.db2.gz BMTJAWIGHFBDHL-HNNXBMFYSA-N 0 3 346.431 2.773 20 5 EFBDHN CCCN1CCC[C@@H]1CNC(=O)c1ccc(SC)c([N+](=O)[O-])c1 ZINC000343570808 145240956 /nfs/dbraw/zinc/24/09/56/145240956.db2.gz ACOQAIFPYDOONZ-CYBMUJFWSA-N 0 3 337.445 2.921 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N[C@@H]2CCCN(C)[C@@H]2C)cc1[N+](=O)[O-] ZINC000343971012 145335556 /nfs/dbraw/zinc/33/55/56/145335556.db2.gz KISNGQRWVJRIBH-GZBFAFLISA-N 0 3 334.420 2.746 20 5 EFBDHN O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2NCc2ccc3c(c2)OCO3)n1 ZINC000351516438 146136499 /nfs/dbraw/zinc/13/64/99/146136499.db2.gz JRMJEGWOROYUCC-ZIAGYGMSSA-N 0 3 344.371 2.794 20 5 EFBDHN C[C@H]1CC[C@H](C)N1CC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000351614908 146159187 /nfs/dbraw/zinc/15/91/87/146159187.db2.gz KDNZNXXEAFUCIQ-RYUDHWBXSA-N 0 3 339.823 2.780 20 5 EFBDHN O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CC[C@H](N2CCCCC2)C1 ZINC000351750295 146194648 /nfs/dbraw/zinc/19/46/48/146194648.db2.gz VCLZSIJYYOOVSM-ZDUSSCGKSA-N 0 3 336.367 2.826 20 5 EFBDHN C[C@@H]1CN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@H](C)CN1C ZINC000351944909 146243713 /nfs/dbraw/zinc/24/37/13/146243713.db2.gz NOKQTOHTZNTSCZ-ZIAGYGMSSA-N 0 3 344.415 2.817 20 5 EFBDHN COc1ccc(-c2ccc(CNC[C@H](CO)C3CC3)o2)c([N+](=O)[O-])c1 ZINC000353103320 146396969 /nfs/dbraw/zinc/39/69/69/146396969.db2.gz COAQWZOADGEIGV-CYBMUJFWSA-N 0 3 346.383 2.972 20 5 EFBDHN COC(=O)COc1ccc(CN2CCC[C@@H]2C(C)C)cc1[N+](=O)[O-] ZINC000355593654 147006529 /nfs/dbraw/zinc/00/65/29/147006529.db2.gz CVDNMZNIBLYGEO-CQSZACIVSA-N 0 3 336.388 2.767 20 5 EFBDHN COC(=O)COc1ccc(CN2CC[C@H](C)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000355779264 147061056 /nfs/dbraw/zinc/06/10/56/147061056.db2.gz ZHEQXECWSDHUHY-QWHCGFSZSA-N 0 3 336.388 2.625 20 5 EFBDHN CC[C@H]1CCCCN1CCNC(=O)c1cccc([N+](=O)[O-])c1OC ZINC000356085384 147142765 /nfs/dbraw/zinc/14/27/65/147142765.db2.gz AQKHKZUOLQLXHG-ZDUSSCGKSA-N 0 3 335.404 2.598 20 5 EFBDHN CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](C)N(C)C ZINC000356323075 147212456 /nfs/dbraw/zinc/21/24/56/147212456.db2.gz IUXWEJXBVCYEOP-LLVKDONJSA-N 0 3 325.434 2.777 20 5 EFBDHN C[C@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1F)N1CCCC[C@H]1C ZINC000358327285 147772541 /nfs/dbraw/zinc/77/25/41/147772541.db2.gz FYGDVLFBXQWHMT-CHWSQXEVSA-N 0 3 337.395 2.656 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCCN[C@H](CO)c2cccc(F)c2)cc1 ZINC000359620667 148142555 /nfs/dbraw/zinc/14/25/55/148142555.db2.gz ZFGZQYRZZSSDDC-QGZVFWFLSA-N 0 3 334.347 2.826 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H](CO)C3CCOCC3)o2)cc1 ZINC000359946906 148231232 /nfs/dbraw/zinc/23/12/32/148231232.db2.gz NBWGXGJRELVXLE-KRWDZBQOSA-N 0 3 346.383 2.732 20 5 EFBDHN CC1CCC(N2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC000359993198 148244970 /nfs/dbraw/zinc/24/49/70/148244970.db2.gz QKAHGHUQPUGMOF-UHFFFAOYSA-N 0 3 345.443 2.860 20 5 EFBDHN Cc1cc(NC[C@H]2CN3CCC[C@@H]3CO2)c2cccc([N+](=O)[O-])c2n1 ZINC000364031899 149051464 /nfs/dbraw/zinc/05/14/64/149051464.db2.gz CMIOYAUELJDUMG-KGLIPLIRSA-N 0 3 342.399 2.727 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCCN2CCC(n3cccn3)CC2)cc1 ZINC000365160838 149333424 /nfs/dbraw/zinc/33/34/24/149333424.db2.gz SREPNZBWSAKSLV-UHFFFAOYSA-N 0 3 330.388 2.897 20 5 EFBDHN NC(=O)C[C@H]1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000368131477 150046375 /nfs/dbraw/zinc/04/63/75/150046375.db2.gz AKCJCFLVRAHPMV-GFCCVEGCSA-N 0 3 329.356 2.552 20 5 EFBDHN NC(=O)C[C@@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000368135134 150047672 /nfs/dbraw/zinc/04/76/72/150047672.db2.gz OPSBFKRAGPBAGL-LBPRGKRZSA-N 0 3 329.356 2.552 20 5 EFBDHN CC1(C)CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H]1[C@@H]1CCCO1 ZINC000368694364 150184165 /nfs/dbraw/zinc/18/41/65/150184165.db2.gz YSYWFIPHKCMXEC-RDJZCZTQSA-N 0 3 347.415 2.813 20 5 EFBDHN Cc1c(CN2CC[C@]3(C2)c2ccccc2NC3=O)cccc1[N+](=O)[O-] ZINC000368712559 150188499 /nfs/dbraw/zinc/18/84/99/150188499.db2.gz OSBBUBNMPXSUJB-IBGZPJMESA-N 0 3 337.379 2.999 20 5 EFBDHN CN(C)c1ccc(C2CCN(CCn3ccc([N+](=O)[O-])n3)CC2)cc1 ZINC000369007580 150255663 /nfs/dbraw/zinc/25/56/63/150255663.db2.gz IWOKIJYLCJUGOX-UHFFFAOYSA-N 0 3 343.431 2.737 20 5 EFBDHN O=[N+]([O-])c1c(NC2CCN([C@H]3CCOC3)CC2)ccc2ncccc21 ZINC000372858475 151071752 /nfs/dbraw/zinc/07/17/52/151071752.db2.gz RSVSRNAXAIXLEN-AWEZNQCLSA-N 0 3 342.399 2.808 20 5 EFBDHN COc1cccc(C2(F)CCN(CCn3ccc([N+](=O)[O-])n3)CC2)c1 ZINC000374168690 151295374 /nfs/dbraw/zinc/29/53/74/151295374.db2.gz AICDZJDGIFOMTG-UHFFFAOYSA-N 0 3 348.378 2.761 20 5 EFBDHN COc1cc(C[NH2+]C[C@]2(C)CCO[C@H]2C2CC2)c([N+](=O)[O-])cc1[O-] ZINC000375121555 151476946 /nfs/dbraw/zinc/47/69/46/151476946.db2.gz RWLQCRPPBBTDEH-IRXDYDNUSA-N 0 3 336.388 2.604 20 5 EFBDHN CC[C@H](N[C@@H]1CCN(c2cnn(C)c2)C1)c1cccc([N+](=O)[O-])c1 ZINC000378170435 152025037 /nfs/dbraw/zinc/02/50/37/152025037.db2.gz SCOKGWWOOAAOQC-PBHICJAKSA-N 0 3 329.404 2.648 20 5 EFBDHN Cc1ccc(CN2CCC[C@@H]2CN2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000092506590 544545863 /nfs/dbraw/zinc/54/58/63/544545863.db2.gz FCZKDNSMOWYYEC-SOLBZPMBSA-N 0 3 347.459 2.977 20 5 EFBDHN Cn1cc(CCNCc2csc(-c3cccc([N+](=O)[O-])c3)n2)cn1 ZINC000113325399 544569943 /nfs/dbraw/zinc/56/99/43/544569943.db2.gz JGNDPWANBFRJJF-UHFFFAOYSA-N 0 3 343.412 2.784 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@H]1CCN(C)C[C@@H]1C ZINC000185406957 265043072 /nfs/dbraw/zinc/04/30/72/265043072.db2.gz VQRHKMFNJYJUNG-LESCRADOSA-N 0 3 347.459 2.962 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCN(CCc1ccc(F)cc1)C1CC1 ZINC000270554098 265744762 /nfs/dbraw/zinc/74/47/62/265744762.db2.gz HUYNYPDZAQPTOC-UHFFFAOYSA-N 0 3 345.374 2.603 20 5 EFBDHN CCNC(=O)[C@@H](C)N[C@H](CC)CSc1ccccc1[N+](=O)[O-] ZINC000271025880 265880566 /nfs/dbraw/zinc/88/05/66/265880566.db2.gz BDWHRVVFYUEJTQ-VXGBXAGGSA-N 0 3 325.434 2.580 20 5 EFBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])NCC(=O)NC(C)C ZINC000271168671 265905412 /nfs/dbraw/zinc/90/54/12/265905412.db2.gz TUYKMIDAENIKTQ-LBPRGKRZSA-N 0 3 325.434 2.580 20 5 EFBDHN CC(C)N1C[C@@H](N[C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1=O ZINC000271536608 266002746 /nfs/dbraw/zinc/00/27/46/266002746.db2.gz SRFVMRWAAOXEJT-HOTGVXAUSA-N 0 3 331.416 2.515 20 5 EFBDHN Cc1ccc([C@H](C)N[C@@H]2CCC[C@@H](S(C)(=O)=O)C2)cc1[N+](=O)[O-] ZINC000271559435 266007810 /nfs/dbraw/zinc/00/78/10/266007810.db2.gz XHVPADQUTLYDKS-NWANDNLSSA-N 0 3 340.445 2.910 20 5 EFBDHN CC[C@H](NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)c1cccc(Cl)c1 ZINC000271761457 266055652 /nfs/dbraw/zinc/05/56/52/266055652.db2.gz MLQYWGKYUIZIEE-GJZGRUSLSA-N 0 3 338.795 2.547 20 5 EFBDHN CO[C@@H]1[C@H](C)[C@@H](NCc2cc([N+](=O)[O-])cc3c2OCOC3)C1(C)C ZINC000271979649 266113206 /nfs/dbraw/zinc/11/32/06/266113206.db2.gz JCUVSGVBBZPDPF-UHNFBRDESA-N 0 3 336.388 2.610 20 5 EFBDHN CN1CC[C@H]2CCN(C(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)[C@@H]2C1 ZINC000272305352 266223324 /nfs/dbraw/zinc/22/33/24/266223324.db2.gz QNPJSOCNJABARY-IINYFYTJSA-N 0 3 338.795 2.806 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N2CC[C@@H]3CCN(C)C[C@@H]32)cc1[N+](=O)[O-] ZINC000272416679 266258370 /nfs/dbraw/zinc/25/83/70/266258370.db2.gz AQJUZUUPLVDTPB-ZQIUZPCESA-N 0 3 346.431 2.700 20 5 EFBDHN COC[C@@H](C)CNCc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000272504538 266286345 /nfs/dbraw/zinc/28/63/45/266286345.db2.gz WDEXZKNDIXHCHK-JTQLQIEISA-N 0 3 348.346 2.619 20 5 EFBDHN COc1ccc(NC(=O)N2CC[C@@H](N3CCCCC3)C2)cc1[N+](=O)[O-] ZINC000272817832 266390522 /nfs/dbraw/zinc/39/05/22/266390522.db2.gz KOLCHUPPKFNHDS-CQSZACIVSA-N 0 3 348.403 2.696 20 5 EFBDHN CCN1CCC(N(C)C(=O)/C=C/c2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000105599396 273004447 /nfs/dbraw/zinc/00/44/47/273004447.db2.gz HVQNPSCRXRQWIN-FNORWQNLSA-N 0 3 335.379 2.690 20 5 EFBDHN CCn1ccnc1[C@H]1OCC[C@@H]1NCc1ccc([N+](=O)[O-])cc1C ZINC000275691366 266856920 /nfs/dbraw/zinc/85/69/20/266856920.db2.gz WZTPICBIQLBOBF-HOTGVXAUSA-N 0 3 330.388 2.739 20 5 EFBDHN CN(C)CCN(C(=O)c1cc([N+](=O)[O-])ccc1N)C1CCCCC1 ZINC000276588739 267018157 /nfs/dbraw/zinc/01/81/57/267018157.db2.gz WBXFWKRVHMDZEK-UHFFFAOYSA-N 0 3 334.420 2.514 20 5 EFBDHN COCCN1CCC(Nc2nc3ccccc3cc2[N+](=O)[O-])CC1 ZINC000276626939 267025431 /nfs/dbraw/zinc/02/54/31/267025431.db2.gz NPXMGJPBOCZURJ-UHFFFAOYSA-N 0 3 330.388 2.666 20 5 EFBDHN CS[C@@H]1CN(c2nc3ccccc3cc2[N+](=O)[O-])C[C@H]1N(C)C ZINC000276683671 267035208 /nfs/dbraw/zinc/03/52/08/267035208.db2.gz VGYIYNZFPOJHFC-HUUCEWRRSA-N 0 3 332.429 2.625 20 5 EFBDHN CN(C)CCN1CCC(Nc2nc3ccccc3cc2[N+](=O)[O-])CC1 ZINC000276682056 267035383 /nfs/dbraw/zinc/03/53/83/267035383.db2.gz VFZYBQKAAPDBLE-UHFFFAOYSA-N 0 3 343.431 2.581 20 5 EFBDHN COc1cc(C(=O)N(C)[C@@H](C)C2CCN(C)CC2)cc([N+](=O)[O-])c1C ZINC000276762675 267044100 /nfs/dbraw/zinc/04/41/00/267044100.db2.gz GHBLAPBFQALWOX-ZDUSSCGKSA-N 0 3 349.431 2.714 20 5 EFBDHN CCO[C@H]1C[C@H](NCc2cccc([N+](=O)[O-])c2C)C12CCOCC2 ZINC000276911577 267074858 /nfs/dbraw/zinc/07/48/58/267074858.db2.gz PEKWHGLYKLIPQB-IRXDYDNUSA-N 0 3 334.416 2.967 20 5 EFBDHN CO[C@@H]1CCCC[C@H]1NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000276940789 267081681 /nfs/dbraw/zinc/08/16/81/267081681.db2.gz JVOQZVFDDTZHHE-TZMCWYRMSA-N 0 3 341.795 2.734 20 5 EFBDHN COc1cc(C(=O)N[C@@H]2CCCN(C(C)C)C2)cc([N+](=O)[O-])c1C ZINC000277038273 267104376 /nfs/dbraw/zinc/10/43/76/267104376.db2.gz LZBNDQPJRJMNLB-CQSZACIVSA-N 0 3 335.404 2.514 20 5 EFBDHN O=C(NC[C@@H]1CCCCN1C1CC1)Nc1ccc([N+](=O)[O-])cc1F ZINC000277484074 267186125 /nfs/dbraw/zinc/18/61/25/267186125.db2.gz MOXFZYKPYKPLCE-ZDUSSCGKSA-N 0 3 336.367 2.872 20 5 EFBDHN O=C(NC[C@@H]1CCCCN1C1CC1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000277564317 267199077 /nfs/dbraw/zinc/19/90/77/267199077.db2.gz PTDWKHRPBXMHAJ-ZDUSSCGKSA-N 0 3 337.807 2.995 20 5 EFBDHN O=C1CCc2cc([N+](=O)[O-])c(NC[C@@H]3CCCCN3C3CC3)cc2N1 ZINC000277567343 267200486 /nfs/dbraw/zinc/20/04/86/267200486.db2.gz ZKPFLBHUXRDNBK-AWEZNQCLSA-N 0 3 344.415 2.908 20 5 EFBDHN O=[N+]([O-])c1ccc(Cl)cc1CNC1CCN(c2cccnn2)CC1 ZINC000277590110 267205467 /nfs/dbraw/zinc/20/54/67/267205467.db2.gz HNPLLDDAIZFGIY-UHFFFAOYSA-N 0 3 347.806 2.797 20 5 EFBDHN O=[N+]([O-])c1ccc(CCN2CCC[C@@H]([C@H](O)C(F)(F)F)C2)cc1 ZINC000277856237 267281056 /nfs/dbraw/zinc/28/10/56/267281056.db2.gz TVUSMWFVWVMRDN-OCCSQVGLSA-N 0 3 332.322 2.773 20 5 EFBDHN O=C(CCc1cccc([N+](=O)[O-])c1)NC[C@H]1CCCCN1C1CC1 ZINC000277947798 267305193 /nfs/dbraw/zinc/30/51/93/267305193.db2.gz OSYPMSWUBWZSEG-QGZVFWFLSA-N 0 3 331.416 2.661 20 5 EFBDHN Cc1c(CC(=O)NC[C@H]2CCCCN2C2CC2)cccc1[N+](=O)[O-] ZINC000277972980 267312053 /nfs/dbraw/zinc/31/20/53/267312053.db2.gz QEFAOKUZYCBVOT-MRXNPFEDSA-N 0 3 331.416 2.579 20 5 EFBDHN C[C@@H]1c2ccccc2CCN1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000181858832 273045475 /nfs/dbraw/zinc/04/54/75/273045475.db2.gz XQHDITZMMRJCME-ZBFHGGJFSA-N 0 3 342.395 2.954 20 5 EFBDHN CCN(CCNC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000184583822 273049327 /nfs/dbraw/zinc/04/93/27/273049327.db2.gz VLHHFAZKPVIEAB-UHFFFAOYSA-N 0 3 340.811 2.532 20 5 EFBDHN C[C@@H](C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)[C@@H](N)c1ccccc1 ZINC000237597034 273071790 /nfs/dbraw/zinc/07/17/90/273071790.db2.gz YMIJBUNWKKVDEP-FZKQIMNGSA-N 0 3 339.395 2.816 20 5 EFBDHN COc1cc(CNCC(C)(C)C[NH+]2CCCC2)c([N+](=O)[O-])cc1[O-] ZINC000276741148 273142470 /nfs/dbraw/zinc/14/24/70/273142470.db2.gz XVQMRCIRCDBMKF-UHFFFAOYSA-N 0 3 337.420 2.521 20 5 EFBDHN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCN1C1CC1 ZINC000279295570 273199151 /nfs/dbraw/zinc/19/91/51/273199151.db2.gz ZFUXQXXQDHOSCV-KRWDZBQOSA-N 0 3 331.416 2.661 20 5 EFBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CNCCN2CC=CCC2)c1 ZINC000279764095 273250759 /nfs/dbraw/zinc/25/07/59/273250759.db2.gz JJRRNCNNTOKCDU-UHFFFAOYSA-N 0 3 327.331 2.548 20 5 EFBDHN CC(=O)N1CCC[C@H](CNCc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000279922897 273269749 /nfs/dbraw/zinc/26/97/49/273269749.db2.gz XMNGFEBADVEVMH-GFCCVEGCSA-N 0 3 325.796 2.596 20 5 EFBDHN C[C@@]1(C(N)=O)CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000280128631 273294055 /nfs/dbraw/zinc/29/40/55/273294055.db2.gz CGLZWJMIMFSMLE-QGZVFWFLSA-N 0 3 329.356 2.552 20 5 EFBDHN COc1ccc(OCCN2CCC[C@](C)(OC)CC2)c([N+](=O)[O-])c1 ZINC000280529579 273337524 /nfs/dbraw/zinc/33/75/24/273337524.db2.gz OVTDLTIAHFEPBX-KRWDZBQOSA-N 0 3 338.404 2.873 20 5 EFBDHN CN(CCOc1cccc([N+](=O)[O-])c1)[C@@H](CC(N)=O)c1ccccc1 ZINC000280557775 273340681 /nfs/dbraw/zinc/34/06/81/273340681.db2.gz QXNFTPNPUFEJPX-KRWDZBQOSA-N 0 3 343.383 2.522 20 5 EFBDHN CN(CCOc1ccccc1[N+](=O)[O-])[C@H](CC(N)=O)c1ccccc1 ZINC000280606767 273346164 /nfs/dbraw/zinc/34/61/64/273346164.db2.gz VQEZZRHGEUHFMI-MRXNPFEDSA-N 0 3 343.383 2.522 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC1(CN(C)C)CCC1 ZINC000281168035 273407222 /nfs/dbraw/zinc/40/72/22/273407222.db2.gz XMELMOYWMOVANW-LBPRGKRZSA-N 0 3 337.445 2.676 20 5 EFBDHN CC(C)(C)N1C[C@H](N[C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1=O ZINC000193012684 273498921 /nfs/dbraw/zinc/49/89/21/273498921.db2.gz PPKPTWKIXUBFIW-CJNGLKHVSA-N 0 3 331.416 2.961 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC1CCN(C2CC2)CC1 ZINC000282049275 273507016 /nfs/dbraw/zinc/50/70/16/273507016.db2.gz VEYYSZMTJUCLDU-UHFFFAOYSA-N 0 3 348.403 2.742 20 5 EFBDHN CCO[C@@H]1CCCC[C@H]1N[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000452032361 273703330 /nfs/dbraw/zinc/70/33/30/273703330.db2.gz CWLRTTVVDBFXRB-BRWVUGGUSA-N 0 3 347.415 2.637 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@@H](CCO)C2CCCCC2)c([N+](=O)[O-])c1 ZINC000284067657 273792767 /nfs/dbraw/zinc/79/27/67/273792767.db2.gz KMHDTGXXRZHOCZ-HNNXBMFYSA-N 0 3 337.376 2.924 20 5 EFBDHN CCO[C@@H]1C[C@H](N[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)[C@@]12CCCO2 ZINC000284897746 273904022 /nfs/dbraw/zinc/90/40/22/273904022.db2.gz CDAGXGOVMNMILS-UQCMEYCASA-N 0 3 335.404 2.554 20 5 EFBDHN C[C@@H](NC[C@H](O)CCc1ccccc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000285270459 273971304 /nfs/dbraw/zinc/97/13/04/273971304.db2.gz QTBIUMNAYDGHIU-CZUORRHYSA-N 0 3 329.400 2.821 20 5 EFBDHN C[C@@H](N[C@H](CO)Cc1ccc(F)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000285358830 273985237 /nfs/dbraw/zinc/98/52/37/273985237.db2.gz VONVSMSEMMGKIW-ABAIWWIYSA-N 0 3 333.363 2.570 20 5 EFBDHN CO[C@H]1C[C@@H](N(C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000285474135 274006682 /nfs/dbraw/zinc/00/66/82/274006682.db2.gz VHDSCSSSELCHMA-GASCZTMLSA-N 0 3 331.372 2.902 20 5 EFBDHN CCC[C@@]1(NCC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CCOC1 ZINC000285605696 274036187 /nfs/dbraw/zinc/03/61/87/274036187.db2.gz PVKICWALOJJLHM-OAHLLOKOSA-N 0 3 341.795 2.736 20 5 EFBDHN O=[N+]([O-])c1ccc(CCN2CCC[C@@](O)(C(F)(F)F)CC2)cc1 ZINC000285709501 274058192 /nfs/dbraw/zinc/05/81/92/274058192.db2.gz WHSPKMMUVBWDOA-AWEZNQCLSA-N 0 3 332.322 2.917 20 5 EFBDHN CO[C@@H](CN1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccccc1 ZINC000374781267 274058878 /nfs/dbraw/zinc/05/88/78/274058878.db2.gz UVSVKSFUMWEKOT-INIZCTEOSA-N 0 3 330.388 2.816 20 5 EFBDHN CCc1ccc(C(=O)N2C[C@H](N3CCCC3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000285895888 274096169 /nfs/dbraw/zinc/09/61/69/274096169.db2.gz RPIQLBUXHUVVOQ-XJKSGUPXSA-N 0 3 331.416 2.856 20 5 EFBDHN CCS[C@H]1CCC[C@@H]1NCC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000286190530 274150950 /nfs/dbraw/zinc/15/09/50/274150950.db2.gz PQCVAUCXEJOZAC-GJZGRUSLSA-N 0 3 337.445 2.821 20 5 EFBDHN CCS[C@@H]1CCC[C@H]1NCC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000286190534 274151002 /nfs/dbraw/zinc/15/10/02/274151002.db2.gz PQCVAUCXEJOZAC-HUUCEWRRSA-N 0 3 337.445 2.821 20 5 EFBDHN CCOc1cc(CN2CCCC[C@H]2CCC(=O)NC)ccc1[N+](=O)[O-] ZINC000286531999 274219828 /nfs/dbraw/zinc/21/98/28/274219828.db2.gz RGMDQXRKUYDEKI-HNNXBMFYSA-N 0 3 349.431 2.874 20 5 EFBDHN C[C@H]1[C@@H](N2CCCC2)CCN1C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000287000916 274319498 /nfs/dbraw/zinc/31/94/98/274319498.db2.gz HJGFTYULMNGEPV-FZMZJTMJSA-N 0 3 337.807 2.947 20 5 EFBDHN O=[N+]([O-])c1cccc(F)c1NCc1ccccc1CN1CC[C@@H](O)C1 ZINC000287094196 274340730 /nfs/dbraw/zinc/34/07/30/274340730.db2.gz YYEKEJQPEIONBQ-OAHLLOKOSA-N 0 3 345.374 2.913 20 5 EFBDHN C[C@@H]1[C@H](N2CCCC2)CCN1C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000287173758 274360205 /nfs/dbraw/zinc/36/02/05/274360205.db2.gz OHWYGGBJJJOBEI-IAQYHMDHSA-N 0 3 337.807 2.947 20 5 EFBDHN C[C@@H]1[C@@H](N2CCCC2)CCN1C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000287173756 274360221 /nfs/dbraw/zinc/36/02/21/274360221.db2.gz OHWYGGBJJJOBEI-ABAIWWIYSA-N 0 3 337.807 2.947 20 5 EFBDHN C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000288218991 274550519 /nfs/dbraw/zinc/55/05/19/274550519.db2.gz DPNXOGWEDFTWIW-WMLDXEAASA-N 0 3 345.443 2.958 20 5 EFBDHN C[C@H]1C[C@H](N2CCCC2)CN1C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000288389055 274582966 /nfs/dbraw/zinc/58/29/66/274582966.db2.gz MDJVOWQJZOFACH-AAEUAGOBSA-N 0 3 337.807 2.947 20 5 EFBDHN O=[N+]([O-])c1cccnc1N1C[C@@H]2CCN(Cc3ccccc3)C[C@H]2C1 ZINC000368592791 275040315 /nfs/dbraw/zinc/04/03/15/275040315.db2.gz MKPYGIUUPANEER-IRXDYDNUSA-N 0 3 338.411 2.948 20 5 EFBDHN CC(C)c1ccc(CN[C@@H]2CC(=O)N3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000337845141 275740932 /nfs/dbraw/zinc/74/09/32/275740932.db2.gz HLUUYQBKRZSFTE-CVEARBPZSA-N 0 3 331.416 2.961 20 5 EFBDHN CC1(C)C[C@H](NC[C@@H]2CN(C3CC3)CCO2)c2cc([N+](=O)[O-])ccc21 ZINC000433228541 275868178 /nfs/dbraw/zinc/86/81/78/275868178.db2.gz BBIIYXMHAZECQQ-QAPCUYQASA-N 0 3 345.443 2.770 20 5 EFBDHN CCO[C@@H]1CCCC[C@H]1N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000452034947 276337207 /nfs/dbraw/zinc/33/72/07/276337207.db2.gz MPEBXGFFJXXIRK-APHBMKBZSA-N 0 3 335.404 2.859 20 5 EFBDHN CN(C)[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000077303540 276863741 /nfs/dbraw/zinc/86/37/41/276863741.db2.gz LHFCTXGOCBNYRD-MRXNPFEDSA-N 0 3 331.347 2.767 20 5 EFBDHN CC(C)CN(CCN(C)C)C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000355322059 277379978 /nfs/dbraw/zinc/37/99/78/277379978.db2.gz UYRSABHZQPEBOV-UHFFFAOYSA-N 0 3 332.404 2.736 20 5 EFBDHN CC(C)C[C@@H](CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-])N(C)C ZINC000074136696 277440659 /nfs/dbraw/zinc/44/06/59/277440659.db2.gz WBASWEBMMMRJIS-LBPRGKRZSA-N 0 3 327.812 2.954 20 5 EFBDHN COc1cccc([C@@H]2C[C@@H](C)CN2CCn2cc([N+](=O)[O-])cn2)c1 ZINC000378641701 278020473 /nfs/dbraw/zinc/02/04/73/278020473.db2.gz DBXHPCBPHIXYPY-DYVFJYSZSA-N 0 3 330.388 2.883 20 5 EFBDHN CC(C)(C(=O)N1CC[C@H](N2CCCCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000265748087 278267418 /nfs/dbraw/zinc/26/74/18/278267418.db2.gz DHTDAJWSYGTGGW-KRWDZBQOSA-N 0 3 345.443 2.959 20 5 EFBDHN CC[C@@H]1CCCCN1CCNC(=O)c1cccc(OC)c1[N+](=O)[O-] ZINC000192571375 280254295 /nfs/dbraw/zinc/25/42/95/280254295.db2.gz NGXBZPCWKJFOCW-CYBMUJFWSA-N 0 3 335.404 2.598 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CC[C@@H](N2CCCC2)C1 ZINC000094094373 280397929 /nfs/dbraw/zinc/39/79/29/280397929.db2.gz BTSHCBCHWPDQCP-OAHLLOKOSA-N 0 3 331.416 2.830 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(N2CCN(C3CCN(C)CC3)[C@H](C)C2)c1 ZINC000354711469 281012191 /nfs/dbraw/zinc/01/21/91/281012191.db2.gz HOWQFSGBERVJCK-OAHLLOKOSA-N 0 3 332.448 2.508 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[C@H](CN2CCOCC2)C1 ZINC000182809960 281020227 /nfs/dbraw/zinc/02/02/27/281020227.db2.gz GWEQRNSGQZEIMN-HZPDHXFCSA-N 0 3 333.432 2.618 20 5 EFBDHN Cc1ccnc(N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)c1[N+](=O)[O-] ZINC000265245247 281452888 /nfs/dbraw/zinc/45/28/88/281452888.db2.gz PRUUEAQSMSHYPX-GJZGRUSLSA-N 0 3 348.447 2.624 20 5 EFBDHN C[C@H](CNC(=O)CCOc1ccccc1[N+](=O)[O-])N1CCC(C)CC1 ZINC000067269849 292694171 /nfs/dbraw/zinc/69/41/71/292694171.db2.gz KUCOPIUMERCTLS-OAHLLOKOSA-N 0 3 349.431 2.600 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCN1CC ZINC000128101041 293091509 /nfs/dbraw/zinc/09/15/09/293091509.db2.gz MACMYXUVNPDUGR-CYBMUJFWSA-N 0 3 337.445 2.921 20 5 EFBDHN O=C(CCN(Cc1ccc([N+](=O)[O-])cc1)C1CC1)N1CCCCC1 ZINC000130971904 293183496 /nfs/dbraw/zinc/18/34/96/293183496.db2.gz LVOFZHKQYDTMDS-UHFFFAOYSA-N 0 3 331.416 2.962 20 5 EFBDHN CC(C)(CNC(=O)NCCc1cccc([N+](=O)[O-])c1)N1CCCCC1 ZINC000159072049 293594708 /nfs/dbraw/zinc/59/47/08/293594708.db2.gz XQDGTHURQDFCHH-UHFFFAOYSA-N 0 3 348.447 2.701 20 5 EFBDHN CCCCN(C)C[C@@H](C)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000290735530 294170393 /nfs/dbraw/zinc/17/03/93/294170393.db2.gz BIZWESPBGVBFDO-GFCCVEGCSA-N 0 3 343.449 2.531 20 5 EFBDHN CN(C[C@@H](O)COc1c(Cl)cc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000290866091 294206692 /nfs/dbraw/zinc/20/66/92/294206692.db2.gz ZFTPBTLLORULEC-SNVBAGLBSA-N 0 3 335.187 2.736 20 5 EFBDHN C[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2N2CCOC2=O)CN1C1CC1 ZINC000290871177 294208012 /nfs/dbraw/zinc/20/80/12/294208012.db2.gz ZQTRZHYGDSYEQJ-NWDGAFQWSA-N 0 3 346.387 2.589 20 5 EFBDHN CCN(Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C[C@H](C)OC ZINC000291129111 294284430 /nfs/dbraw/zinc/28/44/30/294284430.db2.gz WCODRFWCPVPRIH-ZDUSSCGKSA-N 0 3 332.404 2.852 20 5 EFBDHN CC(C)(NC(=O)NC1CCN(C2CC2)CC1)c1ccccc1[N+](=O)[O-] ZINC000291548531 294410684 /nfs/dbraw/zinc/41/06/84/294410684.db2.gz AUFANTKJLKYDIP-UHFFFAOYSA-N 0 3 346.431 2.756 20 5 EFBDHN C[C@H]1CN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CCN(C2CCC2)C1 ZINC000293695930 295029766 /nfs/dbraw/zinc/02/97/66/295029766.db2.gz MUGJVSLOCWYOPV-BOLDSZDNSA-N 0 3 343.427 2.941 20 5 EFBDHN CC(C)c1ccc(C(=O)Nc2ccnn2CCN(C)C)cc1[N+](=O)[O-] ZINC000294044466 295102792 /nfs/dbraw/zinc/10/27/92/295102792.db2.gz KZWCQRRBSNUDRQ-UHFFFAOYSA-N 0 3 345.403 2.729 20 5 EFBDHN O=C(CCC(=O)c1cccc([N+](=O)[O-])c1)NCCN1CCCCCC1 ZINC000294259426 295136683 /nfs/dbraw/zinc/13/66/83/295136683.db2.gz GJHNUWBAMFIKRB-UHFFFAOYSA-N 0 3 347.415 2.550 20 5 EFBDHN CC(C)(CCC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1)[N+](=O)[O-] ZINC000294329728 295148615 /nfs/dbraw/zinc/14/86/15/295148615.db2.gz DUCYGBMMTFUIDE-MRXNPFEDSA-N 0 3 333.432 2.603 20 5 EFBDHN CN(C)C1(CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CCCC1 ZINC000294620242 295195452 /nfs/dbraw/zinc/19/54/52/295195452.db2.gz WIOQSBNHPZQKIL-UHFFFAOYSA-N 0 3 347.415 2.548 20 5 EFBDHN CN(C)CCN(Cc1ccccc1F)C(=O)CCC(C)(C)[N+](=O)[O-] ZINC000294694155 295209521 /nfs/dbraw/zinc/20/95/21/295209521.db2.gz YPLUENDHUZYQAW-UHFFFAOYSA-N 0 3 339.411 2.551 20 5 EFBDHN COc1cc(CNC[C@H](Cc2ccccc2)OC)c([N+](=O)[O-])cc1O ZINC000294759467 295222363 /nfs/dbraw/zinc/22/23/63/295222363.db2.gz IZAZUTMQCXHDQG-HNNXBMFYSA-N 0 3 346.383 2.656 20 5 EFBDHN CC[C@@H](C)[C@H](CNCc1cc(OC)c(OC)cc1[N+](=O)[O-])OC ZINC000294764280 295223145 /nfs/dbraw/zinc/22/31/45/295223145.db2.gz JJFPQOALHFPEPB-BZNIZROVSA-N 0 3 326.393 2.763 20 5 EFBDHN COc1ccc([C@@H]2CCCN2CCn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC000159728315 295223781 /nfs/dbraw/zinc/22/37/81/295223781.db2.gz ZDRFRSDFNZOFPF-KRWDZBQOSA-N 0 3 343.383 2.602 20 5 EFBDHN COc1ccc2c(c1)ncc([N+](=O)[O-])c2N1CC[C@H]2CCN(C)C[C@@H]21 ZINC000294827068 295233562 /nfs/dbraw/zinc/23/35/62/295233562.db2.gz AHHYOADWMVNVLC-PXAZEXFGSA-N 0 3 342.399 2.682 20 5 EFBDHN CN1CCC(N(Cc2ccco2)C(=O)CCC(C)(C)[N+](=O)[O-])CC1 ZINC000294897014 295242535 /nfs/dbraw/zinc/24/25/35/295242535.db2.gz GSJSGIPULAHQJV-UHFFFAOYSA-N 0 3 337.420 2.538 20 5 EFBDHN Cc1cc(Cl)c(C(=O)N[C@@H]2C[C@H](C)N(C3CC3)C2)cc1[N+](=O)[O-] ZINC000295055956 295262547 /nfs/dbraw/zinc/26/25/47/295262547.db2.gz GXEVNNVSRFVAHK-WDEREUQCSA-N 0 3 337.807 2.912 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCC(CF)CC1 ZINC000295122991 295270713 /nfs/dbraw/zinc/27/07/13/295270713.db2.gz JZKYYBNVKAEJJZ-UHFFFAOYSA-N 0 3 339.367 2.614 20 5 EFBDHN C[C@@H]1C[C@@H](NC(=O)CCC(C)(C)[N+](=O)[O-])CN1Cc1ccccc1 ZINC000295121766 295270769 /nfs/dbraw/zinc/27/07/69/295270769.db2.gz MKZFNYVNOQSRTG-GDBMZVCRSA-N 0 3 333.432 2.601 20 5 EFBDHN CCC[C@@H](CNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)OC ZINC000295173290 295278102 /nfs/dbraw/zinc/27/81/02/295278102.db2.gz UQQYKMHXEGUURL-INIZCTEOSA-N 0 3 332.404 2.900 20 5 EFBDHN CCCN(CC)C[C@@H](C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000295260757 295289034 /nfs/dbraw/zinc/28/90/34/295289034.db2.gz ADZLPYHHRUIYOV-CQSZACIVSA-N 0 3 349.431 2.794 20 5 EFBDHN Cc1nc(N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)ncc1[N+](=O)[O-] ZINC000295714640 295364705 /nfs/dbraw/zinc/36/47/05/295364705.db2.gz SJVAWVCMFTZLRR-HIFRSBDPSA-N 0 3 327.388 2.768 20 5 EFBDHN CC(C)(C[C@@H]1CCCN(CCOc2ccc([N+](=O)[O-])cc2)C1)C(N)=O ZINC000295772492 295373875 /nfs/dbraw/zinc/37/38/75/295373875.db2.gz YQKUYSLSTDPHML-AWEZNQCLSA-N 0 3 349.431 2.587 20 5 EFBDHN CC[C@H](C)N1CCN(CCC(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000296007510 295410847 /nfs/dbraw/zinc/41/08/47/295410847.db2.gz LBPCANGTDHAKKW-AWEZNQCLSA-N 0 3 348.447 2.648 20 5 EFBDHN CC[C@H](C)N1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000296007567 295410895 /nfs/dbraw/zinc/41/08/95/295410895.db2.gz LBSPKKNEIBPBOL-HNNXBMFYSA-N 0 3 348.447 2.648 20 5 EFBDHN CCO[C@H]1C[C@@H](NCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C12CCC2 ZINC000296052102 295417498 /nfs/dbraw/zinc/41/74/98/295417498.db2.gz FTSVUXPECKHHED-CVEARBPZSA-N 0 3 347.415 2.779 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@@H]2[C@@H]3CCO[C@H]3C23CCCC3)c([N+](=O)[O-])c1 ZINC000296146238 295431437 /nfs/dbraw/zinc/43/14/37/295431437.db2.gz XOWHAAAFCQAQQN-NUEKZKHPSA-N 0 3 347.371 2.940 20 5 EFBDHN Cc1cccc([C@@H]2CCCN2CCn2cc([N+](=O)[O-])ccc2=O)c1 ZINC000159769361 302026323 /nfs/dbraw/zinc/02/63/23/302026323.db2.gz LCSILJADMRUBAX-KRWDZBQOSA-N 0 3 327.384 2.902 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000345528876 302039220 /nfs/dbraw/zinc/03/92/20/302039220.db2.gz KNLDVPPCOSIRNZ-INIZCTEOSA-N 0 3 341.411 2.806 20 5 EFBDHN CC1CCN(CCNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CC1 ZINC000134605508 310644137 /nfs/dbraw/zinc/64/41/37/310644137.db2.gz SYCLAHOEILMFFI-UHFFFAOYSA-N 0 3 325.796 2.710 20 5 EFBDHN CCC1(NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CCCC1 ZINC000296459673 310822310 /nfs/dbraw/zinc/82/23/10/310822310.db2.gz XASAMTPAYWIGEF-UHFFFAOYSA-N 0 3 326.418 2.681 20 5 EFBDHN C[C@@H]1CN(C[C@H]2CCCN2Cc2ccccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000299189282 311060513 /nfs/dbraw/zinc/06/05/13/311060513.db2.gz FJUMTTWTHWXPTR-HLLBOEOZSA-N 0 3 333.432 2.668 20 5 EFBDHN C[C@@H]1CN(C[C@H]2CCCN2Cc2cccc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000299258321 311066265 /nfs/dbraw/zinc/06/62/65/311066265.db2.gz GKKAZPXVMQDRIG-RVKKMQEKSA-N 0 3 333.432 2.668 20 5 EFBDHN C[C@H](CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)N1CCC[C@H](C)C1 ZINC000299293927 311069880 /nfs/dbraw/zinc/06/98/80/311069880.db2.gz QRTCPZYGDUGHDH-QWHCGFSZSA-N 0 3 344.415 2.926 20 5 EFBDHN Cc1ccc([C@H](CNC(=O)c2csc([N+](=O)[O-])c2)N(C)C)cc1 ZINC000299343887 311074567 /nfs/dbraw/zinc/07/45/67/311074567.db2.gz LCPOBKKMAAKCOT-AWEZNQCLSA-N 0 3 333.413 2.997 20 5 EFBDHN Cc1ccc([C@@H](CNC(=O)c2csc([N+](=O)[O-])c2)N(C)C)cc1 ZINC000299343895 311074641 /nfs/dbraw/zinc/07/46/41/311074641.db2.gz LCPOBKKMAAKCOT-CQSZACIVSA-N 0 3 333.413 2.997 20 5 EFBDHN CCN1CCN(CCCNc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000301098282 311118635 /nfs/dbraw/zinc/11/86/35/311118635.db2.gz SBKVENOYFTYMPQ-UHFFFAOYSA-N 0 3 326.828 2.688 20 5 EFBDHN CCN1CCN([C@H](C)CNc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000301113216 311119640 /nfs/dbraw/zinc/11/96/40/311119640.db2.gz PRSVJJAJDJLOQG-GFCCVEGCSA-N 0 3 326.828 2.686 20 5 EFBDHN CCc1nn(C)c(N[C@@H]2CCCN(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000301349901 311133031 /nfs/dbraw/zinc/13/30/31/311133031.db2.gz JKHLKGTXEILFKB-OAHLLOKOSA-N 0 3 343.431 2.967 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1NC[C@H]1C[C@@H](O)CN1Cc1ccccc1 ZINC000301892063 311165067 /nfs/dbraw/zinc/16/50/67/311165067.db2.gz VMKFXABGYINILE-IAGOWNOFSA-N 0 3 341.411 2.951 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1NC[C@@H]1C[C@H](O)CN1Cc1ccccc1 ZINC000301892064 311165292 /nfs/dbraw/zinc/16/52/92/311165292.db2.gz VMKFXABGYINILE-IRXDYDNUSA-N 0 3 341.411 2.951 20 5 EFBDHN CC(C)(O)CN1CCc2c(cccc2Nc2ncccc2[N+](=O)[O-])C1 ZINC000302186390 311183150 /nfs/dbraw/zinc/18/31/50/311183150.db2.gz UILAPYWPDUUGSB-UHFFFAOYSA-N 0 3 342.399 2.862 20 5 EFBDHN Cc1cc(N2CCN(CC3CC3)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302187812 311183517 /nfs/dbraw/zinc/18/35/17/311183517.db2.gz QDFWRRMRLYZGBS-UHFFFAOYSA-N 0 3 326.400 2.983 20 5 EFBDHN Cc1cc(NC[C@@H](C)CN2CCOCC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302212657 311184909 /nfs/dbraw/zinc/18/49/09/311184909.db2.gz YXXVFAZOLNNYIU-CYBMUJFWSA-N 0 3 344.415 2.832 20 5 EFBDHN Cc1cc(N[C@H](C)CCN2CCN(C)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000302228496 311186268 /nfs/dbraw/zinc/18/62/68/311186268.db2.gz ASZYDDTUFRKNOC-CYBMUJFWSA-N 0 3 340.855 2.995 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CN1CCNC[C@@H]1c1ccccc1 ZINC000313369059 311232326 /nfs/dbraw/zinc/23/23/26/311232326.db2.gz RFKNZDNJQIWTKW-QGZVFWFLSA-N 0 3 327.384 2.750 20 5 EFBDHN O=[N+]([O-])c1cccc(CNC[C@H](O)COc2ccc(Cl)cc2)c1 ZINC000320218278 311237541 /nfs/dbraw/zinc/23/75/41/311237541.db2.gz YVGMPLOLJRITSN-HNNXBMFYSA-N 0 3 336.775 2.778 20 5 EFBDHN CCN1C[C@H](C)N(CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C[C@@H]1C ZINC000330559381 311321936 /nfs/dbraw/zinc/32/19/36/311321936.db2.gz IGCDXVODJZSDHL-GJZGRUSLSA-N 0 3 348.447 2.646 20 5 EFBDHN CCN1C[C@H](C)N(CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C[C@H]1C ZINC000330578816 311322712 /nfs/dbraw/zinc/32/27/12/311322712.db2.gz PIRULCIGHMDPFV-CABCVRRESA-N 0 3 348.447 2.646 20 5 EFBDHN CCN1CCC(N(C)C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000330823158 311336851 /nfs/dbraw/zinc/33/68/51/311336851.db2.gz NYPVDEVEKQIROJ-UHFFFAOYSA-N 0 3 339.823 2.733 20 5 EFBDHN CCN1C[C@@H](C)N(CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)[C@@H](C)C1 ZINC000330855653 311338716 /nfs/dbraw/zinc/33/87/16/311338716.db2.gz SCGFAXJCGVKGRC-GASCZTMLSA-N 0 3 348.447 2.646 20 5 EFBDHN CCN1C[C@@H](C)N(CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)[C@H](C)C1 ZINC000330855655 311338782 /nfs/dbraw/zinc/33/87/82/311338782.db2.gz SCGFAXJCGVKGRC-HUUCEWRRSA-N 0 3 348.447 2.646 20 5 EFBDHN COc1c(C(=O)N(CC(C)C)C2CCN(C)CC2)cccc1[N+](=O)[O-] ZINC000330921301 311343840 /nfs/dbraw/zinc/34/38/40/311343840.db2.gz QMJSRRGKNFWHIN-UHFFFAOYSA-N 0 3 349.431 2.796 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN[C@@H]1CC(C)(C)OC1(C)C ZINC000331292617 311365545 /nfs/dbraw/zinc/36/55/45/311365545.db2.gz LKUXNWKQVZLSKW-CYBMUJFWSA-N 0 3 335.404 2.777 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[C@@H](N2CCCC2)[C@@H]1C ZINC000332081278 311452089 /nfs/dbraw/zinc/45/20/89/311452089.db2.gz LPTHBNFYLYQKHD-GOEBONIOSA-N 0 3 331.416 2.910 20 5 EFBDHN C[C@@H](C(=O)N1CC[C@@H](N2CCCCC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000332655254 311531876 /nfs/dbraw/zinc/53/18/76/311531876.db2.gz JEUMJOGNKRKHPZ-UKRRQHHQSA-N 0 3 349.406 2.924 20 5 EFBDHN O=C(NCCc1ccc([N+](=O)[O-])cc1)Nc1ccc2c(c1)CNCC2 ZINC000415886719 312179766 /nfs/dbraw/zinc/17/97/66/312179766.db2.gz VYEQVDSVZSWJLR-UHFFFAOYSA-N 0 3 340.383 2.605 20 5 EFBDHN C[C@H]1COCCN1CCN[C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417317974 312208514 /nfs/dbraw/zinc/20/85/14/312208514.db2.gz XTCWELBZRWJJNH-KBXCAEBGSA-N 0 3 333.432 2.673 20 5 EFBDHN O=C(NCCN[C@H]1CCCCc2ccc([N+](=O)[O-])cc21)c1ccco1 ZINC000417331378 312209956 /nfs/dbraw/zinc/20/99/56/312209956.db2.gz WBNKDWPVIXBGOT-INIZCTEOSA-N 0 3 343.383 2.975 20 5 EFBDHN CS(=O)(=O)C1(CN[C@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000417334646 312210523 /nfs/dbraw/zinc/21/05/23/312210523.db2.gz RKPOFUNBKMNKLB-HNNXBMFYSA-N 0 3 338.429 2.529 20 5 EFBDHN C[C@@H](CN1CCCC1=O)N[C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417345391 312212264 /nfs/dbraw/zinc/21/22/64/312212264.db2.gz UHQSDYDLTLYDDQ-SUMWQHHRSA-N 0 3 331.416 2.963 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](N[C@@H]1CCN(CC(F)F)C1)CCC2 ZINC000417394623 312217739 /nfs/dbraw/zinc/21/77/39/312217739.db2.gz VNYWWLKTYLQYJD-IUODEOHRSA-N 0 3 325.359 2.901 20 5 EFBDHN CCOc1ccc([C@@H](C)N[C@@H]2CCN(CC(F)F)C2)cc1[N+](=O)[O-] ZINC000417397254 312218308 /nfs/dbraw/zinc/21/83/08/312218308.db2.gz XXJCPNNEKQNSDN-DGCLKSJQSA-N 0 3 343.374 2.984 20 5 EFBDHN C[C@H](CNc1c(C(N)=O)cccc1[N+](=O)[O-])N(C)Cc1ccccc1 ZINC000420606142 312375361 /nfs/dbraw/zinc/37/53/61/312375361.db2.gz WRBAXLOJMGQVLO-CYBMUJFWSA-N 0 3 342.399 2.626 20 5 EFBDHN CCc1ccccc1[C@@H](N)CNC(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000423955332 312488883 /nfs/dbraw/zinc/48/88/83/312488883.db2.gz CDKZFWJRBLNUPX-ZDUSSCGKSA-N 0 3 333.413 2.957 20 5 EFBDHN Cc1c(C(=O)N2C[C@@H](c3cccc(F)c3)[C@H](N)C2)cccc1[N+](=O)[O-] ZINC000424013136 312496216 /nfs/dbraw/zinc/49/62/16/312496216.db2.gz QVVDEZOWYGNVFD-JKSUJKDBSA-N 0 3 343.358 2.609 20 5 EFBDHN CN(C)[C@@H](CNc1cccc(C(N)=O)c1[N+](=O)[O-])c1ccc(F)cc1 ZINC000439104955 312633671 /nfs/dbraw/zinc/63/36/71/312633671.db2.gz GMPCPACPAHUJJK-HNNXBMFYSA-N 0 3 346.362 2.548 20 5 EFBDHN O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2NCc2cn3ccccc3n2)n1 ZINC000447505803 312677895 /nfs/dbraw/zinc/67/78/95/312677895.db2.gz ASTWWXZHNQOIPZ-LSDHHAIUSA-N 0 3 340.387 2.713 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])NCc1c2c(nn1C)CCCC2 ZINC000449337922 312684385 /nfs/dbraw/zinc/68/43/85/312684385.db2.gz TWTCGTVWXHOWJY-CYBMUJFWSA-N 0 3 328.416 2.928 20 5 EFBDHN CN(C)CCN(Cc1ccsc1)C(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000458197028 313082776 /nfs/dbraw/zinc/08/27/76/313082776.db2.gz FQVJDTMLGOXFDT-UHFFFAOYSA-N 0 3 347.440 2.789 20 5 EFBDHN Cc1cc(NC(=O)c2ccc([N+](=O)[O-])o2)ccc1OCCN(C)C ZINC000458196818 313083400 /nfs/dbraw/zinc/08/34/00/313083400.db2.gz IXVFGCSUSMGNCL-UHFFFAOYSA-N 0 3 333.344 2.689 20 5 EFBDHN C[C@@H](CCCc1cccnc1)NCc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000459636406 313111437 /nfs/dbraw/zinc/11/14/37/313111437.db2.gz HJSOJBOAQRRURI-ZDUSSCGKSA-N 0 3 342.399 2.590 20 5 EFBDHN COc1ccc(-c2ccc(CN3C[C@H](O)C[C@H]3C)o2)c([N+](=O)[O-])c1 ZINC000471809596 313162587 /nfs/dbraw/zinc/16/25/87/313162587.db2.gz IOCKMKCPEYJDQB-VXGBXAGGSA-N 0 3 332.356 2.819 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CNCc1ccc(C)n(C)c1=O ZINC000487183788 313373960 /nfs/dbraw/zinc/37/39/60/313373960.db2.gz XAPKSZCTUHJQBM-UKTHLTGXSA-N 0 3 327.384 2.795 20 5 EFBDHN CCN1CCC(N(C)C(=O)/C=C\c2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000491531677 313760930 /nfs/dbraw/zinc/76/09/30/313760930.db2.gz HVQNPSCRXRQWIN-ALCCZGGFSA-N 0 3 335.379 2.690 20 5 EFBDHN O=C(/C=C\c1cccc([N+](=O)[O-])c1)N1CC[C@@H](N2CCCCC2)C1 ZINC000491564992 313765921 /nfs/dbraw/zinc/76/59/21/313765921.db2.gz ZWAMFCKSSSLEGN-ZPUOCTKUSA-N 0 3 329.400 2.695 20 5 EFBDHN CN(C)C1(CN(C)C(=O)/C=C\c2ccc(F)cc2[N+](=O)[O-])CCC1 ZINC000491956581 313822676 /nfs/dbraw/zinc/82/26/76/313822676.db2.gz BFBFXWRZIJKQSM-VURMDHGXSA-N 0 3 335.379 2.690 20 5 EFBDHN CC1=CCN(CCNC(=O)/C=C/c2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000492626123 314063394 /nfs/dbraw/zinc/06/33/94/314063394.db2.gz RLRRGRIFPASJRR-HWKANZROSA-N 0 3 333.363 2.515 20 5 EFBDHN O=C(/C=C\c1ccccc1[N+](=O)[O-])NC[C@H]1CCCCN1C1CC1 ZINC000492987243 314202120 /nfs/dbraw/zinc/20/21/20/314202120.db2.gz RSFFZBOTEFPFDN-JXMNSVBMSA-N 0 3 329.400 2.741 20 5 EFBDHN CN1CCC[C@@]2(CCN(C(=O)/C=C\c3ccccc3[N+](=O)[O-])C2)C1 ZINC000493026529 314215830 /nfs/dbraw/zinc/21/58/30/314215830.db2.gz QTQCZRMTUQDEAS-JTHGQSKGSA-N 0 3 329.400 2.552 20 5 EFBDHN C[C@@H]1CN(C(=O)/C=C/c2cccc([N+](=O)[O-])c2)CCN(C2CC2)C1 ZINC000493169733 314264654 /nfs/dbraw/zinc/26/46/54/314264654.db2.gz HBVTXHXPIXJMNJ-GPAKFWEMSA-N 0 3 329.400 2.551 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@@H](CN2CCOC2=O)C1 ZINC000496362968 315040141 /nfs/dbraw/zinc/04/01/41/315040141.db2.gz NXLALTBIAFSEEJ-UONOGXRCSA-N 0 3 333.388 2.738 20 5 EFBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])NCC(=O)NC(C)(C)C ZINC000504911223 315450893 /nfs/dbraw/zinc/45/08/93/315450893.db2.gz CFZICLCERODIHR-LBPRGKRZSA-N 0 3 339.461 2.970 20 5 EFBDHN O=C(NCCc1ccc([N+](=O)[O-])cc1)Nc1cccc2c1CCNC2 ZINC000519748020 315905508 /nfs/dbraw/zinc/90/55/08/315905508.db2.gz MTGJUUNFZGCNEZ-UHFFFAOYSA-N 0 3 340.383 2.605 20 5 EFBDHN COc1cc(C(=O)N2CCCN(C(C)(C)C)CC2)ccc1[N+](=O)[O-] ZINC000522271974 316086069 /nfs/dbraw/zinc/08/60/69/316086069.db2.gz JPVADWWPNQMZBE-UHFFFAOYSA-N 0 3 335.404 2.550 20 5 EFBDHN O=C(Cc1cccc([N+](=O)[O-])c1)N1CCN(CC2CCCCC2)CC1 ZINC000525153381 316191543 /nfs/dbraw/zinc/19/15/43/316191543.db2.gz JMIDRJLVXPOLFQ-UHFFFAOYSA-N 0 3 345.443 2.862 20 5 EFBDHN Cc1c([C@H](C)N[C@@H]2CCC[C@H](S(C)(=O)=O)C2)cccc1[N+](=O)[O-] ZINC000537981485 317687297 /nfs/dbraw/zinc/68/72/97/317687297.db2.gz NMVCJWUTBIFQIE-MJBXVCDLSA-N 0 3 340.445 2.910 20 5 EFBDHN O=C(CCNCCOc1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000548826223 318147826 /nfs/dbraw/zinc/14/78/26/318147826.db2.gz FALGNJUQBWGKKA-UHFFFAOYSA-N 0 3 329.356 2.592 20 5 EFBDHN O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2NCc2cnc3n2CCCC3)n1 ZINC000551573079 318210079 /nfs/dbraw/zinc/21/00/79/318210079.db2.gz ZRGUJSYMQCQWMR-GJZGRUSLSA-N 0 3 344.419 2.598 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@@H]2CCc3cc(F)ccc32)c1 ZINC000552030987 318238263 /nfs/dbraw/zinc/23/82/63/318238263.db2.gz ZAXAFDJHFNBOJG-MAUKXSAKSA-N 0 3 346.358 2.751 20 5 EFBDHN CC1(C)CCN(CC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)C1 ZINC000553199059 318274567 /nfs/dbraw/zinc/27/45/67/318274567.db2.gz MKAGKQPYTRDHTM-UHFFFAOYSA-N 0 3 331.416 2.818 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCNCc2cc(C(F)(F)F)n[nH]2)cc1 ZINC000555929357 318374507 /nfs/dbraw/zinc/37/45/07/318374507.db2.gz SBNJIKPPOHQKDN-UHFFFAOYSA-N 0 3 330.266 2.505 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1cccc2c1CCNC2 ZINC000562767264 318697541 /nfs/dbraw/zinc/69/75/41/318697541.db2.gz BEGVULGVLJIHNI-UHFFFAOYSA-N 0 3 340.383 2.904 20 5 EFBDHN Cc1ccc2c(c1)CC[C@H]2NC[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000563748580 318813673 /nfs/dbraw/zinc/81/36/73/318813673.db2.gz VSACKMPHKQTIBG-DOTOQJQBSA-N 0 3 342.395 2.920 20 5 EFBDHN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@H](N2CCCC2)C1 ZINC000564446485 318863422 /nfs/dbraw/zinc/86/34/22/318863422.db2.gz MUHUXLYMVFTZJE-OAHLLOKOSA-N 0 3 332.404 2.859 20 5 EFBDHN C[C@@H](c1ccccc1)[C@@H](O)CNCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000565300024 318956329 /nfs/dbraw/zinc/95/63/29/318956329.db2.gz MICMRVVSSUCYRT-SJCJKPOMSA-N 0 3 340.383 2.725 20 5 EFBDHN C[C@H](c1ccccc1)[C@@H](O)CNCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000565300022 318956356 /nfs/dbraw/zinc/95/63/56/318956356.db2.gz MICMRVVSSUCYRT-PXAZEXFGSA-N 0 3 340.383 2.725 20 5 EFBDHN O=C(CCN1CC[C@@H](c2cccnc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000565949395 319017737 /nfs/dbraw/zinc/01/77/37/319017737.db2.gz QZQNYYKXGACAGI-OAHLLOKOSA-N 0 3 340.383 2.808 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CN[C@H]1CSc2ccccc21 ZINC000566116017 319035037 /nfs/dbraw/zinc/03/50/37/319035037.db2.gz MXBSKAXMMMVRAX-OCCSQVGLSA-N 0 3 346.408 2.771 20 5 EFBDHN CCOc1ccc(C(=O)Nc2cccc3c2CCNC3)cc1[N+](=O)[O-] ZINC000567377009 319166015 /nfs/dbraw/zinc/16/60/15/319166015.db2.gz HDYAXZGMBSGUEH-UHFFFAOYSA-N 0 3 341.367 2.892 20 5 EFBDHN Cc1ccccc1CCNCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000567679649 319195764 /nfs/dbraw/zinc/19/57/64/319195764.db2.gz ARVHHFBHKORWSI-UHFFFAOYSA-N 0 3 348.424 2.509 20 5 EFBDHN CO[C@@H](CNCCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000567891842 319222542 /nfs/dbraw/zinc/22/25/42/319222542.db2.gz WJUXOCKWKLJNDF-KRWDZBQOSA-N 0 3 343.383 2.901 20 5 EFBDHN CCN(C)c1ccc(CNCCOc2ccc([N+](=O)[O-])cc2)cn1 ZINC000572335887 319658086 /nfs/dbraw/zinc/65/80/86/319658086.db2.gz GLVLDDCBXYZTCX-UHFFFAOYSA-N 0 3 330.388 2.615 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2N[C@@H]1CCN(c2ncccc2F)C1 ZINC000572422616 319668549 /nfs/dbraw/zinc/66/85/49/319668549.db2.gz DIGJCANCWDADDD-MLGOLLRUSA-N 0 3 342.374 2.985 20 5 EFBDHN CCOc1ccc(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1 ZINC000575020507 319917828 /nfs/dbraw/zinc/91/78/28/319917828.db2.gz SPQKWTQFMIWDHT-OAHLLOKOSA-N 0 3 346.383 2.523 20 5 EFBDHN CCn1ccnc1[C@H]1OCC[C@@H]1N[C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000575329501 319940516 /nfs/dbraw/zinc/94/05/16/319940516.db2.gz ITWTXWDVQCGVSM-VYDXJSESSA-N 0 3 342.399 2.918 20 5 EFBDHN CCOc1ccc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC000575944157 319968780 /nfs/dbraw/zinc/96/87/80/319968780.db2.gz ZJLPTLUEYCUZAY-INIZCTEOSA-N 0 3 346.383 2.523 20 5 EFBDHN CN(C)C[C@@H]1CCCCN1C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000576908569 320059314 /nfs/dbraw/zinc/05/93/14/320059314.db2.gz WAWUASGREQDOOK-INIZCTEOSA-N 0 3 347.415 2.500 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@@H]2C[C@H]2c2cccc(F)c2)c1 ZINC000577055345 320073454 /nfs/dbraw/zinc/07/34/54/320073454.db2.gz LUIWXBFYUGFEON-BPQIPLTHSA-N 0 3 346.358 2.619 20 5 EFBDHN O=[N+]([O-])c1ccc(S(=O)(=O)CCNCCCc2ccccc2)cc1 ZINC000578161692 320179556 /nfs/dbraw/zinc/17/95/56/320179556.db2.gz VLAWSZSSJKLMJS-UHFFFAOYSA-N 0 3 348.424 2.591 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCOc1ccc2c(c1)OCCNC2 ZINC000578315457 320194065 /nfs/dbraw/zinc/19/40/65/320194065.db2.gz QYUOYURMHMFWAY-UHFFFAOYSA-N 0 3 330.340 2.535 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN(Cc1ccccc1)C1CC1 ZINC000182202970 323268261 /nfs/dbraw/zinc/26/82/61/323268261.db2.gz HUHUBKBYWRRYJE-KRWDZBQOSA-N 0 3 342.395 2.999 20 5 EFBDHN CC[C@@H](NC[C@H](O)COc1ccccc1[N+](=O)[O-])c1c(C)noc1C ZINC000182519250 323287179 /nfs/dbraw/zinc/28/71/79/323287179.db2.gz ZLNYUYOJLIITOT-UONOGXRCSA-N 0 3 349.387 2.680 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CCCN(C)C1 ZINC000184769179 323373894 /nfs/dbraw/zinc/37/38/94/323373894.db2.gz BHZLTJVNSCYQMA-HOTGVXAUSA-N 0 3 333.432 2.622 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CCCN(C)C1 ZINC000184769200 323374119 /nfs/dbraw/zinc/37/41/19/323374119.db2.gz BHZLTJVNSCYQMA-JKSUJKDBSA-N 0 3 333.432 2.622 20 5 EFBDHN CC(C)N(CCN(C)C)C(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000185108474 323383199 /nfs/dbraw/zinc/38/31/99/323383199.db2.gz VAKKWUXWLWZRMV-LBPRGKRZSA-N 0 3 325.384 2.636 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN[C@H]1CCCc2occc21 ZINC000580947293 324273094 /nfs/dbraw/zinc/27/30/94/324273094.db2.gz OVLSDNWITXTHFX-JSGCOSHPSA-N 0 3 332.356 2.595 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@@H]1CC[C@H](C)C[C@H]1C ZINC000119277691 472541827 /nfs/dbraw/zinc/54/18/27/472541827.db2.gz YPSNCKTVCOQUQR-OUCADQQQSA-N 0 3 335.404 2.956 20 5 EFBDHN CCN1CCCC[C@H]1C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000124093792 473211302 /nfs/dbraw/zinc/21/13/02/473211302.db2.gz DSULFNRDMXAXAY-KRWDZBQOSA-N 0 3 333.432 2.908 20 5 EFBDHN O=[N+]([O-])c1ccc(CCN2CCN(CCc3ccccc3)CC2)cc1 ZINC000095560773 473223228 /nfs/dbraw/zinc/22/32/28/473223228.db2.gz DRUKAFOOIUONFU-UHFFFAOYSA-N 0 3 339.439 2.998 20 5 EFBDHN CN1CCN(CCCCNc2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000112074190 473241686 /nfs/dbraw/zinc/24/16/86/473241686.db2.gz DVKYAWQFVZQTGG-UHFFFAOYSA-N 0 3 343.431 2.583 20 5 EFBDHN Cn1cc(CNCCc2nccs2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000171052081 473264980 /nfs/dbraw/zinc/26/49/80/473264980.db2.gz NKESJUREFVPFHJ-UHFFFAOYSA-N 0 3 343.412 2.784 20 5 EFBDHN Cn1cnc([N+](=O)[O-])c1NC[C@H]1CCCN(Cc2cccs2)C1 ZINC000142823069 473268083 /nfs/dbraw/zinc/26/80/83/473268083.db2.gz WDUWBUKLMFTCFE-GFCCVEGCSA-N 0 3 335.433 2.714 20 5 EFBDHN CN1CCN(CCCCNc2nc3ccccc3cc2[N+](=O)[O-])CC1 ZINC000530543006 467992136 /nfs/dbraw/zinc/99/21/36/467992136.db2.gz SZPDCHNNOGFLQU-UHFFFAOYSA-N 0 3 343.431 2.583 20 5 EFBDHN COC(=O)CCN(Cc1nc2cc([N+](=O)[O-])ccc2o1)CC(C)C ZINC000083169467 473326310 /nfs/dbraw/zinc/32/63/10/473326310.db2.gz ZWTYRYXEBBBDJC-UHFFFAOYSA-N 0 3 335.360 2.757 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCN(c2ccncc2)CC1 ZINC000162730930 473375728 /nfs/dbraw/zinc/37/57/28/473375728.db2.gz JKDUPADIHLWYHB-UHFFFAOYSA-N 0 3 341.371 2.652 20 5 EFBDHN COc1cc(CN[C@H](C)[C@@H]2CCOC2)c([N+](=O)[O-])cc1OC(F)F ZINC000162778661 473381501 /nfs/dbraw/zinc/38/15/01/473381501.db2.gz LAHRIRMRLMVGQM-NXEZZACHSA-N 0 3 346.330 2.719 20 5 EFBDHN Cn1c(CCNCc2ccc([N+](=O)[O-])cc2)nc2c1cccc2F ZINC000113358950 473387631 /nfs/dbraw/zinc/38/76/31/473387631.db2.gz GEXWVQZSBOSCIX-UHFFFAOYSA-N 0 3 328.347 2.953 20 5 EFBDHN O=C(CN[C@H]1CCC12CCCC2)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000451465119 478031164 /nfs/dbraw/zinc/03/11/64/478031164.db2.gz ZSTZWQRJAAXQAL-INIZCTEOSA-N 0 3 329.400 2.796 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCN(CC2CC2)C1 ZINC000613233641 479930499 /nfs/dbraw/zinc/93/04/99/479930499.db2.gz ACZWAUMSGCOMJN-SJORKVTESA-N 0 3 345.443 2.764 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCN(CC2CC2)C1 ZINC000613233639 479930793 /nfs/dbraw/zinc/93/07/93/479930793.db2.gz ACZWAUMSGCOMJN-IAGOWNOFSA-N 0 3 345.443 2.764 20 5 EFBDHN CC(=O)c1ccc(N2CCN(c3ccncc3)CC2)c([N+](=O)[O-])c1 ZINC000007365399 471610089 /nfs/dbraw/zinc/61/00/89/471610089.db2.gz DVZHRTRHTRGPLQ-UHFFFAOYSA-N 0 3 326.356 2.519 20 5 EFBDHN Cc1cccc(C(=O)NCc2ccccc2CN(C)C)c1[N+](=O)[O-] ZINC000009916955 471723683 /nfs/dbraw/zinc/72/36/83/471723683.db2.gz LXDYHRNWXIJCOF-UHFFFAOYSA-N 0 3 327.384 2.895 20 5 EFBDHN COc1ccc(C(=O)NCc2ccccc2CN(C)C)cc1[N+](=O)[O-] ZINC000009917223 471723758 /nfs/dbraw/zinc/72/37/58/471723758.db2.gz FXMWEKRWOYWQFH-UHFFFAOYSA-N 0 3 343.383 2.595 20 5 EFBDHN Cc1ccc([C@H](CNC(=O)c2cccc([N+](=O)[O-])c2)N(C)C)cc1 ZINC000010017823 471725736 /nfs/dbraw/zinc/72/57/36/471725736.db2.gz RRSZAOKZHIQJAF-KRWDZBQOSA-N 0 3 327.384 2.936 20 5 EFBDHN C[C@@H]1CCCN(C(C)(C)CNC(=O)c2csc([N+](=O)[O-])c2)C1 ZINC000053405070 472004664 /nfs/dbraw/zinc/00/46/64/472004664.db2.gz YQQAMUNUDCNSKT-LLVKDONJSA-N 0 3 325.434 2.897 20 5 EFBDHN C[C@H]1CCCN(C(C)(C)CNC(=O)c2csc([N+](=O)[O-])c2)C1 ZINC000053405072 472004945 /nfs/dbraw/zinc/00/49/45/472004945.db2.gz YQQAMUNUDCNSKT-NSHDSACASA-N 0 3 325.434 2.897 20 5 EFBDHN CC1CCN(C[C@@H](O)CNc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000067373279 472024940 /nfs/dbraw/zinc/02/49/40/472024940.db2.gz UTYTXLUYXBSGDA-ZDUSSCGKSA-N 0 3 327.812 2.753 20 5 EFBDHN C[C@@H]1CN(C[C@@H]2CCCN2Cc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000067715154 472078557 /nfs/dbraw/zinc/07/85/57/472078557.db2.gz RCLKTGBCMQWZHI-DAYGRLMNSA-N 0 3 333.432 2.668 20 5 EFBDHN CCc1ccc([C@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]2)N(C)C)cc1 ZINC000054373837 472082365 /nfs/dbraw/zinc/08/23/65/472082365.db2.gz QGNUCHRJFWOUPE-INIZCTEOSA-N 0 3 330.388 2.518 20 5 EFBDHN C[C@@H](CNC(=O)NCCc1ccc([N+](=O)[O-])cc1)N1CCCC[C@H]1C ZINC000054647055 472104538 /nfs/dbraw/zinc/10/45/38/472104538.db2.gz OYFONNBVPLSBNS-CABCVRRESA-N 0 3 348.447 2.699 20 5 EFBDHN CC(C)(CNC(=O)NCCc1ccc([N+](=O)[O-])cc1)N1CCCCC1 ZINC000054645831 472104907 /nfs/dbraw/zinc/10/49/07/472104907.db2.gz OEACPYYUJZBCEL-UHFFFAOYSA-N 0 3 348.447 2.701 20 5 EFBDHN CC1CCC(N(C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000042475185 472138090 /nfs/dbraw/zinc/13/80/90/472138090.db2.gz IUKNQWNNOLEJIM-UHFFFAOYSA-N 0 3 331.416 2.994 20 5 EFBDHN C[C@@H]1CCC[C@H](N(C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000026476360 472138784 /nfs/dbraw/zinc/13/87/84/472138784.db2.gz WXMJDZFVWGJXIG-HIFRSBDPSA-N 0 3 331.416 2.994 20 5 EFBDHN C[C@H]1CCC[C@H](N(C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000026480176 472138951 /nfs/dbraw/zinc/13/89/51/472138951.db2.gz ADRGGEAYAOFZLO-ZFWWWQNUSA-N 0 3 331.416 2.994 20 5 EFBDHN C[C@@H]1CCC[C@@H](N(C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000026480153 472139450 /nfs/dbraw/zinc/13/94/50/472139450.db2.gz ADRGGEAYAOFZLO-UKRRQHHQSA-N 0 3 331.416 2.994 20 5 EFBDHN CN(C)CCN(Cc1cccs1)C(=O)c1ccc([N+](=O)[O-])s1 ZINC000084251521 472160394 /nfs/dbraw/zinc/16/03/94/472160394.db2.gz KDOUUDQDSREHHH-UHFFFAOYSA-N 0 3 339.442 2.922 20 5 EFBDHN C[C@@H](CN1CCCCC1)NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000027740260 472194076 /nfs/dbraw/zinc/19/40/76/472194076.db2.gz DZPNCURSTVSIHX-ZDUSSCGKSA-N 0 3 337.445 2.678 20 5 EFBDHN CNc1ccc(C(=O)NC[C@H](C)N2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000043084533 472196709 /nfs/dbraw/zinc/19/67/09/472196709.db2.gz JCOWBRAXYZPMKJ-OLZOCXBDSA-N 0 3 334.420 2.629 20 5 EFBDHN CC(C)C1CCC(N2CCN(c3c([N+](=O)[O-])ncn3C)CC2)CC1 ZINC000084649800 472203759 /nfs/dbraw/zinc/20/37/59/472203759.db2.gz URWUGXLSLHZHIR-UHFFFAOYSA-N 0 3 335.452 2.665 20 5 EFBDHN Cc1cccc(C(=O)N[C@@H](C)CN2C[C@H](C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000055757873 472235529 /nfs/dbraw/zinc/23/55/29/472235529.db2.gz AZBUBJQNVDVZBR-GUTXKFCHSA-N 0 3 333.432 2.999 20 5 EFBDHN Cc1nn(C)c(N(C)C[C@@H]2CCN(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000076065069 472258224 /nfs/dbraw/zinc/25/82/24/472258224.db2.gz UDYBDWJUSMKPGW-INIZCTEOSA-N 0 3 343.431 2.595 20 5 EFBDHN COc1ccc(C(=O)NCc2cccc(CN(C)C)c2)cc1[N+](=O)[O-] ZINC000043966568 472277522 /nfs/dbraw/zinc/27/75/22/472277522.db2.gz ZFHPUTOLAAQPEH-UHFFFAOYSA-N 0 3 343.383 2.595 20 5 EFBDHN O=C(c1cc([N+](=O)[O-])c[nH]1)N1CCCN(CC2CCCCC2)CC1 ZINC000056346431 472309420 /nfs/dbraw/zinc/30/94/20/472309420.db2.gz IXDNRXQHDSBDBL-UHFFFAOYSA-N 0 3 334.420 2.651 20 5 EFBDHN CCO[C@H]1CCCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000076407327 472341814 /nfs/dbraw/zinc/34/18/14/472341814.db2.gz BIYCJXYBTBZQBH-HNNXBMFYSA-N 0 3 335.404 2.733 20 5 EFBDHN O=C(c1c[nH]c2cc([N+](=O)[O-])ccc12)N1CCN(C2CCCC2)CC1 ZINC000056689957 472344550 /nfs/dbraw/zinc/34/45/50/472344550.db2.gz VLAMXZNVJHDEEQ-UHFFFAOYSA-N 0 3 342.399 2.777 20 5 EFBDHN C[C@H](CN1CCC[C@@H](C)C1)NC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000056786854 472351748 /nfs/dbraw/zinc/35/17/48/472351748.db2.gz YTLXWRKEWCMIQA-ZIAGYGMSSA-N 0 3 334.420 2.514 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)N(CCN(C)C)Cc2ccco2)c1 ZINC000088250882 472352364 /nfs/dbraw/zinc/35/23/64/472352364.db2.gz LUDJKOZRANILCV-UHFFFAOYSA-N 0 3 331.372 2.700 20 5 EFBDHN Cc1c(NC(=O)CCN(C)CCOCC2CC2)cccc1[N+](=O)[O-] ZINC000088599504 472374687 /nfs/dbraw/zinc/37/46/87/472374687.db2.gz NWAJYFMDXOXLAG-UHFFFAOYSA-N 0 3 335.404 2.590 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CN[C@H](CO)[C@H](C)c1ccccc1 ZINC000613389611 479984685 /nfs/dbraw/zinc/98/46/85/479984685.db2.gz OXGRVPHSWPWODO-CXAGYDPISA-N 0 3 330.384 2.858 20 5 EFBDHN CCOc1ccc([C@@H](C)N[C@@H](C)CO[C@@H]2CCOC2)cc1[N+](=O)[O-] ZINC000154192591 472401123 /nfs/dbraw/zinc/40/11/23/472401123.db2.gz PTGLQQYDUBDHBO-GZBFAFLISA-N 0 3 338.404 2.838 20 5 EFBDHN Cc1cccc(C(=O)NC[C@H](Cc2ccccc2)N(C)C)c1[N+](=O)[O-] ZINC000057288196 472410621 /nfs/dbraw/zinc/41/06/21/472410621.db2.gz CQGZPGRMYXWQTJ-INIZCTEOSA-N 0 3 341.411 2.806 20 5 EFBDHN CC(C)N1C[C@@H](C)[C@@H](NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000154650753 472456878 /nfs/dbraw/zinc/45/68/78/472456878.db2.gz QYFSLOKWZODDBU-DOMZBBRYSA-N 0 3 342.399 2.602 20 5 EFBDHN CC(C)C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12)N(C)C ZINC000154673015 472458495 /nfs/dbraw/zinc/45/84/95/472458495.db2.gz XJTJHWPXZULYJO-ZDUSSCGKSA-N 0 3 344.415 2.849 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H](C)N(C)C1CC1 ZINC000057716859 472466475 /nfs/dbraw/zinc/46/64/75/472466475.db2.gz HIIOEDKEJPCANG-VXGBXAGGSA-N 0 3 337.445 2.674 20 5 EFBDHN O=[N+]([O-])c1cc(F)ccc1NC[C@H]1C[C@@H](O)CN1Cc1ccccc1 ZINC000089644551 472477540 /nfs/dbraw/zinc/47/75/40/472477540.db2.gz VGKACJPZKQEZEM-HZPDHXFCSA-N 0 3 345.374 2.781 20 5 EFBDHN COc1cccc([C@H](CNc2c([N+](=O)[O-])ncn2C)N2CCCC2)c1 ZINC000070790986 472512706 /nfs/dbraw/zinc/51/27/06/472512706.db2.gz MMFFZLLCGBMWCC-HNNXBMFYSA-N 0 3 345.403 2.586 20 5 EFBDHN CC1(C)C[C@@H](NCc2cc([N+](=O)[O-])cc3c2OCOC3)C(C)(C)O1 ZINC000155159492 472514252 /nfs/dbraw/zinc/51/42/52/472514252.db2.gz RFKRJMMYXQTWMY-CQSZACIVSA-N 0 3 336.388 2.897 20 5 EFBDHN CCc1ccc(C(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)cc1[N+](=O)[O-] ZINC000118987670 472516981 /nfs/dbraw/zinc/51/69/81/472516981.db2.gz DAOMDSNHTOCMJG-HOTGVXAUSA-N 0 3 331.416 2.714 20 5 EFBDHN CCN1CCC(NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000118983083 472517744 /nfs/dbraw/zinc/51/77/44/472517744.db2.gz HKYQGEQNLMYBKQ-UHFFFAOYSA-N 0 3 348.447 2.701 20 5 EFBDHN C[C@@H](NCCC(=O)NCc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000129313086 472536681 /nfs/dbraw/zinc/53/66/81/472536681.db2.gz NTTBOUDHZQSTHI-CQSZACIVSA-N 0 3 327.384 2.952 20 5 EFBDHN C[C@@H](CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-])N1CCC[C@@H](C)C1 ZINC000046365911 472548669 /nfs/dbraw/zinc/54/86/69/472548669.db2.gz UFVLEKFZAGSIAF-CABCVRRESA-N 0 3 348.447 2.857 20 5 EFBDHN Cc1ccccc1CN1CCC(NC(=O)c2ccc([N+](=O)[O-])o2)CC1 ZINC000058399471 472563107 /nfs/dbraw/zinc/56/31/07/472563107.db2.gz JGXKPIXMSMHNHN-UHFFFAOYSA-N 0 3 343.383 2.891 20 5 EFBDHN CCN1CCN(CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000058734058 472596760 /nfs/dbraw/zinc/59/67/60/472596760.db2.gz HBTNUBCJNQESEU-UHFFFAOYSA-N 0 3 346.353 2.663 20 5 EFBDHN O=C(CN1CCC[C@@H]1C1CCC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000102926066 472600272 /nfs/dbraw/zinc/60/02/72/472600272.db2.gz RDCCHYJGSQOWKF-MRXNPFEDSA-N 0 3 329.400 2.748 20 5 EFBDHN CCOc1ccc(C(=O)N(CCN(C)C)CC(C)C)cc1[N+](=O)[O-] ZINC000058883004 472608540 /nfs/dbraw/zinc/60/85/40/472608540.db2.gz BSEBXMQVPLYGHG-UHFFFAOYSA-N 0 3 337.420 2.653 20 5 EFBDHN C[C@@H](N[C@@H](C)c1ccc(-n2cnnn2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000155814841 472620159 /nfs/dbraw/zinc/62/01/59/472620159.db2.gz BPECKVZBIKQZGS-QWHCGFSZSA-N 0 3 338.371 2.982 20 5 EFBDHN CN(C)[C@H](CNc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000059394192 472625061 /nfs/dbraw/zinc/62/50/61/472625061.db2.gz VPUKFMCTYJOJHD-MRXNPFEDSA-N 0 3 346.362 2.548 20 5 EFBDHN CCN(CCn1cc([N+](=O)[O-])ccc1=O)[C@H](C)c1ccc(F)cc1 ZINC000090519105 472628909 /nfs/dbraw/zinc/62/89/09/472628909.db2.gz AFLAFDZSLROCGR-CYBMUJFWSA-N 0 3 333.363 2.979 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN[C@H](C[C@@H]2CCOC2)c2ccccc2)c1 ZINC000090539654 472631663 /nfs/dbraw/zinc/63/16/63/472631663.db2.gz DMTCSQFKLMQQOD-WMLDXEAASA-N 0 3 330.388 2.549 20 5 EFBDHN C[C@H]1C[C@@H](c2cccc(F)c2)N(CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000090550818 472633348 /nfs/dbraw/zinc/63/33/48/472633348.db2.gz DZVIKGWUYNTIDO-GUYCJALGSA-N 0 3 345.374 2.979 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCN(C1CC1)[C@@H]1CCc2ccccc21 ZINC000090553266 472635130 /nfs/dbraw/zinc/63/51/30/472635130.db2.gz ZHIQQVXFHLRNFB-GOSISDBHSA-N 0 3 339.395 2.908 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCNC1(c2ccc(F)cc2)CCCC1 ZINC000090554063 472635408 /nfs/dbraw/zinc/63/54/08/472635408.db2.gz QKWZAKOYBWQJNF-UHFFFAOYSA-N 0 3 345.374 2.955 20 5 EFBDHN C[C@@H](NCC1(CO)COC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000090644567 472647707 /nfs/dbraw/zinc/64/77/07/472647707.db2.gz GAWWJUKBUYDHLZ-GFCCVEGCSA-N 0 3 348.424 2.983 20 5 EFBDHN C[C@H]1CN(CC2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)C[C@H](C)O1 ZINC000060368497 472648486 /nfs/dbraw/zinc/64/84/86/472648486.db2.gz VRJSEEURAVPPPU-HOTGVXAUSA-N 0 3 347.459 2.916 20 5 EFBDHN CCOc1ccc(C(=O)NC[C@@H](C)N2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000060412771 472654686 /nfs/dbraw/zinc/65/46/86/472654686.db2.gz FDICAPGZAGUNRV-ZIAGYGMSSA-N 0 3 349.431 2.986 20 5 EFBDHN C[C@H](NCc1ccnc(OCCN(C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000090937013 472666246 /nfs/dbraw/zinc/66/62/46/472666246.db2.gz VHGKGMHTANPSCO-AWEZNQCLSA-N 0 3 344.415 2.781 20 5 EFBDHN C[C@H](NCc1ccnc(OCCN(C)C)c1)c1ccc([N+](=O)[O-])cc1 ZINC000090937403 472667045 /nfs/dbraw/zinc/66/70/45/472667045.db2.gz RQXXFSQMWASLFN-AWEZNQCLSA-N 0 3 344.415 2.781 20 5 EFBDHN C[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1F)N1CCC[C@H](C)C1 ZINC000131374082 472667508 /nfs/dbraw/zinc/66/75/08/472667508.db2.gz NCIXAJRZPFBZHD-STQMWFEESA-N 0 3 337.395 2.513 20 5 EFBDHN C[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1F)N1CCC[C@@H](C)C1 ZINC000131373898 472667619 /nfs/dbraw/zinc/66/76/19/472667619.db2.gz NCIXAJRZPFBZHD-OLZOCXBDSA-N 0 3 337.395 2.513 20 5 EFBDHN COc1ccc(NC(=O)CCN(C)CCC(F)(F)F)c([N+](=O)[O-])c1 ZINC000104678574 472682263 /nfs/dbraw/zinc/68/22/63/472682263.db2.gz GSPXOYZCQNJNQL-UHFFFAOYSA-N 0 3 349.309 2.816 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(C[C@H](C)O)C1CCCCC1 ZINC000072600483 472684187 /nfs/dbraw/zinc/68/41/87/472684187.db2.gz WZTDBLXKAYCDCO-AWEZNQCLSA-N 0 3 349.431 2.857 20 5 EFBDHN CCN1CCC(Nc2cc(Cl)c(C(=O)OC)cc2[N+](=O)[O-])CC1 ZINC000120436360 472688195 /nfs/dbraw/zinc/68/81/95/472688195.db2.gz UCRFEHKBTKCSKN-UHFFFAOYSA-N 0 3 341.795 2.931 20 5 EFBDHN CN(Cc1ccccc1)C[C@H](O)COc1c(F)cccc1[N+](=O)[O-] ZINC000613450825 480004049 /nfs/dbraw/zinc/00/40/49/480004049.db2.gz GQZBJGBAASNQHP-AWEZNQCLSA-N 0 3 334.347 2.606 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@@H]2CCN(CCCOc3ccccc3)C2)nc1 ZINC000072665249 472696694 /nfs/dbraw/zinc/69/66/94/472696694.db2.gz FXHASKSSOFMMSC-OAHLLOKOSA-N 0 3 342.399 2.945 20 5 EFBDHN CN(C)c1cccc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000072665003 472697069 /nfs/dbraw/zinc/69/70/69/472697069.db2.gz QFMHGYORZOSMQR-OAHLLOKOSA-N 0 3 341.415 2.742 20 5 EFBDHN Nc1nc(N[C@H](CN2CCCCC2)c2ccccc2)ncc1[N+](=O)[O-] ZINC000078333965 472697194 /nfs/dbraw/zinc/69/71/94/472697194.db2.gz WVYNLXNODGIFLO-CQSZACIVSA-N 0 3 342.403 2.606 20 5 EFBDHN O=C1CC[C@@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CN1 ZINC000105481575 472753982 /nfs/dbraw/zinc/75/39/82/472753982.db2.gz WWYHYJIQIFTRPR-GFCCVEGCSA-N 0 3 331.397 2.692 20 5 EFBDHN Cc1nn(C)c(N2CC[C@@H](C)N(Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000078689427 472755262 /nfs/dbraw/zinc/75/52/62/472755262.db2.gz JKWVVUOJTMIDPM-CQSZACIVSA-N 0 3 343.431 2.738 20 5 EFBDHN CCN1CCC(N(C)C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC1 ZINC000105599804 472761508 /nfs/dbraw/zinc/76/15/08/472761508.db2.gz XALRHSAYJGEXMY-UHFFFAOYSA-N 0 3 346.431 2.725 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@@H]2CN(Cc3ccccc3)CC[C@H]2CO)cc1 ZINC000091486186 472773476 /nfs/dbraw/zinc/77/34/76/472773476.db2.gz WJVYHJJVXSTMPS-QFBILLFUSA-N 0 3 341.411 2.890 20 5 EFBDHN CC(C)c1nc2n(n1)C[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000105873925 472794221 /nfs/dbraw/zinc/79/42/21/472794221.db2.gz ZNHHKZHYCJUJMW-TZMCWYRMSA-N 0 3 329.404 2.975 20 5 EFBDHN C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000121129596 472803804 /nfs/dbraw/zinc/80/38/04/472803804.db2.gz AKJQYBOTMCFGCB-YGRLFVJLSA-N 0 3 325.796 2.660 20 5 EFBDHN CC(C)(C)N1CCCN(C(=O)CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000063722138 472805649 /nfs/dbraw/zinc/80/56/49/472805649.db2.gz HARLCBZJSIHRJD-UHFFFAOYSA-N 0 3 349.431 2.697 20 5 EFBDHN C[C@H]1CCCN(C(C)(C)CNC(=O)c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000133473556 472807973 /nfs/dbraw/zinc/80/79/73/472807973.db2.gz YZWVRGBGVWHXTP-LBPRGKRZSA-N 0 3 337.395 2.974 20 5 EFBDHN C[C@@H]1CCCN(C(C)(C)CNC(=O)c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000133473389 472808318 /nfs/dbraw/zinc/80/83/18/472808318.db2.gz YZWVRGBGVWHXTP-GFCCVEGCSA-N 0 3 337.395 2.974 20 5 EFBDHN CN(CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CCc1nccs1 ZINC000157565917 472835671 /nfs/dbraw/zinc/83/56/71/472835671.db2.gz USUUKEVUSFZHEE-UHFFFAOYSA-N 0 3 334.401 2.554 20 5 EFBDHN COCOc1ccc(OC)cc1CNCCc1cccc([N+](=O)[O-])c1 ZINC000121549525 472869470 /nfs/dbraw/zinc/86/94/70/472869470.db2.gz YPDUPPJXSCRTTO-UHFFFAOYSA-N 0 3 346.383 2.918 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)CCN1Cc1ccccc1 ZINC000079553995 472886094 /nfs/dbraw/zinc/88/60/94/472886094.db2.gz WVHFTCFDAAJSHB-ZFWWWQNUSA-N 0 3 342.399 2.706 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CCCCC[C@H]2C[C@H](O)c2ccco2)n1 ZINC000121841674 472927657 /nfs/dbraw/zinc/92/76/57/472927657.db2.gz PKLIWKHQQAJDEI-GJZGRUSLSA-N 0 3 348.403 2.753 20 5 EFBDHN C[C@@H]1CCCN(CCNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C1 ZINC000079914678 472941380 /nfs/dbraw/zinc/94/13/80/472941380.db2.gz SGWOASITEXCXOV-CYBMUJFWSA-N 0 3 346.431 2.631 20 5 EFBDHN CC(C)(NC(=O)N[C@@H]1CCN(CC2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000080146208 472983897 /nfs/dbraw/zinc/98/38/97/472983897.db2.gz YLXZCGSTHQKMLV-OAHLLOKOSA-N 0 3 346.431 2.613 20 5 EFBDHN C[C@@H]1C[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2)CN1Cc1ccccc1 ZINC000134931175 472994502 /nfs/dbraw/zinc/99/45/02/472994502.db2.gz NOTZGVQBOPUDIA-RHSMWYFYSA-N 0 3 339.395 2.988 20 5 EFBDHN CN(C[C@H]1CCCN(C)C1)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000134965534 473000196 /nfs/dbraw/zinc/00/01/96/473000196.db2.gz ZHMWIUPDUBUVBH-NSHDSACASA-N 0 3 325.796 2.662 20 5 EFBDHN COC1CCN(CCNc2ccc3cc([N+](=O)[O-])ccc3n2)CC1 ZINC000080249925 473002801 /nfs/dbraw/zinc/00/28/01/473002801.db2.gz IZYIBIPQNBHEQH-UHFFFAOYSA-N 0 3 330.388 2.666 20 5 EFBDHN Cn1cc(CN2CCC[C@@H](CCO)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000093105749 473042482 /nfs/dbraw/zinc/04/24/82/473042482.db2.gz YPZZLUDKADYQFI-AWEZNQCLSA-N 0 3 344.415 2.590 20 5 EFBDHN Cn1cc(CN2CCC[C@H](CCO)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000093105746 473044092 /nfs/dbraw/zinc/04/40/92/473044092.db2.gz YPZZLUDKADYQFI-CQSZACIVSA-N 0 3 344.415 2.590 20 5 EFBDHN CN1CCC[C@@H]1CNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000051383499 473045331 /nfs/dbraw/zinc/04/53/31/473045331.db2.gz ZUWIKZIIGLTIMG-CYBMUJFWSA-N 0 3 346.412 2.542 20 5 EFBDHN CN(CCc1ccccc1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000051404560 473046510 /nfs/dbraw/zinc/04/65/10/473046510.db2.gz ODNFYJIBVFOEPL-QGZVFWFLSA-N 0 3 330.384 2.509 20 5 EFBDHN CN(CCOc1ccccc1[N+](=O)[O-])Cc1ccc2c(c1)OCO2 ZINC000051588859 473057707 /nfs/dbraw/zinc/05/77/07/473057707.db2.gz MIKUWRMGABJNCG-UHFFFAOYSA-N 0 3 330.340 2.834 20 5 EFBDHN C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1CCn1cc([N+](=O)[O-])ccc1=O ZINC000159837339 473064940 /nfs/dbraw/zinc/06/49/40/473064940.db2.gz BKOBIUHGALEKPX-UKRRQHHQSA-N 0 3 345.374 2.774 20 5 EFBDHN C[C@@H]1C[C@H](c2ccc(F)cc2)CN1CCn1cc([N+](=O)[O-])ccc1=O ZINC000159837074 473065006 /nfs/dbraw/zinc/06/50/06/473065006.db2.gz BKOBIUHGALEKPX-HIFRSBDPSA-N 0 3 345.374 2.774 20 5 EFBDHN Cc1nn(C)c(N2CCCN(Cc3ccccc3C)CC2)c1[N+](=O)[O-] ZINC000051993615 473077587 /nfs/dbraw/zinc/07/75/87/473077587.db2.gz YPKZDURPZUZYLA-UHFFFAOYSA-N 0 3 343.431 2.657 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN(CCO)CCCO)s1 ZINC000093323951 473084169 /nfs/dbraw/zinc/08/41/69/473084169.db2.gz UYUOIDRMJLTRQJ-UHFFFAOYSA-N 0 3 336.413 2.500 20 5 EFBDHN CN(CCOc1ccccc1[N+](=O)[O-])[C@@H]1CCCc2c1cnn2C ZINC000135592325 473096792 /nfs/dbraw/zinc/09/67/92/473096792.db2.gz YGZTVKDPGVGCLB-CQSZACIVSA-N 0 3 330.388 2.717 20 5 EFBDHN COc1ccc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000093534672 473116707 /nfs/dbraw/zinc/11/67/07/473116707.db2.gz QCDUPAQCKKXAIW-CQSZACIVSA-N 0 3 328.372 2.685 20 5 EFBDHN CC(C)c1ccc(CN2CC[C@H](CN3CCOCC3)C2)cc1[N+](=O)[O-] ZINC000093664727 473133296 /nfs/dbraw/zinc/13/32/96/473133296.db2.gz RALPDXPAVBRIRJ-QGZVFWFLSA-N 0 3 347.459 2.872 20 5 EFBDHN C[C@H](CNC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)N1CCCC1 ZINC000052641299 473136001 /nfs/dbraw/zinc/13/60/01/473136001.db2.gz GXQWYJTVVVLVHV-OLZOCXBDSA-N 0 3 337.445 2.676 20 5 EFBDHN O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCN(c2ccncc2)CC1 ZINC000136159115 473139495 /nfs/dbraw/zinc/13/94/95/473139495.db2.gz HCNZZNCYLCKCRY-UHFFFAOYSA-N 0 3 346.774 2.606 20 5 EFBDHN Cn1cc(CN2CC[C@@]3(CCOC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000093819957 473150464 /nfs/dbraw/zinc/15/04/64/473150464.db2.gz ATQLDTIOSMGHRX-GOSISDBHSA-N 0 3 342.399 2.608 20 5 EFBDHN CNC(=O)[C@@H](C)CN(C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000093899097 473158641 /nfs/dbraw/zinc/15/86/41/473158641.db2.gz GYQXSXMNIHTPLX-LBPRGKRZSA-N 0 3 331.372 2.669 20 5 EFBDHN CNC(=O)[C@H](C)CN(C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000093899098 473159241 /nfs/dbraw/zinc/15/92/41/473159241.db2.gz GYQXSXMNIHTPLX-GFCCVEGCSA-N 0 3 331.372 2.669 20 5 EFBDHN CCc1nn(C)c(NC[C@@H](c2ccc(C)cc2)N(C)C)c1[N+](=O)[O-] ZINC000094150979 473180553 /nfs/dbraw/zinc/18/05/53/473180553.db2.gz WMNYIXNZBYVJQN-HNNXBMFYSA-N 0 3 331.420 2.914 20 5 EFBDHN CCc1nn(C)c(N2CCN(C3CCC(C)CC3)CC2)c1[N+](=O)[O-] ZINC000094160219 473183149 /nfs/dbraw/zinc/18/31/49/473183149.db2.gz UECRCPAEWDRSTK-UHFFFAOYSA-N 0 3 335.452 2.591 20 5 EFBDHN CCN1CCN(CCCNc2ccc([N+](=O)[O-])c3cnccc23)CC1 ZINC000075469742 473189641 /nfs/dbraw/zinc/18/96/41/473189641.db2.gz LVQWMDHPOLXETB-UHFFFAOYSA-N 0 3 343.431 2.583 20 5 EFBDHN CCN1CCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000124007041 473204671 /nfs/dbraw/zinc/20/46/71/473204671.db2.gz LKEAUYNHLJFTOJ-LBPRGKRZSA-N 0 3 345.321 2.828 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CN2CCC[C@@H]2c2ccncc2)c1 ZINC000125446437 473410620 /nfs/dbraw/zinc/41/06/20/473410620.db2.gz QQVGLHMLDOWVIC-FUHWJXTLSA-N 0 3 343.383 2.567 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@@H]1CCCN(C)C1 ZINC000185410390 473420344 /nfs/dbraw/zinc/42/03/44/473420344.db2.gz VKXDDXILFUTQLE-DOTOQJQBSA-N 0 3 333.432 2.716 20 5 EFBDHN Cc1c(CC(=O)NC[C@H](C)N2CCC(C)CC2)cccc1[N+](=O)[O-] ZINC000163379312 473439013 /nfs/dbraw/zinc/43/90/13/473439013.db2.gz MFHTZVYYXHGOKB-AWEZNQCLSA-N 0 3 333.432 2.682 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCN2CCC(O)(c3ccccc3)CC2)cc1 ZINC000185503847 473444345 /nfs/dbraw/zinc/44/43/45/473444345.db2.gz GKGYCCGZLQAHKT-UHFFFAOYSA-N 0 3 342.395 2.957 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCN1CCN([C@H]2C[C@H]3CC[C@@H]2C3)CC1 ZINC000177923811 473450707 /nfs/dbraw/zinc/45/07/07/473450707.db2.gz RUZBNMLMRKYMLN-JZXOWHBKSA-N 0 3 345.443 2.780 20 5 EFBDHN C[C@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])[C@H]1COc2ccccc21 ZINC000185579584 473460507 /nfs/dbraw/zinc/46/05/07/473460507.db2.gz CLUPDLBBHZTMRN-GXTWGEPZSA-N 0 3 341.367 2.688 20 5 EFBDHN Cc1ccc([C@@H](CNC(=O)c2cccc([N+](=O)[O-])c2N)N(C)C)cc1 ZINC000178180315 473472941 /nfs/dbraw/zinc/47/29/41/473472941.db2.gz ODCKGSADDHECAC-MRXNPFEDSA-N 0 3 342.399 2.518 20 5 EFBDHN Cc1c(Br)c(NCCN(C)C2CC2)ncc1[N+](=O)[O-] ZINC000165760948 473515012 /nfs/dbraw/zinc/51/50/12/473515012.db2.gz MFUSTXJHEIZHBA-UHFFFAOYSA-N 0 3 329.198 2.567 20 5 EFBDHN COCC[C@](C)(O)CNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000172070367 473514990 /nfs/dbraw/zinc/51/49/90/473514990.db2.gz CRFGHMPVLIYVIY-KRWDZBQOSA-N 0 3 334.372 2.732 20 5 EFBDHN CC[C@@H]1Cc2ccccc2CN1CCn1cc([N+](=O)[O-])ccc1=O ZINC000185803443 473518356 /nfs/dbraw/zinc/51/83/56/473518356.db2.gz DDBITBYMBSLTAZ-MRXNPFEDSA-N 0 3 327.384 2.593 20 5 EFBDHN CCC1(CC)[C@@H](NCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@@H]1OC ZINC000191367939 473531819 /nfs/dbraw/zinc/53/18/19/473531819.db2.gz FQGPIRACYQOHAT-HOTGVXAUSA-N 0 3 349.431 2.741 20 5 EFBDHN C[C@@H](NC(=O)N(C)C[C@@H]1CCCN(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000172138960 473531847 /nfs/dbraw/zinc/53/18/47/473531847.db2.gz SPVKVKBZWPYKQF-ZIAGYGMSSA-N 0 3 334.420 2.639 20 5 EFBDHN C[C@@H](NC(=O)N(C)C[C@H]1CCCN(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000172138968 473532372 /nfs/dbraw/zinc/53/23/72/473532372.db2.gz SPVKVKBZWPYKQF-KGLIPLIRSA-N 0 3 334.420 2.639 20 5 EFBDHN COc1ccc(NC(=O)CCN(C)Cc2ccoc2C)c([N+](=O)[O-])c1 ZINC000178724407 473549080 /nfs/dbraw/zinc/54/90/80/473549080.db2.gz AGLJBLUMEZDVIC-UHFFFAOYSA-N 0 3 347.371 2.965 20 5 EFBDHN CN(CC1CCN(C)CC1)C(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000152473665 473567505 /nfs/dbraw/zinc/56/75/05/473567505.db2.gz HFBXCNAFWBJHAC-UHFFFAOYSA-N 0 3 342.399 2.557 20 5 EFBDHN CN(C[C@@H]1CCCN(C)C1)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000115438128 473567734 /nfs/dbraw/zinc/56/77/34/473567734.db2.gz FQHKCFUCIGHCSK-CYBMUJFWSA-N 0 3 346.431 2.583 20 5 EFBDHN COc1ccc(NC(=O)CN(CC2CC2)CC2CC2)c([N+](=O)[O-])c1 ZINC000115562559 473581775 /nfs/dbraw/zinc/58/17/75/473581775.db2.gz NFPIMOWNIGZWQU-UHFFFAOYSA-N 0 3 333.388 2.664 20 5 EFBDHN Cc1ccc(C(=O)N2CCCN(C3CCCC3)CC2)cc1[N+](=O)[O-] ZINC000172417477 473605086 /nfs/dbraw/zinc/60/50/86/473605086.db2.gz LGZYQEYNAMAYHS-UHFFFAOYSA-N 0 3 331.416 2.994 20 5 EFBDHN COc1cc(C(=O)N2CCCN(C3CCCC3)CC2)ccc1[N+](=O)[O-] ZINC000172420273 473606582 /nfs/dbraw/zinc/60/65/82/473606582.db2.gz QPGRPFYJMFEWKD-UHFFFAOYSA-N 0 3 347.415 2.694 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN[C@H]2CCO[C@@H]2c2ccc(Cl)cc2)c1 ZINC000192043587 473614192 /nfs/dbraw/zinc/61/41/92/473614192.db2.gz OXNJEBQKGQDMGL-LSDHHAIUSA-N 0 3 336.779 2.565 20 5 EFBDHN CN(C(=O)/C=C/c1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CCCN(C)C1 ZINC000153593332 473631435 /nfs/dbraw/zinc/63/14/35/473631435.db2.gz PQUWCNDQQQOETP-CFNZNRNTSA-N 0 3 337.807 2.814 20 5 EFBDHN CN1CCC[C@@H](CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 ZINC000170977491 473659563 /nfs/dbraw/zinc/65/95/63/473659563.db2.gz GFDHAQGKFRFEGN-NSHDSACASA-N 0 3 333.413 2.881 20 5 EFBDHN CSc1ccc(C(=O)NCCN2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000192472984 473683893 /nfs/dbraw/zinc/68/38/93/473683893.db2.gz DEBGNVAJLCJKEZ-LBPRGKRZSA-N 0 3 337.445 2.778 20 5 EFBDHN CNC(=O)CCN(C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000179409907 473685596 /nfs/dbraw/zinc/68/55/96/473685596.db2.gz LQOSAZBIISLRSW-UHFFFAOYSA-N 0 3 333.413 2.891 20 5 EFBDHN CCn1nc(C)c([N+](=O)[O-])c1NC[C@H](c1cccc(OC)c1)N(C)C ZINC000172823494 473689361 /nfs/dbraw/zinc/68/93/61/473689361.db2.gz NHWSHHSHJQNNDW-OAHLLOKOSA-N 0 3 347.419 2.843 20 5 EFBDHN CC[C@H]1CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)CCCO1 ZINC000281398323 473706018 /nfs/dbraw/zinc/70/60/18/473706018.db2.gz NJFDRVSZPQEYNJ-HNNXBMFYSA-N 0 3 335.404 2.733 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN[C@@H](CCCO)c2ccccc2)c1 ZINC000179743069 473717544 /nfs/dbraw/zinc/71/75/44/473717544.db2.gz YRGIIGBAKRKLAM-ZWKOTPCHSA-N 0 3 330.384 2.732 20 5 EFBDHN CN(C)[C@@H]1Cc2ccccc2N(C(=O)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000173004040 473723087 /nfs/dbraw/zinc/72/30/87/473723087.db2.gz ZVTGPGAUZHADQI-QGZVFWFLSA-N 0 3 339.395 2.657 20 5 EFBDHN O=C(C1CCN(C2CC2)CC1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000192794387 473726038 /nfs/dbraw/zinc/72/60/38/473726038.db2.gz WNFNJLRODLFNEV-UHFFFAOYSA-N 0 3 343.427 2.960 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)CCN(C)C1CC1 ZINC000186768393 473752572 /nfs/dbraw/zinc/75/25/72/473752572.db2.gz ZPDPUKKZZNMEGS-UHFFFAOYSA-N 0 3 337.445 2.873 20 5 EFBDHN CC[NH+](CC)Cc1cccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)c1 ZINC000186900953 473778718 /nfs/dbraw/zinc/77/87/18/473778718.db2.gz CCAPHRCXSXSAMN-UHFFFAOYSA-N 0 3 344.371 2.790 20 5 EFBDHN CN1CCCN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000269352925 473783493 /nfs/dbraw/zinc/78/34/93/473783493.db2.gz LADFFAHPDWGATD-UHFFFAOYSA-N 0 3 332.429 2.856 20 5 EFBDHN NC(=O)C[C@@H]1CCCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000180065067 473789245 /nfs/dbraw/zinc/78/92/45/473789245.db2.gz QOYOCSUOMGHWSS-ZDUSSCGKSA-N 0 3 343.383 2.942 20 5 EFBDHN COc1ccc(C(=O)NCCN[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000173339432 473809674 /nfs/dbraw/zinc/80/96/74/473809674.db2.gz ASIHXSSQQLUQHD-CYBMUJFWSA-N 0 3 343.383 2.684 20 5 EFBDHN CC(C)N1CCC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000274408758 473812027 /nfs/dbraw/zinc/81/20/27/473812027.db2.gz BRMLGBJYQCADHA-LLVKDONJSA-N 0 3 325.796 2.851 20 5 EFBDHN C[C@H]1c2ccccc2CCN1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000246287726 473817528 /nfs/dbraw/zinc/81/75/28/473817528.db2.gz BLEWYGBFFYMVTR-WMLDXEAASA-N 0 3 342.395 2.954 20 5 EFBDHN CC(C)N1CCC[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000274429912 473819341 /nfs/dbraw/zinc/81/93/41/473819341.db2.gz FSTXZLJAZUNVSU-CYBMUJFWSA-N 0 3 339.823 2.780 20 5 EFBDHN CCCN(CCN1CCCC1)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000288014211 473825258 /nfs/dbraw/zinc/82/52/58/473825258.db2.gz RLLQMAPHTWDDNA-UHFFFAOYSA-N 0 3 348.447 2.655 20 5 EFBDHN O=C(NCC1CCN(c2ccncc2)CC1)c1csc([N+](=O)[O-])c1 ZINC000180209024 473829138 /nfs/dbraw/zinc/82/91/38/473829138.db2.gz STCWCNJDLCNNAU-UHFFFAOYSA-N 0 3 346.412 2.698 20 5 EFBDHN COc1cc(OC)cc([C@H](O)CN[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173426430 473834784 /nfs/dbraw/zinc/83/47/84/473834784.db2.gz UKYMBBWIBAZPFL-KPZWWZAWSA-N 0 3 346.383 2.996 20 5 EFBDHN CCN1CCN(C[C@@H](C)CNc2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC000269676599 473857160 /nfs/dbraw/zinc/85/71/60/473857160.db2.gz YYSGYHLYUWUXMP-LBPRGKRZSA-N 0 3 342.390 2.559 20 5 EFBDHN COc1ccc(CNC(=O)[C@@H]2CCCN2C2CCCC2)cc1[N+](=O)[O-] ZINC000269684510 473860438 /nfs/dbraw/zinc/86/04/38/473860438.db2.gz NKESBRMIDWUFBO-HNNXBMFYSA-N 0 3 347.415 2.627 20 5 EFBDHN O=C(CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)NC1CC1 ZINC000263822778 473863695 /nfs/dbraw/zinc/86/36/95/473863695.db2.gz QNTNQXXXNFGBET-UHFFFAOYSA-N 0 3 331.397 2.692 20 5 EFBDHN C[C@H](NCCC(=O)Nc1cc(N)ccc1F)c1cccc([N+](=O)[O-])c1 ZINC000180411182 473870679 /nfs/dbraw/zinc/87/06/79/473870679.db2.gz UGOQNHNKRKVVLN-NSHDSACASA-N 0 3 346.362 2.996 20 5 EFBDHN CN(C)CCOc1ccc(CCNc2ncc([N+](=O)[O-])s2)cc1 ZINC000281935593 473889661 /nfs/dbraw/zinc/88/96/61/473889661.db2.gz PAXKRYAWXSJLJY-UHFFFAOYSA-N 0 3 336.417 2.646 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](N3CCCC3)C[C@H]2C)c1 ZINC000288264786 473891348 /nfs/dbraw/zinc/89/13/48/473891348.db2.gz GQROWFNNBQNNEX-KGLIPLIRSA-N 0 3 347.415 2.692 20 5 EFBDHN CCn1c(C)nc([N+](=O)[O-])c1NC[C@@H](c1cccc(OC)c1)N(C)C ZINC000288264393 473892291 /nfs/dbraw/zinc/89/22/91/473892291.db2.gz YTYPMENEICESQP-HNNXBMFYSA-N 0 3 347.419 2.843 20 5 EFBDHN CSc1ccc(C(=O)N2CCCN(C(C)C)CC2)cc1[N+](=O)[O-] ZINC000263923026 473906709 /nfs/dbraw/zinc/90/67/09/473906709.db2.gz WEDDTZHJBLVRNU-UHFFFAOYSA-N 0 3 337.445 2.873 20 5 EFBDHN CS[C@H]1CN(c2ccc(F)cc2[N+](=O)[O-])C[C@@H]1N1CCCC1 ZINC000274677926 473917187 /nfs/dbraw/zinc/91/71/87/473917187.db2.gz MZZDNNIABVWOKX-GJZGRUSLSA-N 0 3 325.409 2.750 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C/CN[C@@H](CO)C[C@@H](O)c1ccccc1 ZINC000269934068 473923677 /nfs/dbraw/zinc/92/36/77/473923677.db2.gz NRUQSHUOWVFTEN-LVJUENIKSA-N 0 3 342.395 2.682 20 5 EFBDHN C[C@@H]1CN(CCCCNc2ccc([N+](=O)[O-])c(N)c2F)C[C@H](C)O1 ZINC000274700013 473925802 /nfs/dbraw/zinc/92/58/02/473925802.db2.gz UDPKCKGTIJBKNI-TXEJJXNPSA-N 0 3 340.399 2.617 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)CCN(C)C1CC1 ZINC000282063997 473935369 /nfs/dbraw/zinc/93/53/69/473935369.db2.gz WGVYQVUEEWASOV-UHFFFAOYSA-N 0 3 336.392 2.551 20 5 EFBDHN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NC1CCN(C)CC1 ZINC000180720624 473950432 /nfs/dbraw/zinc/95/04/32/473950432.db2.gz FTZDJGWJFLSVRM-UHFFFAOYSA-N 0 3 337.445 2.919 20 5 EFBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@@H](CN2CCOCC2)C1 ZINC000282121201 473952828 /nfs/dbraw/zinc/95/28/28/473952828.db2.gz JLWIXUJBZFQBPH-CVEARBPZSA-N 0 3 333.432 2.700 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H](CN2CCOCC2)C1 ZINC000282130960 473955580 /nfs/dbraw/zinc/95/55/80/473955580.db2.gz KDAYITYLYVDKCE-CVEARBPZSA-N 0 3 333.432 2.700 20 5 EFBDHN CN(C)Cc1ccc(C(=O)N(C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000288552193 473978445 /nfs/dbraw/zinc/97/84/45/473978445.db2.gz YZHKGFDUFLJQPR-UHFFFAOYSA-N 0 3 341.411 2.971 20 5 EFBDHN C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000288582855 473988882 /nfs/dbraw/zinc/98/88/82/473988882.db2.gz XNUFRDUVDSQIQN-NWDGAFQWSA-N 0 3 337.807 2.947 20 5 EFBDHN CC(C)Oc1ccc([C@@H](CNc2c([N+](=O)[O-])ncn2C)N(C)C)cc1 ZINC000288591479 473992933 /nfs/dbraw/zinc/99/29/33/473992933.db2.gz SKSAIFWRSQKXDG-OAHLLOKOSA-N 0 3 347.419 2.830 20 5 EFBDHN CN(CCc1cccs1)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000174154685 473996549 /nfs/dbraw/zinc/99/65/49/473996549.db2.gz VGSFTUOSKUCCOG-AWEZNQCLSA-N 0 3 336.413 2.571 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)c1cccc(SC)c1[N+](=O)[O-] ZINC000188153347 474002710 /nfs/dbraw/zinc/00/27/10/474002710.db2.gz LJCJGECVGBIHTN-LBPRGKRZSA-N 0 3 337.445 2.921 20 5 EFBDHN C[C@H]1CCCN(CCNC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)C1 ZINC000282330049 474024083 /nfs/dbraw/zinc/02/40/83/474024083.db2.gz FSFSYBIOOHRRDK-HNNXBMFYSA-N 0 3 348.447 2.511 20 5 EFBDHN C[C@@H](NCCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1cccc(O)c1 ZINC000181521451 474043461 /nfs/dbraw/zinc/04/34/61/474043461.db2.gz ZBKLBQYEPQBYRD-GFCCVEGCSA-N 0 3 329.356 2.980 20 5 EFBDHN C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)C1CCN(C2CC2)CC1 ZINC000195347212 474062832 /nfs/dbraw/zinc/06/28/32/474062832.db2.gz XASBUZPIFDAKEZ-GFCCVEGCSA-N 0 3 329.400 2.747 20 5 EFBDHN CN(C)C(=O)c1cccc(CN(C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000282497295 474086913 /nfs/dbraw/zinc/08/69/13/474086913.db2.gz QNTDUGMINWUQDA-UHFFFAOYSA-N 0 3 341.411 2.971 20 5 EFBDHN CS[C@@H]1CN(C(=O)c2cc(C)cc([N+](=O)[O-])c2)C[C@@H]1N1CCCC1 ZINC000275164904 474090635 /nfs/dbraw/zinc/09/06/35/474090635.db2.gz VKRHCKJJMKJKEF-JKSUJKDBSA-N 0 3 349.456 2.555 20 5 EFBDHN CS[C@H]1CN(c2ccc([N+](=O)[O-])c3cnccc32)C[C@H]1N(C)C ZINC000270399456 474105186 /nfs/dbraw/zinc/10/51/86/474105186.db2.gz UZVQLSFOQYKCME-CVEARBPZSA-N 0 3 332.429 2.625 20 5 EFBDHN CN(C)c1cccc([C@@H]2CCCN2CCn2cc([N+](=O)[O-])cn2)c1 ZINC000174867669 474108027 /nfs/dbraw/zinc/10/80/27/474108027.db2.gz NXOKVWKIMGQUDN-KRWDZBQOSA-N 0 3 329.404 2.694 20 5 EFBDHN CN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000247331551 474121655 /nfs/dbraw/zinc/12/16/55/474121655.db2.gz VBSNZECEUMWDMB-SMDDNHRTSA-N 0 3 337.807 2.805 20 5 EFBDHN CC[C@H]1CN2CCC[C@@H]2CN1C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000175004640 474130428 /nfs/dbraw/zinc/13/04/28/474130428.db2.gz LEMLGTMEMBIFQU-DZGCQCFKSA-N 0 3 349.456 2.772 20 5 EFBDHN C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000247452310 474150717 /nfs/dbraw/zinc/15/07/17/474150717.db2.gz QHSAYQKWIHJYNJ-IAQYHMDHSA-N 0 3 339.823 2.589 20 5 EFBDHN COc1ccc([C@H](CCO)NCCOc2ccccc2[N+](=O)[O-])cc1 ZINC000182403003 474166982 /nfs/dbraw/zinc/16/69/82/474166982.db2.gz VRFKCLPSKBEWTR-INIZCTEOSA-N 0 3 346.383 2.696 20 5 EFBDHN C[C@@H](c1ccccc1)N(CCn1cc([N+](=O)[O-])ccc1=O)C1CC1 ZINC000270556530 474168177 /nfs/dbraw/zinc/16/81/77/474168177.db2.gz IVLBIDXHQPYYRL-AWEZNQCLSA-N 0 3 327.384 2.982 20 5 EFBDHN C[C@H]1CN(C)CC[C@H]1N(C)C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000247552535 474179744 /nfs/dbraw/zinc/17/97/44/474179744.db2.gz YXSOEODJVIRDTO-GXFFZTMASA-N 0 3 325.796 2.660 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c1 ZINC000282793390 474197659 /nfs/dbraw/zinc/19/76/59/474197659.db2.gz HMGWFIYVHWAMJP-STQMWFEESA-N 0 3 335.404 2.548 20 5 EFBDHN CC(C)N1C[C@@H](C)[C@H](NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000247690582 474200052 /nfs/dbraw/zinc/20/00/52/474200052.db2.gz QYFSLOKWZODDBU-IUODEOHRSA-N 0 3 342.399 2.602 20 5 EFBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])N[C@@H](C)C(=O)NCCF ZINC000282842241 474214383 /nfs/dbraw/zinc/21/43/83/474214383.db2.gz SUFLKTFUKSQZLN-RYUDHWBXSA-N 0 3 343.424 2.529 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nc(CNC[C@H]3CC[C@H](O)C3)cs2)c1 ZINC000188846952 474214928 /nfs/dbraw/zinc/21/49/28/474214928.db2.gz XAJNOTXOSKWBHV-NHYWBVRUSA-N 0 3 333.413 2.969 20 5 EFBDHN CN(C)CCN(Cc1ccccc1)C(=O)c1cccc([N+](=O)[O-])c1 ZINC000247964873 474235451 /nfs/dbraw/zinc/23/54/51/474235451.db2.gz GGSFYXLCQVGCIB-UHFFFAOYSA-N 0 3 327.384 2.799 20 5 EFBDHN COCCCN(CCO)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000188929557 474237853 /nfs/dbraw/zinc/23/78/53/474237853.db2.gz TXVOVFBLZFCKSO-UHFFFAOYSA-N 0 3 334.372 2.686 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC[C@H](Cn2cncn2)C1 ZINC000182790625 474256460 /nfs/dbraw/zinc/25/64/60/474256460.db2.gz GXPSBBMWUJAUTP-CABCVRRESA-N 0 3 329.404 2.968 20 5 EFBDHN CN1CC[C@@H](CNC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C1 ZINC000275660305 474270567 /nfs/dbraw/zinc/27/05/67/474270567.db2.gz LMCQHEJIDNJOMN-ZDUSSCGKSA-N 0 3 335.407 2.775 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC[C@H](Cn2ccnn2)C1 ZINC000182924990 474288694 /nfs/dbraw/zinc/28/86/94/474288694.db2.gz ZEAOYNJBTRHQQN-GJZGRUSLSA-N 0 3 329.404 2.968 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC[C@H](Cn2ccnn2)C1 ZINC000182924969 474288899 /nfs/dbraw/zinc/28/88/99/474288899.db2.gz ZEAOYNJBTRHQQN-CABCVRRESA-N 0 3 329.404 2.968 20 5 EFBDHN CN(C)C1(CN(C)C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)CCC1 ZINC000275722735 474294607 /nfs/dbraw/zinc/29/46/07/474294607.db2.gz IQGNRUUWBHBPPM-UHFFFAOYSA-N 0 3 331.372 2.897 20 5 EFBDHN C[C@@H]1CCC[C@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@H]1C ZINC000248373547 474298587 /nfs/dbraw/zinc/29/85/87/474298587.db2.gz JRBJHKFHOJKZIW-WWGRRREGSA-N 0 3 340.445 2.783 20 5 EFBDHN CN(C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@H]1CCc2ccccc21 ZINC000248375151 474299534 /nfs/dbraw/zinc/29/95/34/474299534.db2.gz VVDBITHFEITYEH-RDJZCZTQSA-N 0 3 342.395 2.954 20 5 EFBDHN CN(C)C1(CN(C)C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CCC1 ZINC000275769988 474311358 /nfs/dbraw/zinc/31/13/58/474311358.db2.gz DHAQMJRNCGSHEZ-UHFFFAOYSA-N 0 3 330.388 2.632 20 5 EFBDHN C[C@@H]1CC[C@@H](NCC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)[C@@H](C)C1 ZINC000248543597 474351370 /nfs/dbraw/zinc/35/13/70/474351370.db2.gz DBVDDQMJXQPIEP-GRYCIOLGSA-N 0 3 349.387 2.676 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000265868189 474366591 /nfs/dbraw/zinc/36/65/91/474366591.db2.gz IDUYPSYOYZJTRG-CQSZACIVSA-N 0 3 342.399 2.660 20 5 EFBDHN C[C@@H](C(=O)NCCN1CCC[C@H](C)C1)c1ccc([N+](=O)[O-])cc1F ZINC000248615497 474378043 /nfs/dbraw/zinc/37/80/43/474378043.db2.gz YVIIXTMWADLRPL-QWHCGFSZSA-N 0 3 337.395 2.686 20 5 EFBDHN CCS[C@H]1CCCC[C@@H]1NCc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000189489865 474416974 /nfs/dbraw/zinc/41/69/74/474416974.db2.gz UHDNMWHOOTXDLT-ZFWWWQNUSA-N 0 3 337.445 2.848 20 5 EFBDHN CCS[C@@H]1CCCC[C@@H]1NCc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000189489843 474417472 /nfs/dbraw/zinc/41/74/72/474417472.db2.gz UHDNMWHOOTXDLT-DZGCQCFKSA-N 0 3 337.445 2.848 20 5 EFBDHN CCOc1ccc([C@H](C)NCCSCCCO)cc1[N+](=O)[O-] ZINC000271170378 474418608 /nfs/dbraw/zinc/41/86/08/474418608.db2.gz UCXHQXAIDCLLJT-LBPRGKRZSA-N 0 3 328.434 2.760 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccccc1[N+](=O)[O-] ZINC000248760228 474429416 /nfs/dbraw/zinc/42/94/16/474429416.db2.gz GMRJOBWJJPHRHL-RHSMWYFYSA-N 0 3 339.395 2.845 20 5 EFBDHN CC(C)c1ccc(C(=O)N2CC[C@@H]3CCN(C)C[C@@H]32)cc1[N+](=O)[O-] ZINC000276166803 474438221 /nfs/dbraw/zinc/43/82/21/474438221.db2.gz RNPZPQKPPVXHOT-GUYCJALGSA-N 0 3 331.416 2.884 20 5 EFBDHN CN(Cc1ccc(Br)c([N+](=O)[O-])c1)C[C@@H]1CCC[C@H]1O ZINC000271231793 474454694 /nfs/dbraw/zinc/45/46/94/474454694.db2.gz CGCLJSKNKYQSLR-SMDDNHRTSA-N 0 3 343.221 2.950 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CNCCC(OCC)OCC ZINC000276253122 474468827 /nfs/dbraw/zinc/46/88/27/474468827.db2.gz SKMABZDYNAOWHC-UHFFFAOYSA-N 0 3 326.393 2.872 20 5 EFBDHN C[C@H]1CN(C)CC[C@H]1N(C)c1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000271304389 474484103 /nfs/dbraw/zinc/48/41/03/474484103.db2.gz HHJDWUJCXFIJON-CMPLNLGQSA-N 0 3 329.347 2.973 20 5 EFBDHN O=C(c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)N1CCCNCC1 ZINC000237873625 474491528 /nfs/dbraw/zinc/49/15/28/474491528.db2.gz QDBGQLIBEKWPOH-UHFFFAOYSA-N 0 3 340.383 2.774 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NCCN2CCCC[C@H]2CC)c1 ZINC000283859599 474513625 /nfs/dbraw/zinc/51/36/25/474513625.db2.gz HMASALSBAOOPTM-CQSZACIVSA-N 0 3 349.431 2.988 20 5 EFBDHN C[C@H](CO)N(Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCCC1 ZINC000276471408 474556194 /nfs/dbraw/zinc/55/61/94/474556194.db2.gz QLHXEFLCRWSUFC-GFCCVEGCSA-N 0 3 346.387 2.770 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CNC[C@]2(O)CCSC2)o1 ZINC000267005727 474562894 /nfs/dbraw/zinc/56/28/94/474562894.db2.gz FEZRMAVFLWJKIU-MRXNPFEDSA-N 0 3 334.397 2.812 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])NCC1(C)OCCO1 ZINC000271479844 474565363 /nfs/dbraw/zinc/56/53/63/474565363.db2.gz JLYMKYVAAFWLAI-GFCCVEGCSA-N 0 3 326.418 2.818 20 5 EFBDHN Cc1cc(F)c(NC(=O)N2C[C@@H]3CCCN3C[C@H]2C)cc1[N+](=O)[O-] ZINC000284081525 474567532 /nfs/dbraw/zinc/56/75/32/474567532.db2.gz RMAVHXWCLLWXFM-NEPJUHHUSA-N 0 3 336.367 2.743 20 5 EFBDHN C[C@@H](CN1CCC[C@H](C)C1)NC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000245389958 474577374 /nfs/dbraw/zinc/57/73/74/474577374.db2.gz KCMDUTJXTQGNBZ-GJZGRUSLSA-N 0 3 348.447 2.557 20 5 EFBDHN C[C@H](CNC(=O)NCc1ccc([N+](=O)[O-])cc1)N1CCC[C@H](C)C1 ZINC000249689805 474603822 /nfs/dbraw/zinc/60/38/22/474603822.db2.gz PGYBJYMDINXRQB-UONOGXRCSA-N 0 3 334.420 2.514 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCN2CCc3ccc(O)cc3CC2)c1 ZINC000609133392 480115169 /nfs/dbraw/zinc/11/51/69/480115169.db2.gz VTUSITGMPAFRNZ-UHFFFAOYSA-N 0 3 328.368 2.780 20 5 EFBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN[C@@H]1CCCC[C@H]1C(N)=O ZINC000184828477 474615762 /nfs/dbraw/zinc/61/57/62/474615762.db2.gz FOHLLWMWOXWDLC-HUUCEWRRSA-N 0 3 335.404 2.516 20 5 EFBDHN CN1CC[C@@H](CNC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000291555871 474617652 /nfs/dbraw/zinc/61/76/52/474617652.db2.gz XGIRYZBOJVDXBB-QMMMGPOBSA-N 0 3 332.187 2.583 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CN2CC[C@@H](c3ccccc3)C2)c1 ZINC000250201508 474631380 /nfs/dbraw/zinc/63/13/80/474631380.db2.gz CVUHSFRLZYGVBV-SJLPKXTDSA-N 0 3 342.395 2.824 20 5 EFBDHN C[C@@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])[C@H](c1ccccc1)N(C)C ZINC000291666410 474645107 /nfs/dbraw/zinc/64/51/07/474645107.db2.gz LHUBZFOXBPYJPB-SJKOYZFVSA-N 0 3 342.399 2.598 20 5 EFBDHN C[C@@H](Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)C1=CCN(C)CC1 ZINC000272940531 474646425 /nfs/dbraw/zinc/64/64/25/474646425.db2.gz LWBAVBZUQMZXOT-LLVKDONJSA-N 0 3 330.388 2.542 20 5 EFBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNC[C@@H](CO)[C@@H]1CCOC1 ZINC000291679316 474647505 /nfs/dbraw/zinc/64/75/05/474647505.db2.gz XDOHQYNQNOUBAL-KOLCDFICSA-N 0 3 349.214 2.636 20 5 EFBDHN C[C@@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CCN(C2CCC2)C1 ZINC000291682878 474648409 /nfs/dbraw/zinc/64/84/09/474648409.db2.gz CMXLIGIBZSXGSI-ZDUSSCGKSA-N 0 3 332.404 2.933 20 5 EFBDHN C[C@H]1OCC[C@@]1(O)CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291702586 474653276 /nfs/dbraw/zinc/65/32/76/474653276.db2.gz ZDSHABRSZYKDAY-AMIZOPFISA-N 0 3 335.187 2.531 20 5 EFBDHN C[C@H](CCc1ccccc1[N+](=O)[O-])NCc1ccnc(N(C)C)n1 ZINC000344339630 474663609 /nfs/dbraw/zinc/66/36/09/474663609.db2.gz XDIVUVZMHAJJSF-CYBMUJFWSA-N 0 3 329.404 2.562 20 5 EFBDHN COc1cc(CNCC[C@@H]2CCO[C@@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000273034629 474682133 /nfs/dbraw/zinc/68/21/33/474682133.db2.gz GXIYWWULUWGZNL-QWHCGFSZSA-N 0 3 338.404 2.907 20 5 EFBDHN CCOc1ccc([C@H](C)NCC2(N3CCOCC3)CC2)cc1[N+](=O)[O-] ZINC000278590855 474723680 /nfs/dbraw/zinc/72/36/80/474723680.db2.gz YWZWBKNTXQOOFL-AWEZNQCLSA-N 0 3 349.431 2.509 20 5 EFBDHN Cc1cccc(CN(C)C[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000338951917 474770786 /nfs/dbraw/zinc/77/07/86/474770786.db2.gz WILFGQICFYDPJJ-QGZVFWFLSA-N 0 3 330.384 2.775 20 5 EFBDHN CCNC(=O)C1(CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)CCC1 ZINC000278677821 474772176 /nfs/dbraw/zinc/77/21/76/474772176.db2.gz JOVKRMDGJXTDKO-INIZCTEOSA-N 0 3 331.416 2.868 20 5 EFBDHN CN(C)C[C@H]1CCCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000268070201 474781558 /nfs/dbraw/zinc/78/15/58/474781558.db2.gz AFULZZIAUUJPOO-CYBMUJFWSA-N 0 3 333.413 2.976 20 5 EFBDHN O=[N+]([O-])c1ccc(NCc2ccccc2CN2CC[C@@H](O)C2)c(F)c1 ZINC000273233582 474792294 /nfs/dbraw/zinc/79/22/94/474792294.db2.gz SDTHVFPGXVBFEE-MRXNPFEDSA-N 0 3 345.374 2.913 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N[C@H]2CN(C3CC3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000268096324 474796064 /nfs/dbraw/zinc/79/60/64/474796064.db2.gz CQKUPOYSXXTXBE-XEZPLFJOSA-N 0 3 346.431 2.746 20 5 EFBDHN C[C@H](CNC(=O)NCCc1ccccc1[N+](=O)[O-])N1CCCC[C@H]1C ZINC000340942986 474802147 /nfs/dbraw/zinc/80/21/47/474802147.db2.gz XMVWTPIKNLTWFJ-HUUCEWRRSA-N 0 3 348.447 2.699 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C\CN1CCN(CC2CCOCC2)CC1 ZINC000255091105 474802421 /nfs/dbraw/zinc/80/24/21/474802421.db2.gz FNVMIOVVFMCTTB-HYXAFXHYSA-N 0 3 345.443 2.652 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@@H](C)C[S@](C)=O ZINC000273257471 474806492 /nfs/dbraw/zinc/80/64/92/474806492.db2.gz MDBUJMTUOJWMPF-DCVWQXJKSA-N 0 3 330.475 2.822 20 5 EFBDHN Cc1nn(C)c(NC[C@@]2(C)CCN(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000310931468 474832189 /nfs/dbraw/zinc/83/21/89/474832189.db2.gz TZUZOTIZGVOZIW-GOSISDBHSA-N 0 3 343.431 2.961 20 5 EFBDHN Cc1ccc([C@H]2C[C@H](C)N(CCn3cc([N+](=O)[O-])ccc3=O)C2)cc1 ZINC000278809515 474846053 /nfs/dbraw/zinc/84/60/53/474846053.db2.gz ZYYVWLJZFINDRD-RDJZCZTQSA-N 0 3 341.411 2.943 20 5 EFBDHN Cc1ccc(CN2CCN(C3CCOCC3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000278843511 474866279 /nfs/dbraw/zinc/86/62/79/474866279.db2.gz ZXOBSDOYNOPNJC-OAHLLOKOSA-N 0 3 333.432 2.588 20 5 EFBDHN C[C@H]1CN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CCN(C2CCC2)C1 ZINC000292161868 474880569 /nfs/dbraw/zinc/88/05/69/474880569.db2.gz DBUMRNRJGOAUIR-GFCCVEGCSA-N 0 3 334.376 2.814 20 5 EFBDHN C[C@@H](NC[C@](C)(O)c1ccc(F)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000285078975 474885249 /nfs/dbraw/zinc/88/52/49/474885249.db2.gz JMAJBWLIJRSYKE-DIFFPNOSSA-N 0 3 333.363 2.874 20 5 EFBDHN O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CCC[C@H]1CN1CCCC1 ZINC000273456981 474907468 /nfs/dbraw/zinc/90/74/68/474907468.db2.gz MBPDVLMLCFVQKB-ZDUSSCGKSA-N 0 3 336.367 2.826 20 5 EFBDHN CN(C)CCOc1cnccc1CNc1c(F)cccc1[N+](=O)[O-] ZINC000341048195 474914531 /nfs/dbraw/zinc/91/45/31/474914531.db2.gz SNPYXOGVCNDREC-UHFFFAOYSA-N 0 3 334.351 2.681 20 5 EFBDHN CC[C@@H]1CCC[C@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000273484190 474924358 /nfs/dbraw/zinc/92/43/58/474924358.db2.gz VDNZAYJWHAPYEQ-IUODEOHRSA-N 0 3 326.418 2.537 20 5 EFBDHN Cc1cc(NCc2ccncc2OCCN(C)C)ccc1[N+](=O)[O-] ZINC000341060379 474928847 /nfs/dbraw/zinc/92/88/47/474928847.db2.gz ZHONSIWDEKPYOV-UHFFFAOYSA-N 0 3 330.388 2.851 20 5 EFBDHN CC[C@@H](NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)c1ccc(Cl)s1 ZINC000273513351 474939609 /nfs/dbraw/zinc/93/96/09/474939609.db2.gz PAVFPWOJPKXJRQ-GHMZBOCLSA-N 0 3 344.824 2.608 20 5 EFBDHN C[C@H]1C[C@@H](O)CCN1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000292291829 474944768 /nfs/dbraw/zinc/94/47/68/474944768.db2.gz CPVLOZYFCYCTTL-WFASDCNBSA-N 0 3 331.372 2.638 20 5 EFBDHN CNC(=O)[C@H]1CCC[C@@H]1NCc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339125408 474951971 /nfs/dbraw/zinc/95/19/71/474951971.db2.gz VJWGUTJUSSMBKK-AAEUAGOBSA-N 0 3 345.321 2.618 20 5 EFBDHN Cc1nnc([C@@H]2CCCN(Cc3nc4cc([N+](=O)[O-])ccc4o3)C2)[nH]1 ZINC000268424999 474971557 /nfs/dbraw/zinc/97/15/57/474971557.db2.gz DPHBIGXIFKTOMX-LLVKDONJSA-N 0 3 342.359 2.542 20 5 EFBDHN Cc1ccc(OC[C@@H](O)CNCc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000324597558 474973174 /nfs/dbraw/zinc/97/31/74/474973174.db2.gz HLCONEYJBRKSKV-KRWDZBQOSA-N 0 3 330.384 2.741 20 5 EFBDHN CN(C)C(=O)c1cccc(CN(C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000285375194 474995470 /nfs/dbraw/zinc/99/54/70/474995470.db2.gz RGHZBMYWEDHXPK-UHFFFAOYSA-N 0 3 341.411 2.971 20 5 EFBDHN Cc1cc(NC[C@@H]2CN3CCC[C@H]3CO2)c2cc([N+](=O)[O-])ccc2n1 ZINC000326872087 475012523 /nfs/dbraw/zinc/01/25/23/475012523.db2.gz AXRNFOWXZSDQQH-LSDHHAIUSA-N 0 3 342.399 2.727 20 5 EFBDHN CN1CC[C@@]2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4o3)C2)C1 ZINC000292416882 475013635 /nfs/dbraw/zinc/01/36/35/475013635.db2.gz ZYVBEJGHFSLYQW-QGZVFWFLSA-N 0 3 329.356 2.509 20 5 EFBDHN CN1CC[C@@]2(CCN(c3cc(C(F)(F)F)ncc3[N+](=O)[O-])C2)C1 ZINC000292417095 475015173 /nfs/dbraw/zinc/01/51/73/475015173.db2.gz WEVYDPNREKVYGF-CYBMUJFWSA-N 0 3 330.310 2.541 20 5 EFBDHN Cc1cc(C(=O)NC[C@@H]2NCCc3ccccc32)cc([N+](=O)[O-])c1 ZINC000261684206 475023881 /nfs/dbraw/zinc/02/38/81/475023881.db2.gz MZKLKJKUBLHBQT-KRWDZBQOSA-N 0 3 325.368 2.520 20 5 EFBDHN COc1ccc(CN2CCNC[C@@H]2c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000261768650 475057524 /nfs/dbraw/zinc/05/75/24/475057524.db2.gz OPJGMVLPZKEGDJ-QGZVFWFLSA-N 0 3 345.374 2.889 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(C2CCC2)C[C@@H](C)C1 ZINC000292528760 475072015 /nfs/dbraw/zinc/07/20/15/475072015.db2.gz ZIKZDPHBFWINNX-CYBMUJFWSA-N 0 3 331.416 2.850 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)CN1C1CC1 ZINC000273889491 475102925 /nfs/dbraw/zinc/10/29/25/475102925.db2.gz VDDNCWGDTLQAOY-NWDGAFQWSA-N 0 3 349.406 2.753 20 5 EFBDHN CCN1CCC[C@H]1CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000273915151 475115582 /nfs/dbraw/zinc/11/55/82/475115582.db2.gz DPOINICJCUCLIA-ZDUSSCGKSA-N 0 3 337.395 2.612 20 5 EFBDHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)NC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000292625657 475121907 /nfs/dbraw/zinc/12/19/07/475121907.db2.gz OUUQBJLGPZLJMH-DOMZBBRYSA-N 0 3 346.431 2.612 20 5 EFBDHN C[C@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cn2)CCN1Cc1ccccc1 ZINC000273959027 475138596 /nfs/dbraw/zinc/13/85/96/475138596.db2.gz NSSGUWISJHITMS-ZFWWWQNUSA-N 0 3 327.388 2.850 20 5 EFBDHN CN(C)C1(CNC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])CCC1 ZINC000292662712 475140033 /nfs/dbraw/zinc/14/00/33/475140033.db2.gz OOXSOZSXCLRIMR-UHFFFAOYSA-N 0 3 334.420 2.613 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(NCC2=CCN(C)CC2)cc1Cl ZINC000274001202 475157691 /nfs/dbraw/zinc/15/76/91/475157691.db2.gz SZLCZOZRXYXIPF-UHFFFAOYSA-N 0 3 339.779 2.709 20 5 EFBDHN CCCOc1ccc([C@@H](C)NCCn2ccc([N+](=O)[O-])n2)cc1OC ZINC000341629448 475194277 /nfs/dbraw/zinc/19/42/77/475194277.db2.gz PADKCSXGEIYVNC-CYBMUJFWSA-N 0 3 348.403 2.940 20 5 EFBDHN CN(C)C1(CNC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CCC1 ZINC000296138875 475206943 /nfs/dbraw/zinc/20/69/43/475206943.db2.gz ZOEOLNDGCWTTIM-UHFFFAOYSA-N 0 3 345.321 2.828 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCN(CC3CC3)C2)c1 ZINC000609383518 480154864 /nfs/dbraw/zinc/15/48/64/480154864.db2.gz ROYUATLXASSVAK-GFCCVEGCSA-N 0 3 335.429 2.531 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCN1CCC[C@@H]1Cc1ccc(F)cc1 ZINC000361178661 475247996 /nfs/dbraw/zinc/24/79/96/475247996.db2.gz QYPOGEVGNUOYAK-MRXNPFEDSA-N 0 3 345.374 2.603 20 5 EFBDHN CCn1cc([C@H](C)NCCOc2ccc(OC)cc2[N+](=O)[O-])cn1 ZINC000296287174 475253695 /nfs/dbraw/zinc/25/36/95/475253695.db2.gz ZAOQAJHUTMCTEG-LBPRGKRZSA-N 0 3 334.376 2.549 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC[C@H](CCC(N)=O)C1 ZINC000347371720 475272892 /nfs/dbraw/zinc/27/28/92/475272892.db2.gz VSXVOPUKJWFXBX-YVGNARHYSA-N 0 3 331.416 2.976 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC2(CNC(=O)C2)CC1 ZINC000347373596 475277856 /nfs/dbraw/zinc/27/78/56/475277856.db2.gz RRSPFUGXPZDBPS-ZROIWOOFSA-N 0 3 329.400 2.600 20 5 EFBDHN NC(=O)C[C@H](NC/C=C/c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000339529944 475278139 /nfs/dbraw/zinc/27/81/39/475278139.db2.gz FDNGKSCDXZDXJK-DHINHOHASA-N 0 3 325.368 2.814 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CN2CC3(CCOCC3)[C@@H]2C2CC2)c1 ZINC000296421817 475307182 /nfs/dbraw/zinc/30/71/82/475307182.db2.gz XZTRWWSUIXYQOL-IRXDYDNUSA-N 0 3 332.400 2.519 20 5 EFBDHN C[C@@H]1CN(C)C[C@H]1c1nc(Cc2c[nH]c3ccc([N+](=O)[O-])cc23)no1 ZINC000361262776 475311539 /nfs/dbraw/zinc/31/15/39/475311539.db2.gz PKCIJNIAJPELTD-QMTHXVAHSA-N 0 3 341.371 2.715 20 5 EFBDHN Cn1ccc(CCNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)n1 ZINC000354660129 475322188 /nfs/dbraw/zinc/32/21/88/475322188.db2.gz UAGLPDYAAJQJQB-UHFFFAOYSA-N 0 3 326.356 2.921 20 5 EFBDHN CC(C)C[C@@H](CN1CCCC1)NC(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000296557380 475370586 /nfs/dbraw/zinc/37/05/86/475370586.db2.gz ZTOKMNCWEWBCJI-AWEZNQCLSA-N 0 3 337.395 2.974 20 5 EFBDHN C[C@@H](CN1CCCCC1)NC(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000296558648 475370767 /nfs/dbraw/zinc/37/07/67/475370767.db2.gz UJNDMQAKBVIEHO-KBPBESRZSA-N 0 3 334.420 2.829 20 5 EFBDHN C[C@@H]1[C@H](NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)CCCN1C ZINC000345750741 475419591 /nfs/dbraw/zinc/41/95/91/475419591.db2.gz OHPWTCQFYNTGEB-CXAGYDPISA-N 0 3 346.431 2.752 20 5 EFBDHN C[C@H]1[C@@H](NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)CCCN1C ZINC000345756440 475425229 /nfs/dbraw/zinc/42/52/29/475425229.db2.gz SLEWFQXVEVGIIG-WFASDCNBSA-N 0 3 334.420 2.612 20 5 EFBDHN Cc1cc(F)c(NC(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000296685655 475429543 /nfs/dbraw/zinc/42/95/43/475429543.db2.gz IZJRCEOSYUVQKX-NEPJUHHUSA-N 0 3 338.383 2.989 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000296697928 475435275 /nfs/dbraw/zinc/43/52/75/475435275.db2.gz RSGPKDQCLYRILI-XJKSGUPXSA-N 0 3 334.420 2.829 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN[C@H](C(C)C)C1(CO)CCC1 ZINC000339726798 475447053 /nfs/dbraw/zinc/44/70/53/475447053.db2.gz AFHWNCDWWBABIX-QGZVFWFLSA-N 0 3 349.431 2.619 20 5 EFBDHN Cc1cc(Cl)c(C(=O)N2CC[C@H]3CCN(C)C[C@H]32)cc1[N+](=O)[O-] ZINC000296791790 475479608 /nfs/dbraw/zinc/47/96/08/475479608.db2.gz OFKHLBYHGIZMLG-IAQYHMDHSA-N 0 3 337.807 2.723 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)ccc1CN[C@@H](C1CC1)[C@@]1(CO)CCCO1 ZINC000339767945 475482044 /nfs/dbraw/zinc/48/20/44/475482044.db2.gz VDIWVHBHXFZFIX-HOTGVXAUSA-N 0 3 340.807 2.658 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)ccc1CN[C@H](C1CC1)[C@]1(CO)CCCO1 ZINC000339767946 475482682 /nfs/dbraw/zinc/48/26/82/475482682.db2.gz VDIWVHBHXFZFIX-HZPDHXFCSA-N 0 3 340.807 2.658 20 5 EFBDHN Cc1cc(NC(=O)N2CC[C@@]3(C2)CCCN(C)C3)ccc1[N+](=O)[O-] ZINC000296837202 475498038 /nfs/dbraw/zinc/49/80/38/475498038.db2.gz NSMDCHRPNIHQAI-KRWDZBQOSA-N 0 3 332.404 2.853 20 5 EFBDHN C[C@H](NC(=O)NC[C@H]1CCCCN1C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000296852847 475506710 /nfs/dbraw/zinc/50/67/10/475506710.db2.gz LCCCFUWVWVROQK-SUMWQHHRSA-N 0 3 346.431 2.972 20 5 EFBDHN CN(C)CCN(C(=O)COc1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000338037611 475531910 /nfs/dbraw/zinc/53/19/10/475531910.db2.gz VKKXWMLVHYBKHS-UHFFFAOYSA-N 0 3 349.431 2.697 20 5 EFBDHN CN1CC[C@@H]2[C@@H](CCCN2C(=O)CSc2ccccc2[N+](=O)[O-])C1 ZINC000332182539 475547125 /nfs/dbraw/zinc/54/71/25/475547125.db2.gz VFVCTYQZYAQAFK-UONOGXRCSA-N 0 3 349.456 2.630 20 5 EFBDHN C[C@@H]1C[C@@H]1N1CCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000346151582 475564638 /nfs/dbraw/zinc/56/46/38/475564638.db2.gz ZEVFWSMVBNRACT-ZOWXZIJZSA-N 0 3 335.379 2.536 20 5 EFBDHN Cc1cccc(C(=O)N2CCN([C@@H]3C[C@H]3C)C[C@@H](C)C2)c1[N+](=O)[O-] ZINC000346160230 475566417 /nfs/dbraw/zinc/56/64/17/475566417.db2.gz FEOFWTABEPXWCJ-XNRPHZJLSA-N 0 3 331.416 2.706 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)CN(CC1CC1)C1CCC1 ZINC000361581088 475566794 /nfs/dbraw/zinc/56/67/94/475566794.db2.gz FKWLPHPQANMPDI-UHFFFAOYSA-N 0 3 333.388 2.806 20 5 EFBDHN C[C@H]1C[C@H](N(C)C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)CCN1C ZINC000332240997 475571222 /nfs/dbraw/zinc/57/12/22/475571222.db2.gz IZQJQBZVUDEXEJ-NWDGAFQWSA-N 0 3 330.388 2.631 20 5 EFBDHN CN(Cc1ccccc1)CC(C)(C)NC(=O)CCC(C)(C)[N+](=O)[O-] ZINC000297113845 475616215 /nfs/dbraw/zinc/61/62/15/475616215.db2.gz LVYJILCPSRKOBX-UHFFFAOYSA-N 0 3 335.448 2.849 20 5 EFBDHN CC(C)(NC[C@@H](O)COc1ccccc1[N+](=O)[O-])c1cccs1 ZINC000348356927 475616717 /nfs/dbraw/zinc/61/67/17/475616717.db2.gz ODDCAHWIPPNYIK-GFCCVEGCSA-N 0 3 336.413 2.921 20 5 EFBDHN Cc1nc(N2CCCN(Cc3ccccc3)C[C@@H]2C)ncc1[N+](=O)[O-] ZINC000297125803 475622686 /nfs/dbraw/zinc/62/26/86/475622686.db2.gz MRVJLUAYLHHFSD-AWEZNQCLSA-N 0 3 341.415 2.794 20 5 EFBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CC[C@@H](N2CCN(C)CC2)[C@H](C)C1 ZINC000332394239 475624311 /nfs/dbraw/zinc/62/43/11/475624311.db2.gz NWMSVDZROBHDJZ-JTDSTZFVSA-N 0 3 346.475 2.614 20 5 EFBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[C@@H](N2CCN(C)CC2)[C@H](C)C1 ZINC000332398326 475624564 /nfs/dbraw/zinc/62/45/64/475624564.db2.gz QRTJQZQGXAGOQZ-SOLBZPMBSA-N 0 3 346.475 2.614 20 5 EFBDHN COc1ccc([C@@H](CNc2ccc([N+](=O)[O-])nc2)N(C)C)cc1OC ZINC000339961096 475641953 /nfs/dbraw/zinc/64/19/53/475641953.db2.gz XNKLCFOAJMIIOS-CQSZACIVSA-N 0 3 346.387 2.722 20 5 EFBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])N[C@@H]1CC(=O)N(C2CC2)C1 ZINC000358391756 475644375 /nfs/dbraw/zinc/64/43/75/475644375.db2.gz FOEIZXBQAQFSLP-QWHCGFSZSA-N 0 3 349.456 2.818 20 5 EFBDHN CCC[C@H]1CN(Cc2ccc(C)c([N+](=O)[O-])c2)CCN1CCOC ZINC000355115406 475676423 /nfs/dbraw/zinc/67/64/23/475676423.db2.gz RORJBUUGYAMTBH-KRWDZBQOSA-N 0 3 335.448 2.836 20 5 EFBDHN CC[C@H]1CN2CCC[C@H]2CN1C(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000332592758 475679724 /nfs/dbraw/zinc/67/97/24/475679724.db2.gz NWOSJGTVEYSTCA-GJZGRUSLSA-N 0 3 331.416 2.910 20 5 EFBDHN COc1cc(C[NH2+]CC2(C)CCC(OC)CC2)c([N+](=O)[O-])cc1[O-] ZINC000355125061 475682728 /nfs/dbraw/zinc/68/27/28/475682728.db2.gz CSDFCKNZVDFCCJ-UHFFFAOYSA-N 0 3 338.404 2.994 20 5 EFBDHN CCNc1ccc(C(=O)N2C[C@H]3CCCN3C[C@H]2CC)cc1[N+](=O)[O-] ZINC000332655471 475703992 /nfs/dbraw/zinc/70/39/92/475703992.db2.gz VKLSFEZZDSUGEK-HUUCEWRRSA-N 0 3 346.431 2.725 20 5 EFBDHN CC(C)(C(=O)N1CCC[C@@H](N2CCCC2)C1)c1ccccc1[N+](=O)[O-] ZINC000340041407 475708968 /nfs/dbraw/zinc/70/89/68/475708968.db2.gz QOCZHNDHQFTTEC-OAHLLOKOSA-N 0 3 345.443 2.959 20 5 EFBDHN Cc1nc([C@@H]2CCCN(CC=Cc3ccccc3[N+](=O)[O-])C2)n[nH]1 ZINC000355172493 475717042 /nfs/dbraw/zinc/71/70/42/475717042.db2.gz OLGRDYSRTOUTBY-IJVDHGTGSA-N 0 3 327.388 2.914 20 5 EFBDHN Cc1n[nH]c([C@@H]2CCCN(CC=Cc3ccccc3[N+](=O)[O-])C2)n1 ZINC000355172493 475717051 /nfs/dbraw/zinc/71/70/51/475717051.db2.gz OLGRDYSRTOUTBY-IJVDHGTGSA-N 0 3 327.388 2.914 20 5 EFBDHN Cc1nnc([C@@H]2CCCN(CC=Cc3ccccc3[N+](=O)[O-])C2)[nH]1 ZINC000355172493 475717060 /nfs/dbraw/zinc/71/70/60/475717060.db2.gz OLGRDYSRTOUTBY-IJVDHGTGSA-N 0 3 327.388 2.914 20 5 EFBDHN CC(C)(C)[C@@H]1NC(=O)CC[C@@H]1NC/C=C/c1ccccc1[N+](=O)[O-] ZINC000353147430 475718322 /nfs/dbraw/zinc/71/83/22/475718322.db2.gz YQXSVXLKEORFMY-KLYJYZACSA-N 0 3 331.416 2.891 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN[C@H]1CCC[C@H]1OC(F)F ZINC000348519496 475720091 /nfs/dbraw/zinc/72/00/91/475720091.db2.gz DBGNPFAOJNQFMB-CMPLNLGQSA-N 0 3 343.330 2.592 20 5 EFBDHN COc1cc(C(=O)NC[C@@H](C)N2CCCC[C@H]2C)cc([N+](=O)[O-])c1C ZINC000358499780 475728208 /nfs/dbraw/zinc/72/82/08/475728208.db2.gz UAYSVNYTWBBRMR-CHWSQXEVSA-N 0 3 349.431 2.905 20 5 EFBDHN CC1CCC(N2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)CC1 ZINC000358505879 475733565 /nfs/dbraw/zinc/73/35/65/475733565.db2.gz BOAALNQGMUUCNB-UHFFFAOYSA-N 0 3 345.443 2.860 20 5 EFBDHN C[C@H](CNC(=O)CCNc1ccccc1[N+](=O)[O-])N1CCCC[C@H]1C ZINC000343068387 475740501 /nfs/dbraw/zinc/74/05/01/475740501.db2.gz TZAGZYWOFDKVFN-HUUCEWRRSA-N 0 3 348.447 2.776 20 5 EFBDHN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@]2(CCN(C)C2)C1 ZINC000297420159 475749658 /nfs/dbraw/zinc/74/96/58/475749658.db2.gz OAOKYVTVLITJIY-QGZVFWFLSA-N 0 3 332.404 2.717 20 5 EFBDHN C[C@H](CNC(=O)NCCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](C)C1 ZINC000340093031 475753037 /nfs/dbraw/zinc/75/30/37/475753037.db2.gz IFRSTZDLFRWGBA-HUUCEWRRSA-N 0 3 348.447 2.557 20 5 EFBDHN C[C@H](CNC(=O)NCCc1ccc([N+](=O)[O-])cc1)N1CCCC[C@@H]1C ZINC000338304515 475765206 /nfs/dbraw/zinc/76/52/06/475765206.db2.gz OYFONNBVPLSBNS-LSDHHAIUSA-N 0 3 348.447 2.699 20 5 EFBDHN C[C@H](CNC(=O)NCCc1cccc([N+](=O)[O-])c1)N1CCCC[C@@H]1C ZINC000340118734 475772011 /nfs/dbraw/zinc/77/20/11/475772011.db2.gz VGSTYGBTJNPGKH-LSDHHAIUSA-N 0 3 348.447 2.699 20 5 EFBDHN C[C@H](NC(=O)N1CC[C@@]2(C1)CCCN(C)C2)c1ccccc1[N+](=O)[O-] ZINC000297509777 475788208 /nfs/dbraw/zinc/78/82/08/475788208.db2.gz YVVWUDBEASEGBF-KSSFIOAISA-N 0 3 346.431 2.783 20 5 EFBDHN O=C(CCN(Cc1ccc([N+](=O)[O-])cc1)C1CC1)Nc1cccnc1 ZINC000361861693 475819161 /nfs/dbraw/zinc/81/91/61/475819161.db2.gz FRVLERAAOAAAGY-UHFFFAOYSA-N 0 3 340.383 2.983 20 5 EFBDHN COc1cccc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000340173593 475823762 /nfs/dbraw/zinc/82/37/62/475823762.db2.gz SIVOQTFWTHIPPM-CQSZACIVSA-N 0 3 328.372 2.685 20 5 EFBDHN CCN(Cc1ccc(CN(C)C)cc1)C(=O)c1ccc([N+](=O)[O-])n1C ZINC000340180422 475830715 /nfs/dbraw/zinc/83/07/15/475830715.db2.gz NFDMGJVBOOPWLE-UHFFFAOYSA-N 0 3 344.415 2.657 20 5 EFBDHN CCNc1ccc(C(=O)N2CCCC23CCN(C)CC3)cc1[N+](=O)[O-] ZINC000361923572 475869989 /nfs/dbraw/zinc/86/99/89/475869989.db2.gz LDUUQTYVNMIDAJ-UHFFFAOYSA-N 0 3 346.431 2.727 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](C)N2CCCC[C@@H]2C)c1 ZINC000338408861 475876121 /nfs/dbraw/zinc/87/61/21/475876121.db2.gz KPDBSNVIPVVBPK-KBPBESRZSA-N 0 3 349.431 2.986 20 5 EFBDHN C[C@H](NC(=O)N1CCC[C@H]2CN(C)CC[C@@H]21)c1ccc([N+](=O)[O-])cc1 ZINC000297816769 475894997 /nfs/dbraw/zinc/89/49/97/475894997.db2.gz ZBCGLDSVDOMZKU-QRTARXTBSA-N 0 3 346.431 2.782 20 5 EFBDHN C[C@H](NC(=O)N1CCC[C@@H]2CN(C)CC[C@H]21)c1ccc([N+](=O)[O-])cc1 ZINC000297816776 475895018 /nfs/dbraw/zinc/89/50/18/475895018.db2.gz ZBCGLDSVDOMZKU-YSVLISHTSA-N 0 3 346.431 2.782 20 5 EFBDHN CCCN(CCN1CCCC1)c1ncnc2sc([N+](=O)[O-])cc21 ZINC000343263533 475902594 /nfs/dbraw/zinc/90/25/94/475902594.db2.gz JFONBLLSFDSFLQ-UHFFFAOYSA-N 0 3 335.433 2.912 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CNCC1(S(C)(=O)=O)CCC1 ZINC000355413059 475914837 /nfs/dbraw/zinc/91/48/37/475914837.db2.gz CFWOIZJQFIVVPT-LCYFTJDESA-N 0 3 338.429 2.555 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCN(C)[C@@H](C)C1 ZINC000343286307 475921021 /nfs/dbraw/zinc/92/10/21/475921021.db2.gz XTXKCHNLZKQBRS-RYUDHWBXSA-N 0 3 337.445 2.919 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCCN2CC(C)C)c1 ZINC000338466190 475933024 /nfs/dbraw/zinc/93/30/24/475933024.db2.gz YVAQTTKHGQUORT-AWEZNQCLSA-N 0 3 349.431 2.844 20 5 EFBDHN CS[C@H]1CN(Cc2c(F)cccc2[N+](=O)[O-])C[C@H]1N1CCCC1 ZINC000358814476 475961970 /nfs/dbraw/zinc/96/19/70/475961970.db2.gz UKZKCXOODKHVBL-CVEARBPZSA-N 0 3 339.436 2.746 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NCCN2CCCCCC2)c1 ZINC000338504647 475962487 /nfs/dbraw/zinc/96/24/87/475962487.db2.gz FJSKZFHGPZBWLQ-UHFFFAOYSA-N 0 3 335.404 2.599 20 5 EFBDHN Cc1cccc(C(=O)N[C@@H]2CCN(CC3CCCC3)C2)c1[N+](=O)[O-] ZINC000362062227 475970348 /nfs/dbraw/zinc/97/03/48/475970348.db2.gz SYDKWKJWUCXWCD-OAHLLOKOSA-N 0 3 331.416 2.898 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@H]2CCN(CCCC3CCOCC3)C2)nc1 ZINC000346941276 475978154 /nfs/dbraw/zinc/97/81/54/475978154.db2.gz RMKZJOYXLDSSED-HNNXBMFYSA-N 0 3 334.420 2.683 20 5 EFBDHN CN(c1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1C[C@H]2CC[C@@H](C1)N2C ZINC000343354638 475979711 /nfs/dbraw/zinc/97/97/11/475979711.db2.gz VCTYXBOFNHXINV-YIONKMFJSA-N 0 3 343.387 2.706 20 5 EFBDHN COc1ccc(CN[C@H]2CCO[C@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000343399380 476026563 /nfs/dbraw/zinc/02/65/63/476026563.db2.gz VELRRAVSHXZSTF-YOEHRIQHSA-N 0 3 329.356 2.618 20 5 EFBDHN CC(=O)N1CCC(NCc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000340463340 476050019 /nfs/dbraw/zinc/05/00/19/476050019.db2.gz HXIMGELKITYWRF-UHFFFAOYSA-N 0 3 343.383 2.955 20 5 EFBDHN C[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1F)N1CCC[C@H](C)C1 ZINC000334043751 476096193 /nfs/dbraw/zinc/09/61/93/476096193.db2.gz MMKMPMHXADGZSU-RYUDHWBXSA-N 0 3 338.383 2.976 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCN1C ZINC000334041506 476097278 /nfs/dbraw/zinc/09/72/78/476097278.db2.gz JHWZSEBBBOLQMP-GXSJLCMTSA-N 0 3 345.321 2.826 20 5 EFBDHN CN(C)CCN1CCC(Nc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000298494383 476113845 /nfs/dbraw/zinc/11/38/45/476113845.db2.gz YHDAGOVBASNVBC-UHFFFAOYSA-N 0 3 326.828 2.686 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N[C@@H]2CCCN(C)[C@H]2C)cc1[N+](=O)[O-] ZINC000343971015 476141098 /nfs/dbraw/zinc/14/10/98/476141098.db2.gz KISNGQRWVJRIBH-KCQAQPDRSA-N 0 3 334.420 2.746 20 5 EFBDHN O=C(NCCCNCc1cccnc1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000336877856 476164826 /nfs/dbraw/zinc/16/48/26/476164826.db2.gz YAIVOWFUTXAGPW-UHFFFAOYSA-N 0 3 348.790 2.553 20 5 EFBDHN CN1CCC(Nc2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)CC1 ZINC000362348137 476186827 /nfs/dbraw/zinc/18/68/27/476186827.db2.gz DOXYKVYGGPOXND-UHFFFAOYSA-N 0 3 330.363 2.724 20 5 EFBDHN Cc1ccccc1[C@H]([C@@H](C)NC(=O)c1ccc([N+](=O)[O-])o1)N(C)C ZINC000344270204 476203838 /nfs/dbraw/zinc/20/38/38/476203838.db2.gz MWIHFZIUFASCKB-WBMJQRKESA-N 0 3 331.372 2.917 20 5 EFBDHN C[C@H](CNC(=O)Nc1cc(F)cc([N+](=O)[O-])c1)N1CCC[C@@H](C)C1 ZINC000347297919 476240728 /nfs/dbraw/zinc/24/07/28/476240728.db2.gz IDJCJRIANXJUGB-VXGBXAGGSA-N 0 3 338.383 2.976 20 5 EFBDHN CC(C)[C@@H]1CCCCN1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000303663744 476245231 /nfs/dbraw/zinc/24/52/31/476245231.db2.gz IBTKVKZQSIFJPJ-INIZCTEOSA-N 0 3 331.416 2.994 20 5 EFBDHN CC(C)[C@H]1CCCCN1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000303663746 476246005 /nfs/dbraw/zinc/24/60/05/476246005.db2.gz IBTKVKZQSIFJPJ-MRXNPFEDSA-N 0 3 331.416 2.994 20 5 EFBDHN CC1(C)C[C@@H](NCCC2(O)CCOCC2)c2cc([N+](=O)[O-])ccc21 ZINC000353822887 476289892 /nfs/dbraw/zinc/28/98/92/476289892.db2.gz UZTVIPMEBNJFDY-MRXNPFEDSA-N 0 3 334.416 2.838 20 5 EFBDHN CC[C@@H](NCc1cc([N+](=O)[O-])ccc1OC)C1(C(=O)OC)CCC1 ZINC000353842688 476298460 /nfs/dbraw/zinc/29/84/60/476298460.db2.gz NDRKVTVXLCFUMH-OAHLLOKOSA-N 0 3 336.388 2.815 20 5 EFBDHN CCc1ccc([N+](=O)[O-])cc1NC(=O)NC1CCN(C2CC2)CC1 ZINC000353925957 476327311 /nfs/dbraw/zinc/32/73/11/476327311.db2.gz ACQOGYPDDWQOLU-UHFFFAOYSA-N 0 3 332.404 2.906 20 5 EFBDHN CN(C)[C@H](CNc1ncnc2cccc([N+](=O)[O-])c21)c1cccs1 ZINC000357324318 476331476 /nfs/dbraw/zinc/33/14/76/476331476.db2.gz PTRCETXGLPMLTH-CYBMUJFWSA-N 0 3 343.412 2.736 20 5 EFBDHN C[C@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1F)N1CCC[C@@H](C)C1 ZINC000357342770 476339359 /nfs/dbraw/zinc/33/93/59/476339359.db2.gz NCIXAJRZPFBZHD-CHWSQXEVSA-N 0 3 337.395 2.513 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2ccc(CNC[C@@H](CO)[C@@H]3CCOC3)o2)c1 ZINC000360761710 476371368 /nfs/dbraw/zinc/37/13/68/476371368.db2.gz CLJFRZNGHZNBBV-CABCVRRESA-N 0 3 346.383 2.589 20 5 EFBDHN C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000357458249 476397337 /nfs/dbraw/zinc/39/73/37/476397337.db2.gz YWEMTTCZUQEEDS-OLZOCXBDSA-N 0 3 337.395 2.513 20 5 EFBDHN CC(C)[C@H](C(=O)NCCNc1ccccc1[N+](=O)[O-])N1CCCCC1 ZINC000354137852 476455136 /nfs/dbraw/zinc/45/51/36/476455136.db2.gz HZUNPIHGSVDKRN-QGZVFWFLSA-N 0 3 348.447 2.633 20 5 EFBDHN O=[N+]([O-])c1ccc(NC[C@@H]2CN3CCC[C@H]3CO2)cc1C(F)(F)F ZINC000363622881 476464881 /nfs/dbraw/zinc/46/48/81/476464881.db2.gz CVXVXFLVYMYHPV-NWDGAFQWSA-N 0 3 345.321 2.889 20 5 EFBDHN CCn1c(C)nc([N+](=O)[O-])c1N1CCN(C2CCC(C)CC2)CC1 ZINC000360902225 476466961 /nfs/dbraw/zinc/46/69/61/476466961.db2.gz WVTWBTRSQOCRRA-UHFFFAOYSA-N 0 3 335.452 2.820 20 5 EFBDHN CN1CCC2(CCN(Cc3ccc([N+](=O)[O-])cc3Cl)CC2)C1=O ZINC000369690629 476478486 /nfs/dbraw/zinc/47/84/86/476478486.db2.gz BDKNJMLTXPUIOM-UHFFFAOYSA-N 0 3 337.807 2.693 20 5 EFBDHN COc1cccc(CC2CCN(CCn3ccc([N+](=O)[O-])n3)CC2)c1 ZINC000363665664 476484579 /nfs/dbraw/zinc/48/45/79/476484579.db2.gz OVPVKWCMMPSZMZ-UHFFFAOYSA-N 0 3 344.415 2.755 20 5 EFBDHN CSc1cccc(C(=O)N[C@H]2CN(C3CC3)C[C@H]2C)c1[N+](=O)[O-] ZINC000362927180 476486031 /nfs/dbraw/zinc/48/60/31/476486031.db2.gz GVNHLQYPLBSSDC-MFKMUULPSA-N 0 3 335.429 2.529 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000360940529 476491415 /nfs/dbraw/zinc/49/14/15/476491415.db2.gz ZWMSDMLNMZELFJ-HOCLYGCPSA-N 0 3 345.443 2.930 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CN(C2CC2)C[C@H]1C ZINC000360944814 476493298 /nfs/dbraw/zinc/49/32/98/476493298.db2.gz PCMNZAKZDNOYCW-SIIHOXLZSA-N 0 3 345.443 2.762 20 5 EFBDHN Cc1noc(C2(C)CCN(CCOc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000374732007 476506317 /nfs/dbraw/zinc/50/63/17/476506317.db2.gz CGYRMMITZRLHMS-UHFFFAOYSA-N 0 3 346.387 2.719 20 5 EFBDHN CC1CCC(O)(CN2CCN(c3ccccc3[N+](=O)[O-])CC2)CC1 ZINC000357661765 476523729 /nfs/dbraw/zinc/52/37/29/476523729.db2.gz IAVCDFPVOUMELM-UHFFFAOYSA-N 0 3 333.432 2.658 20 5 EFBDHN C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000354287990 476562715 /nfs/dbraw/zinc/56/27/15/476562715.db2.gz ASUJCSHGUDHYNU-CABCVRRESA-N 0 3 345.443 2.958 20 5 EFBDHN CCn1c(C)nc([N+](=O)[O-])c1N(CCN(C)C)Cc1cccc(C)c1 ZINC000361064049 476577757 /nfs/dbraw/zinc/57/77/57/476577757.db2.gz YWUYFAMPHMYYDV-UHFFFAOYSA-N 0 3 345.447 2.996 20 5 EFBDHN Cc1ccc(CN(CCO)CCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000361072020 476581975 /nfs/dbraw/zinc/58/19/75/476581975.db2.gz DLKMOZILRFWTIV-UHFFFAOYSA-N 0 3 330.384 2.777 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCN([C@@H]2CCCN(C)C2)CC1 ZINC000374916802 476592464 /nfs/dbraw/zinc/59/24/64/476592464.db2.gz PSVYAQXTUKIVEP-SJLPKXTDSA-N 0 3 346.475 2.676 20 5 EFBDHN CC(=O)Oc1ccc(CN2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc1 ZINC000365510510 476597754 /nfs/dbraw/zinc/59/77/54/476597754.db2.gz KEGCNRWKKLTPMS-UHFFFAOYSA-N 0 3 344.371 2.554 20 5 EFBDHN CN(C(=O)c1cc([N+](=O)[O-])c[nH]1)C1CCN(Cc2ccccc2)CC1 ZINC000354359407 476609162 /nfs/dbraw/zinc/60/91/62/476609162.db2.gz CGGVMJPSZNVFPW-UHFFFAOYSA-N 0 3 342.399 2.660 20 5 EFBDHN C[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)CCN1C ZINC000361113568 476609306 /nfs/dbraw/zinc/60/93/06/476609306.db2.gz ZNZRZJSLUOIBOC-UKRRQHHQSA-N 0 3 346.431 2.725 20 5 EFBDHN CC[C@H]1CCCCN1CCNC(=O)c1cc([N+](=O)[O-])ccc1OC ZINC000354372107 476617690 /nfs/dbraw/zinc/61/76/90/476617690.db2.gz LJTYBDCUOSGXHF-ZDUSSCGKSA-N 0 3 335.404 2.598 20 5 EFBDHN Cc1ccccc1[C@@H]([C@@H](C)NC(=O)c1ccc([N+](=O)[O-])[nH]1)N(C)C ZINC000354383861 476625502 /nfs/dbraw/zinc/62/55/02/476625502.db2.gz GZUWLICUZJLWKQ-MLGOLLRUSA-N 0 3 330.388 2.653 20 5 EFBDHN Cc1ccccc1[C@@H]([C@H](C)NC(=O)c1ccc([N+](=O)[O-])[nH]1)N(C)C ZINC000354383856 476625573 /nfs/dbraw/zinc/62/55/73/476625573.db2.gz GZUWLICUZJLWKQ-BLLLJJGKSA-N 0 3 330.388 2.653 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CCC[C@@H](C[C@H]3CCOC3)C2)c1 ZINC000375010964 476634611 /nfs/dbraw/zinc/63/46/11/476634611.db2.gz DDMPQMMGRIHSJY-HDMKZQKVSA-N 0 3 334.416 2.767 20 5 EFBDHN COc1ccc(OCCN2CCC(n3cccn3)CC2)c([N+](=O)[O-])c1 ZINC000365638335 476658969 /nfs/dbraw/zinc/65/89/69/476658969.db2.gz ZUQFHFXMZHRFEK-UHFFFAOYSA-N 0 3 346.387 2.516 20 5 EFBDHN COC(=O)COc1ccc(CN2CC[C@H](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000354524333 476707347 /nfs/dbraw/zinc/70/73/47/476707347.db2.gz GIDVSXRONXOBFQ-OAHLLOKOSA-N 0 3 348.399 2.769 20 5 EFBDHN Cc1c([C@@H](C)N[C@@H]2CCCN(c3ccnn3C)C2)cccc1[N+](=O)[O-] ZINC000365804876 476709140 /nfs/dbraw/zinc/70/91/40/476709140.db2.gz HGMNVZNZMMEUOT-HUUCEWRRSA-N 0 3 343.431 2.956 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H](C)[C@H](N)c1ccccc1 ZINC000429966117 476726302 /nfs/dbraw/zinc/72/63/02/476726302.db2.gz DVUGZIHUBHXSHB-SJCJKPOMSA-N 0 3 343.383 2.556 20 5 EFBDHN CCO[C@@H]1CCC[C@H]1NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000452014013 476774643 /nfs/dbraw/zinc/77/46/43/476774643.db2.gz KBEIFIJOTHXZDX-TZMCWYRMSA-N 0 3 341.795 2.734 20 5 EFBDHN C[C@H](CNC(=O)CCc1cccc([N+](=O)[O-])c1)N1CCCC[C@@H]1C ZINC000445822303 476774732 /nfs/dbraw/zinc/77/47/32/476774732.db2.gz QKDBGOAXSXZJGA-LSDHHAIUSA-N 0 3 333.432 2.907 20 5 EFBDHN COC1CCN(C(C)(C)CNC(=O)c2c(C)cccc2[N+](=O)[O-])CC1 ZINC000446033395 476810638 /nfs/dbraw/zinc/81/06/38/476810638.db2.gz MGCRYDYQQUXYDD-UHFFFAOYSA-N 0 3 349.431 2.522 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC(C)(C)[C@@H]2COC[C@@H]21 ZINC000452108701 476828682 /nfs/dbraw/zinc/82/86/82/476828682.db2.gz FJWNQJMWZITLPH-ZBFHGGJFSA-N 0 3 347.415 2.589 20 5 EFBDHN CC1(C)CCCN1CCNC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000457071700 476858591 /nfs/dbraw/zinc/85/85/91/476858591.db2.gz HZXQLWMZDACORH-UHFFFAOYSA-N 0 3 325.796 2.852 20 5 EFBDHN COc1ccc(C[C@H](C)NCc2cc([N+](=O)[O-])ccc2OC)cn1 ZINC000414063198 476860145 /nfs/dbraw/zinc/86/01/45/476860145.db2.gz CNBSYONCNVPYOM-LBPRGKRZSA-N 0 3 331.372 2.728 20 5 EFBDHN C[C@H](C(=O)N1CCN(C2CC2)C[C@H](C)C1)c1ccc([N+](=O)[O-])cc1F ZINC000452174028 476869256 /nfs/dbraw/zinc/86/92/56/476869256.db2.gz OQFSEQAMBKLBHH-STQMWFEESA-N 0 3 349.406 2.780 20 5 EFBDHN CC(C)N1CC[C@H](N(C)C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000457105378 476877624 /nfs/dbraw/zinc/87/76/24/476877624.db2.gz CFGFRMMFVQUDAU-INIZCTEOSA-N 0 3 333.432 2.814 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@@H](C)C(=O)NC(C)C ZINC000414332883 476878847 /nfs/dbraw/zinc/87/88/47/476878847.db2.gz FFJFYGYALSZVFK-QWHCGFSZSA-N 0 3 339.461 2.968 20 5 EFBDHN CC(C)N1CC[C@@H](N(C)C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC000457112366 476882119 /nfs/dbraw/zinc/88/21/19/476882119.db2.gz JESMOTAYHDOBIJ-CYBMUJFWSA-N 0 3 330.388 2.631 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@H]1NCCc2ccccc21 ZINC000414960616 476903313 /nfs/dbraw/zinc/90/33/13/476903313.db2.gz UEPCGHXIDUICNE-GOSISDBHSA-N 0 3 341.411 2.970 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@]3(CCO)CCOC3)s2)cc1 ZINC000447068668 476947858 /nfs/dbraw/zinc/94/78/58/476947858.db2.gz MEXVCSOSGQQZCM-QGZVFWFLSA-N 0 3 348.424 2.954 20 5 EFBDHN O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2NCc2cn3ccccc3n2)n1 ZINC000447505800 477000032 /nfs/dbraw/zinc/00/00/32/477000032.db2.gz ASTWWXZHNQOIPZ-GJZGRUSLSA-N 0 3 340.387 2.713 20 5 EFBDHN COCC1(CNCc2ccc([N+](=O)[O-])cc2Cl)CCOCC1 ZINC000366475452 477026555 /nfs/dbraw/zinc/02/65/55/477026555.db2.gz PWRFAIMETQMJKZ-UHFFFAOYSA-N 0 3 328.796 2.781 20 5 EFBDHN C[C@@H]1CN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)CN1 ZINC000423507392 477053094 /nfs/dbraw/zinc/05/30/94/477053094.db2.gz QAHZQERSNRRZMR-NXEZZACHSA-N 0 3 343.836 2.549 20 5 EFBDHN Cc1cc(OCC(=O)NC[C@@H](C)N2CCC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000431576085 477054578 /nfs/dbraw/zinc/05/45/78/477054578.db2.gz SMGJAWFLGMDVPD-DZGCQCFKSA-N 0 3 349.431 2.519 20 5 EFBDHN C[C@@H](NC[C@@H]1CNCCO1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423514494 477057568 /nfs/dbraw/zinc/05/75/68/477057568.db2.gz DDBCEFXGOSMHMQ-OLZOCXBDSA-N 0 3 347.440 2.962 20 5 EFBDHN C[C@@H]1C[C@@H](NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)CCN1C ZINC000431666440 477072246 /nfs/dbraw/zinc/07/22/46/477072246.db2.gz TYLBXHPCNIQZGL-OCCSQVGLSA-N 0 3 334.420 2.612 20 5 EFBDHN C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000375903510 477072938 /nfs/dbraw/zinc/07/29/38/477072938.db2.gz SFAOZMTZHICJBD-XHDPSFHLSA-N 0 3 337.807 2.947 20 5 EFBDHN CN1CCCC(C)(C)[C@H]1CNC(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000447898931 477087295 /nfs/dbraw/zinc/08/72/95/477087295.db2.gz ZZGXYZUQHOBDMW-CQSZACIVSA-N 0 3 338.383 2.976 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H](CO)[C@H]3CCCO3)s2)cc1 ZINC000447974068 477108208 /nfs/dbraw/zinc/10/82/08/477108208.db2.gz WGIZCLJLZBLSAI-JKSUJKDBSA-N 0 3 348.424 2.953 20 5 EFBDHN O=[N+]([O-])c1cc(CN2CC[C@@H](C3CCOCC3)C2)c2c(c1)COCO2 ZINC000371072649 477110648 /nfs/dbraw/zinc/11/06/48/477110648.db2.gz DHJIGWBVXPJNCV-CQSZACIVSA-N 0 3 348.399 2.710 20 5 EFBDHN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NCC1(N(C)C)CC1 ZINC000416308755 477118666 /nfs/dbraw/zinc/11/86/66/477118666.db2.gz RXAXTHOEQOXTSD-UHFFFAOYSA-N 0 3 337.445 2.919 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NC[C@H]1N(C)CCCC1(C)C ZINC000448028091 477118928 /nfs/dbraw/zinc/11/89/28/477118928.db2.gz BHITWPMJEUZRGW-MRXNPFEDSA-N 0 3 348.447 2.857 20 5 EFBDHN CN1CCC2(CCN(Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)C1=O ZINC000376048545 477149689 /nfs/dbraw/zinc/14/96/89/477149689.db2.gz ZHOLJGCKGAZHFF-UHFFFAOYSA-N 0 3 337.807 2.693 20 5 EFBDHN C[C@@H](CCN1CCN(C)CC1)Nc1ccnc2c1cccc2[N+](=O)[O-] ZINC000432142058 477166168 /nfs/dbraw/zinc/16/61/68/477166168.db2.gz XSLFDUNDZOEPSC-AWEZNQCLSA-N 0 3 343.431 2.581 20 5 EFBDHN COC1([C@@H](C)NCc2ccc([N+](=O)[O-])cc2Cl)CCOCC1 ZINC000453200324 477190693 /nfs/dbraw/zinc/19/06/93/477190693.db2.gz QSTMZDUSUKXXRX-LLVKDONJSA-N 0 3 328.796 2.922 20 5 EFBDHN CCc1ccccc1[C@H](N)CNC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000423937008 477224621 /nfs/dbraw/zinc/22/46/21/477224621.db2.gz FRFNPIPUOLWPTC-QGZVFWFLSA-N 0 3 341.411 2.824 20 5 EFBDHN CCc1ccccc1[C@@H](N)CNC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000423937007 477224892 /nfs/dbraw/zinc/22/48/92/477224892.db2.gz FRFNPIPUOLWPTC-KRWDZBQOSA-N 0 3 341.411 2.824 20 5 EFBDHN C[C@@H](CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](C)C1 ZINC000411417144 477226940 /nfs/dbraw/zinc/22/69/40/477226940.db2.gz DXBUAVODJKEPFS-IDCJVQTKSA-N 0 3 345.443 2.935 20 5 EFBDHN CC(C)Oc1cc(C(=O)NCCN2CCC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000411416429 477227056 /nfs/dbraw/zinc/22/70/56/477227056.db2.gz OJDOXPANPVIOKH-AWEZNQCLSA-N 0 3 349.431 2.844 20 5 EFBDHN CC(C)N1CC[C@@H](N(C)C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000457843629 477227930 /nfs/dbraw/zinc/22/79/30/477227930.db2.gz BKJRACINQLKBJE-CZUORRHYSA-N 0 3 334.420 2.780 20 5 EFBDHN O=C(CCN(Cc1cccnc1)C1CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411426791 477230778 /nfs/dbraw/zinc/23/07/78/477230778.db2.gz YZLRKUQMKVDIPB-UHFFFAOYSA-N 0 3 340.383 2.983 20 5 EFBDHN CC(C)Oc1cc(C(=O)NCCN2CCCCC2)ccc1[N+](=O)[O-] ZINC000411430225 477232898 /nfs/dbraw/zinc/23/28/98/477232898.db2.gz VPHKPIAGMPVAGC-UHFFFAOYSA-N 0 3 335.404 2.598 20 5 EFBDHN COc1cc(CNC[C@@H]2CCOC(C)(C)C2)c([N+](=O)[O-])cc1OC ZINC000453588181 477242637 /nfs/dbraw/zinc/24/26/37/477242637.db2.gz YNJHWBHFCOHYHM-GFCCVEGCSA-N 0 3 338.404 2.907 20 5 EFBDHN CCc1ccccc1[C@@H](N)CNC(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000423983291 477245851 /nfs/dbraw/zinc/24/58/51/477245851.db2.gz SSCJWCDKIKVITE-HNNXBMFYSA-N 0 3 343.383 2.596 20 5 EFBDHN CCc1ccccc1[C@@H](N)CNC(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000423989130 477248582 /nfs/dbraw/zinc/24/85/82/477248582.db2.gz YGGGDKNAKYVHST-INIZCTEOSA-N 0 3 327.384 2.895 20 5 EFBDHN C[C@H](CN1CCC[C@@H](C)C1)NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411604459 477291133 /nfs/dbraw/zinc/29/11/33/477291133.db2.gz NWEDQAKBLCGCNU-KJWYOANISA-N 0 3 345.443 2.935 20 5 EFBDHN C[C@H]1COCCN1CCN[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433168294 477314407 /nfs/dbraw/zinc/31/44/07/477314407.db2.gz MGIKHNCTDZULCR-GUYCJALGSA-N 0 3 333.432 2.628 20 5 EFBDHN CN(C)CCN(Cc1ccsc1)C(=O)c1cccc([N+](=O)[O-])c1 ZINC000458201258 477316646 /nfs/dbraw/zinc/31/66/46/477316646.db2.gz LTCQJQJGGIPDFE-UHFFFAOYSA-N 0 3 333.413 2.860 20 5 EFBDHN CC1(C)C[C@H](NC[C@H]2CN(C3CC3)CCO2)c2cc([N+](=O)[O-])ccc21 ZINC000433228542 477318221 /nfs/dbraw/zinc/31/82/21/477318221.db2.gz BBIIYXMHAZECQQ-YJBOKZPZSA-N 0 3 345.443 2.770 20 5 EFBDHN CC(C)N1C[C@H](N[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1=O ZINC000433280894 477320811 /nfs/dbraw/zinc/32/08/11/477320811.db2.gz GIXAEPOPNSPNEA-MLGOLLRUSA-N 0 3 331.416 2.916 20 5 EFBDHN O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CC[C@H](N2CCCCC2)C1 ZINC000412088278 477410187 /nfs/dbraw/zinc/41/01/87/477410187.db2.gz BGZHDRLMUNKFAI-OKZBNKHCSA-N 0 3 343.427 2.785 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C/CN[C@@H]1COc2ccccc2[C@H]1O ZINC000367282935 477430940 /nfs/dbraw/zinc/43/09/40/477430940.db2.gz QABOMJWJLMQYLU-KIAIAAEYSA-N 0 3 326.352 2.692 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N[C@H]1CC(=O)N(c2ccccc2)C1 ZINC000449108017 477442490 /nfs/dbraw/zinc/44/24/90/477442490.db2.gz RVJRQWJBBGFQPH-HOCLYGCPSA-N 0 3 339.395 2.921 20 5 EFBDHN CN1CCC2(CCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 ZINC000367351087 477466951 /nfs/dbraw/zinc/46/69/51/477466951.db2.gz BJNDNGNYLCYPMH-UHFFFAOYSA-N 0 3 331.416 2.614 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCCC12CCN(C)CC2 ZINC000367352788 477467472 /nfs/dbraw/zinc/46/74/72/477467472.db2.gz BHECCDURIIZXEN-UHFFFAOYSA-N 0 3 348.403 2.696 20 5 EFBDHN CCN1CCN([C@H](C)CNc2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413049796 477486814 /nfs/dbraw/zinc/48/68/14/477486814.db2.gz CLBHYPCAVXFANK-CQSZACIVSA-N 0 3 343.431 2.581 20 5 EFBDHN CCN1CCN([C@@H](C)CNc2ccc([N+](=O)[O-])c3ncccc23)CC1 ZINC000413053681 477489935 /nfs/dbraw/zinc/48/99/35/477489935.db2.gz KOSGKRLBGCAKMZ-AWEZNQCLSA-N 0 3 343.431 2.581 20 5 EFBDHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)c1ncc([N+](=O)[O-])cn1 ZINC000371857475 477528432 /nfs/dbraw/zinc/52/84/32/477528432.db2.gz FXFAALUAROOMCM-INIZCTEOSA-N 0 3 341.415 2.733 20 5 EFBDHN Cc1c(CNC(=O)N(C)[C@@H]2CCN(C(C)C)C2)cccc1[N+](=O)[O-] ZINC000458693619 477550554 /nfs/dbraw/zinc/55/05/54/477550554.db2.gz NXRLLQIAUSEOFY-OAHLLOKOSA-N 0 3 334.420 2.527 20 5 EFBDHN CCO[C@@H]1C[C@H](N[C@H](C)Cc2ccccc2[N+](=O)[O-])[C@H]1n1cccn1 ZINC000449343751 477556873 /nfs/dbraw/zinc/55/68/73/477556873.db2.gz MUFFYKGOJOQTRP-AETAKHFUSA-N 0 3 344.415 2.731 20 5 EFBDHN CC(C)(C)c1ccc(C(=O)N[C@H]2CNCCC2(F)F)cc1[N+](=O)[O-] ZINC000449664172 477569827 /nfs/dbraw/zinc/56/98/27/477569827.db2.gz PMIURZUVCORXCC-ZDUSSCGKSA-N 0 3 341.358 2.619 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN2C[C@H]3[C@H](CO)[C@H]3C2)s1 ZINC000367839095 477713331 /nfs/dbraw/zinc/71/33/31/477713331.db2.gz JYOCIUXREKFKAB-FICVDOATSA-N 0 3 330.409 2.993 20 5 EFBDHN C[C@H]1CN(Cc2ccccc2)CCN(c2ccc([N+](=O)[O-])cn2)C1 ZINC000450811149 477725816 /nfs/dbraw/zinc/72/58/16/477725816.db2.gz NDQMEHWJASYCIY-HNNXBMFYSA-N 0 3 326.400 2.948 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(CN(C)C)cc1 ZINC000426892905 477756324 /nfs/dbraw/zinc/75/63/24/477756324.db2.gz BTPOZSUEKAQOKP-UHFFFAOYSA-N 0 3 329.356 2.917 20 5 EFBDHN C[C@H](C1CCN(C)CC1)N(C)C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413669324 477774042 /nfs/dbraw/zinc/77/40/42/477774042.db2.gz LOEONUSNHQZLRX-JEBQAFNWSA-N 0 3 345.443 2.887 20 5 EFBDHN C[C@H]1CN(C(=O)/C=C/c2ccc(F)cc2[N+](=O)[O-])CCN(C2CC2)C1 ZINC000493790328 477825029 /nfs/dbraw/zinc/82/50/29/477825029.db2.gz YEVLRYUBVPKANI-LPZVBRGNSA-N 0 3 347.390 2.690 20 5 EFBDHN CCOC(=O)C[C@@H](C)CNc1cc(C)nc2ccc([N+](=O)[O-])cc21 ZINC000428136692 477825791 /nfs/dbraw/zinc/82/57/91/477825791.db2.gz VGNFVBSGTDCIKS-LLVKDONJSA-N 0 3 331.372 2.875 20 5 EFBDHN CC(C)c1[nH]nc(C(=O)Nc2ccccc2CCN(C)C)c1[N+](=O)[O-] ZINC000438570300 477866702 /nfs/dbraw/zinc/86/67/02/477866702.db2.gz VPTJZTJLTDOAQV-UHFFFAOYSA-N 0 3 345.403 2.798 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCN[C@@H](CC(F)F)c1ccccc1 ZINC000420999411 477887191 /nfs/dbraw/zinc/88/71/91/477887191.db2.gz UUKKYRWYIASXIU-AWEZNQCLSA-N 0 3 337.326 2.743 20 5 EFBDHN CC(C)N(C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)[C@@H](C)c1ccsc1 ZINC000421009660 477895785 /nfs/dbraw/zinc/89/57/85/477895785.db2.gz NHXRRDFMIGZNHE-WFASDCNBSA-N 0 3 338.433 2.685 20 5 EFBDHN C[C@@H]1CC[C@H](O)CN1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000421013821 477901806 /nfs/dbraw/zinc/90/18/06/477901806.db2.gz KGYMQALGBDDJIK-DOMZBBRYSA-N 0 3 331.372 2.638 20 5 EFBDHN CN(C[C@@H]1CCCN1C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000421033187 477921708 /nfs/dbraw/zinc/92/17/08/477921708.db2.gz AGIJWMKTPZXCCQ-NSHDSACASA-N 0 3 326.784 2.806 20 5 EFBDHN O=[N+]([O-])c1ccc(CNC[C@@]2(CO)C[C@@H]2c2ccc(F)cc2)cc1 ZINC000428541795 477924161 /nfs/dbraw/zinc/92/41/61/477924161.db2.gz CTOONODKUWZKFK-QZTJIDSGSA-N 0 3 330.359 2.990 20 5 EFBDHN C[C@H]1C[C@H]1N1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000494375874 477973400 /nfs/dbraw/zinc/97/34/00/477973400.db2.gz RWLHADYJXPFMBE-HEHGZKQESA-N 0 3 332.404 2.789 20 5 EFBDHN CC(C)CN(CCOc1ccc([N+](=O)[O-])cc1)Cc1cnn(C)c1 ZINC000459589315 477993694 /nfs/dbraw/zinc/99/36/94/477993694.db2.gz HYSMKXKFNCFIEJ-UHFFFAOYSA-N 0 3 332.404 2.865 20 5 EFBDHN CO[C@@H]1C[C@H](N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1(C)C ZINC000439510607 477993793 /nfs/dbraw/zinc/99/37/93/477993793.db2.gz GZKIURKRTJNTKG-BYCMXARLSA-N 0 3 335.404 2.633 20 5 EFBDHN CCOc1cc(CN2CC[C@H](c3nccn3C)C2)ccc1[N+](=O)[O-] ZINC000516875859 478003390 /nfs/dbraw/zinc/00/33/90/478003390.db2.gz YLIQGMUKNFWZLQ-AWEZNQCLSA-N 0 3 330.388 2.717 20 5 EFBDHN C[C@H](N[C@@H]1[C@@H]2CCCO[C@@H]2C1(C)C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000439615281 478007237 /nfs/dbraw/zinc/00/72/37/478007237.db2.gz FOZQPVVRHAIWIT-KSYCFECVSA-N 0 3 347.415 2.715 20 5 EFBDHN C[C@H](N[C@@H]1[C@H]2CCCO[C@H]2C1(C)C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000439650010 478014228 /nfs/dbraw/zinc/01/42/28/478014228.db2.gz REXSYVFHTJSHKM-AEAUEXCSSA-N 0 3 347.415 2.715 20 5 EFBDHN C[C@H]1C[C@@H]1N1CCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@@H](C)C1 ZINC000428999579 478030860 /nfs/dbraw/zinc/03/08/60/478030860.db2.gz VDSPKHHVCBKGDJ-WWGRRREGSA-N 0 3 344.415 2.898 20 5 EFBDHN CCO[C@H]1C[C@H](NCC(=O)Nc2c(C)cccc2[N+](=O)[O-])C12CCC2 ZINC000451478616 478040386 /nfs/dbraw/zinc/04/03/86/478040386.db2.gz JXOPERBCNJTFFV-GJZGRUSLSA-N 0 3 347.415 2.779 20 5 EFBDHN CCO[C@@H]1C[C@@H](N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C12CCC2 ZINC000451480793 478041716 /nfs/dbraw/zinc/04/17/16/478041716.db2.gz QBXGOWBIEZCPHQ-APHBMKBZSA-N 0 3 347.415 2.859 20 5 EFBDHN CCO[C@H]1C[C@@H](NCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C12CCC2 ZINC000451481507 478041837 /nfs/dbraw/zinc/04/18/37/478041837.db2.gz RHHGYGYSEZBQRY-CVEARBPZSA-N 0 3 347.415 2.779 20 5 EFBDHN NC(=O)[C@H]1CC[C@H](CNCc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000421353627 478047590 /nfs/dbraw/zinc/04/75/90/478047590.db2.gz TXVBMJDMKZTYNH-XYPYZODXSA-N 0 3 325.796 2.630 20 5 EFBDHN COc1cccc2c1C[C@@H]([NH2+]Cc1cc(OC)c([O-])cc1[N+](=O)[O-])C2 ZINC000459712984 478054130 /nfs/dbraw/zinc/05/41/30/478054130.db2.gz WVPNJXHZKMDMQK-ZDUSSCGKSA-N 0 3 344.367 2.575 20 5 EFBDHN COc1cc(CN[C@@H]2C[C@@H](OC)C23CCC3)c([N+](=O)[O-])cc1OC ZINC000459728876 478061193 /nfs/dbraw/zinc/06/11/93/478061193.db2.gz CRQMRXLSQUCBHT-HZPDHXFCSA-N 0 3 336.388 2.659 20 5 EFBDHN CC(C)COC[C@@H](O)CN1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548748 478084472 /nfs/dbraw/zinc/08/44/72/478084472.db2.gz OGSSWXHSXGVOCC-AEFFLSMTSA-N 0 3 336.432 2.808 20 5 EFBDHN CC[C@@H]1OCC[C@H]1N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000459773911 478085237 /nfs/dbraw/zinc/08/52/37/478085237.db2.gz KVMQRBFACPKULY-FZZIBODNSA-N 0 3 341.795 2.732 20 5 EFBDHN CC(C)(NC[C@H](O)COCc1ccco1)c1ccccc1[N+](=O)[O-] ZINC000429243196 478088571 /nfs/dbraw/zinc/08/85/71/478088571.db2.gz CFPGYACHGQDFDJ-ZDUSSCGKSA-N 0 3 334.372 2.590 20 5 EFBDHN COc1ccc(NC(=O)[C@@H](C)N[C@@H]2CCC[C@@H]3C[C@@H]32)c([N+](=O)[O-])c1 ZINC000459794689 478096612 /nfs/dbraw/zinc/09/66/12/478096612.db2.gz WUULNVJUDDGKQL-MHDGFBEUSA-N 0 3 333.388 2.709 20 5 EFBDHN COc1ccc(NC(=O)[C@H](C)N[C@H]2CCC[C@@H]3C[C@@H]32)c([N+](=O)[O-])c1 ZINC000459794698 478096884 /nfs/dbraw/zinc/09/68/84/478096884.db2.gz WUULNVJUDDGKQL-XCCSTKFXSA-N 0 3 333.388 2.709 20 5 EFBDHN COc1cc(CN2CCN(C)[C@@H](C(C)C)C2)c([N+](=O)[O-])cc1F ZINC000487989622 478099598 /nfs/dbraw/zinc/09/95/98/478099598.db2.gz AHBIYMLSXGPQTK-OAHLLOKOSA-N 0 3 325.384 2.515 20 5 EFBDHN COc1cc(CN2CCN(C)[C@H](C(C)C)C2)c([N+](=O)[O-])cc1F ZINC000487989620 478099648 /nfs/dbraw/zinc/09/96/48/478099648.db2.gz AHBIYMLSXGPQTK-HNNXBMFYSA-N 0 3 325.384 2.515 20 5 EFBDHN Cc1c(NC(=O)[C@H](C)N2CCN(C)[C@@H](C(C)C)C2)cccc1[N+](=O)[O-] ZINC000487987737 478099873 /nfs/dbraw/zinc/09/98/73/478099873.db2.gz KWEFRTPKMYFSEM-WMLDXEAASA-N 0 3 348.447 2.502 20 5 EFBDHN Cc1cccc2c1CN(C[C@H](O)COc1cccc([N+](=O)[O-])c1)CC2 ZINC000429583571 478159805 /nfs/dbraw/zinc/15/98/05/478159805.db2.gz BLKXWISXUQAOKO-KRWDZBQOSA-N 0 3 342.395 2.701 20 5 EFBDHN CC(C)[C@H]1CN(Cc2cc([N+](=O)[O-])ccc2OC(F)F)CCN1C ZINC000488557250 478161298 /nfs/dbraw/zinc/16/12/98/478161298.db2.gz KUVSGSQGEQFJCL-CQSZACIVSA-N 0 3 343.374 2.968 20 5 EFBDHN CCOc1cc(CN2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)ccc1[N+](=O)[O-] ZINC000451698764 478162033 /nfs/dbraw/zinc/16/20/33/478162033.db2.gz JVPHSECOXSCSJK-PMPSAXMXSA-N 0 3 334.416 2.976 20 5 EFBDHN CC(=O)c1cc(N2CCN([C@@H]3C[C@@H]3C)C[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000488750673 478178522 /nfs/dbraw/zinc/17/85/22/478178522.db2.gz OGPRWAMBIYHINH-ZJNRKIDTSA-N 0 3 331.416 2.964 20 5 EFBDHN CC[C@@H]1CN(CC)CCN1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000451727932 478179767 /nfs/dbraw/zinc/17/97/67/478179767.db2.gz CSVAPXCKNLTHCB-OAHLLOKOSA-N 0 3 348.447 2.648 20 5 EFBDHN CC[C@@H]1CN(CC)CCN1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000451733968 478183016 /nfs/dbraw/zinc/18/30/16/478183016.db2.gz VYOZPFHOSZXQCT-OAHLLOKOSA-N 0 3 348.447 2.648 20 5 EFBDHN CC[C@H]1CN(CC)CCN1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000451733967 478183663 /nfs/dbraw/zinc/18/36/63/478183663.db2.gz VYOZPFHOSZXQCT-HNNXBMFYSA-N 0 3 348.447 2.648 20 5 EFBDHN CC(C)(C)N1CCCN(C(=O)NCCc2cccc([N+](=O)[O-])c2)CC1 ZINC000536233491 478245002 /nfs/dbraw/zinc/24/50/02/478245002.db2.gz MNQHHZOIUWDXSZ-UHFFFAOYSA-N 0 3 348.447 2.653 20 5 EFBDHN CCCCN(C)CCNC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000489578588 478257394 /nfs/dbraw/zinc/25/73/94/478257394.db2.gz AZFUGFMMKFRYSL-CQSZACIVSA-N 0 3 336.436 2.995 20 5 EFBDHN O=[N+]([O-])c1ccc([C@@H]2CCCN(CCOC[C@@H]3CCCO3)C2)cc1 ZINC000562545296 478266012 /nfs/dbraw/zinc/26/60/12/478266012.db2.gz RVRRMOOHPGQACF-AEFFLSMTSA-N 0 3 334.416 2.970 20 5 EFBDHN C[C@H](NC(=O)N[C@H]1CCCN2CCCC[C@@H]12)c1cccc([N+](=O)[O-])c1 ZINC000594213265 478277894 /nfs/dbraw/zinc/27/78/94/478277894.db2.gz UCWXUFWEEJIMQI-JQFCIGGWSA-N 0 3 346.431 2.972 20 5 EFBDHN CN1CCCC(C)(C)[C@H]1CNc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000562615210 478284348 /nfs/dbraw/zinc/28/43/48/478284348.db2.gz UCODQGRYQQDALF-OAHLLOKOSA-N 0 3 345.403 2.776 20 5 EFBDHN CCC(C)(C)N1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)CC1 ZINC000594228054 478285793 /nfs/dbraw/zinc/28/57/93/478285793.db2.gz ZPVDSEUPGDGJHP-UHFFFAOYSA-N 0 3 334.420 2.611 20 5 EFBDHN C[C@@H]1[C@@H](NC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])CCCN1C ZINC000489990654 478296970 /nfs/dbraw/zinc/29/69/70/478296970.db2.gz GAPCEGVRLBVARK-OCCSQVGLSA-N 0 3 334.420 2.612 20 5 EFBDHN C[C@H]1[C@H](NC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])CCCN1C ZINC000489990652 478297034 /nfs/dbraw/zinc/29/70/34/478297034.db2.gz GAPCEGVRLBVARK-GXTWGEPZSA-N 0 3 334.420 2.612 20 5 EFBDHN O=C(CCN[C@H]1CCc2c1cccc2[N+](=O)[O-])NCc1ccccc1 ZINC000570174620 478302587 /nfs/dbraw/zinc/30/25/87/478302587.db2.gz CKLHMWDALHOQFG-KRWDZBQOSA-N 0 3 339.395 2.878 20 5 EFBDHN Cc1ccc(CN(C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)nc1 ZINC000590754400 478320282 /nfs/dbraw/zinc/32/02/82/478320282.db2.gz FEJAOAZACHCDIP-UHFFFAOYSA-N 0 3 328.372 2.759 20 5 EFBDHN CCN(C[C@H]1CCCN1CC)C(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000570306748 478333821 /nfs/dbraw/zinc/33/38/21/478333821.db2.gz VFGNVPZIJJFJBN-MRXNPFEDSA-N 0 3 333.432 2.779 20 5 EFBDHN O=[N+]([O-])c1ccc(CNC2CCN([C@@H]3CCOC3)CC2)c(Cl)c1 ZINC000594501121 478413204 /nfs/dbraw/zinc/41/32/04/478413204.db2.gz RHORDWAAEFTMNT-OAHLLOKOSA-N 0 3 339.823 2.591 20 5 EFBDHN CCOc1ccc(C(=O)N2CCCN(C)C[C@@H]2CC)cc1[N+](=O)[O-] ZINC000597606523 478430313 /nfs/dbraw/zinc/43/03/13/478430313.db2.gz WODJYIGOXLFVNQ-AWEZNQCLSA-N 0 3 335.404 2.550 20 5 EFBDHN CC(C)Oc1nc(N2CC[C@@H](N3CCCCC3)C2)ccc1[N+](=O)[O-] ZINC000594550163 478433699 /nfs/dbraw/zinc/43/36/99/478433699.db2.gz LLHXRBKXXBAINC-CQSZACIVSA-N 0 3 334.420 2.842 20 5 EFBDHN C[C@H](N[C@H]1CCCN2CCCC[C@@H]12)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000594554081 478434950 /nfs/dbraw/zinc/43/49/50/478434950.db2.gz KJRUPRDWGMYSPC-DZKIICNBSA-N 0 3 346.431 2.528 20 5 EFBDHN COC(=O)[C@@]1(C)CCCN(CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000591054120 478445053 /nfs/dbraw/zinc/44/50/53/478445053.db2.gz RCLVCFKUBQHSRC-KRWDZBQOSA-N 0 3 336.388 2.639 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@H]2CCN(Cc3ccc4[nH]cnc4c3)C2)nc1 ZINC000539838785 478445790 /nfs/dbraw/zinc/44/57/90/478445790.db2.gz YHUCISLQVNKEEE-ZDUSSCGKSA-N 0 3 338.371 2.553 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@H]2CCN(Cc3ccc4nc[nH]c4c3)C2)nc1 ZINC000539838785 478445795 /nfs/dbraw/zinc/44/57/95/478445795.db2.gz YHUCISLQVNKEEE-ZDUSSCGKSA-N 0 3 338.371 2.553 20 5 EFBDHN CCC(C)(C)N1CCN(c2ncnc3ccc([N+](=O)[O-])cc32)CC1 ZINC000594594757 478454102 /nfs/dbraw/zinc/45/41/02/478454102.db2.gz RECXSUKVVAOYGY-UHFFFAOYSA-N 0 3 329.404 2.849 20 5 EFBDHN COC(=O)Cc1ccc(N[C@H]2CCCN3CCCC[C@H]23)c([N+](=O)[O-])c1 ZINC000594599217 478458823 /nfs/dbraw/zinc/45/88/23/478458823.db2.gz IGIOQHJBCXEBHH-GOEBONIOSA-N 0 3 347.415 2.739 20 5 EFBDHN O=C1CCc2cc([N+](=O)[O-])c(N[C@H]3CCCN4CCCC[C@H]34)cc2N1 ZINC000594604582 478461751 /nfs/dbraw/zinc/46/17/51/478461751.db2.gz ZZLPHLIYOSVCQF-XJKSGUPXSA-N 0 3 344.415 2.908 20 5 EFBDHN O=C1CCc2cc([N+](=O)[O-])c(N[C@@H]3CCCN4CCCC[C@H]34)cc2N1 ZINC000594604581 478462849 /nfs/dbraw/zinc/46/28/49/478462849.db2.gz ZZLPHLIYOSVCQF-CZUORRHYSA-N 0 3 344.415 2.908 20 5 EFBDHN O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CCNC2(CCCCC2)C1 ZINC000594628729 478473582 /nfs/dbraw/zinc/47/35/82/478473582.db2.gz DYZBDHBMZXLRIZ-UHFFFAOYSA-N 0 3 342.399 2.824 20 5 EFBDHN O=[N+]([O-])c1cnc(N[C@@H]2CCN(CC3CC3)C2)c(C(F)(F)F)c1 ZINC000591146261 478474534 /nfs/dbraw/zinc/47/45/34/478474534.db2.gz RAGRZRVQQCIWQZ-SNVBAGLBSA-N 0 3 330.310 2.905 20 5 EFBDHN COCCN1CCC[C@@H](Nc2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000591146506 478474856 /nfs/dbraw/zinc/47/48/56/478474856.db2.gz FUHMOEBRBPQDBW-CQSZACIVSA-N 0 3 330.388 2.666 20 5 EFBDHN CSc1cccc(C(=O)N2CCC[C@@]3(CCN(C)C3)C2)c1[N+](=O)[O-] ZINC000597709912 478474860 /nfs/dbraw/zinc/47/48/60/478474860.db2.gz CPCGWHXTIAOYCG-KRWDZBQOSA-N 0 3 349.456 2.875 20 5 EFBDHN COC1CCN(CCNc2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000591149320 478475451 /nfs/dbraw/zinc/47/54/51/478475451.db2.gz GNHXNMDOHKGPNN-UHFFFAOYSA-N 0 3 330.388 2.666 20 5 EFBDHN O=[N+]([O-])c1ccc2ccnc(NC3CCN([C@@H]4CCOC4)CC3)c2c1 ZINC000591150693 478476521 /nfs/dbraw/zinc/47/65/21/478476521.db2.gz NZWLJBNLQBKRKV-MRXNPFEDSA-N 0 3 342.399 2.808 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1CN1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000563362228 478531451 /nfs/dbraw/zinc/53/14/51/478531451.db2.gz BXGOITLBKSZLQR-INIZCTEOSA-N 0 3 344.415 2.963 20 5 EFBDHN Cn1cc([C@H]2CN(CCOc3ccc([N+](=O)[O-])cc3)CC2(C)C)cn1 ZINC000563363855 478534018 /nfs/dbraw/zinc/53/40/18/478534018.db2.gz LUTMSZSALRVMEM-QGZVFWFLSA-N 0 3 344.415 2.833 20 5 EFBDHN CC(COC(=O)C[C@@H]1CCCC[C@@H]1NC(=O)OC(C)(C)C)[N+](=O)[O-] ZINC000496106629 478541846 /nfs/dbraw/zinc/54/18/46/478541846.db2.gz YFSWTCLKDIUAPQ-AGIUHOORSA-N 0 3 344.408 2.668 20 5 EFBDHN O=C(CCN1CC[C@@H](c2ccncc2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000571294847 478564844 /nfs/dbraw/zinc/56/48/44/478564844.db2.gz HHGADYIOCMLNDI-OAHLLOKOSA-N 0 3 340.383 2.808 20 5 EFBDHN COc1cc(C(=O)N[C@H]2CCN(C(C)(C)C)C2)cc([N+](=O)[O-])c1C ZINC000597923682 478577246 /nfs/dbraw/zinc/57/72/46/478577246.db2.gz OEXUCMOHJMLNLM-ZDUSSCGKSA-N 0 3 335.404 2.514 20 5 EFBDHN CC(C)(C)N1CC[C@@H](NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C1 ZINC000597923663 478578261 /nfs/dbraw/zinc/57/82/61/478578261.db2.gz NWBQEZOBVJVOMU-LLVKDONJSA-N 0 3 330.388 2.679 20 5 EFBDHN CC(C)(C)N1CC[C@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000597926018 478581018 /nfs/dbraw/zinc/58/10/18/478581018.db2.gz ZMNZRRRCNJJPHC-AWEZNQCLSA-N 0 3 347.415 2.547 20 5 EFBDHN COc1ccc([C@@H](CO)CN[C@H]2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000582370434 478583205 /nfs/dbraw/zinc/58/32/05/478583205.db2.gz PTICUFBMMRJHMA-KDOFPFPSSA-N 0 3 342.395 2.956 20 5 EFBDHN CN(C)[C@H](CNC(=O)c1c(F)cccc1[N+](=O)[O-])Cc1ccccc1 ZINC000600964507 478587533 /nfs/dbraw/zinc/58/75/33/478587533.db2.gz CEYGIHDYPNCELC-AWEZNQCLSA-N 0 3 345.374 2.637 20 5 EFBDHN CC[C@@H]1CC[C@H](C)N1Cc1ccc(OCC(=O)OC)c([N+](=O)[O-])c1 ZINC000582448067 478600382 /nfs/dbraw/zinc/60/03/82/478600382.db2.gz PZURWHYZRCVNOL-GXTWGEPZSA-N 0 3 336.388 2.910 20 5 EFBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)[C@H]1CNCCC1(F)F ZINC000591672883 478605934 /nfs/dbraw/zinc/60/59/34/478605934.db2.gz QIXCUWPSUNXIAX-CQSZACIVSA-N 0 3 341.358 2.577 20 5 EFBDHN CC1(C)CNCCN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000591678371 478606140 /nfs/dbraw/zinc/60/61/40/478606140.db2.gz RJYALCYAYPCSTG-UHFFFAOYSA-N 0 3 346.412 2.542 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@H]2CSc3ccccc32)c1 ZINC000591740789 478616593 /nfs/dbraw/zinc/61/65/93/478616593.db2.gz HTXLWMIIOLBGLC-BBRMVZONSA-N 0 3 346.408 2.771 20 5 EFBDHN C[C@]1(c2ccccc2)C[C@H]1NC[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000591744292 478618327 /nfs/dbraw/zinc/61/83/27/478618327.db2.gz PEKQPWDWWJYOGS-ATZDWAIDSA-N 0 3 342.395 2.654 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)N[C@@H]1CCc2nc(C)ncc2C1 ZINC000595006027 478626788 /nfs/dbraw/zinc/62/67/88/478626788.db2.gz DZUBARBHQYUEHI-BXUZGUMPSA-N 0 3 342.399 2.910 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NCCCOC[C@@H]1CCOC1 ZINC000595007937 478626936 /nfs/dbraw/zinc/62/69/36/478626936.db2.gz LIDRRRSBUWXTCO-KBPBESRZSA-N 0 3 338.404 2.697 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NCC1CCN(C(C)=O)CC1 ZINC000595012894 478630080 /nfs/dbraw/zinc/63/00/80/478630080.db2.gz PWXKELMDIZQVPT-LBPRGKRZSA-N 0 3 335.404 2.513 20 5 EFBDHN CCN(CC)C(=O)CCCN[C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595014861 478630169 /nfs/dbraw/zinc/63/01/69/478630169.db2.gz UVXKXUALZPCKMN-CYBMUJFWSA-N 0 3 337.420 2.903 20 5 EFBDHN CCN(CC)C(=O)CCCN[C@@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595014863 478630186 /nfs/dbraw/zinc/63/01/86/478630186.db2.gz UVXKXUALZPCKMN-ZDUSSCGKSA-N 0 3 337.420 2.903 20 5 EFBDHN CN(C(=O)/C=C\c1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CCN(C2CC2)C1 ZINC000491684100 478632133 /nfs/dbraw/zinc/63/21/33/478632133.db2.gz CQXAVMNBQWMIPC-UMSKNGNOSA-N 0 3 349.818 2.957 20 5 EFBDHN CN(C)CCOC1CCN(c2ccnc3ccc([N+](=O)[O-])cc32)CC1 ZINC000601116099 478665844 /nfs/dbraw/zinc/66/58/44/478665844.db2.gz OEBKZCMFPDJMID-UHFFFAOYSA-N 0 3 344.415 2.690 20 5 EFBDHN CCOC(=O)Cc1ccc(NC[C@H]2CCCN2CC)c([N+](=O)[O-])c1 ZINC000591888759 478675672 /nfs/dbraw/zinc/67/56/72/478675672.db2.gz AUMLUIKKMQAQCC-CQSZACIVSA-N 0 3 335.404 2.597 20 5 EFBDHN CS[C@@H]1CN(c2ccnc3ccc([N+](=O)[O-])cc32)C[C@H]1N(C)C ZINC000601134403 478678356 /nfs/dbraw/zinc/67/83/56/478678356.db2.gz BPAULNPHAVVQLV-HZPDHXFCSA-N 0 3 332.429 2.625 20 5 EFBDHN COc1ccc(-c2ccc(CN[C@H]3C[C@@H](CO)C3)o2)c([N+](=O)[O-])c1 ZINC000601139688 478683223 /nfs/dbraw/zinc/68/32/23/478683223.db2.gz HJDOBTVJAGUXRI-TXEJJXNPSA-N 0 3 332.356 2.724 20 5 EFBDHN CCCN(CCN1CCCCCC1)C(=O)c1cc([N+](=O)[O-])cn1C ZINC000564136076 478697277 /nfs/dbraw/zinc/69/72/77/478697277.db2.gz JOEQIRACDFWJHR-UHFFFAOYSA-N 0 3 336.436 2.662 20 5 EFBDHN Cc1c(CNC(=O)C[C@@H]2NCc3ccccc32)cccc1[N+](=O)[O-] ZINC000595254720 478703188 /nfs/dbraw/zinc/70/31/88/478703188.db2.gz VNLDALCNJUSQSQ-INIZCTEOSA-N 0 3 325.368 2.754 20 5 EFBDHN CCOC(=O)Cc1ccc(N[C@@H]2C[C@@H](C)N(C3CC3)C2)c([N+](=O)[O-])c1 ZINC000591926910 478710127 /nfs/dbraw/zinc/71/01/27/478710127.db2.gz WUVWKYWFDCYLSN-TZMCWYRMSA-N 0 3 347.415 2.738 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCN(C3CCCCC3)C2)c1 ZINC000598222084 478713188 /nfs/dbraw/zinc/71/31/88/478713188.db2.gz ZYQWJWHJJGUUIK-CYBMUJFWSA-N 0 3 347.415 2.740 20 5 EFBDHN CC(C)N(CCN1C[C@@H](C)O[C@H](C)C1)Cc1ccc([N+](=O)[O-])cc1 ZINC000595294974 478720059 /nfs/dbraw/zinc/72/00/59/478720059.db2.gz DRGZVRFFXXXUBK-HZPDHXFCSA-N 0 3 335.448 2.914 20 5 EFBDHN Cc1c(CC(=O)N[C@@H](C)CN2CCC(C)CC2)cccc1[N+](=O)[O-] ZINC000598261511 478730450 /nfs/dbraw/zinc/73/04/50/478730450.db2.gz GAJMOHQNKZQXGD-AWEZNQCLSA-N 0 3 333.432 2.682 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H](C)CN1CCC(C)CC1 ZINC000598260217 478731047 /nfs/dbraw/zinc/73/10/47/478731047.db2.gz IQYKVZLQTNSQQT-CQSZACIVSA-N 0 3 349.431 2.844 20 5 EFBDHN C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)/C=C\c1ccc(F)cc1[N+](=O)[O-] ZINC000491909784 478732831 /nfs/dbraw/zinc/73/28/31/478732831.db2.gz XHNFGXWGDXDDJF-BRDDXIKOSA-N 0 3 335.379 2.546 20 5 EFBDHN C[C@@H](CN1CCC(C)CC1)NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000598266410 478733649 /nfs/dbraw/zinc/73/36/49/478733649.db2.gz XNYBWSHXEOYWTB-ZDUSSCGKSA-N 0 3 344.415 2.926 20 5 EFBDHN Cc1nn(C)c(N[C@@H]2CCN(Cc3cccc(C)c3)C2)c1[N+](=O)[O-] ZINC000601239441 478741913 /nfs/dbraw/zinc/74/19/13/478741913.db2.gz KWFLBZJONYMAMM-OAHLLOKOSA-N 0 3 329.404 2.632 20 5 EFBDHN CCCN(C(=O)NCc1cccc([N+](=O)[O-])c1C)[C@@H]1CCN(C)C1 ZINC000592016701 478745079 /nfs/dbraw/zinc/74/50/79/478745079.db2.gz MKSYRIZGTCYGDX-OAHLLOKOSA-N 0 3 334.420 2.529 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@@H]2CCN(CCOCc3ccccc3)C2)nc1 ZINC000595374587 478752992 /nfs/dbraw/zinc/75/29/92/478752992.db2.gz HBAFONSAJIDEGF-MRXNPFEDSA-N 0 3 342.399 2.693 20 5 EFBDHN C[C@H](N[C@@H]1COC[C@@H]1O)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000601291040 478767444 /nfs/dbraw/zinc/76/74/44/478767444.db2.gz FCQISLUFLYJETD-SUHUHFCYSA-N 0 3 334.397 2.734 20 5 EFBDHN Cc1ccc([C@@H](C)NCCc2nnn(C(C)(C)C)n2)cc1[N+](=O)[O-] ZINC000595419261 478769255 /nfs/dbraw/zinc/76/92/55/478769255.db2.gz JKZGMXOBELULBA-GFCCVEGCSA-N 0 3 332.408 2.538 20 5 EFBDHN C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)N[C@@H]1C[C@H]1C(F)(F)F ZINC000601306715 478776849 /nfs/dbraw/zinc/77/68/49/478776849.db2.gz PCDIRHDIYZHHOP-XXILOJSOSA-N 0 3 331.294 2.852 20 5 EFBDHN CCCN1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000598343909 478777582 /nfs/dbraw/zinc/77/75/82/478777582.db2.gz YGENNMQSZJRZTJ-SNVBAGLBSA-N 0 3 345.321 2.828 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)/C=C\c1ccc(F)cc1[N+](=O)[O-] ZINC000492089277 478817955 /nfs/dbraw/zinc/81/79/55/478817955.db2.gz PPVIMJUXGNEGHZ-FXIPVCQGSA-N 0 3 347.390 2.832 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)/C=C/c1ccc(F)cc1[N+](=O)[O-] ZINC000492089279 478818974 /nfs/dbraw/zinc/81/89/74/478818974.db2.gz PPVIMJUXGNEGHZ-VFXWJFPTSA-N 0 3 347.390 2.832 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCN[C@@H](C(C)C)C1 ZINC000592244348 478838142 /nfs/dbraw/zinc/83/81/42/478838142.db2.gz AZJZXWQACCNKGV-CQSZACIVSA-N 0 3 337.445 2.777 20 5 EFBDHN CC(C)[C@H]1CN(C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)CCN1 ZINC000592244345 478838701 /nfs/dbraw/zinc/83/87/01/478838701.db2.gz AZGXORUHPSAPDE-SWLSCSKDSA-N 0 3 337.445 2.532 20 5 EFBDHN Cc1c(CNC(=O)N[C@H](C)CN2CCC(C)CC2)cccc1[N+](=O)[O-] ZINC000595587351 478871643 /nfs/dbraw/zinc/87/16/43/478871643.db2.gz GVONIYSOGQGSRN-CQSZACIVSA-N 0 3 348.447 2.823 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCN1CC[C@@H](C)C1 ZINC000545201458 478897071 /nfs/dbraw/zinc/89/70/71/478897071.db2.gz BQNDMOUJIPNAES-ZBFHGGJFSA-N 0 3 333.432 2.622 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN[C@H](C(C)C)C1 ZINC000598569221 478901415 /nfs/dbraw/zinc/90/14/15/478901415.db2.gz BTFLRUJTTPZQNU-WBVHZDCISA-N 0 3 333.432 2.620 20 5 EFBDHN CC(C)C[C@@H](CN1CCCC1)NC(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000601610933 478905637 /nfs/dbraw/zinc/90/56/37/478905637.db2.gz UFDDNSCSJXCTHQ-ZDUSSCGKSA-N 0 3 337.395 2.974 20 5 EFBDHN CC(C)[C@@H]1CN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CCN1 ZINC000598576345 478906172 /nfs/dbraw/zinc/90/61/72/478906172.db2.gz RIEZITFHRWCCGK-ZDUSSCGKSA-N 0 3 333.413 2.880 20 5 EFBDHN C[C@H](N[C@@H]1CSC[C@@H]1C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000507263509 478911667 /nfs/dbraw/zinc/91/16/67/478911667.db2.gz BMIOUJVRVRVCNZ-MWODSPESSA-N 0 3 343.836 2.916 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1CN1CCC[C@H]1[C@@H]1CCCOC1)OCCO2 ZINC000592516970 478925532 /nfs/dbraw/zinc/92/55/32/478925532.db2.gz LYARJYOUMJQMQL-HIFRSBDPSA-N 0 3 348.399 2.757 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1CN1CCC[C@H]1[C@H]1CCCOC1)OCCO2 ZINC000592516972 478925927 /nfs/dbraw/zinc/92/59/27/478925927.db2.gz LYARJYOUMJQMQL-ZFWWWQNUSA-N 0 3 348.399 2.757 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1CN1CCC[C@@H]1[C@H]1CCCOC1)OCCO2 ZINC000592516969 478926064 /nfs/dbraw/zinc/92/60/64/478926064.db2.gz LYARJYOUMJQMQL-DZGCQCFKSA-N 0 3 348.399 2.757 20 5 EFBDHN O=C(CCN1CCC2(CCCC2=O)CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000595804698 479007086 /nfs/dbraw/zinc/00/70/86/479007086.db2.gz CEHRZDLCPNRCDC-UHFFFAOYSA-N 0 3 345.399 2.759 20 5 EFBDHN O=C(Nc1ccc([N+](=O)[O-])cc1)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000598804288 479030599 /nfs/dbraw/zinc/03/05/99/479030599.db2.gz ZMBYXYLTAGOHJG-VXGBXAGGSA-N 0 3 348.277 2.517 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H]1CCCN(c2ccnn2C)C1 ZINC000584271635 479072612 /nfs/dbraw/zinc/07/26/12/479072612.db2.gz COPZDWYQMGTPJL-HUUCEWRRSA-N 0 3 343.431 2.956 20 5 EFBDHN CN(C(=O)CCNCCOc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000596061316 479113937 /nfs/dbraw/zinc/11/39/37/479113937.db2.gz OABKAEBDYSEFIY-UHFFFAOYSA-N 0 3 343.383 2.616 20 5 EFBDHN COC(=O)COc1ccc(CN[C@H]2CC23CCCCC3)cc1[N+](=O)[O-] ZINC000598983147 479114316 /nfs/dbraw/zinc/11/43/16/479114316.db2.gz CBODDMVNTHBQHH-INIZCTEOSA-N 0 3 348.399 2.959 20 5 EFBDHN O=c1[n-]ccc(N2CCC(C[NH+]3CCCCCC3)CC2)c1[N+](=O)[O-] ZINC000596073120 479122060 /nfs/dbraw/zinc/12/20/60/479122060.db2.gz FVBBRICTXPHKSC-UHFFFAOYSA-N 0 3 334.420 2.788 20 5 EFBDHN Cc1cc([N+](=O)[O-])cc(Cl)c1NCCCN1CCC(O)CC1 ZINC000596085091 479129339 /nfs/dbraw/zinc/12/93/39/479129339.db2.gz IKRORYQVPKKEEX-UHFFFAOYSA-N 0 3 327.812 2.815 20 5 EFBDHN C[C@@H](c1ccccc1)[N@@H+]1CC[C@@H](Nc2cc[n-]c(=O)c2[N+](=O)[O-])C1 ZINC000596090003 479131754 /nfs/dbraw/zinc/13/17/54/479131754.db2.gz SUBITTJVPUUZQF-GXTWGEPZSA-N 0 3 328.372 2.943 20 5 EFBDHN C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2cc[n-]c(=O)c2[N+](=O)[O-])C1 ZINC000596090003 479131760 /nfs/dbraw/zinc/13/17/60/479131760.db2.gz SUBITTJVPUUZQF-GXTWGEPZSA-N 0 3 328.372 2.943 20 5 EFBDHN C[C@H](c1ccccc1)[N@@H+]1CC[C@H](Nc2cc[n-]c(=O)c2[N+](=O)[O-])C1 ZINC000596090005 479132420 /nfs/dbraw/zinc/13/24/20/479132420.db2.gz SUBITTJVPUUZQF-OCCSQVGLSA-N 0 3 328.372 2.943 20 5 EFBDHN C[C@H](c1ccccc1)[N@H+]1CC[C@H](Nc2cc[n-]c(=O)c2[N+](=O)[O-])C1 ZINC000596090005 479132428 /nfs/dbraw/zinc/13/24/28/479132428.db2.gz SUBITTJVPUUZQF-OCCSQVGLSA-N 0 3 328.372 2.943 20 5 EFBDHN CN1CCC[C@]2(CCN(C(=O)/C=C/c3ccc(F)cc3[N+](=O)[O-])C2)C1 ZINC000493751572 479145401 /nfs/dbraw/zinc/14/54/01/479145401.db2.gz VMFPWURZCUXHOK-JXTAAOLFSA-N 0 3 347.390 2.691 20 5 EFBDHN CC1(C)C(CNCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1(C)C ZINC000569686839 479155358 /nfs/dbraw/zinc/15/53/58/479155358.db2.gz LORMSIGNWRTJBN-UHFFFAOYSA-N 0 3 340.445 2.640 20 5 EFBDHN COc1ccc(NC(=O)[C@H](C)NC2(C3CCC3)CC2)c([N+](=O)[O-])c1 ZINC000593079998 479161969 /nfs/dbraw/zinc/16/19/69/479161969.db2.gz KAVKYISGVBAMHJ-NSHDSACASA-N 0 3 333.388 2.853 20 5 EFBDHN C[C@H]1CCN(c2cc[n-]c(=O)c2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000596144745 479162862 /nfs/dbraw/zinc/16/28/62/479162862.db2.gz MQYJGWSTVPRJRD-AWEZNQCLSA-N 0 3 342.399 2.796 20 5 EFBDHN C[C@H]1CCN(c2cc[n-]c(=O)c2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000596144745 479162867 /nfs/dbraw/zinc/16/28/67/479162867.db2.gz MQYJGWSTVPRJRD-AWEZNQCLSA-N 0 3 342.399 2.796 20 5 EFBDHN COc1cc(NC[C@@]2(N(C)C)CCSC2)c([N+](=O)[O-])cc1C ZINC000596148465 479163751 /nfs/dbraw/zinc/16/37/51/479163751.db2.gz ASJZNKVYXISKPY-HNNXBMFYSA-N 0 3 325.434 2.761 20 5 EFBDHN Cc1nc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000593088015 479165490 /nfs/dbraw/zinc/16/54/90/479165490.db2.gz ZZAIKHLIUNVFPC-ZJUUUORDSA-N 0 3 347.293 2.984 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CNCCSc1ccccc1 ZINC000569762252 479169362 /nfs/dbraw/zinc/16/93/62/479169362.db2.gz KMPINTSEVIMVCZ-CQSZACIVSA-N 0 3 348.424 2.716 20 5 EFBDHN CCN(CCN1CCCCCC1)C(=O)c1ccc(NC)c([N+](=O)[O-])c1 ZINC000573908051 479170228 /nfs/dbraw/zinc/17/02/28/479170228.db2.gz JCGFFZNWGVNHEJ-UHFFFAOYSA-N 0 3 348.447 2.975 20 5 EFBDHN C[C@@H]1C[C@H](Nc2cc[n-]c(=O)c2[N+](=O)[O-])C[N@@H+]1Cc1ccccc1 ZINC000596163375 479172766 /nfs/dbraw/zinc/17/27/66/479172766.db2.gz SNMGZPJCDOCIAU-OCCSQVGLSA-N 0 3 328.372 2.770 20 5 EFBDHN C[C@@H]1C[C@H](Nc2cc[n-]c(=O)c2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000596163375 479172771 /nfs/dbraw/zinc/17/27/71/479172771.db2.gz SNMGZPJCDOCIAU-OCCSQVGLSA-N 0 3 328.372 2.770 20 5 EFBDHN CN(C)CCN(CC1CCCCC1)c1ccc([N+](=O)[O-])c(C(N)=O)c1 ZINC000596170104 479178142 /nfs/dbraw/zinc/17/81/42/479178142.db2.gz PHXWQRPBQVBGBI-UHFFFAOYSA-N 0 3 348.447 2.642 20 5 EFBDHN COc1ccc(NC(=O)CCN2CCC(C)(F)CC2)c([N+](=O)[O-])c1 ZINC000602993186 479184785 /nfs/dbraw/zinc/18/47/85/479184785.db2.gz SSXLRGSSVJEVGZ-UHFFFAOYSA-N 0 3 339.367 2.756 20 5 EFBDHN CN(C(=O)C(C[C@H]1CCCO1)C(F)(F)F)c1ccc([N+](=O)[O-])nc1 ZINC000593144384 479202277 /nfs/dbraw/zinc/20/22/77/479202277.db2.gz WBNCKYRKKITQIK-MNOVXSKESA-N 0 3 347.293 2.700 20 5 EFBDHN CN(CCc1cccc([N+](=O)[O-])c1)C(=O)[C@H]1CCN1C1CCCC1 ZINC000602150337 479204260 /nfs/dbraw/zinc/20/42/60/479204260.db2.gz HCJXYDMCOKBWDD-QGZVFWFLSA-N 0 3 331.416 2.613 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1CN[C@H]1CCOC3(CCCC3)C1)OCCO2 ZINC000610860075 479212137 /nfs/dbraw/zinc/21/21/37/479212137.db2.gz DHAMSNSLHSDHLQ-AWEZNQCLSA-N 0 3 348.399 2.947 20 5 EFBDHN COc1ccc(NC(=O)N(C)CCN2CCCCC2)cc1[N+](=O)[O-] ZINC000593178168 479221821 /nfs/dbraw/zinc/22/18/21/479221821.db2.gz SHKWLXWHNJDAEU-UHFFFAOYSA-N 0 3 336.392 2.553 20 5 EFBDHN Cc1ccc(C(=O)N2CCCN(c3ccncc3)CC2)cc1[N+](=O)[O-] ZINC000603082426 479237050 /nfs/dbraw/zinc/23/70/50/479237050.db2.gz FQPGYPUBLRTXPH-UHFFFAOYSA-N 0 3 340.383 2.651 20 5 EFBDHN Cc1c(C(=O)N2CCCN(c3ccncc3)CC2)cccc1[N+](=O)[O-] ZINC000603084984 479239132 /nfs/dbraw/zinc/23/91/32/479239132.db2.gz ZAEAJPPGNSWZBZ-UHFFFAOYSA-N 0 3 340.383 2.651 20 5 EFBDHN C[C@H](C(=O)N1C[C@H](N2CCCC2)C[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000557118334 479257760 /nfs/dbraw/zinc/25/77/60/479257760.db2.gz YHCJSZLGQNHUJH-JKIFEVAISA-N 0 3 331.416 2.784 20 5 EFBDHN Cc1ccc(CN2CC[C@@H](CN(C)c3c([N+](=O)[O-])ncn3C)C2)s1 ZINC000585092020 479278906 /nfs/dbraw/zinc/27/89/06/479278906.db2.gz BFDFTNOJSXJHIU-ZDUSSCGKSA-N 0 3 349.460 2.657 20 5 EFBDHN Cc1ccc(CN2CC[C@H](CN(C)c3c([N+](=O)[O-])ncn3C)C2)s1 ZINC000585092019 479279033 /nfs/dbraw/zinc/27/90/33/479279033.db2.gz BFDFTNOJSXJHIU-CYBMUJFWSA-N 0 3 349.460 2.657 20 5 EFBDHN O=[N+]([O-])c1ccc(NCC2CCN(Cc3ccncc3)CC2)cn1 ZINC000596436343 479294523 /nfs/dbraw/zinc/29/45/23/479294523.db2.gz MIRSOBMWNQYVBN-UHFFFAOYSA-N 0 3 327.388 2.709 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCn1cc(CNC2CCCCC2)nn1 ZINC000603199569 479298914 /nfs/dbraw/zinc/29/89/14/479298914.db2.gz CEPIFVJUAWHISJ-UHFFFAOYSA-N 0 3 345.403 2.688 20 5 EFBDHN CC(C)N1CCN(C2CCN(c3ccc([N+](=O)[O-])s3)CC2)CC1 ZINC000611166127 479299520 /nfs/dbraw/zinc/29/95/20/479299520.db2.gz KPVQXRQLNZYTQS-UHFFFAOYSA-N 0 3 338.477 2.651 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CN2CC(Cc3ccccc3)C2)c1 ZINC000611177963 479302539 /nfs/dbraw/zinc/30/25/39/479302539.db2.gz HGYJCGXYMRHBAS-SFHVURJKSA-N 0 3 342.395 2.509 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC(N2CCOCC2)CC1 ZINC000599473163 479307633 /nfs/dbraw/zinc/30/76/33/479307633.db2.gz YTOVNAXJDIMQOT-OAHLLOKOSA-N 0 3 333.432 2.761 20 5 EFBDHN CCN(C[C@@H]1CCOC1)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000611205220 479310565 /nfs/dbraw/zinc/31/05/65/479310565.db2.gz OECLQSIQGJJXSO-KBPBESRZSA-N 0 3 335.404 2.589 20 5 EFBDHN COCCC1CCN(CCOc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC000599507601 479316346 /nfs/dbraw/zinc/31/63/46/479316346.db2.gz ZVCKYVGENVQGSE-UHFFFAOYSA-N 0 3 338.404 2.731 20 5 EFBDHN COc1ccc(CN[C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cc1O ZINC000574633130 479320192 /nfs/dbraw/zinc/32/01/92/479320192.db2.gz DAKKRUYMCYVVAU-KGLIPLIRSA-N 0 3 346.387 2.779 20 5 EFBDHN CCOc1ccc([C@@H](C)NCCOC[C@H]2CCOC2)cc1[N+](=O)[O-] ZINC000611248451 479322703 /nfs/dbraw/zinc/32/27/03/479322703.db2.gz GDCPUWUUPLBTQM-KGLIPLIRSA-N 0 3 338.404 2.697 20 5 EFBDHN Cc1ccc(CN2CCCN(C[C@@H]3CCCO3)CC2)cc1[N+](=O)[O-] ZINC000611254054 479324612 /nfs/dbraw/zinc/32/46/12/479324612.db2.gz KIYVCFCNMSJEJH-KRWDZBQOSA-N 0 3 333.432 2.590 20 5 EFBDHN COC1CCC(N(C)Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1 ZINC000611271830 479331606 /nfs/dbraw/zinc/33/16/06/479331606.db2.gz SASOQNYEGOLHKX-UHFFFAOYSA-N 0 3 336.388 2.755 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1CN1CC[C@H](C3CCOCC3)C1)OCCO2 ZINC000611274859 479334650 /nfs/dbraw/zinc/33/46/50/479334650.db2.gz YJAWPNGPOFKVCH-AWEZNQCLSA-N 0 3 348.399 2.615 20 5 EFBDHN Cc1cccc(C(=O)NCCN[C@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000574770986 479346650 /nfs/dbraw/zinc/34/66/50/479346650.db2.gz NMWMJAKZPYRDQX-KRWDZBQOSA-N 0 3 339.395 2.910 20 5 EFBDHN CCc1ccc(C(=O)NC[C@H]2CCCCN2C2CC2)cc1[N+](=O)[O-] ZINC000574856287 479359457 /nfs/dbraw/zinc/35/94/57/479359457.db2.gz BOLBMWLWLIOEBE-MRXNPFEDSA-N 0 3 331.416 2.904 20 5 EFBDHN Cc1cc([N+](=O)[O-])cnc1N(C)CCCN(C)Cc1ccncc1 ZINC000603403773 479372430 /nfs/dbraw/zinc/37/24/30/479372430.db2.gz YDFDVJWICMYSJG-UHFFFAOYSA-N 0 3 329.404 2.652 20 5 EFBDHN Cc1nccn1C[C@H](C)CNCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602508200 479372815 /nfs/dbraw/zinc/37/28/15/479372815.db2.gz ADYPNYMRXHXUDV-LLVKDONJSA-N 0 3 329.360 2.667 20 5 EFBDHN CN(CCN1CCCCC1)c1ncc(Br)cc1[N+](=O)[O-] ZINC000593516466 479374125 /nfs/dbraw/zinc/37/41/25/479374125.db2.gz NXLUNJXRNGZLPE-UHFFFAOYSA-N 0 3 343.225 2.674 20 5 EFBDHN O=[N+]([O-])c1sc(CNCCCn2cccn2)cc1Br ZINC000602511411 479374382 /nfs/dbraw/zinc/37/43/82/479374382.db2.gz RCEQCVYTRHTDJW-UHFFFAOYSA-N 0 3 345.222 2.795 20 5 EFBDHN C[C@@H](CNCc1nc2cc([N+](=O)[O-])ccc2o1)N1CCC(C)CC1 ZINC000602523448 479380048 /nfs/dbraw/zinc/38/00/48/479380048.db2.gz CPMYNTLANDJSLT-ZDUSSCGKSA-N 0 3 332.404 2.946 20 5 EFBDHN O=C(CNCCc1ccc([N+](=O)[O-])cc1)N1CCCc2ccccc21 ZINC000602528882 479382996 /nfs/dbraw/zinc/38/29/96/479382996.db2.gz PCUAVFQWTMOOSW-UHFFFAOYSA-N 0 3 339.395 2.706 20 5 EFBDHN Cc1nccn1CCNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602535008 479385555 /nfs/dbraw/zinc/38/55/55/479385555.db2.gz WXLRZUYDCRQQOY-UHFFFAOYSA-N 0 3 328.294 2.908 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN[C@H]1CCc2n[nH]cc2C1 ZINC000602550874 479392508 /nfs/dbraw/zinc/39/25/08/479392508.db2.gz DUORSQCHTBGTPW-LBPRGKRZSA-N 0 3 340.305 2.984 20 5 EFBDHN CNC(=O)[C@H]1CCC[C@H]1NCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602576211 479406238 /nfs/dbraw/zinc/40/62/38/479406238.db2.gz JXNFNCIHKMQSCM-NWDGAFQWSA-N 0 3 345.321 2.618 20 5 EFBDHN COc1ccc(CN(C)C)cc1NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000603589928 479409854 /nfs/dbraw/zinc/40/98/54/479409854.db2.gz PRYQGFAWQKTCHD-UHFFFAOYSA-N 0 3 329.356 2.917 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCN1CCC[C@H]1/C=C\c1ccccc1 ZINC000611554805 479414363 /nfs/dbraw/zinc/41/43/63/479414363.db2.gz XRMIMTZPEWEQJI-JJEJIETFSA-N 0 3 339.395 2.934 20 5 EFBDHN CO[C@]1(CNCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCOC1 ZINC000602616496 479426015 /nfs/dbraw/zinc/42/60/15/479426015.db2.gz JSRSAEDNZAKGBA-ZDUSSCGKSA-N 0 3 334.294 2.509 20 5 EFBDHN CC1(C)C[C@H](NCC[C@@]2(O)CCCOC2)c2cc([N+](=O)[O-])ccc21 ZINC000593719553 479433951 /nfs/dbraw/zinc/43/39/51/479433951.db2.gz FIORSQBHJQLCHZ-WMZOPIPTSA-N 0 3 334.416 2.838 20 5 EFBDHN CC1(C)C[C@@H](NCC[C@]2(O)CCCOC2)c2cc([N+](=O)[O-])ccc21 ZINC000593719551 479434435 /nfs/dbraw/zinc/43/44/35/479434435.db2.gz FIORSQBHJQLCHZ-SJLPKXTDSA-N 0 3 334.416 2.838 20 5 EFBDHN CNC(=O)[C@]1(C)CCN(Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602641828 479442282 /nfs/dbraw/zinc/44/22/82/479442282.db2.gz FMWZAQATMLGHCD-CQSZACIVSA-N 0 3 345.321 2.572 20 5 EFBDHN O=[N+]([O-])c1ccc2ncnc(N3CCN(C4CCCCC4)CC3)c2c1 ZINC000611712174 479454271 /nfs/dbraw/zinc/45/42/71/479454271.db2.gz XETNBBOCXVISJP-UHFFFAOYSA-N 0 3 341.415 2.993 20 5 EFBDHN C[C@H](CCCO)CNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602672687 479465773 /nfs/dbraw/zinc/46/57/73/479465773.db2.gz FHYUZOHMDWTVGQ-MRVPVSSYSA-N 0 3 337.239 2.917 20 5 EFBDHN O=[N+]([O-])c1ccc(CCNc2cccc(CN3CC[C@@H](O)C3)c2)cc1 ZINC000602676295 479469305 /nfs/dbraw/zinc/46/93/05/479469305.db2.gz LVNPBFXJSLHBDU-LJQANCHMSA-N 0 3 341.411 2.816 20 5 EFBDHN O=[N+]([O-])c1sc(CN[C@H]2CCC[C@H]2CO)cc1Br ZINC000602679697 479470229 /nfs/dbraw/zinc/47/02/29/479470229.db2.gz AHFJRWWHQPMFQB-XVKPBYJWSA-N 0 3 335.223 2.669 20 5 EFBDHN CCCN1CC[C@H](NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)C1 ZINC000596882729 479471596 /nfs/dbraw/zinc/47/15/96/479471596.db2.gz VZJWTVCIBHUVIT-INIZCTEOSA-N 0 3 348.447 2.999 20 5 EFBDHN CCn1ccnc1[C@H](C)NC1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602681676 479471760 /nfs/dbraw/zinc/47/17/60/479471760.db2.gz KKVKHJDAONYIOY-ZDUSSCGKSA-N 0 3 344.419 2.526 20 5 EFBDHN CN(C)[C@@H](CNc1c(Cl)cncc1[N+](=O)[O-])c1cccc(F)c1 ZINC000589104179 479477685 /nfs/dbraw/zinc/47/76/85/479477685.db2.gz VUYIYOHZARCKPE-ZDUSSCGKSA-N 0 3 338.770 2.919 20 5 EFBDHN O=[N+]([O-])c1ccc2oc(CN[C@H]3CCCN4CCCC[C@H]34)nc2c1 ZINC000602713004 479496864 /nfs/dbraw/zinc/49/68/64/479496864.db2.gz XRWOQPAWGVVVEY-DZGCQCFKSA-N 0 3 330.388 2.843 20 5 EFBDHN CCOc1ccc(C(=O)N(C)CCN2CCCCC2)cc1[N+](=O)[O-] ZINC000593884984 479496970 /nfs/dbraw/zinc/49/69/70/479496970.db2.gz ZBJHQAFMFREYAH-UHFFFAOYSA-N 0 3 335.404 2.551 20 5 EFBDHN O=[N+]([O-])c1ccc2oc(CN[C@@H]3CCCN4CCCC[C@H]34)nc2c1 ZINC000602713006 479497339 /nfs/dbraw/zinc/49/73/39/479497339.db2.gz XRWOQPAWGVVVEY-UKRRQHHQSA-N 0 3 330.388 2.843 20 5 EFBDHN CN(CCN1CCCCC1)C(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000593883712 479497410 /nfs/dbraw/zinc/49/74/10/479497410.db2.gz RWZKHAMYHSVDQJ-UHFFFAOYSA-N 0 3 342.399 2.701 20 5 EFBDHN COC(=O)C[C@H]1CCCCN1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000604305051 479498100 /nfs/dbraw/zinc/49/81/00/479498100.db2.gz QGEKATVUQIAGIR-OAHLLOKOSA-N 0 3 336.388 2.781 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC[C@@H](C(=O)N2CCCC2)C1 ZINC000575907892 479498543 /nfs/dbraw/zinc/49/85/43/479498543.db2.gz VQDCMEBWJWQMGN-JBXOJTMHSA-N 0 3 343.427 2.942 20 5 EFBDHN CN(CCNCc1ccc(C(F)(F)F)cc1[N+](=O)[O-])CC(F)F ZINC000602729356 479511799 /nfs/dbraw/zinc/51/17/99/479511799.db2.gz IQMWSCCCKKLOFA-UHFFFAOYSA-N 0 3 341.280 2.900 20 5 EFBDHN O=C(NC[C@@H]1CCCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])[nH]1 ZINC000604472209 479522617 /nfs/dbraw/zinc/52/26/17/479522617.db2.gz MNPFTWDSMQAZSK-HNNXBMFYSA-N 0 3 342.399 2.565 20 5 EFBDHN O=C(NC[C@@H]1CCCN(Cc2ccccc2)C1)c1cc([N+](=O)[O-])c[nH]1 ZINC000604472165 479522786 /nfs/dbraw/zinc/52/27/86/479522786.db2.gz GPHDBFIONRMPGZ-HNNXBMFYSA-N 0 3 342.399 2.565 20 5 EFBDHN Cc1ccncc1[C@H](C)NCCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000611938538 479527439 /nfs/dbraw/zinc/52/74/39/479527439.db2.gz FKZLTLYMEZRILN-ZDUSSCGKSA-N 0 3 328.372 2.978 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN(C)CCCOc1ccc(F)cc1 ZINC000602760728 479533392 /nfs/dbraw/zinc/53/33/92/479533392.db2.gz AJWAGJXLHXDWDU-UHFFFAOYSA-N 0 3 336.367 2.640 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN(Cc1ccccc1)C[C@@H]1CCCO1 ZINC000602761905 479533582 /nfs/dbraw/zinc/53/35/82/479533582.db2.gz BTJBHTZQVCTQSM-KRWDZBQOSA-N 0 3 344.415 2.781 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN1CCC(OC2CCCCC2)CC1 ZINC000602767050 479536786 /nfs/dbraw/zinc/53/67/86/479536786.db2.gz UZKQNFLGSPFVPI-UHFFFAOYSA-N 0 3 336.436 2.913 20 5 EFBDHN CCC(C)(C)N1CCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000594020703 479551875 /nfs/dbraw/zinc/55/18/75/479551875.db2.gz LOKBGVMFJHQXSY-UHFFFAOYSA-N 0 3 348.447 2.648 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN(Cc1cccc(O)c1)CC1CC1 ZINC000602787344 479554016 /nfs/dbraw/zinc/55/40/16/479554016.db2.gz PUDNPIQJHSPCHN-UHFFFAOYSA-N 0 3 330.388 2.718 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN[C@@H]1CCc2ccccc21 ZINC000612028261 479554147 /nfs/dbraw/zinc/55/41/47/479554147.db2.gz YCPFAMYBCNRGHL-GOEBONIOSA-N 0 3 328.368 2.612 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN1CCC[C@@H](Nc2ccccc2)C1 ZINC000602794775 479558781 /nfs/dbraw/zinc/55/87/81/479558781.db2.gz JODXOSCWWQKQAV-MRXNPFEDSA-N 0 3 329.404 2.676 20 5 EFBDHN Cc1ncc(CNC(=O)CCN[C@@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000602800185 479562652 /nfs/dbraw/zinc/56/26/52/479562652.db2.gz KGPLHUVRMDPEFR-NSHDSACASA-N 0 3 348.428 2.717 20 5 EFBDHN CC[C@H](NCCn1c(C)ncc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000602802969 479564726 /nfs/dbraw/zinc/56/47/26/479564726.db2.gz SYKFPVITTRIJTQ-AWEZNQCLSA-N 0 3 346.387 2.612 20 5 EFBDHN COc1ccc([C@H](NCCn2c(C)ncc2[N+](=O)[O-])C2CC2)cc1 ZINC000602805054 479565872 /nfs/dbraw/zinc/56/58/72/479565872.db2.gz LCEBFLYJKKTXJK-QGZVFWFLSA-N 0 3 330.388 2.849 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN1CC[C@@H](COc2ccccc2)C1 ZINC000602807943 479567647 /nfs/dbraw/zinc/56/76/47/479567647.db2.gz VNDGFUZMPKJXHX-OAHLLOKOSA-N 0 3 330.388 2.501 20 5 EFBDHN CCOc1cc(N2CCN(C[C@H]3CCO[C@@H]3C)CC2)ccc1[N+](=O)[O-] ZINC000602822092 479575611 /nfs/dbraw/zinc/57/56/11/479575611.db2.gz RKQOSIKULOUXMP-HUUCEWRRSA-N 0 3 349.431 2.541 20 5 EFBDHN COc1ccc(NC(=O)N[C@@H]2CCCN3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC000594077867 479581089 /nfs/dbraw/zinc/58/10/89/479581089.db2.gz BAOFLUBHMMFOER-ZIAGYGMSSA-N 0 3 348.403 2.742 20 5 EFBDHN CC(C)(NC(=O)N[C@@H]1CCN(CC2CC2)C1)c1ccccc1[N+](=O)[O-] ZINC000589886813 479581171 /nfs/dbraw/zinc/58/11/71/479581171.db2.gz CXGUIPKIZHGEJN-CQSZACIVSA-N 0 3 346.431 2.613 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1CCCN2CCCC[C@@H]12 ZINC000594094441 479586410 /nfs/dbraw/zinc/58/64/10/479586410.db2.gz JYGLEVMELYPWLM-HIFRSBDPSA-N 0 3 348.403 2.742 20 5 EFBDHN CC[C@@H]1CN(C)CCN1c1cc(C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000590146734 479609959 /nfs/dbraw/zinc/60/99/59/479609959.db2.gz PBLXYIBWVYQMGD-OAHLLOKOSA-N 0 3 341.415 2.891 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC[C@@H]2NC(=O)CC[C@@H]2C1 ZINC000597207185 479621412 /nfs/dbraw/zinc/62/14/12/479621412.db2.gz SQEKZLZVZHPGEV-OUOSUHLLSA-N 0 3 329.400 2.599 20 5 EFBDHN O=C(CSc1ccccc1[N+](=O)[O-])N[C@@H]1CCCN2CCCC[C@H]12 ZINC000594196156 479626614 /nfs/dbraw/zinc/62/66/14/479626614.db2.gz LBVTWOWHLLUBPO-ZIAGYGMSSA-N 0 3 349.456 2.820 20 5 EFBDHN O=C(N[C@H]1CCCN2CCCC[C@@H]12)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000594195693 479626637 /nfs/dbraw/zinc/62/66/37/479626637.db2.gz HIDXNBQNMIITGJ-GJZGRUSLSA-N 0 3 337.807 2.995 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@@H]1CCCN2CCCC[C@H]12 ZINC000594195709 479626770 /nfs/dbraw/zinc/62/67/70/479626770.db2.gz HQOQGOGFPNPOMM-HZPDHXFCSA-N 0 3 331.416 2.958 20 5 EFBDHN O=C(CSc1ccccc1[N+](=O)[O-])N[C@H]1CCCN2CCCC[C@H]12 ZINC000594196154 479626846 /nfs/dbraw/zinc/62/68/46/479626846.db2.gz LBVTWOWHLLUBPO-UONOGXRCSA-N 0 3 349.456 2.820 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@H]1CCCN2CCCC[C@@H]12 ZINC000594195708 479627474 /nfs/dbraw/zinc/62/74/74/479627474.db2.gz HQOQGOGFPNPOMM-HOTGVXAUSA-N 0 3 331.416 2.958 20 5 EFBDHN COc1cc(C(=O)N[C@@H]2CCCN3CCCC[C@H]23)cc([N+](=O)[O-])c1C ZINC000594197501 479628481 /nfs/dbraw/zinc/62/84/81/479628481.db2.gz OUGYQDIVJYQSLA-HUUCEWRRSA-N 0 3 347.415 2.659 20 5 EFBDHN O=C(N[C@@H]1CCCN2CCCC[C@@H]12)c1c(Cl)cccc1[N+](=O)[O-] ZINC000594198981 479628940 /nfs/dbraw/zinc/62/89/40/479628940.db2.gz WZMCEDVWSDVWQJ-OLZOCXBDSA-N 0 3 337.807 2.995 20 5 EFBDHN O=C(CCc1cccc([N+](=O)[O-])c1)N[C@@H]1CCCN2CCCC[C@H]12 ZINC000594198708 479629823 /nfs/dbraw/zinc/62/98/23/479629823.db2.gz VEJGFQKJQNUVCV-IAGOWNOFSA-N 0 3 331.416 2.661 20 5 EFBDHN CCOc1ccc(C(=O)N[C@H]2CCCN3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC000594201737 479630476 /nfs/dbraw/zinc/63/04/76/479630476.db2.gz QOIFEEXYDVHFAX-LSDHHAIUSA-N 0 3 347.415 2.740 20 5 EFBDHN O=C1CCCN1C[C@@H]1CCN(C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000597227209 479631979 /nfs/dbraw/zinc/63/19/79/479631979.db2.gz ATPKNUXVRASHRT-YFCVBGDOSA-N 0 3 329.400 2.552 20 5 EFBDHN CC[C@H]1CN(C)CCCN1C(=O)CCOc1cc(C)ccc1[N+](=O)[O-] ZINC000590538042 479657315 /nfs/dbraw/zinc/65/73/15/479657315.db2.gz OGTKBPHCRQNAHF-HNNXBMFYSA-N 0 3 349.431 2.615 20 5 EFBDHN CCO[C@@H]1C[C@H](NC/C=C\c2ccccc2[N+](=O)[O-])[C@]12CCCO2 ZINC000612691922 479733791 /nfs/dbraw/zinc/73/37/91/479733791.db2.gz UFDQREVPNDGJAU-TVCHPBECSA-N 0 3 332.400 2.924 20 5 EFBDHN COc1c(C(=O)N2CCC[C@H]2CN2CCCCC2)cccc1[N+](=O)[O-] ZINC000619434411 479789065 /nfs/dbraw/zinc/78/90/65/479789065.db2.gz ZXQBVVXBMYUICZ-AWEZNQCLSA-N 0 3 347.415 2.694 20 5 EFBDHN CCn1nc(C)c([N+](=O)[O-])c1N1CC[C@@H](N(C)Cc2ccccc2)C1 ZINC000619482999 479807885 /nfs/dbraw/zinc/80/78/85/479807885.db2.gz CKZBTQWHLFQTHM-MRXNPFEDSA-N 0 3 343.431 2.830 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1CNC[C@@H]1CCC(F)(F)C1)OCCO2 ZINC000619530065 479819593 /nfs/dbraw/zinc/81/95/93/479819593.db2.gz WTGPTPVERXQQKH-SNVBAGLBSA-N 0 3 328.315 2.891 20 5 EFBDHN Cc1cc(N2CC[C@@H](C)[S@@](=O)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000617483679 480236782 /nfs/dbraw/zinc/23/67/82/480236782.db2.gz JEWCWPXMJPJEEV-SPSFWMDKSA-N 0 3 333.413 2.799 20 5 EFBDHN C[C@H](NC[C@H]1CCCN1c1cccnn1)c1ccccc1[N+](=O)[O-] ZINC000610342233 480283505 /nfs/dbraw/zinc/28/35/05/480283505.db2.gz ALKLNQLSDNIRLK-UONOGXRCSA-N 0 3 327.388 2.704 20 5 EFBDHN COCCN1CCC[C@H](Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000610550191 480334815 /nfs/dbraw/zinc/33/48/15/480334815.db2.gz HNCDPSCKUPFYFT-LBPRGKRZSA-N 0 3 345.346 2.719 20 5 EFBDHN COc1cc(CNCC2(CO)CCCCC2)c([N+](=O)[O-])cc1OC ZINC000610583451 480344435 /nfs/dbraw/zinc/34/44/35/480344435.db2.gz MDXWTCBCQCGFRG-UHFFFAOYSA-N 0 3 338.404 2.644 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000617746235 480351041 /nfs/dbraw/zinc/35/10/41/480351041.db2.gz HNQHICHMWJDSQJ-LXZKKBNFSA-N 0 3 331.416 2.784 20 5 EFBDHN C[C@@H](CCNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)N(C)C ZINC000617758129 480354319 /nfs/dbraw/zinc/35/43/19/480354319.db2.gz IKHNDMHRBOUQBI-ZDUSSCGKSA-N 0 3 337.423 2.751 20 5 EFBDHN CC[C@@H](CN1CCCC1)Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000610715918 480373407 /nfs/dbraw/zinc/37/34/07/480373407.db2.gz COWAFKJXFBRMED-AWEZNQCLSA-N 0 3 346.431 2.773 20 5 EFBDHN O=C(NCCN[C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccco1 ZINC000192629257 534358437 /nfs/dbraw/zinc/35/84/37/534358437.db2.gz GLDUPYUSJGDHQO-HNNXBMFYSA-N 0 3 329.356 2.585 20 5 EFBDHN CN(CCOc1ccccc1[N+](=O)[O-])[C@H]1CCCc2c1cnn2C ZINC000135592351 522923070 /nfs/dbraw/zinc/92/30/70/522923070.db2.gz YGZTVKDPGVGCLB-AWEZNQCLSA-N 0 3 330.388 2.717 20 5 EFBDHN CC[C@H]1CCCCN1CCNC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000119407884 523023233 /nfs/dbraw/zinc/02/32/33/523023233.db2.gz SBFOOWGZTDGKMO-INIZCTEOSA-N 0 3 348.447 2.701 20 5 EFBDHN CC[C@H]1CCCC[C@@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000120515246 523043117 /nfs/dbraw/zinc/04/31/17/523043117.db2.gz CFZFTMOXEPFPJM-BBRMVZONSA-N 0 3 340.445 2.927 20 5 EFBDHN CC[C@@H]1CCCC[C@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000120515389 523221875 /nfs/dbraw/zinc/22/18/75/523221875.db2.gz CFZFTMOXEPFPJM-CZUORRHYSA-N 0 3 340.445 2.927 20 5 EFBDHN COc1ccc(CN2CCNC[C@H]2c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000261768649 524034927 /nfs/dbraw/zinc/03/49/27/524034927.db2.gz OPJGMVLPZKEGDJ-KRWDZBQOSA-N 0 3 345.374 2.889 20 5 EFBDHN CN(C)CCN(C(=O)CCc1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000087356522 524058612 /nfs/dbraw/zinc/05/86/12/524058612.db2.gz GYGJLETUTIDAQO-UHFFFAOYSA-N 0 3 333.432 2.860 20 5 EFBDHN CN(C)CCN(C(=O)Cc1ccc([N+](=O)[O-])cc1F)C1CCCC1 ZINC000154624346 524058860 /nfs/dbraw/zinc/05/88/60/524058860.db2.gz OGNMLEAPIHFMFJ-UHFFFAOYSA-N 0 3 337.395 2.609 20 5 EFBDHN C[C@@H](CNC(=O)NCCc1cccc([N+](=O)[O-])c1)N1CCC[C@H](C)C1 ZINC000119279193 524678843 /nfs/dbraw/zinc/67/88/43/524678843.db2.gz IFRSTZDLFRWGBA-GJZGRUSLSA-N 0 3 348.447 2.557 20 5 EFBDHN C[C@@H]1CN(CCn2cc([N+](=O)[O-])ccc2=O)CC[C@H]1c1ccccc1 ZINC000245586115 524962495 /nfs/dbraw/zinc/96/24/95/524962495.db2.gz MJSQNKNSHXRRLP-CRAIPNDOSA-N 0 3 341.411 2.882 20 5 EFBDHN C[S@](=O)C[C@H](NCCOc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000183131010 525389738 /nfs/dbraw/zinc/38/97/38/525389738.db2.gz HNJSKUFDXQXAKN-XDHUDOTRSA-N 0 3 348.424 2.683 20 5 EFBDHN Cc1ccc([C@@H](C)NC[C@@H](C(C)C)N2CCOCC2)cc1[N+](=O)[O-] ZINC000120077714 525728920 /nfs/dbraw/zinc/72/89/20/525728920.db2.gz LNGGTLOGANQLHV-QAPCUYQASA-N 0 3 335.448 2.911 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@]3(CO)CCOC3)s2)cc1 ZINC000184194851 534881484 /nfs/dbraw/zinc/88/14/84/534881484.db2.gz RTLVNCCGOKWYEJ-INIZCTEOSA-N 0 3 334.397 2.564 20 5 EFBDHN Cc1ccsc1CN(C)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000078991271 525838322 /nfs/dbraw/zinc/83/83/22/525838322.db2.gz GBMXGHQGKSWMRI-AWEZNQCLSA-N 0 3 336.413 2.836 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N2CC[C@@H](N3CCCC3)C2)cc1[N+](=O)[O-] ZINC000176746831 525897673 /nfs/dbraw/zinc/89/76/73/525897673.db2.gz XUGKALQVFKTYCR-GOEBONIOSA-N 0 3 346.431 2.844 20 5 EFBDHN C[C@H](C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21)c1ccc([N+](=O)[O-])cc1F ZINC000185025140 525973491 /nfs/dbraw/zinc/97/34/91/525973491.db2.gz GOIRZPLRVAKOSR-AHIWAGSCSA-N 0 3 349.406 2.780 20 5 EFBDHN CCCN1CCC[C@H]1CNC(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000343563953 534909041 /nfs/dbraw/zinc/90/90/41/534909041.db2.gz ZSLDVSLAVPZCCC-LBPRGKRZSA-N 0 3 337.445 2.921 20 5 EFBDHN CCCN1CCC[C@H]1CNC(=O)c1cc(OCC)ccc1[N+](=O)[O-] ZINC000343638840 534910471 /nfs/dbraw/zinc/91/04/71/534910471.db2.gz ZZQLCTZYAXWIAI-ZDUSSCGKSA-N 0 3 335.404 2.598 20 5 EFBDHN O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CCN(C2CCCCC2)CC1 ZINC000154807310 527247296 /nfs/dbraw/zinc/24/72/96/527247296.db2.gz OENSUZQQJVVXMC-UHFFFAOYSA-N 0 3 349.406 2.753 20 5 EFBDHN O=[N+]([O-])c1ccc(CCN2CCC[C@H](c3nnc4n3CCC4)C2)cc1 ZINC000195521097 527346797 /nfs/dbraw/zinc/34/67/97/527346797.db2.gz VCGXHRRIEIGDIY-HNNXBMFYSA-N 0 3 341.415 2.555 20 5 EFBDHN O=[N+]([O-])c1ccc(CN2CCC(CCCN3CCOCC3)CC2)cc1 ZINC000182981089 527349657 /nfs/dbraw/zinc/34/96/57/527349657.db2.gz ZGPCNNOPCZVVMO-UHFFFAOYSA-N 0 3 347.459 2.919 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CN2CCCN(c3ccccc3)CC2)c1 ZINC000136981634 527394461 /nfs/dbraw/zinc/39/44/61/527394461.db2.gz CZJIFXBWYHNZSA-IBGZPJMESA-N 0 3 341.411 2.841 20 5 EFBDHN CC(C)Oc1cc(C(=O)N2CC[C@H]3CC[C@@H](C2)N3C)ccc1[N+](=O)[O-] ZINC000412153711 534946024 /nfs/dbraw/zinc/94/60/24/534946024.db2.gz HVIYYVWPPMZOGN-CABCVRRESA-N 0 3 347.415 2.691 20 5 EFBDHN CC(C)Oc1cc(C(=O)NC2(CN(C)C)CCC2)ccc1[N+](=O)[O-] ZINC000412319069 534946170 /nfs/dbraw/zinc/94/61/70/534946170.db2.gz HOQJGWNFGIJRMW-UHFFFAOYSA-N 0 3 335.404 2.596 20 5 EFBDHN CC(C)Oc1cc(C(=O)N[C@H]2CCN(C)[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000412134058 534951697 /nfs/dbraw/zinc/95/16/97/534951697.db2.gz LGWUKKMTNYQVDO-OCCSQVGLSA-N 0 3 335.404 2.595 20 5 EFBDHN CCN1CCC(N(C)C(=O)CCOc2cc(C)ccc2[N+](=O)[O-])CC1 ZINC000344665263 535455907 /nfs/dbraw/zinc/45/59/07/535455907.db2.gz CUBDINNFWKZJEN-UHFFFAOYSA-N 0 3 349.431 2.615 20 5 EFBDHN CC[C@@H](NCC1(CS(C)(=O)=O)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000342288335 535802997 /nfs/dbraw/zinc/80/29/97/535802997.db2.gz OYDMYEXUXQKQLG-OAHLLOKOSA-N 0 3 340.445 2.850 20 5 EFBDHN CN(C)CCOc1cccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000337270279 535910518 /nfs/dbraw/zinc/91/05/18/535910518.db2.gz ZPQYXMFJMLVDPE-UHFFFAOYSA-N 0 3 343.383 2.716 20 5 EFBDHN CN(C)Cc1ccc(C(=O)NCCc2ccccc2[N+](=O)[O-])cc1 ZINC000266086414 535996506 /nfs/dbraw/zinc/99/65/06/535996506.db2.gz XMXLDEWXPSTGDE-UHFFFAOYSA-N 0 3 327.384 2.629 20 5 EFBDHN CCn1nc(C)c([N+](=O)[O-])c1N1CCN(C2CCC(C)CC2)CC1 ZINC000192599411 536144257 /nfs/dbraw/zinc/14/42/57/536144257.db2.gz ZQXHLVUDSGMEDF-UHFFFAOYSA-N 0 3 335.452 2.820 20 5 EFBDHN CN(CCN1CCCC1)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425403900 536371328 /nfs/dbraw/zinc/37/13/28/536371328.db2.gz KQBJEHKSNASXSK-UHFFFAOYSA-N 0 3 342.237 2.885 20 5 EFBDHN COc1c(C(=O)N[C@@H](C)CN2CCCCCC2)cccc1[N+](=O)[O-] ZINC000356813587 536847846 /nfs/dbraw/zinc/84/78/46/536847846.db2.gz GRHVFEHMFSNTFT-ZDUSSCGKSA-N 0 3 335.404 2.598 20 5 EFBDHN COc1ccc([C@H](C)NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC000341203252 536898609 /nfs/dbraw/zinc/89/86/09/536898609.db2.gz CBJPBHAFMAJVGR-BBRMVZONSA-N 0 3 346.383 2.694 20 5 EFBDHN C[C@@H]1CN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@H](C)S1 ZINC000753917422 575359150 /nfs/dbraw/zinc/35/91/50/575359150.db2.gz PNHFGFQORDQNFY-PHIMTYICSA-N 0 3 341.408 2.888 20 5 EFBDHN COC(=O)C[C@H](NCc1cc([N+](=O)[O-])ccc1OC(C)C)C1CC1 ZINC000754539788 575449126 /nfs/dbraw/zinc/44/91/26/575449126.db2.gz MINJHYUFSDTZKN-HNNXBMFYSA-N 0 3 336.388 2.813 20 5 EFBDHN COCC[C@@H](NC[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(C)o1 ZINC000754547521 575450422 /nfs/dbraw/zinc/45/04/22/575450422.db2.gz WGPFKAHBNULHCG-CVEARBPZSA-N 0 3 334.372 2.897 20 5 EFBDHN CCCCN(C)CCNC(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000756951641 575804532 /nfs/dbraw/zinc/80/45/32/575804532.db2.gz VHFXDNZTMKODKG-UHFFFAOYSA-N 0 3 342.827 2.779 20 5 EFBDHN C[C@@H]1CC[C@@H](C)N1CC(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000756998573 575809333 /nfs/dbraw/zinc/80/93/33/575809333.db2.gz MTUXJXABNBBKHH-GHMZBOCLSA-N 0 3 325.796 2.737 20 5 EFBDHN CN(C)Cc1ccc(CN(C)C(=O)c2cccc([N+](=O)[O-])c2N)cc1 ZINC000759081185 575884174 /nfs/dbraw/zinc/88/41/74/575884174.db2.gz YLEFEEFNRDHFIU-UHFFFAOYSA-N 0 3 342.399 2.511 20 5 EFBDHN Cc1nn(CN2CC[C@H](C3CCOCC3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761292734 576141549 /nfs/dbraw/zinc/14/15/49/576141549.db2.gz MSMDFTPGDZPANW-HNNXBMFYSA-N 0 3 344.415 2.959 20 5 EFBDHN Cc1nn(CN2CC[C@@H]([C@H]3CCOC3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761293920 576141599 /nfs/dbraw/zinc/14/15/99/576141599.db2.gz TUMPEEUDBRBMGT-KGLIPLIRSA-N 0 3 330.388 2.569 20 5 EFBDHN C[C@H]1CN(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)Cc2ccccc21 ZINC000763629765 576383338 /nfs/dbraw/zinc/38/33/38/576383338.db2.gz SJCWQHBBSLJMOP-WMLDXEAASA-N 0 3 342.395 2.954 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H]1C[C@@H](O)c1cnn(C)c1 ZINC000766946881 577189357 /nfs/dbraw/zinc/18/93/57/577189357.db2.gz PQWDHPHWZJNKBU-QIIPPGSGSA-N 0 3 344.415 2.977 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCC(N[C@H](CCO)c3ccco3)CC2)cc1 ZINC000769409632 577360489 /nfs/dbraw/zinc/36/04/89/577360489.db2.gz ACTPAMPTIFWSCD-QGZVFWFLSA-N 0 3 345.399 2.870 20 5 EFBDHN C[C@@H](CN1CCOCC1)NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000726607605 577375442 /nfs/dbraw/zinc/37/54/42/577375442.db2.gz UXDAYABDROZCNO-AWEZNQCLSA-N 0 3 345.399 2.665 20 5 EFBDHN CN1CCC[C@@H](CNC(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000770011017 577397694 /nfs/dbraw/zinc/39/76/94/577397694.db2.gz YKACBMLXKZSELC-JTQLQIEISA-N 0 3 326.784 2.712 20 5 EFBDHN Cc1cc([N+](=O)[O-])cc(Cl)c1NC[C@@H]1CN2CCC[C@H]2CO1 ZINC000770099896 577402121 /nfs/dbraw/zinc/40/21/21/577402121.db2.gz LLVSWYFAYAQYGL-WCQYABFASA-N 0 3 325.796 2.832 20 5 EFBDHN O=[N+]([O-])c1ccc([C@H](O)CNC[C@H](O)c2ccc(Cl)cc2)cc1 ZINC000771568314 581223234 /nfs/dbraw/zinc/22/32/34/581223234.db2.gz SQCAFIZTVFURMW-JKSUJKDBSA-N 0 3 336.775 2.605 20 5 EFBDHN O=[N+]([O-])c1ccc(Cl)c(CNC2CCN(c3cnccn3)CC2)c1 ZINC000773043316 581390362 /nfs/dbraw/zinc/39/03/62/581390362.db2.gz YTRZIFOTWPBASQ-UHFFFAOYSA-N 0 3 347.806 2.797 20 5 EFBDHN O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2NC[C@H](O)c2ccccc2F)n1 ZINC000774136112 581485089 /nfs/dbraw/zinc/48/50/89/581485089.db2.gz XMYUJJVELUDKJU-XHSDSOJGSA-N 0 3 348.378 2.737 20 5 EFBDHN COC(=O)N1CCC[C@@H](N[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000774167439 581486295 /nfs/dbraw/zinc/48/62/95/581486295.db2.gz CZZSTJGTEVFNBY-CZUORRHYSA-N 0 3 333.388 2.793 20 5 EFBDHN CN(C[C@@H]1CCCOC1)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774627687 581495647 /nfs/dbraw/zinc/49/56/47/581495647.db2.gz RLDKOAZVMFVECO-NSHDSACASA-N 0 3 338.795 2.914 20 5 EFBDHN CCN(C[C@@H]1CCOC1)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774635440 581495915 /nfs/dbraw/zinc/49/59/15/581495915.db2.gz IIEFGEHFHYIVOQ-NSHDSACASA-N 0 3 338.795 2.914 20 5 EFBDHN O=[N+]([O-])c1cc2cnn(CN3CCN(CC4CC4)CC3)c2c(Cl)c1 ZINC000774636449 581495989 /nfs/dbraw/zinc/49/59/89/581495989.db2.gz USJINEXMZSYVDV-UHFFFAOYSA-N 0 3 349.822 2.583 20 5 EFBDHN CN(CC1CCOCC1)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774639993 581496105 /nfs/dbraw/zinc/49/61/05/581496105.db2.gz OFYGDGUUZHJUBO-UHFFFAOYSA-N 0 3 338.795 2.914 20 5 EFBDHN CC(C)(CNCc1cc([N+](=O)[O-])ccc1Cl)[C@@]1(O)CCCOC1 ZINC000850400921 1250466717 /nfs/dbraw/zinc/46/67/17/1250466717.db2.gz QLTRDJPEZMZKOU-MRXNPFEDSA-N 0 3 342.823 2.906 20 5 EFBDHN CC(COC(=O)C(C)(C)Oc1ccc(Br)cc1)[N+](=O)[O-] ZINC000851036680 1250765971 /nfs/dbraw/zinc/76/59/71/1250765971.db2.gz LZRKYWNEOKXYTC-VIFPVBQESA-N 0 3 346.177 2.815 20 5 EFBDHN CC(COC(=O)Cc1c(Cl)cccc1Br)[N+](=O)[O-] ZINC000851036562 1250766230 /nfs/dbraw/zinc/76/62/30/1250766230.db2.gz KJMUVVYVGWCAJC-SSDOTTSWSA-N 0 3 336.569 2.853 20 5 EFBDHN CCN(C)C(C)(C)C(=O)NC/C=C/CNc1ccc(C)cc1[N+](=O)[O-] ZINC001107391471 1255724169 /nfs/dbraw/zinc/72/41/69/1255724169.db2.gz ILSDCMORDQUFSJ-BQYQJAHWSA-N 0 3 348.447 2.718 20 5 EFBDHN O=C(NCCNCc1cccc([N+](=O)[O-])c1)c1ccc2occc2c1 ZINC001127886325 1256944158 /nfs/dbraw/zinc/94/41/58/1256944158.db2.gz FUKJLKYGHSBKCX-UHFFFAOYSA-N 0 3 339.351 2.861 20 5 EFBDHN COC(=O)Cc1ccc(CNc2cc3c(cc2[N+](=O)[O-])CNC3)cc1 ZINC001168567212 1257714869 /nfs/dbraw/zinc/71/48/69/1257714869.db2.gz DVCBGAHMJCIJKD-UHFFFAOYSA-N 0 3 341.367 2.526 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCNCc2cnn(CC3CCC3)c2)cc1 ZINC000921721534 1261273082 /nfs/dbraw/zinc/27/30/82/1261273082.db2.gz JXFCQQXBSZPKRR-UHFFFAOYSA-N 0 3 330.388 2.760 20 5 EFBDHN CC(=O)N1CC[C@@H](CN(C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000156519491 1267231620 /nfs/dbraw/zinc/23/16/20/1267231620.db2.gz IVGWARKCYGPTTP-ZDUSSCGKSA-N 0 3 325.796 2.548 20 5 EFBDHN Cc1c[nH]cc1C(=O)NC[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001086271437 1270781974 /nfs/dbraw/zinc/78/19/74/1270781974.db2.gz ZNEWCBYZUJZDOD-OTVXOJSOSA-N 0 3 342.399 2.530 20 5 EFBDHN C[C@@H](NCCNC(=O)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000746049361 1271742983 /nfs/dbraw/zinc/74/29/83/1271742983.db2.gz PXEQWERCUNYGLR-GFCCVEGCSA-N 0 3 331.347 2.815 20 5 EFBDHN CC(C)(C)OC(=O)N1C[C@@H]2[C@@H]1CCCN2[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169011850 1272584741 /nfs/dbraw/zinc/58/47/41/1272584741.db2.gz MTVVVWVVGADXIA-ZQDZILKHSA-N 0 3 339.436 2.516 20 5 EFBDHN C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H](C)N1[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169012906 1272585597 /nfs/dbraw/zinc/58/55/97/1272585597.db2.gz SMQFMRJTCYXZEM-LJISPDSOSA-N 0 3 341.452 2.762 20 5 EFBDHN O=[N+]([O-])C[C@@H]1CC[C@H](N2CCN(Cc3ccccc3Cl)CC2)C1 ZINC001169028419 1272592242 /nfs/dbraw/zinc/59/22/42/1272592242.db2.gz RYEJZPHRRUPMCI-ZBFHGGJFSA-N 0 3 337.851 2.903 20 5 EFBDHN C[C@H]1CN([C@@H]2CC[C@H](C[N+](=O)[O-])C2)[C@@H](C)CN1C(=O)OC(C)(C)C ZINC001169035136 1272598634 /nfs/dbraw/zinc/59/86/34/1272598634.db2.gz AKSLWYWRZGGDBS-ZQDZILKHSA-N 0 3 341.452 2.762 20 5 EFBDHN C[C@@H]1CN([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C[C@H](C)N1C(=O)OC(C)(C)C ZINC001169037542 1272602748 /nfs/dbraw/zinc/60/27/48/1272602748.db2.gz SEDOFOLAONWQEW-LXTVHRRPSA-N 0 3 341.452 2.762 20 5 EFBDHN CC(C)(C)OC(=O)N1CCN([C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1(C)C ZINC001169038363 1272606278 /nfs/dbraw/zinc/60/62/78/1272606278.db2.gz YIBQLMKMLPQPOV-KBPBESRZSA-N 0 3 341.452 2.763 20 5 EFBDHN CC(C)(C)OC(=O)N1CCN([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1(C)C ZINC001169038365 1272606743 /nfs/dbraw/zinc/60/67/43/1272606743.db2.gz YIBQLMKMLPQPOV-UONOGXRCSA-N 0 3 341.452 2.763 20 5 EFBDHN O=[N+]([O-])C[C@H]1CC[C@@H](N2CCN(c3nccc4ccccc43)CC2)C1 ZINC001169038000 1272606873 /nfs/dbraw/zinc/60/68/73/1272606873.db2.gz UZQNFJNFJIMXPR-DOTOQJQBSA-N 0 3 340.427 2.802 20 5 EFBDHN Cc1cc(-n2ccc([C@H](C)N)n2)c([N+](=O)[O-])cc1Br ZINC001169235270 1272742710 /nfs/dbraw/zinc/74/27/10/1272742710.db2.gz UWNHKSMQVRCSGD-QMMMGPOBSA-N 0 3 325.166 2.871 20 5 EFBDHN C[C@H](N)c1ccn(-c2c(Br)cc(F)cc2[N+](=O)[O-])n1 ZINC001169231642 1272748161 /nfs/dbraw/zinc/74/81/61/1272748161.db2.gz OPIMIGONKPXFTG-LURJTMIESA-N 0 3 329.129 2.702 20 5 EFBDHN NCc1cnnn1-c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC001169309688 1272829244 /nfs/dbraw/zinc/82/92/44/1272829244.db2.gz JFLZETSBWFKYLX-UHFFFAOYSA-N 0 3 327.369 2.785 20 5 EFBDHN O=C(C1CC1)N1CCC2(CCN(Cc3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC001035150090 1273653385 /nfs/dbraw/zinc/65/33/85/1273653385.db2.gz ZXXNGWVYYMVZIC-UHFFFAOYSA-N 0 3 343.427 2.819 20 5 EFBDHN CCn1cc(CN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)C(C)C)cn1 ZINC000844417104 1278964691 /nfs/dbraw/zinc/96/46/91/1278964691.db2.gz JVCXUOLUMUITPU-QGZVFWFLSA-N 0 3 332.404 2.755 20 5 EFBDHN Cc1cc(CN(C)C)cc(NC(=O)c2cc([N+](=O)[O-])ccc2N)c1 ZINC000787161814 1275695600 /nfs/dbraw/zinc/69/56/00/1275695600.db2.gz FQEBSVYJKVJZPB-UHFFFAOYSA-N 0 3 328.372 2.799 20 5 EFBDHN CN(C)C1(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCC1 ZINC000787603523 1275833416 /nfs/dbraw/zinc/83/34/16/1275833416.db2.gz IPAITXKFEOSUGJ-UHFFFAOYSA-N 0 3 345.321 2.714 20 5 EFBDHN CN1CCC[C@H]2CN(c3nc(Cl)c(Cl)cc3[N+](=O)[O-])C[C@H]21 ZINC001157265268 1275860068 /nfs/dbraw/zinc/86/00/68/1275860068.db2.gz IKOVYZXZWQTZJE-GZMMTYOYSA-N 0 3 331.203 2.827 20 5 EFBDHN COc1ccc(C[C@@H](C)NCC(=O)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC001170313322 1279008292 /nfs/dbraw/zinc/00/82/92/1279008292.db2.gz LEPXEUUZSPOKTI-CQSZACIVSA-N 0 3 342.395 2.936 20 5 EFBDHN COc1ccc(C[C@H](C)N[C@@H]2CCCc3nccnc32)c([N+](=O)[O-])c1 ZINC001170323460 1279015592 /nfs/dbraw/zinc/01/55/92/1279015592.db2.gz KVTOUQDNUOKMIF-BLLLJJGKSA-N 0 3 342.399 2.992 20 5 EFBDHN Cc1cccc(F)c1-n1nc(C(=O)OCC(C)[N+](=O)[O-])c2c1CCC2 ZINC000817739019 1276285677 /nfs/dbraw/zinc/28/56/77/1276285677.db2.gz FSBXXEQQCZQBEO-NSHDSACASA-N 0 3 347.346 2.631 20 5 EFBDHN CC(COC(=O)c1nn(-c2cccc(F)c2)c2c1CCCC2)[N+](=O)[O-] ZINC000817740249 1276286416 /nfs/dbraw/zinc/28/64/16/1276286416.db2.gz YQRCZBDTBONGOY-NSHDSACASA-N 0 3 347.346 2.712 20 5 EFBDHN Cc1ccc(F)c(-n2nc(C(=O)OCC(C)[N+](=O)[O-])c3c2CCC3)c1 ZINC000817739579 1276287119 /nfs/dbraw/zinc/28/71/19/1276287119.db2.gz MVIDRKOIXDXMQW-NSHDSACASA-N 0 3 347.346 2.631 20 5 EFBDHN COc1ccc(C[C@@H](C)NCc2cc3ccccn3n2)c([N+](=O)[O-])c1 ZINC001170326810 1279018318 /nfs/dbraw/zinc/01/83/18/1279018318.db2.gz NQWAUOSTOZKGFD-CYBMUJFWSA-N 0 3 340.383 2.972 20 5 EFBDHN CCN1CCN(c2ccc(Nc3ccc([N+](=O)[O-])cn3)cc2)CC1 ZINC000818253305 1276496672 /nfs/dbraw/zinc/49/66/72/1276496672.db2.gz RIGZSNBJQHPECI-UHFFFAOYSA-N 0 3 327.388 2.875 20 5 EFBDHN CCC(=O)Nc1cccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000818963118 1276552199 /nfs/dbraw/zinc/55/21/99/1276552199.db2.gz HAOSDIIVCNDCQH-QGZVFWFLSA-N 0 3 343.383 2.767 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CNCc2ccc(OCC3CC3)nc2)c1 ZINC000818991149 1276565458 /nfs/dbraw/zinc/56/54/58/1276565458.db2.gz XPAFINCMMAGTNU-QGZVFWFLSA-N 0 3 343.383 2.602 20 5 EFBDHN CCSc1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)ccn1 ZINC000819244442 1276681505 /nfs/dbraw/zinc/68/15/05/1276681505.db2.gz NZGKHGGGWBNABW-OAHLLOKOSA-N 0 3 333.413 2.925 20 5 EFBDHN CCSc1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)ccn1 ZINC000819244441 1276681779 /nfs/dbraw/zinc/68/17/79/1276681779.db2.gz NZGKHGGGWBNABW-HNNXBMFYSA-N 0 3 333.413 2.925 20 5 EFBDHN CC(C)(C)Oc1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cn1 ZINC000819213638 1276690545 /nfs/dbraw/zinc/69/05/45/1276690545.db2.gz NUYWPOGCCIHMFY-INIZCTEOSA-N 0 3 345.399 2.990 20 5 EFBDHN CC[C@H](C)Oc1cc(CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)ccn1 ZINC000819215824 1276691928 /nfs/dbraw/zinc/69/19/28/1276691928.db2.gz OCPONJUGXAYENA-GUYCJALGSA-N 0 3 345.399 2.990 20 5 EFBDHN CC(C)Oc1cc(C(=O)N2[C@@H]3CC[C@H]2CN(C)CC3)ccc1[N+](=O)[O-] ZINC000923262728 1277384915 /nfs/dbraw/zinc/38/49/15/1277384915.db2.gz UENFHFKUZNURMZ-CABCVRRESA-N 0 3 347.415 2.691 20 5 EFBDHN O=C(Cc1ccccc1F)NCCCNCc1ccccc1[N+](=O)[O-] ZINC001175114024 1287314427 /nfs/dbraw/zinc/31/44/27/1287314427.db2.gz XOBMZEUFONNFSQ-UHFFFAOYSA-N 0 3 345.374 2.573 20 5 EFBDHN CCCCN1CCN([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC001170346615 1279051075 /nfs/dbraw/zinc/05/10/75/1279051075.db2.gz OSWOSKWNJBKZAS-HNNXBMFYSA-N 0 3 335.448 2.952 20 5 EFBDHN COCCN1CCC(Nc2cc(Cl)c(F)cc2[N+](=O)[O-])CC1 ZINC000845473547 1279665303 /nfs/dbraw/zinc/66/53/03/1279665303.db2.gz GIAUCWZXLNNOHW-UHFFFAOYSA-N 0 3 331.775 2.910 20 5 EFBDHN Cc1nn(C)c(C)c1CC(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845872270 1279900519 /nfs/dbraw/zinc/90/05/19/1279900519.db2.gz FTEJGSRVFVYDIJ-SJKOYZFVSA-N 0 3 349.362 2.668 20 5 EFBDHN COc1ccc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])cn1 ZINC000845873387 1279901154 /nfs/dbraw/zinc/90/11/54/1279901154.db2.gz SZFPIEGALFTZBZ-BMIGLBTASA-N 0 3 334.303 2.793 20 5 EFBDHN CC([C@H](OC(=O)c1cc(C2CC2)[nH]n1)c1ccccc1F)[N+](=O)[O-] ZINC000845874978 1279901821 /nfs/dbraw/zinc/90/18/21/1279901821.db2.gz KLKFGXZQIJVFBH-PSLIRLAXSA-N 0 3 333.319 2.990 20 5 EFBDHN Cc1nccc(CCC(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])n1 ZINC000845875336 1279901865 /nfs/dbraw/zinc/90/18/65/1279901865.db2.gz BIBQIBMAJGRUBZ-PIGZYNQJSA-N 0 3 347.346 2.806 20 5 EFBDHN Cc1ccc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])c(=O)[nH]1 ZINC000845873964 1279901971 /nfs/dbraw/zinc/90/19/71/1279901971.db2.gz GEDFPKLAYVZMJW-IINYFYTJSA-N 0 3 334.303 2.798 20 5 EFBDHN CC([C@H](OC(=O)c1cc(C2CC2)n(C)n1)c1ccccc1F)[N+](=O)[O-] ZINC000845875927 1279902114 /nfs/dbraw/zinc/90/21/14/1279902114.db2.gz LYQPTAGEZYFYIP-QFYYESIMSA-N 0 3 347.346 3.000 20 5 EFBDHN CC([C@H](OC(=O)C[C@@H](C)n1cccn1)c1ccccc1F)[N+](=O)[O-] ZINC000845875302 1279902506 /nfs/dbraw/zinc/90/25/06/1279902506.db2.gz BBRCGNIBRCORIM-WQGACYEGSA-N 0 3 335.335 2.923 20 5 EFBDHN CC([C@H](OC(=O)[C@H](C)OCC1CC1)c1ccccc1F)[N+](=O)[O-] ZINC000845878753 1279903492 /nfs/dbraw/zinc/90/34/92/1279903492.db2.gz VUWHSOXXHXKDDH-ZETOZRRWSA-N 0 3 325.336 2.890 20 5 EFBDHN COc1cccc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])n1 ZINC000845877468 1279903528 /nfs/dbraw/zinc/90/35/28/1279903528.db2.gz PWQBPGXIKZUYSK-BMIGLBTASA-N 0 3 334.303 2.793 20 5 EFBDHN CC([C@@H](OC(=O)COCc1ccccn1)c1ccccc1F)[N+](=O)[O-] ZINC000845878651 1279903782 /nfs/dbraw/zinc/90/37/82/1279903782.db2.gz HYTKANBKZRODSR-YVEFUNNKSA-N 0 3 348.330 2.687 20 5 EFBDHN CCOC1CC(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])C1 ZINC000845880013 1279904327 /nfs/dbraw/zinc/90/43/27/1279904327.db2.gz JXEWPDWTBFUAIU-FLRBZUCHSA-N 0 3 325.336 2.890 20 5 EFBDHN CC([C@H](OC(=O)C[C@@H](C)n1ccnc1)c1ccccc1F)[N+](=O)[O-] ZINC000845882334 1279904760 /nfs/dbraw/zinc/90/47/60/1279904760.db2.gz SRRJKLISPKCXFS-WQGACYEGSA-N 0 3 335.335 2.923 20 5 EFBDHN CC([C@@H](OC(=O)c1cnn(CCF)c1)c1ccccc1F)[N+](=O)[O-] ZINC000845881938 1279905583 /nfs/dbraw/zinc/90/55/83/1279905583.db2.gz MUMOTRCRIBWLFW-QMTHXVAHSA-N 0 3 339.298 2.555 20 5 EFBDHN CC([C@@H](OC(=O)[C@H](C)Cc1cnn(C)c1)c1ccccc1F)[N+](=O)[O-] ZINC000845883201 1279905902 /nfs/dbraw/zinc/90/59/02/1279905902.db2.gz ZVDBGCNXMCJQLL-XHBSWPGZSA-N 0 3 349.362 2.688 20 5 EFBDHN CC([C@H](OC(=O)[C@H](C)Oc1ccccn1)c1ccccc1F)[N+](=O)[O-] ZINC000845882358 1279906385 /nfs/dbraw/zinc/90/63/85/1279906385.db2.gz ONPVPYQDTQEVBE-WQGACYEGSA-N 0 3 348.330 2.938 20 5 EFBDHN CC([C@@H](OC(=O)CCOCC(F)F)c1ccccc1F)[N+](=O)[O-] ZINC000845884403 1279906996 /nfs/dbraw/zinc/90/69/96/1279906996.db2.gz YZCVNIKZUASUQE-YMTOWFKASA-N 0 3 335.278 2.747 20 5 EFBDHN CC([C@H](OC(=O)[C@@H]1O[C@H](C)C[C@@H]1C)c1ccccc1F)[N+](=O)[O-] ZINC000845884548 1279907547 /nfs/dbraw/zinc/90/75/47/1279907547.db2.gz ZKSYZTVNMHWDCZ-OJBMOBIPSA-N 0 3 325.336 2.889 20 5 EFBDHN CC([C@H](OC(=O)[C@@H]1O[C@H](C)C[C@@H]1C)c1ccccc1F)[N+](=O)[O-] ZINC000845884547 1279907648 /nfs/dbraw/zinc/90/76/48/1279907648.db2.gz ZKSYZTVNMHWDCZ-ILYYPIBPSA-N 0 3 325.336 2.889 20 5 EFBDHN CC([C@@H](OC(=O)CCC(C)(C)[N+](=O)[O-])c1ccccc1F)[N+](=O)[O-] ZINC000845882871 1279907763 /nfs/dbraw/zinc/90/77/63/1279907763.db2.gz PYDKYHGMVJDATG-QMTHXVAHSA-N 0 3 342.323 2.911 20 5 EFBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCC[C@@]1(O)CCCOC1 ZINC000846110738 1280019651 /nfs/dbraw/zinc/01/96/51/1280019651.db2.gz ZNYNOPTUPBZZPO-AWEZNQCLSA-N 0 3 349.214 2.923 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@]1(O)CCSC1 ZINC000872040591 1287409936 /nfs/dbraw/zinc/40/99/36/1287409936.db2.gz MJFQIWXOOBYQBY-IINYFYTJSA-N 0 3 328.459 2.835 20 5 EFBDHN CCn1cnnc1CCN[C@@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872044457 1287409949 /nfs/dbraw/zinc/40/99/49/1287409949.db2.gz BHCQMCOIDNLSQA-NSHDSACASA-N 0 3 335.433 2.821 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](C)[C@@H]1CN(C)CCO1 ZINC000872051233 1287412785 /nfs/dbraw/zinc/41/27/85/1287412785.db2.gz GOFPSPXDETYKTO-ZOWXZIJZSA-N 0 3 339.461 2.686 20 5 EFBDHN Cc1ccc(N[C@H]2C[C@@H](CNC(=O)CN(C)C(C)C)C2)c([N+](=O)[O-])c1 ZINC001091350164 1280383148 /nfs/dbraw/zinc/38/31/48/1280383148.db2.gz HSMRAWOQEGATDV-GASCZTMLSA-N 0 3 348.447 2.550 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCC1([S@](C)=O)CC1 ZINC000872069059 1287418753 /nfs/dbraw/zinc/41/87/53/1287418753.db2.gz LMCXNSQJXOKNGR-UZJPJQLHSA-N 0 3 328.459 2.878 20 5 EFBDHN CN(CCN1CCCCC1)C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000846662497 1280404043 /nfs/dbraw/zinc/40/40/43/1280404043.db2.gz SYWYJQZFWICLRL-UHFFFAOYSA-N 0 3 325.796 2.806 20 5 EFBDHN CCOC(=O)C1=C(Nc2ccc([N+](=O)[O-])c3ccccc23)CCNC1 ZINC001170520054 1281250319 /nfs/dbraw/zinc/25/03/19/1281250319.db2.gz BQDLGCPHLBVBIR-UHFFFAOYSA-N 0 3 341.367 2.970 20 5 EFBDHN CCOC(=O)C1=C(Nc2cc3ccccc3c([N+](=O)[O-])c2)CCNC1 ZINC001170521753 1281282905 /nfs/dbraw/zinc/28/29/05/1281282905.db2.gz NSACOGAHXZTBNG-UHFFFAOYSA-N 0 3 341.367 2.970 20 5 EFBDHN Cc1oc(C)c(C(=O)NCCNCc2ccc([N+](=O)[O-])cc2)c1C ZINC001131043972 1281415452 /nfs/dbraw/zinc/41/54/52/1281415452.db2.gz VCNDSEWSACOTLN-UHFFFAOYSA-N 0 3 331.372 2.633 20 5 EFBDHN CN(C)c1ccccc1CN(C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000808785731 1281899208 /nfs/dbraw/zinc/89/92/08/1281899208.db2.gz RNVSHZDQMOHSTD-SFHVURJKSA-N 0 3 329.400 2.826 20 5 EFBDHN CCOC(=O)[C@H](CC(C)(C)F)Nc1cc2c(cc1[N+](=O)[O-])CNC2 ZINC001170790403 1287581247 /nfs/dbraw/zinc/58/12/47/1287581247.db2.gz BBOAVYHXFVXXOO-ZDUSSCGKSA-N 0 3 339.367 2.680 20 5 EFBDHN O=C(NCCNCc1ccc([N+](=O)[O-])cc1)C1(C2CCC2)CCC1 ZINC001131940930 1282603801 /nfs/dbraw/zinc/60/38/01/1282603801.db2.gz OVCVLHABXLGBIV-UHFFFAOYSA-N 0 3 331.416 2.771 20 5 EFBDHN C[C@@H](N[C@H]1CC(=O)N(c2ccccc2)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815567293 1287601263 /nfs/dbraw/zinc/60/12/63/1287601263.db2.gz SYAYOHJRJITUIK-OCCSQVGLSA-N 0 3 340.383 2.633 20 5 EFBDHN C[C@@H](NCCNC(=O)CC1CCCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815593789 1287620461 /nfs/dbraw/zinc/62/04/61/1287620461.db2.gz XKKIIGZNZOEJHC-CYBMUJFWSA-N 0 3 348.447 2.914 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ncn(CN3C[C@@H]4CC=CC[C@@H]4C3)n2)cc1 ZINC000872712388 1287754517 /nfs/dbraw/zinc/75/45/17/1287754517.db2.gz MVVVUPPDRRGOGR-GASCZTMLSA-N 0 3 325.372 2.709 20 5 EFBDHN Cc1ccc(C)c(-n2ccnc2SCC(=O)OCC(C)[N+](=O)[O-])c1 ZINC000813101897 1285652562 /nfs/dbraw/zinc/65/25/62/1285652562.db2.gz LCFNFXPKGHHTPZ-CYBMUJFWSA-N 0 3 349.412 2.790 20 5 EFBDHN CC(COC(=O)CCc1nnc(-c2cc3ccccc3o2)o1)[N+](=O)[O-] ZINC000813100574 1285652602 /nfs/dbraw/zinc/65/26/02/1285652602.db2.gz URPYFTHMJWWWNT-JTQLQIEISA-N 0 3 345.311 2.624 20 5 EFBDHN CC(COC(=O)c1cc(NC(=O)C(C)(C)C)ccc1F)[N+](=O)[O-] ZINC000813105571 1285654215 /nfs/dbraw/zinc/65/42/15/1285654215.db2.gz PDTGJIHQJRSASB-SECBINFHSA-N 0 3 326.324 2.632 20 5 EFBDHN Cc1nn(-c2ccccc2)c2ncc(C(=O)OCC(C)[N+](=O)[O-])cc12 ZINC000813105702 1285661586 /nfs/dbraw/zinc/66/15/86/1285661586.db2.gz SCXKSECMYVDPEG-LLVKDONJSA-N 0 3 340.339 2.551 20 5 EFBDHN CC(COC(=O)c1ccccc1C(=O)c1ccc(F)cc1)[N+](=O)[O-] ZINC000813105745 1285666476 /nfs/dbraw/zinc/66/64/76/1285666476.db2.gz UABFKCKEOWUFRD-LLVKDONJSA-N 0 3 331.299 2.879 20 5 EFBDHN CC(COC(=O)c1cccc(C(=O)Nc2ccccc2)c1)[N+](=O)[O-] ZINC000813107344 1285679858 /nfs/dbraw/zinc/67/98/58/1285679858.db2.gz PIBFWGIUBHJONE-LBPRGKRZSA-N 0 3 328.324 2.761 20 5 EFBDHN CCc1c(C(=O)OCC(C)[N+](=O)[O-])cnn1-c1ccccc1Cl ZINC000813109124 1285681991 /nfs/dbraw/zinc/68/19/91/1285681991.db2.gz FUFMJOYSNCQRAF-SNVBAGLBSA-N 0 3 337.763 2.910 20 5 EFBDHN CC(COC(=O)c1cc(-c2ccco2)nn1-c1ccccc1)[N+](=O)[O-] ZINC000813112096 1285682997 /nfs/dbraw/zinc/68/29/97/1285682997.db2.gz ZOFTYALLGGPFOB-GFCCVEGCSA-N 0 3 341.323 2.954 20 5 EFBDHN CC(COC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)[N+](=O)[O-] ZINC000813112527 1285683628 /nfs/dbraw/zinc/68/36/28/1285683628.db2.gz HSNYYGVSHGDREN-SNVBAGLBSA-N 0 3 326.308 2.503 20 5 EFBDHN CC(COC(=O)c1cn(-c2ccccc2)nc1C(C)(C)C)[N+](=O)[O-] ZINC000813113053 1285684021 /nfs/dbraw/zinc/68/40/21/1285684021.db2.gz ABXKOKQIDAORIC-GFCCVEGCSA-N 0 3 331.372 2.992 20 5 EFBDHN Cc1nn(Cc2ccccc2)c(Cl)c1C(=O)OCC(C)[N+](=O)[O-] ZINC000813112612 1285684639 /nfs/dbraw/zinc/68/46/39/1285684639.db2.gz JPYXNXYJXZNFQK-SNVBAGLBSA-N 0 3 337.763 2.715 20 5 EFBDHN O=C(NCCCNCc1ccccc1[N+](=O)[O-])c1c(F)cccc1F ZINC001171928201 1285928028 /nfs/dbraw/zinc/92/80/28/1285928028.db2.gz VQPOAOLQIODAQB-UHFFFAOYSA-N 0 3 349.337 2.783 20 5 EFBDHN O=C(CN[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1cccnc1 ZINC001172912743 1286353477 /nfs/dbraw/zinc/35/34/77/1286353477.db2.gz OZAKSJJNMQUYHY-INIZCTEOSA-N 0 3 325.368 2.710 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)NCc2cncnc2C)c1F ZINC001173177680 1286453874 /nfs/dbraw/zinc/45/38/74/1286453874.db2.gz CTQWOUXIHICPFR-SNVBAGLBSA-N 0 3 334.351 2.562 20 5 EFBDHN C=Cc1ccc(C(=O)NCCNCc2cccc([N+](=O)[O-])c2)cc1 ZINC001134198754 1286456911 /nfs/dbraw/zinc/45/69/11/1286456911.db2.gz BTDFACOMLBXNLJ-UHFFFAOYSA-N 0 3 325.368 2.757 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)NCc2ccc(F)cn2)c1F ZINC001173191541 1286458025 /nfs/dbraw/zinc/45/80/25/1286458025.db2.gz MMQAJBCLJPHTKP-JTQLQIEISA-N 0 3 337.326 2.997 20 5 EFBDHN CCCN1CCN([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])CC1 ZINC001173190545 1286458296 /nfs/dbraw/zinc/45/82/96/1286458296.db2.gz VMAUFMFNAZLADX-ZDUSSCGKSA-N 0 3 339.411 2.701 20 5 EFBDHN CCN1CCN([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C[C@H]1C ZINC001173192115 1286458971 /nfs/dbraw/zinc/45/89/71/1286458971.db2.gz HZZDCDONJADHJK-CHWSQXEVSA-N 0 3 339.411 2.700 20 5 EFBDHN Cc1ccn2c(c1)nnc2CN[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173209777 1286485408 /nfs/dbraw/zinc/48/54/08/1286485408.db2.gz FYSGRZWEFOYIJB-CYBMUJFWSA-N 0 3 325.372 2.667 20 5 EFBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N[C@@H](C)c1nnc2ccccn21 ZINC001173210318 1286485585 /nfs/dbraw/zinc/48/55/85/1286485585.db2.gz ITGYMFZNVBEODT-OLZOCXBDSA-N 0 3 325.372 2.919 20 5 EFBDHN Cc1cc(F)cc(C(=O)NCCNCc2ccc([N+](=O)[O-])cc2)c1 ZINC001134249483 1286488202 /nfs/dbraw/zinc/48/82/02/1286488202.db2.gz QJXYQTMGVMWQCO-UHFFFAOYSA-N 0 3 331.347 2.562 20 5 EFBDHN Cc1nccnc1O[C@@H]1CCN([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173238363 1286495955 /nfs/dbraw/zinc/49/59/55/1286495955.db2.gz QMBWHBHPICUOOT-SUMWQHHRSA-N 0 3 342.399 2.778 20 5 EFBDHN Cc1cnc(O[C@@H]2CCN([C@H](C)Cc3ccc([N+](=O)[O-])cc3)C2)nc1 ZINC001173238585 1286496051 /nfs/dbraw/zinc/49/60/51/1286496051.db2.gz VVGLUOOQBSEUDY-RHSMWYFYSA-N 0 3 342.399 2.778 20 5 EFBDHN Cc1nccnc1O[C@H]1CCN([C@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173238361 1286496378 /nfs/dbraw/zinc/49/63/78/1286496378.db2.gz QMBWHBHPICUOOT-DYVFJYSZSA-N 0 3 342.399 2.778 20 5 EFBDHN CC(C)NC(=O)N[C@H]1CCCN([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173238140 1286496449 /nfs/dbraw/zinc/49/64/49/1286496449.db2.gz NWWNPASNVUAAMR-HOCLYGCPSA-N 0 3 348.447 2.698 20 5 EFBDHN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)CCC(C)(C)[N+](=O)[O-])C1 ZINC000822712654 1289088712 /nfs/dbraw/zinc/08/87/12/1289088712.db2.gz ZRUIFRQPXMFDKS-GOEBONIOSA-N 0 3 333.432 2.774 20 5 EFBDHN CCN(C)C(C)(C)C(=O)N1CCC(Nc2ccccc2[N+](=O)[O-])CC1 ZINC001095241643 1286734248 /nfs/dbraw/zinc/73/42/48/1286734248.db2.gz MTHBATUSIMHTLI-UHFFFAOYSA-N 0 3 348.447 2.728 20 5 EFBDHN CCCN(C)CC(=O)N1CCC(CNc2ccccc2[N+](=O)[O-])CC1 ZINC001095262889 1286811234 /nfs/dbraw/zinc/81/12/34/1286811234.db2.gz QVMBRXSAQDXIGX-UHFFFAOYSA-N 0 3 348.447 2.587 20 5 EFBDHN O=[N+]([O-])c1cc(Br)ccc1CN[C@@H](CCO)C1CC1 ZINC000822845376 1289130366 /nfs/dbraw/zinc/13/03/66/1289130366.db2.gz NYOCCXPJKDXSBR-LBPRGKRZSA-N 0 3 329.194 2.608 20 5 EFBDHN Cc1ccc(CC(=O)NCCCNCc2ccccc2[N+](=O)[O-])s1 ZINC001176920638 1288173129 /nfs/dbraw/zinc/17/31/29/1288173129.db2.gz KCYSLKASRVCRLG-UHFFFAOYSA-N 0 3 347.440 2.803 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@H](C2CC2)[C@@]2(CO)CCCO2)cc1Cl ZINC000816667564 1288236168 /nfs/dbraw/zinc/23/61/68/1288236168.db2.gz PXVRRKWSJVOCIU-CVEARBPZSA-N 0 3 340.807 2.658 20 5 EFBDHN C[C@H]1CCCN(CCNC(=O)c2cccc([N+](=O)[O-])c2Cl)C1 ZINC000816874160 1288308475 /nfs/dbraw/zinc/30/84/75/1288308475.db2.gz WQMGKBLBTMLGIF-NSHDSACASA-N 0 3 325.796 2.710 20 5 EFBDHN Cc1ccccc1CN1CCCN(C(=O)CCC(C)(C)[N+](=O)[O-])CC1 ZINC000822487304 1289005930 /nfs/dbraw/zinc/00/59/30/1289005930.db2.gz ORLKQKFDBOAXHK-UHFFFAOYSA-N 0 3 347.459 2.865 20 5 EFBDHN CN(CCN1CCCCC1)C(=O)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC000824115257 1289547017 /nfs/dbraw/zinc/54/70/17/1289547017.db2.gz PKEXBIWRAWEQDK-IAGOWNOFSA-N 0 3 331.416 2.643 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@@H]1CCCN2CCCC[C@H]12 ZINC000824311333 1289602059 /nfs/dbraw/zinc/60/20/59/1289602059.db2.gz CHRKATKGQRWOLM-GDBMZVCRSA-N 0 3 331.416 2.958 20 5 EFBDHN O=[N+]([O-])c1ccc([C@@H](O)[C@@H](CO)NCc2ccccc2C2CC2)cc1 ZINC000873192718 1289632816 /nfs/dbraw/zinc/63/28/16/1289632816.db2.gz GCEXAYKYEUBEMZ-RTBURBONSA-N 0 3 342.395 2.656 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@H]1Cc2ccccc2CN1 ZINC000873320293 1289729042 /nfs/dbraw/zinc/72/90/42/1289729042.db2.gz UEFOVJOJIPEVJJ-OAHLLOKOSA-N 0 3 340.383 2.739 20 5 EFBDHN Cc1cc(Cl)c(C(=O)N2CC[C@@H](N3CCCC3)C2)cc1[N+](=O)[O-] ZINC000825699909 1290071599 /nfs/dbraw/zinc/07/15/99/1290071599.db2.gz KWMUBLHTQPWJMO-GFCCVEGCSA-N 0 3 337.807 2.867 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN1CCCC[C@@H]1[C@H](O)c1ccccc1 ZINC000878223714 1291564876 /nfs/dbraw/zinc/56/48/76/1291564876.db2.gz RCZXKARWMOETCG-SJLPKXTDSA-N 0 3 344.415 2.688 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN1CCCC[C@H]1[C@@H](O)c1ccccc1 ZINC000878223716 1291565516 /nfs/dbraw/zinc/56/55/16/1291565516.db2.gz RCZXKARWMOETCG-WMZOPIPTSA-N 0 3 344.415 2.688 20 5 EFBDHN CCCN(C)CC(=O)N[C@H]1C[C@H](CNc2ccc([N+](=O)[O-])c(C)c2)C1 ZINC001114780653 1291925663 /nfs/dbraw/zinc/92/56/63/1291925663.db2.gz KZCJUPFGWLSHBG-KOMQPUFPSA-N 0 3 348.447 2.552 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(NC[C@H]2C[C@H](NC(=O)CN(C)C(C)C)C2)c1 ZINC001114775784 1291931380 /nfs/dbraw/zinc/93/13/80/1291931380.db2.gz IDLGRHZJYLHDLL-SHTZXODSSA-N 0 3 348.447 2.550 20 5 EFBDHN CCOc1cc(CN(CCOC)C2CCOCC2)ccc1[N+](=O)[O-] ZINC000879710148 1292239368 /nfs/dbraw/zinc/23/93/68/1292239368.db2.gz YEEZCEXWRPNURX-UHFFFAOYSA-N 0 3 338.404 2.621 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@@]1(O)CCc2ccccc21 ZINC000132118892 1293628122 /nfs/dbraw/zinc/62/81/22/1293628122.db2.gz TURXMUNOYZBNAA-IBGZPJMESA-N 0 3 342.395 2.917 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H](CO)C[C@H]2CCCO2)o1 ZINC000886229339 1294776484 /nfs/dbraw/zinc/77/64/84/1294776484.db2.gz OFIWIKVRDPXOLK-ZIAGYGMSSA-N 0 3 346.383 2.874 20 5 EFBDHN Cc1ccccc1[C@@H](CO)N(C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000886435869 1294967179 /nfs/dbraw/zinc/96/71/79/1294967179.db2.gz KVEWZCHSTZZWRP-QZTJIDSGSA-N 0 3 330.384 2.602 20 5 EFBDHN CCCSCC(=O)NCCCN(C)Cc1cccc([N+](=O)[O-])c1 ZINC001234521466 1313144511 /nfs/dbraw/zinc/14/45/11/1313144511.db2.gz SCWUQOPCLGIYKU-UHFFFAOYSA-N 0 3 339.461 2.676 20 5 EFBDHN O=C(CC(C1CC1)C1CC1)NCCNCc1ccc([N+](=O)[O-])cc1 ZINC001152547017 1295416248 /nfs/dbraw/zinc/41/62/48/1295416248.db2.gz FFPBSWCNAJVICP-UHFFFAOYSA-N 0 3 331.416 2.627 20 5 EFBDHN COCCN1[C@H](C)CN(c2nccc3cc([N+](=O)[O-])ccc32)C[C@@H]1C ZINC000826633222 1295730769 /nfs/dbraw/zinc/73/07/69/1295730769.db2.gz QIULHQNDLFANDS-OKILXGFUSA-N 0 3 344.415 2.688 20 5 EFBDHN [NH3+]CC1(c2ccccc2)CCN(Cc2cc([O-])ccc2[N+](=O)[O-])CC1 ZINC000903792909 1313222995 /nfs/dbraw/zinc/22/29/95/1313222995.db2.gz JMXFNYWPUYLUJT-UHFFFAOYSA-N 0 3 341.411 2.793 20 5 EFBDHN Cc1ncc(C(=O)NCCCN(C)Cc2ccc([N+](=O)[O-])cc2)s1 ZINC001235275221 1313280429 /nfs/dbraw/zinc/28/04/29/1313280429.db2.gz CWJRHRKSVRITLS-UHFFFAOYSA-N 0 3 348.428 2.612 20 5 EFBDHN CN(CCOc1ccccc1F)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776273404 1297336037 /nfs/dbraw/zinc/33/60/37/1297336037.db2.gz AZPKWNFMYMGOPG-MRXNPFEDSA-N 0 3 334.347 2.778 20 5 EFBDHN COC[C@H](NC[C@H](O)c1ccc([N+](=O)[O-])cc1)c1cccc(OC)c1 ZINC000852443018 1299705535 /nfs/dbraw/zinc/70/55/35/1299705535.db2.gz HZSNKNNYDUTDET-ROUUACIJSA-N 0 3 346.383 2.614 20 5 EFBDHN COc1ccc(C2(NC[C@H](O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000776605497 1299795318 /nfs/dbraw/zinc/79/53/18/1299795318.db2.gz LNOLCEHBFCFFKR-KRWDZBQOSA-N 0 3 328.368 2.916 20 5 EFBDHN O=[N+]([O-])c1ccc([C@H](O)CNCc2cnccc2C(F)(F)F)cc1 ZINC000853134384 1300020437 /nfs/dbraw/zinc/02/04/37/1300020437.db2.gz RGEQUCKOVMVHPZ-CQSZACIVSA-N 0 3 341.289 2.832 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCN2CCC[C@@](O)(c3ccccc3)C2)cc1 ZINC000859583732 1301499526 /nfs/dbraw/zinc/49/95/26/1301499526.db2.gz GONURZGGNMGZIS-IBGZPJMESA-N 0 3 342.395 2.957 20 5 EFBDHN CCO[C@H](C(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-])C1CC1 ZINC000860854846 1301942961 /nfs/dbraw/zinc/94/29/61/1301942961.db2.gz KPEZVZFDEKODEO-LKTVYLICSA-N 0 3 325.336 2.890 20 5 EFBDHN CCC(C)(C)N1CCN(C(=O)Cc2cccc(F)c2[N+](=O)[O-])CC1 ZINC000869193516 1304653565 /nfs/dbraw/zinc/65/35/65/1304653565.db2.gz SSAOLMMNVAHBOA-UHFFFAOYSA-N 0 3 337.395 2.609 20 5 EFBDHN COc1ccc(CN2CCC[C@H](Cc3nccn3C)C2)cc1[N+](=O)[O-] ZINC000090003450 1314032874 /nfs/dbraw/zinc/03/28/74/1314032874.db2.gz GREHWHAFRPZNQF-CQSZACIVSA-N 0 3 344.415 2.792 20 5 EFBDHN CCn1ncc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])c1C ZINC000870453625 1305329331 /nfs/dbraw/zinc/32/93/31/1305329331.db2.gz BLEPUAVZHWUIPF-ABAIWWIYSA-N 0 3 335.335 2.914 20 5 EFBDHN CC([C@@H](OC(=O)c1cnn(CC2CC2)c1)c1ccccc1F)[N+](=O)[O-] ZINC000870455389 1305330572 /nfs/dbraw/zinc/33/05/72/1305330572.db2.gz YLVBPTUIOJKYGE-MEDUHNTESA-N 0 3 347.346 2.996 20 5 EFBDHN Cc1ccn(C[C@H](C)C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])n1 ZINC000870455378 1305331199 /nfs/dbraw/zinc/33/11/99/1305331199.db2.gz YJSGHEKWZQBBFS-NORZTCDRSA-N 0 3 349.362 2.916 20 5 EFBDHN Cc1cc(Br)cc([N+](=O)[O-])c1O[C@@H]1CCNC[C@@H]1F ZINC001218071410 1315143011 /nfs/dbraw/zinc/14/30/11/1315143011.db2.gz PJYDUJACJAAWPU-GXSJLCMTSA-N 0 3 333.157 2.745 20 5 EFBDHN CN1CCN(Cc2cccc(Nc3ccc(N)c([N+](=O)[O-])c3)c2)CC1 ZINC001209935301 1314261219 /nfs/dbraw/zinc/26/12/19/1314261219.db2.gz LWKAEMSZYOXEBK-UHFFFAOYSA-N 0 3 341.415 2.668 20 5 EFBDHN Cc1cc(N2CCN(C)CC2)ccc1Nc1ccc(N)c([N+](=O)[O-])c1 ZINC001209934932 1314261371 /nfs/dbraw/zinc/26/13/71/1314261371.db2.gz IYBVHJKJSPMFED-UHFFFAOYSA-N 0 3 341.415 2.981 20 5 EFBDHN C[C@@H]1C[C@H](NC(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)CN1C1CC1 ZINC000900998271 1309145019 /nfs/dbraw/zinc/14/50/19/1309145019.db2.gz YKITZAWDPMBBCF-SCZZXKLOSA-N 0 3 341.770 2.742 20 5 EFBDHN CN(CCNc1nc2ccccn2c1[N+](=O)[O-])Cc1ccc(F)cc1 ZINC000749102481 1314334209 /nfs/dbraw/zinc/33/42/09/1314334209.db2.gz PEKWQHURICAOGD-UHFFFAOYSA-N 0 3 343.362 2.926 20 5 EFBDHN CC(C)=CC(=O)NCC1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001222302576 1311112537 /nfs/dbraw/zinc/11/25/37/1311112537.db2.gz GNQJLKZHWQIUMH-UHFFFAOYSA-N 0 3 331.416 2.889 20 5 EFBDHN CC(=O)O[C@@H]1C[C@@H]2C[C@H](OCc3ccc(C)c([N+](=O)[O-])c3)C[C@H]1N2C ZINC001223221485 1311231747 /nfs/dbraw/zinc/23/17/47/1311231747.db2.gz CWHHKWZNNRTAAP-CWLKWCNXSA-N 0 3 348.399 2.587 20 5 EFBDHN Cc1cnc(CO[C@H]2CC[C@@H](N3CCOCC3)CC2)c(C)c1[N+](=O)[O-] ZINC001224181555 1311357185 /nfs/dbraw/zinc/35/71/85/1311357185.db2.gz NKXLLCIJXYONSM-IYBDPMFKSA-N 0 3 349.431 2.767 20 5 EFBDHN C[C@H](Nc1nc2ccccc2c(Cl)c1[N+](=O)[O-])[C@@H]1CNCCO1 ZINC001159501076 1311528519 /nfs/dbraw/zinc/52/85/19/1311528519.db2.gz YESHNSCFFFWBAS-CABZTGNLSA-N 0 3 336.779 2.585 20 5 EFBDHN COCCCN1CCC(Oc2cc(C(C)=O)ccc2[N+](=O)[O-])CC1 ZINC001225807862 1311577805 /nfs/dbraw/zinc/57/78/05/1311577805.db2.gz ZQUHXGPPTDHKGB-UHFFFAOYSA-N 0 3 336.388 2.677 20 5 EFBDHN NCc1ccc(Nc2cc3ncnc(Cl)c3cc2[N+](=O)[O-])cn1 ZINC001160402627 1311703881 /nfs/dbraw/zinc/70/38/81/1311703881.db2.gz YPGZXYQMXYTUCJ-UHFFFAOYSA-N 0 3 330.735 2.789 20 5 EFBDHN CC(C)N1CC[C@H](Oc2ccc(Br)nc2[N+](=O)[O-])C1 ZINC001227256750 1311783890 /nfs/dbraw/zinc/78/38/90/1311783890.db2.gz NLDMSYJIBYMEDK-VIFPVBQESA-N 0 3 330.182 2.614 20 5 EFBDHN CCc1ccc(C(=O)NCCCNCc2ccccc2[N+](=O)[O-])o1 ZINC001161141183 1311868509 /nfs/dbraw/zinc/86/85/09/1311868509.db2.gz CURUDQZCDICXDX-UHFFFAOYSA-N 0 3 331.372 2.660 20 5 EFBDHN Cc1cncc(C)c1C(=O)NCCCNCc1ccccc1[N+](=O)[O-] ZINC001162484553 1312112165 /nfs/dbraw/zinc/11/21/65/1312112165.db2.gz WKJDNGGQHYHAHI-UHFFFAOYSA-N 0 3 342.399 2.516 20 5 EFBDHN CC(C)N1CC[C@H](Oc2cc(Br)cnc2[N+](=O)[O-])C1 ZINC001229561216 1312113897 /nfs/dbraw/zinc/11/38/97/1312113897.db2.gz UWEMTMCRWQNHNM-JTQLQIEISA-N 0 3 330.182 2.614 20 5 EFBDHN O=C(C1=CCCC1)N1C[C@H]2CN(Cc3ccccc3[N+](=O)[O-])C[C@H]2C1 ZINC001048765706 1312117342 /nfs/dbraw/zinc/11/73/42/1312117342.db2.gz HIWUTDUJGCONMC-CALCHBBNSA-N 0 3 341.411 2.595 20 5 EFBDHN CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3ccc([N+](=O)[O-])c(C)c3C)C[C@H]1N2C ZINC001229880802 1312153557 /nfs/dbraw/zinc/15/35/57/1312153557.db2.gz IZQCKNLJCGKWDG-KJGCVMFHSA-N 0 3 348.399 2.757 20 5 EFBDHN COC(=O)c1ccc(C)c([N+](=O)[O-])c1OC1CCN(C2CC2)CC1 ZINC001229898584 1312156532 /nfs/dbraw/zinc/15/65/32/1312156532.db2.gz AWAWFVDIVXNKRE-UHFFFAOYSA-N 0 3 334.372 2.695 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(C)cc1OC1CCN(C2CC2)CC1 ZINC001229960924 1312163286 /nfs/dbraw/zinc/16/32/86/1312163286.db2.gz QEKISIDMHHIVOW-UHFFFAOYSA-N 0 3 334.372 2.695 20 5 EFBDHN C[C@H](N)c1nc2ccccc2n1-c1ncnc2sc([N+](=O)[O-])cc21 ZINC001162764358 1312171187 /nfs/dbraw/zinc/17/11/87/1312171187.db2.gz WXUJEBWAWIGLFF-QMMMGPOBSA-N 0 3 340.368 2.958 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])cc(-n2c3ccccc3nc2[C@H](C)N)c1 ZINC001162777839 1312174121 /nfs/dbraw/zinc/17/41/21/1312174121.db2.gz WAGKQCBZAARAAB-JTQLQIEISA-N 0 3 340.339 2.740 20 5 EFBDHN CC(C)(C)c1ccc(NCc2nnn3c2CNCCC3)c([N+](=O)[O-])c1 ZINC001162978261 1312217352 /nfs/dbraw/zinc/21/73/52/1312217352.db2.gz VWTYHXTULJZFRF-UHFFFAOYSA-N 0 3 344.419 2.589 20 5 EFBDHN CC(F)(F)C(=O)NCCC1(CNCc2ccccc2[N+](=O)[O-])CC1 ZINC001163149951 1312251924 /nfs/dbraw/zinc/25/19/24/1312251924.db2.gz ZZNGFMVGBOCALX-UHFFFAOYSA-N 0 3 341.358 2.626 20 5 EFBDHN CC(C)=CC(=O)NCCC1(CNCc2csc([N+](=O)[O-])c2)CC1 ZINC001163276190 1312280826 /nfs/dbraw/zinc/28/08/26/1312280826.db2.gz SPBMHWMCIARKDZ-UHFFFAOYSA-N 0 3 337.445 2.999 20 5 EFBDHN CC1(C(=O)N2C[C@H]3CN(Cc4ccccc4[N+](=O)[O-])C[C@H]3C2)CCC1 ZINC001048988517 1312329026 /nfs/dbraw/zinc/32/90/26/1312329026.db2.gz FIRDORGZUDOTMF-IYBDPMFKSA-N 0 3 343.427 2.675 20 5 EFBDHN Cc1c(Br)c(OC2CCN(C)CC2)ncc1[N+](=O)[O-] ZINC001231092219 1312428548 /nfs/dbraw/zinc/42/85/48/1312428548.db2.gz CQCOLFTYKZCSKS-UHFFFAOYSA-N 0 3 330.182 2.534 20 5 EFBDHN Cc1ccnc(N2CCC(Oc3nc(C)cc(O)c3[N+](=O)[O-])CC2)c1 ZINC001231264903 1312468008 /nfs/dbraw/zinc/46/80/08/1312468008.db2.gz VRVAFNAMFRUDJV-UHFFFAOYSA-N 0 3 344.371 2.755 20 5 EFBDHN CN(CCCNC(=O)/C=C/c1ccco1)Cc1ccc([N+](=O)[O-])cc1 ZINC001231294809 1312473313 /nfs/dbraw/zinc/47/33/13/1312473313.db2.gz GGGWKISRCPYMCU-MDZDMXLPSA-N 0 3 343.383 2.839 20 5 EFBDHN CC1(C(=O)NCCC2(CNCc3csc([N+](=O)[O-])c3)CC2)CC1 ZINC001164604184 1312547833 /nfs/dbraw/zinc/54/78/33/1312547833.db2.gz BQDJKQBJPQKXEI-UHFFFAOYSA-N 0 3 337.445 2.833 20 5 EFBDHN COCCCN1CCN(c2cc(C)c3cc([N+](=O)[O-])ccc3n2)CC1 ZINC001165098338 1312567675 /nfs/dbraw/zinc/56/76/75/1312567675.db2.gz XIIDINYSSIBMDT-UHFFFAOYSA-N 0 3 344.415 2.610 20 5 EFBDHN CNC(=O)C1CCN(Cc2ccc3ccc4cccnc4c3n2)CC1 ZINC001232219770 1312651770 /nfs/dbraw/zinc/65/17/70/1312651770.db2.gz USPVRTVSXMQSRX-UHFFFAOYSA-N 0 3 334.423 2.741 20 5 EFBDHN CN1C(=O)CC[C@@H]2[C@H]1CCN2Cc1ccc2ccc3cccnc3c2n1 ZINC001232222189 1312651837 /nfs/dbraw/zinc/65/18/37/1312651837.db2.gz JLUNHBYKERSBMS-QZTJIDSGSA-N 0 3 346.434 2.978 20 5 EFBDHN O=C1NC2(CO1)CCN(Cc1ccc3ccc4cccnc4c3n1)CC2 ZINC001232224973 1312652702 /nfs/dbraw/zinc/65/27/02/1312652702.db2.gz LURQBEKEASXFPB-UHFFFAOYSA-N 0 3 348.406 2.857 20 5 EFBDHN O=C(N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1)C1C=CC=CC=C1 ZINC001020203167 1314665450 /nfs/dbraw/zinc/66/54/50/1314665450.db2.gz GSCORLFFQGBKTO-QAQDUYKDSA-N 0 3 339.395 2.630 20 5 EFBDHN NCC(=O)NCc1nc(-c2cc3ccccc3c3ccccc23)no1 ZINC001247626854 1314809966 /nfs/dbraw/zinc/80/99/66/1314809966.db2.gz WBJXCTIRUBSUPM-UHFFFAOYSA-N 0 3 332.363 2.618 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1-c1nc(-c2ccc3c(n2)CCNC3)no1 ZINC001215376918 1314826645 /nfs/dbraw/zinc/82/66/45/1314826645.db2.gz RDQZCXBQQKTYRW-UHFFFAOYSA-N 0 3 337.339 2.661 20 5 EFBDHN Cc1ccc(-c2nc(-c3ccc4c(n3)CCNC4)no2)cc1[N+](=O)[O-] ZINC001215638571 1314861981 /nfs/dbraw/zinc/86/19/81/1314861981.db2.gz UOXQXYUKLWATRB-UHFFFAOYSA-N 0 3 337.339 2.661 20 5 EFBDHN Cc1ncc([N+](=O)[O-])cc1Nc1ccc(CN2CCN(C)CC2)cc1 ZINC001249548730 1315095130 /nfs/dbraw/zinc/09/51/30/1315095130.db2.gz RLCFECPQXQWXNV-UHFFFAOYSA-N 0 3 341.415 2.789 20 5 EFBDHN O=[N+]([O-])c1cc2[n-]c(O[C@@H]3CCC[NH2+]C[C@H]3F)nc2cc1Cl ZINC001217945968 1315123504 /nfs/dbraw/zinc/12/35/04/1315123504.db2.gz FUXUTQBWGFZTGH-PRHODGIISA-N 0 3 328.731 2.593 20 5 EFBDHN O=[N+]([O-])c1cc2nc(O[C@@H]3CCC[NH2+]C[C@H]3F)[n-]c2cc1Cl ZINC001217945968 1315123506 /nfs/dbraw/zinc/12/35/06/1315123506.db2.gz FUXUTQBWGFZTGH-PRHODGIISA-N 0 3 328.731 2.593 20 5 EFBDHN O=[N+]([O-])c1cc(O[C@@H]2CNCCC2(F)F)ccc1C(F)(F)F ZINC001218446825 1315197043 /nfs/dbraw/zinc/19/70/43/1315197043.db2.gz DBNOANVCHMILFO-SNVBAGLBSA-N 0 3 326.221 2.990 20 5 EFBDHN O=[N+]([O-])c1cccc(O[C@H]2CNCCC2(F)F)c1Br ZINC001218448483 1315197192 /nfs/dbraw/zinc/19/71/92/1315197192.db2.gz NCPFIMXEWKFFEM-VIFPVBQESA-N 0 3 337.120 2.733 20 5 EFBDHN CCOC(=O)c1ccc(O[C@@H]2CNCc3ccccc32)cc1[N+](=O)[O-] ZINC001218486721 1315203682 /nfs/dbraw/zinc/20/36/82/1315203682.db2.gz CUUDTJJGOULIJR-QGZVFWFLSA-N 0 3 342.351 2.995 20 5 EFBDHN CCOC(=O)c1ccc(O[C@H]2CNCc3ccccc32)c([N+](=O)[O-])c1 ZINC001218485288 1315203938 /nfs/dbraw/zinc/20/39/38/1315203938.db2.gz GUPGXBCEKHZHCW-KRWDZBQOSA-N 0 3 342.351 2.995 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCC(NCc3cc(F)ccn3)CC2)cc1 ZINC001254469269 1315706893 /nfs/dbraw/zinc/70/68/93/1315706893.db2.gz LHMAHOIYTRMCRY-UHFFFAOYSA-N 0 3 330.363 2.888 20 5 EFBDHN CCn1cnc(CNC2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC001254473010 1315707730 /nfs/dbraw/zinc/70/77/30/1315707730.db2.gz ZVDJITNXBAUEFF-UHFFFAOYSA-N 0 3 329.404 2.570 20 5 EFBDHN CCOC(=O)c1ccnc(CN[C@@H](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC001254537714 1315721262 /nfs/dbraw/zinc/72/12/62/1315721262.db2.gz GSFARLFTPXAUMY-ZDUSSCGKSA-N 0 3 343.383 2.887 20 5 EFBDHN COCCCCN1CCN([C@@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC001254567992 1315724650 /nfs/dbraw/zinc/72/46/50/1315724650.db2.gz DWPQMYAXULOEFS-INIZCTEOSA-N 0 3 335.448 2.570 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N1CC[C@H](Oc2ncc(F)cn2)C1 ZINC001254569983 1315725382 /nfs/dbraw/zinc/72/53/82/1315725382.db2.gz LMQMUQKNFLKNLQ-DOMZBBRYSA-N 0 3 346.362 2.608 20 5 EFBDHN CCC(=O)N(C)C1CCN([C@@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC001254569728 1315725443 /nfs/dbraw/zinc/72/54/43/1315725443.db2.gz KIOMNYJCUAGWFG-AWEZNQCLSA-N 0 3 333.432 2.859 20 5 EFBDHN COc1cccc(OC)c1CN[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254580738 1315726951 /nfs/dbraw/zinc/72/69/51/1315726951.db2.gz FBZXJQTVCGYGCN-CQSZACIVSA-N 0 3 328.368 2.869 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@@H](NCc1ccnc(OC3CCC3)n1)C2 ZINC001254585210 1315727939 /nfs/dbraw/zinc/72/79/39/1315727939.db2.gz BZUWZPHMNXYVNR-HNNXBMFYSA-N 0 3 340.383 2.573 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@H](NCc1cncnc1C(F)(F)F)C2 ZINC001254589843 1315728265 /nfs/dbraw/zinc/72/82/65/1315728265.db2.gz SEQSSKJEEPMZSY-GFCCVEGCSA-N 0 3 338.289 2.661 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@@H](NCc1cncnc1C(F)(F)F)C2 ZINC001254589844 1315728444 /nfs/dbraw/zinc/72/84/44/1315728444.db2.gz SEQSSKJEEPMZSY-LBPRGKRZSA-N 0 3 338.289 2.661 20 5 EFBDHN CC(C)C(=O)N(C)C1CCN([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254605227 1315730355 /nfs/dbraw/zinc/73/03/55/1315730355.db2.gz AMIKZEBTUBLVCT-GOSISDBHSA-N 0 3 345.443 2.641 20 5 EFBDHN Cc1nnc(C2CCN([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)CC2)o1 ZINC001254605474 1315730433 /nfs/dbraw/zinc/73/04/33/1315730433.db2.gz AHFDUMQVOJSAAS-MRXNPFEDSA-N 0 3 328.372 2.633 20 5 EFBDHN Cc1ccc(O[C@H]2CCN([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)nc1 ZINC001254605294 1315730515 /nfs/dbraw/zinc/73/05/15/1315730515.db2.gz BDEAFWZYXSWOQW-MSOLQXFVSA-N 0 3 339.395 2.919 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@H](N1CC[C@H](Oc3ccncc3)C1)C2 ZINC001254606833 1315730663 /nfs/dbraw/zinc/73/06/63/1315730663.db2.gz IDYUNIYDELVYSO-AEFFLSMTSA-N 0 3 325.368 2.610 20 5 EFBDHN CCc1nnc(C2CCN([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)CC2)o1 ZINC001254608272 1315731162 /nfs/dbraw/zinc/73/11/62/1315731162.db2.gz QDJASDKYPCXPEN-INIZCTEOSA-N 0 3 342.399 2.887 20 5 EFBDHN CCC(=O)N(CC)C1CCN([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254610358 1315731166 /nfs/dbraw/zinc/73/11/66/1315731166.db2.gz KDQWEEZJKJLHOI-GOSISDBHSA-N 0 3 345.443 2.785 20 5 EFBDHN Cc1cccnc1O[C@@H]1CCN([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254612058 1315731728 /nfs/dbraw/zinc/73/17/28/1315731728.db2.gz USWGDGNGRAFCKW-QZTJIDSGSA-N 0 3 339.395 2.919 20 5 EFBDHN COc1cc(N2CCC(NCc3cc(C)no3)CC2)ccc1[N+](=O)[O-] ZINC001256085185 1315903375 /nfs/dbraw/zinc/90/33/75/1315903375.db2.gz LAXPWGDVFKTJAT-UHFFFAOYSA-N 0 3 346.387 2.658 20 5 EFBDHN CC[C@@H]1COCCN1C1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC001256100351 1315904547 /nfs/dbraw/zinc/90/45/47/1315904547.db2.gz GCZHRQYOILFSJP-CQSZACIVSA-N 0 3 349.431 2.683 20 5 EFBDHN COc1cc(N2CCC(N3C[C@@H](C)OC[C@H]3C)CC2)ccc1[N+](=O)[O-] ZINC001256101694 1315904767 /nfs/dbraw/zinc/90/47/67/1315904767.db2.gz QWIFBNLRFXWVNI-ZIAGYGMSSA-N 0 3 349.431 2.681 20 5 EFBDHN CC(C)CN(CCN(C)C)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC001262081900 1316447254 /nfs/dbraw/zinc/44/72/54/1316447254.db2.gz KIGMMWIOUUMGJX-UHFFFAOYSA-N 0 3 326.372 2.785 20 5 EFBDHN CN1CCN(C(C)(C)CNc2ccc([N+](=O)[O-])c3cnccc23)CC1 ZINC001317797568 1328385122 /nfs/dbraw/zinc/38/51/22/1328385122.db2.gz DJKPNTZJWXXBDY-UHFFFAOYSA-N 0 3 343.431 2.581 20 5 EFBDHN O=C(c1ccccc1)N1CCC[C@H](NCc2ccc([N+](=O)[O-])cc2)C1 ZINC001323346018 1329536918 /nfs/dbraw/zinc/53/69/18/1329536918.db2.gz PYAJEOLFZYMWJU-KRWDZBQOSA-N 0 3 339.395 2.989 20 5 EFBDHN CN(C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccc(C(N)=O)cc1 ZINC001325714398 1329708255 /nfs/dbraw/zinc/70/82/55/1329708255.db2.gz VFWILJNPNBDBGR-XQRVVYSFSA-N 0 3 325.368 2.839 20 5 EFBDHN CCN1CCN(c2ncnc3c(Cl)cc([N+](=O)[O-])cc32)[C@@H](C)C1 ZINC001327679446 1330507896 /nfs/dbraw/zinc/50/78/96/1330507896.db2.gz QGLZHMKEGFXQDD-JTQLQIEISA-N 0 3 335.795 2.722 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)c2ncnc(NCCN3CC=CCC3)c2c1 ZINC001328023021 1330542875 /nfs/dbraw/zinc/54/28/75/1330542875.db2.gz FFBVXWGWPOJGJK-UHFFFAOYSA-N 0 3 333.779 2.865 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CCC[C@](O)(c3ccccc3)C2)c1 ZINC001328882626 1330643404 /nfs/dbraw/zinc/64/34/04/1330643404.db2.gz AYAFGSYUPKUNJN-RTBURBONSA-N 0 3 342.395 2.612 20 5 EFBDHN COc1cccc([C@@H]2CCCN2CCn2c(C)ncc2[N+](=O)[O-])c1 ZINC001330657693 1330764452 /nfs/dbraw/zinc/76/44/52/1330764452.db2.gz NMOHSTFVDGAMML-INIZCTEOSA-N 0 3 330.388 2.945 20 5 EFBDHN CC(C)[C@H](NC[C@H](O)COc1ccccc1[N+](=O)[O-])c1ccccn1 ZINC001336722647 1331496044 /nfs/dbraw/zinc/49/60/44/1331496044.db2.gz LGENTQZBGBTHTD-KSSFIOAISA-N 0 3 345.399 2.716 20 5 EFBDHN CC(C)Oc1cc(C(=O)NC[C@@H]2CCCCN2C)ccc1[N+](=O)[O-] ZINC001340856705 1332213311 /nfs/dbraw/zinc/21/33/11/1332213311.db2.gz IUXPGKXZCMOQSP-AWEZNQCLSA-N 0 3 335.404 2.596 20 5 EFBDHN CC(COC(=O)Cc1cc(Br)ccc1Cl)[N+](=O)[O-] ZINC001344996452 1332500757 /nfs/dbraw/zinc/50/07/57/1332500757.db2.gz FUXMKYBKAWJSKA-ZETCQYMHSA-N 0 3 336.569 2.853 20 5 EFBDHN CC([C@@H](OC(=O)COCc1ccncc1)c1ccccc1F)[N+](=O)[O-] ZINC001345037050 1332503531 /nfs/dbraw/zinc/50/35/31/1332503531.db2.gz PUHIJDYVTQIBTE-YVEFUNNKSA-N 0 3 348.330 2.687 20 5 EFBDHN Cc1cc([N+](=O)[O-])c(C)cc1-c1noc(C[C@H]2CSCCN2)n1 ZINC001345957882 1332587857 /nfs/dbraw/zinc/58/78/57/1332587857.db2.gz PXKBFTCFGBHDNM-NSHDSACASA-N 0 3 334.401 2.509 20 5 EFBDHN Cc1cn2c(CNC[C@H](O)c3ccc([N+](=O)[O-])cc3)c(C)nc2s1 ZINC001346110850 1332600344 /nfs/dbraw/zinc/60/03/44/1332600344.db2.gz WHRQTLGKECWHBA-HNNXBMFYSA-N 0 3 346.412 2.744 20 5 EFBDHN CN1CCCC[C@H]1CNC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC001351666918 1333265400 /nfs/dbraw/zinc/26/54/00/1333265400.db2.gz RIJZQVHVRHXGQF-INIZCTEOSA-N 0 3 346.431 2.753 20 5 EFBDHN O=C(N[C@@H]1CCCN2CCCC[C@H]12)c1cccc(Cl)c1[N+](=O)[O-] ZINC000847254937 1333449371 /nfs/dbraw/zinc/44/93/71/1333449371.db2.gz HXUKAIDLRVLMMB-ZIAGYGMSSA-N 0 3 337.807 2.995 20 5 EFBDHN O=C(N[C@H]1CCCN2CCCC[C@H]12)c1cc(F)c([N+](=O)[O-])cc1F ZINC000847255364 1333450818 /nfs/dbraw/zinc/45/08/18/1333450818.db2.gz KOZFYRKVVKXGNC-UONOGXRCSA-N 0 3 339.342 2.620 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2N[C@H](CO)C[C@@H](O)c1ccccc1 ZINC000848537108 1334782117 /nfs/dbraw/zinc/78/21/17/1334782117.db2.gz ZRRCGRRGTDPNMP-UCLAIMLFSA-N 0 3 342.395 2.656 20 5 EFBDHN CN1CCCC[C@@H]1CNC(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC001357313478 1335299362 /nfs/dbraw/zinc/29/93/62/1335299362.db2.gz FGVFFWOARRKWBG-CYBMUJFWSA-N 0 3 340.811 2.532 20 5 EFBDHN O=C(N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1)c1cc(Cl)c[nH]1 ZINC001021831147 714547543 /nfs/dbraw/zinc/54/75/43/714547543.db2.gz BCSXTOKEMKCUGW-BETUJISGSA-N 0 3 348.790 2.627 20 5 EFBDHN Cc1ccoc1C(=O)N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001021839393 714554545 /nfs/dbraw/zinc/55/45/45/714554545.db2.gz YJIOHCFATDLRDY-OKILXGFUSA-N 0 3 329.356 2.547 20 5 EFBDHN Cc1cc(C)c(C(=O)N[C@H]2C[C@@H](NCc3ccccc3[N+](=O)[O-])C2)o1 ZINC001021938643 714605967 /nfs/dbraw/zinc/60/59/67/714605967.db2.gz KAUDNLDCOYXLCJ-GASCZTMLSA-N 0 3 343.383 2.855 20 5 EFBDHN CC1(C(=O)N[C@H]2C[C@@H](NCc3ccccc3[N+](=O)[O-])C2)CCCC1 ZINC001022509557 715192817 /nfs/dbraw/zinc/19/28/17/715192817.db2.gz RKJNKFRCXDEPQE-GASCZTMLSA-N 0 3 331.416 2.912 20 5 EFBDHN Cc1ccc([C@H](CNc2c([N+](=O)[O-])cnn2C)N2CCCC2)cc1 ZINC000892135517 715269535 /nfs/dbraw/zinc/26/95/35/715269535.db2.gz TWZCOGOHHCLXMI-HNNXBMFYSA-N 0 3 329.404 2.886 20 5 EFBDHN Cc1ccc([C@@H](CNc2c([N+](=O)[O-])cnn2C)N2CCCC2)cc1 ZINC000892135518 715269629 /nfs/dbraw/zinc/26/96/29/715269629.db2.gz TWZCOGOHHCLXMI-OAHLLOKOSA-N 0 3 329.404 2.886 20 5 EFBDHN C[C@H](Cc1cccnc1)NCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000934236370 715274421 /nfs/dbraw/zinc/27/44/21/715274421.db2.gz NZWVITRNUUAIJB-LLVKDONJSA-N 0 3 348.790 2.803 20 5 EFBDHN O=C(N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1)c1ccc(Cl)[nH]1 ZINC001022671239 715283701 /nfs/dbraw/zinc/28/37/01/715283701.db2.gz OKKIUUFGXLSNKG-TXEJJXNPSA-N 0 3 348.790 2.627 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1 ZINC000934398100 715449807 /nfs/dbraw/zinc/44/98/07/715449807.db2.gz RLSNIFNJNLDWMQ-WDEREUQCSA-N 0 3 335.429 2.672 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCN1C[C@@H](Cc2ccccc2)[C@H](O)C1 ZINC000934438365 715474390 /nfs/dbraw/zinc/47/43/90/715474390.db2.gz OWJSGVLRWZHFKB-SJLPKXTDSA-N 0 3 342.395 2.509 20 5 EFBDHN Cc1cc(F)cc(C(=O)NC[C@@H](C)N2CCC(C)CC2)c1[N+](=O)[O-] ZINC000176790540 716188466 /nfs/dbraw/zinc/18/84/66/716188466.db2.gz BSEJJFUWDPZELK-CYBMUJFWSA-N 0 3 337.395 2.893 20 5 EFBDHN COc1ccc(C)cc1CC[NH2+]Cc1ccc([O-])c(OC)c1[N+](=O)[O-] ZINC000892461261 717634470 /nfs/dbraw/zinc/63/44/70/717634470.db2.gz FOMAAWXIQZCJIA-UHFFFAOYSA-N 0 3 346.383 2.958 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)ccc1CNCCc1nnc2n1CCCCC2 ZINC000892523662 718209169 /nfs/dbraw/zinc/20/91/69/718209169.db2.gz BISIWYUFENQTSW-UHFFFAOYSA-N 0 3 349.822 2.898 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]C[C@]2(C)CCO[C@@H]2C2CC2)c1[N+](=O)[O-] ZINC000893642225 719009150 /nfs/dbraw/zinc/00/91/50/719009150.db2.gz MTQDJCDCOMQEGX-SJORKVTESA-N 0 3 336.388 2.604 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)ccc1CN[C@@H]1CCN(CC(F)(F)F)C1 ZINC000892754468 719122294 /nfs/dbraw/zinc/12/22/94/719122294.db2.gz AJZRGSRSVNGHCF-LLVKDONJSA-N 0 3 337.729 2.974 20 5 EFBDHN Cc1cc(N2C[C@H](C)N(C)C[C@@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000351504602 719242827 /nfs/dbraw/zinc/24/28/27/719242827.db2.gz BTZOGOHKKMPBJY-KBPBESRZSA-N 0 3 341.415 2.889 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2cnn(CN(C[C@@H]3CCOC3)C3CC3)c2)cc1 ZINC000103457802 719303757 /nfs/dbraw/zinc/30/37/57/719303757.db2.gz FAFQHGDEEYEYLY-AWEZNQCLSA-N 0 3 342.399 2.917 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)ccc1CNCCCOC1CCOCC1 ZINC000893018565 719470591 /nfs/dbraw/zinc/47/05/91/719470591.db2.gz JUFVJWCOMCWMQS-UHFFFAOYSA-N 0 3 328.796 2.924 20 5 EFBDHN COc1c([O-])ccc(C[NH2+][C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)c1[N+](=O)[O-] ZINC000893210655 720059732 /nfs/dbraw/zinc/05/97/32/720059732.db2.gz RHAOFQKTEUGSDK-VUCTXSBTSA-N 0 3 348.399 2.746 20 5 EFBDHN CC(C)Oc1ccc([C@@H](CNc2c([N+](=O)[O-])cnn2C)N(C)C)cc1 ZINC000893865047 720130501 /nfs/dbraw/zinc/13/05/01/720130501.db2.gz FKUMUVILKHCNJB-OAHLLOKOSA-N 0 3 347.419 2.830 20 5 EFBDHN CSc1ccc([C@@H](CNc2c([N+](=O)[O-])cnn2C)N(C)C)cc1 ZINC000893999246 720213251 /nfs/dbraw/zinc/21/32/51/720213251.db2.gz DKQULAHCSGONBG-CYBMUJFWSA-N 0 3 335.433 2.765 20 5 EFBDHN O=[N+]([O-])c1c(NC[C@H]2NCCc3ccccc32)nc2sccn21 ZINC000261810832 721713860 /nfs/dbraw/zinc/71/38/60/721713860.db2.gz GNGBRTZPDRORAH-GFCCVEGCSA-N 0 3 329.385 2.603 20 5 EFBDHN COc1c([O-])ccc(C[N@@H+]2CCCCC[C@@H]2C[C@@H](C)O)c1[N+](=O)[O-] ZINC000894412213 722719539 /nfs/dbraw/zinc/71/95/39/722719539.db2.gz ILFKRBVISLJIME-TZMCWYRMSA-N 0 3 338.404 2.825 20 5 EFBDHN COc1c([O-])ccc(C[N@H+]2CCCCC[C@@H]2C[C@@H](C)O)c1[N+](=O)[O-] ZINC000894412213 722719542 /nfs/dbraw/zinc/71/95/42/722719542.db2.gz ILFKRBVISLJIME-TZMCWYRMSA-N 0 3 338.404 2.825 20 5 EFBDHN CSc1ccc(C(=O)NC[C@H](C)N2CCCCC2)cc1[N+](=O)[O-] ZINC000917836949 728793573 /nfs/dbraw/zinc/79/35/73/728793573.db2.gz DEQOMEPPQFCPPJ-LBPRGKRZSA-N 0 3 337.445 2.921 20 5 EFBDHN COc1c([O-])ccc(C[N@@H+]2CC3(C[C@@H]2C)CCOCC3)c1[N+](=O)[O-] ZINC000895120467 723343829 /nfs/dbraw/zinc/34/38/29/723343829.db2.gz DMYNQQBKJXTITQ-LBPRGKRZSA-N 0 3 336.388 2.700 20 5 EFBDHN COc1c([O-])ccc(C[N@H+]2CC3(C[C@@H]2C)CCOCC3)c1[N+](=O)[O-] ZINC000895120467 723343831 /nfs/dbraw/zinc/34/38/31/723343831.db2.gz DMYNQQBKJXTITQ-LBPRGKRZSA-N 0 3 336.388 2.700 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C1CCN(C(=O)C(C)(C)F)CC1 ZINC000985202675 723977522 /nfs/dbraw/zinc/97/75/22/723977522.db2.gz VVTJBMBJJITMMX-UHFFFAOYSA-N 0 3 337.395 2.766 20 5 EFBDHN CCO[C@H]1CCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000897068929 723979093 /nfs/dbraw/zinc/97/90/93/723979093.db2.gz PKHINDBBJPVATR-INIZCTEOSA-N 0 3 330.388 2.606 20 5 EFBDHN C/C=C(\C)C(=O)N1CCC(N(C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000985367427 724175381 /nfs/dbraw/zinc/17/53/81/724175381.db2.gz GSZNMXRNXGDTGE-LNKIKWGQSA-N 0 3 331.416 2.984 20 5 EFBDHN C[C@H](NC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1)C1=CCN(C)CC1 ZINC000907283398 726907075 /nfs/dbraw/zinc/90/70/75/726907075.db2.gz SIRCVHQUQVYKHU-VIFPVBQESA-N 0 3 341.770 2.768 20 5 EFBDHN C[C@@H](NC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1)C1=CCN(C)CC1 ZINC000907283395 726907250 /nfs/dbraw/zinc/90/72/50/726907250.db2.gz SIRCVHQUQVYKHU-SECBINFHSA-N 0 3 341.770 2.768 20 5 EFBDHN CC[C@@H]1CN(C)CCCN1C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC000907924684 727055340 /nfs/dbraw/zinc/05/53/40/727055340.db2.gz KHDRZCYFPVFPSY-LLVKDONJSA-N 0 3 343.786 2.944 20 5 EFBDHN CCN(C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1)C1CCN(C)CC1 ZINC000908917633 727282711 /nfs/dbraw/zinc/28/27/11/727282711.db2.gz YMCBXYOQLINXNV-UHFFFAOYSA-N 0 3 343.786 2.944 20 5 EFBDHN CCN1CCCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000910297941 727431516 /nfs/dbraw/zinc/43/15/16/727431516.db2.gz NVOAPBWQYLRRSI-CYBMUJFWSA-N 0 3 337.445 2.630 20 5 EFBDHN O=[N+]([O-])c1sc(CNCCc2cnccn2)cc1Br ZINC000877131971 728309749 /nfs/dbraw/zinc/30/97/49/728309749.db2.gz QBMXBPGSJFJASD-UHFFFAOYSA-N 0 3 343.206 2.541 20 5 EFBDHN COc1ccc(C[C@](C)(CO)NCc2csc([N+](=O)[O-])c2)cc1 ZINC000873190699 1126118040 /nfs/dbraw/zinc/11/80/40/1126118040.db2.gz CNEIHAHQIZUEOF-MRXNPFEDSA-N 0 3 336.413 2.748 20 5 EFBDHN CC[C@@H]1CN[C@@H](CC)CN1C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC001573721132 1087881760 /nfs/dbraw/zinc/88/17/60/1087881760.db2.gz XJFHUIWGDRZLFM-WDEREUQCSA-N 0 3 325.796 2.851 20 5 EFBDHN C[C@H](C(=O)NC[C@@H]1Cc2ccccc2CN1)c1cccc([N+](=O)[O-])c1 ZINC001575069784 1088224423 /nfs/dbraw/zinc/22/44/23/1088224423.db2.gz NCYZGGZVUREXLI-GUYCJALGSA-N 0 3 339.395 2.529 20 5 EFBDHN CC1(C)CN[C@H]1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC001576470253 1089275893 /nfs/dbraw/zinc/27/58/93/1089275893.db2.gz YDRIVAULZGHUNJ-LBPRGKRZSA-N 0 3 332.385 2.655 20 5 EFBDHN C[C@H]1OC(C)(C)N[C@H]1CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC001576910754 1089523068 /nfs/dbraw/zinc/52/30/68/1089523068.db2.gz WACKGEITHBZFDS-SKDRFNHKSA-N 0 3 349.412 2.652 20 5 EFBDHN CNc1ccc([N+](=O)[O-])cc1NC(=O)c1cccc2c1CCNC2 ZINC001578760655 1090437957 /nfs/dbraw/zinc/43/79/57/1090437957.db2.gz SMRWFZUGYKSBIX-UHFFFAOYSA-N 0 3 326.356 2.535 20 5 EFBDHN Cc1sc(NC(=O)CNC2CC2)nc1-c1cccc([N+](=O)[O-])c1 ZINC001579934284 1090725646 /nfs/dbraw/zinc/72/56/46/1090725646.db2.gz QEBMSPMGNNIFMB-UHFFFAOYSA-N 0 3 332.385 2.717 20 5 EFBDHN O=C(Nc1ccc2c(c1)CNC2)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC001580770316 1091004164 /nfs/dbraw/zinc/00/41/64/1091004164.db2.gz QOORBFRGKZGHEP-UHFFFAOYSA-N 0 3 349.350 2.636 20 5 EFBDHN O=C(Nc1ccnc([C@@H]2CCCN2)n1)c1ccc([N+](=O)[O-])cc1Cl ZINC001580785519 1091008361 /nfs/dbraw/zinc/00/83/61/1091008361.db2.gz RGWLEUIHIVTHHD-LBPRGKRZSA-N 0 3 347.762 2.715 20 5 EFBDHN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCNCC12CCCCC2 ZINC001580822395 1091021373 /nfs/dbraw/zinc/02/13/73/1091021373.db2.gz QZPYBHLMEHJAOI-UHFFFAOYSA-N 0 3 337.807 2.997 20 5 EFBDHN C[C@H](C[NH2+]Cc1ccc(-c2nnn[n-]2)cc1)c1ccccc1[N+](=O)[O-] ZINC001589871811 1093162980 /nfs/dbraw/zinc/16/29/80/1093162980.db2.gz CCRXBDRNAJTLQV-GFCCVEGCSA-N 0 3 338.371 2.668 20 5 EFBDHN C[C@H](C[NH2+]Cc1ccc(-c2nn[n-]n2)cc1)c1ccccc1[N+](=O)[O-] ZINC001589871811 1093162982 /nfs/dbraw/zinc/16/29/82/1093162982.db2.gz CCRXBDRNAJTLQV-GFCCVEGCSA-N 0 3 338.371 2.668 20 5 EFBDHN CC1(C)C[N@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])[C@@H]2CCC[C@@H]21 ZINC001590104711 1093270498 /nfs/dbraw/zinc/27/04/98/1093270498.db2.gz SLLRXDWAGWHQNV-UONOGXRCSA-N 0 3 342.403 2.785 20 5 EFBDHN CC1(C)C[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])[C@@H]2CCC[C@@H]21 ZINC001590104711 1093270503 /nfs/dbraw/zinc/27/05/03/1093270503.db2.gz SLLRXDWAGWHQNV-UONOGXRCSA-N 0 3 342.403 2.785 20 5 EFBDHN CC1(C)C[N@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])[C@@H]2CCC[C@@H]21 ZINC001590104711 1093270508 /nfs/dbraw/zinc/27/05/08/1093270508.db2.gz SLLRXDWAGWHQNV-UONOGXRCSA-N 0 3 342.403 2.785 20 5 EFBDHN CC1(C)C[N@@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])[C@@H]2CCC[C@@H]21 ZINC001590104711 1093270516 /nfs/dbraw/zinc/27/05/16/1093270516.db2.gz SLLRXDWAGWHQNV-UONOGXRCSA-N 0 3 342.403 2.785 20 5 EFBDHN C[C@@H]1C[C@@H](C)[C@H](C)[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590189656 1093298459 /nfs/dbraw/zinc/29/84/59/1093298459.db2.gz WLZKOARPGBBJCT-UTUOFQBUSA-N 0 3 330.392 2.641 20 5 EFBDHN C[C@@H]1C[C@@H](C)[C@H](C)[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590189656 1093298465 /nfs/dbraw/zinc/29/84/65/1093298465.db2.gz WLZKOARPGBBJCT-UTUOFQBUSA-N 0 3 330.392 2.641 20 5 EFBDHN C[C@@H]1C[C@@H](C)[C@H](C)[N@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590189656 1093298468 /nfs/dbraw/zinc/29/84/68/1093298468.db2.gz WLZKOARPGBBJCT-UTUOFQBUSA-N 0 3 330.392 2.641 20 5 EFBDHN C[C@@H]1C[C@@H](C)[C@H](C)[N@@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590189656 1093298475 /nfs/dbraw/zinc/29/84/75/1093298475.db2.gz WLZKOARPGBBJCT-UTUOFQBUSA-N 0 3 330.392 2.641 20 5 EFBDHN CC1CCC([N@H+](C)Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC1 ZINC001590231788 1093319583 /nfs/dbraw/zinc/31/95/83/1093319583.db2.gz WWYUSDAOVJXEBX-UHFFFAOYSA-N 0 3 330.392 2.785 20 5 EFBDHN CC1CCC([N@@H+](C)Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC1 ZINC001590231788 1093319592 /nfs/dbraw/zinc/31/95/92/1093319592.db2.gz WWYUSDAOVJXEBX-UHFFFAOYSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@H](C)[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590245012 1093331561 /nfs/dbraw/zinc/33/15/61/1093331561.db2.gz XPOZKQKWBORAAL-NEPJUHHUSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@H](C)[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590245012 1093331568 /nfs/dbraw/zinc/33/15/68/1093331568.db2.gz XPOZKQKWBORAAL-NEPJUHHUSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@H](C)[N@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590245012 1093331576 /nfs/dbraw/zinc/33/15/76/1093331576.db2.gz XPOZKQKWBORAAL-NEPJUHHUSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@H](C)[N@@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590245012 1093331581 /nfs/dbraw/zinc/33/15/81/1093331581.db2.gz XPOZKQKWBORAAL-NEPJUHHUSA-N 0 3 330.392 2.785 20 5 EFBDHN C/C=C\C[C@@H]1CCC[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590352616 1093387265 /nfs/dbraw/zinc/38/72/65/1093387265.db2.gz CGTKBQHKYAHABI-XQJDBVBESA-N 0 3 342.403 2.953 20 5 EFBDHN C/C=C\C[C@@H]1CCC[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590352616 1093387276 /nfs/dbraw/zinc/38/72/76/1093387276.db2.gz CGTKBQHKYAHABI-XQJDBVBESA-N 0 3 342.403 2.953 20 5 EFBDHN C/C=C\C[C@@H]1CCC[N@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590352616 1093387283 /nfs/dbraw/zinc/38/72/83/1093387283.db2.gz CGTKBQHKYAHABI-XQJDBVBESA-N 0 3 342.403 2.953 20 5 EFBDHN C/C=C\C[C@@H]1CCC[N@@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590352616 1093387291 /nfs/dbraw/zinc/38/72/91/1093387291.db2.gz CGTKBQHKYAHABI-XQJDBVBESA-N 0 3 342.403 2.953 20 5 EFBDHN CCC(CC)[C@H](CNc1ccc(-c2nnn[n-]2)c([N+](=O)[O-])c1)[NH+](C)C ZINC001590432967 1093420206 /nfs/dbraw/zinc/42/02/06/1093420206.db2.gz TXQVKNVJJYYBLG-HNNXBMFYSA-N 0 3 347.423 2.553 20 5 EFBDHN CCC(CC)[C@@H](CNc1cc(-c2nnn[n-]2)ccc1[N+](=O)[O-])[NH+](C)C ZINC001590432242 1093420619 /nfs/dbraw/zinc/42/06/19/1093420619.db2.gz GBAUNKRDAYGHQB-OAHLLOKOSA-N 0 3 347.423 2.553 20 5 EFBDHN CCC(CC)[C@@H](CNc1cc(-c2nn[n-]n2)ccc1[N+](=O)[O-])[NH+](C)C ZINC001590432242 1093420623 /nfs/dbraw/zinc/42/06/23/1093420623.db2.gz GBAUNKRDAYGHQB-OAHLLOKOSA-N 0 3 347.423 2.553 20 5 EFBDHN CC[C@@H]1CCCC[C@H]1[NH2+]Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001590510183 1093465270 /nfs/dbraw/zinc/46/52/70/1093465270.db2.gz FNNRTRHLHASGDR-BXUZGUMPSA-N 0 3 330.392 2.833 20 5 EFBDHN CC[C@@H]1CCCC[C@H]1[NH2+]Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001590510183 1093465271 /nfs/dbraw/zinc/46/52/71/1093465271.db2.gz FNNRTRHLHASGDR-BXUZGUMPSA-N 0 3 330.392 2.833 20 5 EFBDHN CCS[C@@H]1CCC[C@H]1[NH2+]Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001590849765 1093597540 /nfs/dbraw/zinc/59/75/40/1093597540.db2.gz BVGCHJVWIZVBNM-TZMCWYRMSA-N 0 3 348.432 2.539 20 5 EFBDHN CCS[C@@H]1CCC[C@H]1[NH2+]Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001590849765 1093597546 /nfs/dbraw/zinc/59/75/46/1093597546.db2.gz BVGCHJVWIZVBNM-TZMCWYRMSA-N 0 3 348.432 2.539 20 5 EFBDHN CC[C@@H]1CC[C@H](C)[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590858401 1093605683 /nfs/dbraw/zinc/60/56/83/1093605683.db2.gz GDDGLVVBDUHHPV-NWDGAFQWSA-N 0 3 330.392 2.785 20 5 EFBDHN CC[C@@H]1CC[C@H](C)[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590858401 1093605685 /nfs/dbraw/zinc/60/56/85/1093605685.db2.gz GDDGLVVBDUHHPV-NWDGAFQWSA-N 0 3 330.392 2.785 20 5 EFBDHN CC[C@@H]1CC[C@H](C)[N@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590858401 1093605688 /nfs/dbraw/zinc/60/56/88/1093605688.db2.gz GDDGLVVBDUHHPV-NWDGAFQWSA-N 0 3 330.392 2.785 20 5 EFBDHN CC[C@@H]1CC[C@H](C)[N@@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590858401 1093605693 /nfs/dbraw/zinc/60/56/93/1093605693.db2.gz GDDGLVVBDUHHPV-NWDGAFQWSA-N 0 3 330.392 2.785 20 5 EFBDHN C[N@@H+](Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])C[C@@H]1CC=CCC1 ZINC001591126415 1093665134 /nfs/dbraw/zinc/66/51/34/1093665134.db2.gz VCDVXGLYGZHOPO-GFCCVEGCSA-N 0 3 328.376 2.563 20 5 EFBDHN C[N@H+](Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])C[C@@H]1CC=CCC1 ZINC001591126415 1093665137 /nfs/dbraw/zinc/66/51/37/1093665137.db2.gz VCDVXGLYGZHOPO-GFCCVEGCSA-N 0 3 328.376 2.563 20 5 EFBDHN C[N@@H+](Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])C[C@@H]1CC=CCC1 ZINC001591126415 1093665140 /nfs/dbraw/zinc/66/51/40/1093665140.db2.gz VCDVXGLYGZHOPO-GFCCVEGCSA-N 0 3 328.376 2.563 20 5 EFBDHN C[N@H+](Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])C[C@@H]1CC=CCC1 ZINC001591126415 1093665142 /nfs/dbraw/zinc/66/51/42/1093665142.db2.gz VCDVXGLYGZHOPO-GFCCVEGCSA-N 0 3 328.376 2.563 20 5 EFBDHN C[N@H+](Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])C1CCCCCC1 ZINC001591137044 1093669508 /nfs/dbraw/zinc/66/95/08/1093669508.db2.gz OTCNKMZPDPLXQW-UHFFFAOYSA-N 0 3 330.392 2.930 20 5 EFBDHN C[N@@H+](Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])C1CCCCCC1 ZINC001591137044 1093669510 /nfs/dbraw/zinc/66/95/10/1093669510.db2.gz OTCNKMZPDPLXQW-UHFFFAOYSA-N 0 3 330.392 2.930 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[N@@H+]1CCC[C@@H]2CCCC[C@@H]21 ZINC001593467226 1094309492 /nfs/dbraw/zinc/30/94/92/1094309492.db2.gz NPDWONGDJPBOED-WFASDCNBSA-N 0 3 342.403 2.930 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[N@H+]1CCC[C@@H]2CCCC[C@@H]21 ZINC001593467226 1094309500 /nfs/dbraw/zinc/30/95/00/1094309500.db2.gz NPDWONGDJPBOED-WFASDCNBSA-N 0 3 342.403 2.930 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1C[N@@H+]1CCC[C@@H]2CCCC[C@@H]21 ZINC001593467226 1094309509 /nfs/dbraw/zinc/30/95/09/1094309509.db2.gz NPDWONGDJPBOED-WFASDCNBSA-N 0 3 342.403 2.930 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nn[n-]n2)ccc1C[N@H+]1CCC[C@@H]2CCCC[C@@H]21 ZINC001593467226 1094309518 /nfs/dbraw/zinc/30/95/18/1094309518.db2.gz NPDWONGDJPBOED-WFASDCNBSA-N 0 3 342.403 2.930 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[NH2+]C1(C2CCC2)CCC1 ZINC001593481753 1094327202 /nfs/dbraw/zinc/32/72/02/1094327202.db2.gz KDLBTUFIYSDVIG-UHFFFAOYSA-N 0 3 328.376 2.587 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[NH2+]C1(C2CCC2)CCC1 ZINC001593481753 1094327205 /nfs/dbraw/zinc/32/72/05/1094327205.db2.gz KDLBTUFIYSDVIG-UHFFFAOYSA-N 0 3 328.376 2.587 20 5 EFBDHN O=[N+]([O-])c1cc(Br)ccc1O[C@H]1CNCCC1(F)F ZINC001218450301 1094800384 /nfs/dbraw/zinc/80/03/84/1094800384.db2.gz ZEYLHKNOVNUSPO-JTQLQIEISA-N 0 3 337.120 2.733 20 5 EFBDHN C[C@@H]([NH2+]Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])C1CCC(F)CC1 ZINC001603665549 1096583091 /nfs/dbraw/zinc/58/30/91/1096583091.db2.gz QPUFNDWDSIGGQS-CDWSIMAYSA-N 0 3 348.382 2.781 20 5 EFBDHN C[C@@H]([NH2+]Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])C1CCC(F)CC1 ZINC001603665549 1096583097 /nfs/dbraw/zinc/58/30/97/1096583097.db2.gz QPUFNDWDSIGGQS-CDWSIMAYSA-N 0 3 348.382 2.781 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[N@@H+]1CCCC2(CC2)CC1 ZINC001607084077 1097509829 /nfs/dbraw/zinc/50/98/29/1097509829.db2.gz SGPDQWQFSBFFNS-UHFFFAOYSA-N 0 3 328.376 2.541 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[N@H+]1CCCC2(CC2)CC1 ZINC001607084077 1097509834 /nfs/dbraw/zinc/50/98/34/1097509834.db2.gz SGPDQWQFSBFFNS-UHFFFAOYSA-N 0 3 328.376 2.541 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[N@@H+]1CCCC2(CC2)CC1 ZINC001607084077 1097509836 /nfs/dbraw/zinc/50/98/36/1097509836.db2.gz SGPDQWQFSBFFNS-UHFFFAOYSA-N 0 3 328.376 2.541 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[N@H+]1CCCC2(CC2)CC1 ZINC001607084077 1097509842 /nfs/dbraw/zinc/50/98/42/1097509842.db2.gz SGPDQWQFSBFFNS-UHFFFAOYSA-N 0 3 328.376 2.541 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[NH+]1CCCCCCCC1 ZINC001607083461 1097510286 /nfs/dbraw/zinc/51/02/86/1097510286.db2.gz HDUOTYLAIBHAKV-UHFFFAOYSA-N 0 3 330.392 2.931 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[NH+]1CCCCCCCC1 ZINC001607083461 1097510291 /nfs/dbraw/zinc/51/02/91/1097510291.db2.gz HDUOTYLAIBHAKV-UHFFFAOYSA-N 0 3 330.392 2.931 20 5 EFBDHN CC(C)[NH+](CCCNc1cc(-c2nnn[n-]2)ccc1[N+](=O)[O-])C(C)C ZINC001609098307 1098144440 /nfs/dbraw/zinc/14/44/40/1098144440.db2.gz DNOIMMMCXDYEKT-UHFFFAOYSA-N 0 3 347.423 2.696 20 5 EFBDHN CC(C)[NH+](CCCNc1cc(-c2nn[n-]n2)ccc1[N+](=O)[O-])C(C)C ZINC001609098307 1098144443 /nfs/dbraw/zinc/14/44/43/1098144443.db2.gz DNOIMMMCXDYEKT-UHFFFAOYSA-N 0 3 347.423 2.696 20 5 EFBDHN C[C@@H]1CCC[C@H]([NH2+]Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])[C@@H]1C ZINC001609164017 1098177299 /nfs/dbraw/zinc/17/72/99/1098177299.db2.gz KFUGCUCCENGYCB-GYSYKLTISA-N 0 3 330.392 2.689 20 5 EFBDHN C[C@@H]1CCC[C@H]([NH2+]Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])[C@@H]1C ZINC001609164017 1098177305 /nfs/dbraw/zinc/17/73/05/1098177305.db2.gz KFUGCUCCENGYCB-GYSYKLTISA-N 0 3 330.392 2.689 20 5 EFBDHN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NC[C@@H](C)N1CCC(C)CC1 ZINC000843776361 1100175801 /nfs/dbraw/zinc/17/58/01/1100175801.db2.gz MGTDETJMCUUYAA-GFCCVEGCSA-N 0 3 337.395 2.893 20 5 EFBDHN Cc1c(Cl)nc(-c2ccc([N+](=O)[O-])cc2)nc1N[C@H]1CCN(C)C1 ZINC001167273020 1102216001 /nfs/dbraw/zinc/21/60/01/1102216001.db2.gz MYIOPTHAQSKBAD-LBPRGKRZSA-N 0 3 347.806 2.552 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1NCC1(c3ccccc3)COC1)CNC2 ZINC001167295132 1102352009 /nfs/dbraw/zinc/35/20/09/1102352009.db2.gz WCHFTRKDQQTDRQ-UHFFFAOYSA-N 0 3 325.368 2.578 20 5 EFBDHN O=C([C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1)N1CCNC2(CCCCC2)C1 ZINC000906635578 1104387552 /nfs/dbraw/zinc/38/75/52/1104387552.db2.gz ZRTUVRSQDBXJRS-IAGOWNOFSA-N 0 3 343.427 2.833 20 5 EFBDHN COc1ccc(-c2ccc(CN3C[C@H](O)[C@@H](C)C3)o2)c([N+](=O)[O-])c1 ZINC000897684004 1106047252 /nfs/dbraw/zinc/04/72/52/1106047252.db2.gz JBYUWTXQPPRQOW-ZBEGNZNMSA-N 0 3 332.356 2.676 20 5 EFBDHN Cc1cccc(C2(Nc3cc4c(cc3[N+](=O)[O-])CNC4)COC2)c1 ZINC001168473189 1111255684 /nfs/dbraw/zinc/25/56/84/1111255684.db2.gz DSONWAOREFRFFA-UHFFFAOYSA-N 0 3 325.368 2.844 20 5 EFBDHN CCN(CCNc1cc(C)ccc1[N+](=O)[O-])C(=O)CN(C)C1CCC1 ZINC001106979118 1118971981 /nfs/dbraw/zinc/97/19/81/1118971981.db2.gz DVMWLTYORJOUBI-UHFFFAOYSA-N 0 3 348.447 2.648 20 5 EFBDHN CCN(CCNc1ccc([N+](=O)[O-])c(C)c1)C(=O)CN(C)C1CCC1 ZINC001106979623 1118978748 /nfs/dbraw/zinc/97/87/48/1118978748.db2.gz UUZCLUWWTAFOPH-UHFFFAOYSA-N 0 3 348.447 2.648 20 5 EFBDHN CN(c1ccc(Br)cc1[N+](=O)[O-])[C@@H]1CCCN(C)C1 ZINC000053250796 214172498 /nfs/dbraw/zinc/17/24/98/214172498.db2.gz VKJSBJXQUJVSHQ-LLVKDONJSA-N 0 3 328.210 2.888 20 5 EFBDHN CC[C@@H]1CN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CCS1 ZINC000181725932 529390442 /nfs/dbraw/zinc/39/04/42/529390442.db2.gz CYDKMYOCUITQED-GFCCVEGCSA-N 0 3 341.408 2.890 20 5 EFBDHN CN(CC1CCN(C)CC1)C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000152737251 529865634 /nfs/dbraw/zinc/86/56/34/529865634.db2.gz BIWGRWNEIMREQP-UHFFFAOYSA-N 0 3 325.796 2.662 20 5 EFBDHN CN(C[C@H]1CCN(C)C1)C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000129840374 529970404 /nfs/dbraw/zinc/97/04/04/529970404.db2.gz YICDGLCBSHCINZ-JTQLQIEISA-N 0 3 345.321 2.637 20 5 EFBDHN CN1CCC(NC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000181784193 530050287 /nfs/dbraw/zinc/05/02/87/530050287.db2.gz RHGZNIVRGTUPSG-UHFFFAOYSA-N 0 3 346.309 2.829 20 5 EFBDHN COc1ccc(C(=O)NCCN[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000178647506 232337256 /nfs/dbraw/zinc/33/72/56/232337256.db2.gz SZKKVHDODFTZAV-ZDUSSCGKSA-N 0 3 343.383 2.684 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2ccc(CN3CCC[C@H](OCCO)C3)o2)c1 ZINC000179576525 233181934 /nfs/dbraw/zinc/18/19/34/233181934.db2.gz FHZJKABQUUBGDI-INIZCTEOSA-N 0 3 346.383 2.828 20 5 EFBDHN O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC[C@@H]1CN1CCCCC1 ZINC000068132209 215281147 /nfs/dbraw/zinc/28/11/47/215281147.db2.gz OLRYCKAVKGJBST-CQSZACIVSA-N 0 3 335.379 2.824 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H](CCCO)c2ccccc2)c1 ZINC000179743047 233392016 /nfs/dbraw/zinc/39/20/16/233392016.db2.gz YRGIIGBAKRKLAM-ROUUACIJSA-N 0 3 330.384 2.732 20 5 EFBDHN C[C@@H](NC[C@H](O)COCc1cccs1)c1cccc([N+](=O)[O-])c1 ZINC000180435994 233864984 /nfs/dbraw/zinc/86/49/84/233864984.db2.gz DHZXIQHSQZDTDR-DOMZBBRYSA-N 0 3 336.413 2.885 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN1CC[C@H](c2ccccc2)C1 ZINC000181642923 234265233 /nfs/dbraw/zinc/26/52/33/234265233.db2.gz BOOAMFKYYFRZGR-IRXDYDNUSA-N 0 3 342.395 2.824 20 5 EFBDHN O=C(NCC1CCN(Cc2cccs2)CC1)c1ccc([N+](=O)[O-])o1 ZINC000038584435 213216254 /nfs/dbraw/zinc/21/62/54/213216254.db2.gz PYFLDCRPFNGBQL-UHFFFAOYSA-N 0 3 349.412 2.891 20 5 EFBDHN CCCN(CCN(C)C)C(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000347605437 283229456 /nfs/dbraw/zinc/22/94/56/283229456.db2.gz WNULSRVHSVUQGR-GFCCVEGCSA-N 0 3 325.384 2.638 20 5 EFBDHN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)CCN(C)C1CC1 ZINC000186780866 236017849 /nfs/dbraw/zinc/01/78/49/236017849.db2.gz XKGIZUFAIAXBCU-LBPRGKRZSA-N 0 3 345.403 2.732 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCN2CCSC3(CCOCC3)C2)cc1 ZINC000186837084 236037130 /nfs/dbraw/zinc/03/71/30/236037130.db2.gz LHNLQWVUKUDHRR-UHFFFAOYSA-N 0 3 338.429 2.572 20 5 EFBDHN COc1ccc(C(=O)N[C@@H](CN(C)C)c2ccccc2)cc1[N+](=O)[O-] ZINC000032781229 212842080 /nfs/dbraw/zinc/84/20/80/212842080.db2.gz REOUHLOVLCMXKR-HNNXBMFYSA-N 0 3 343.383 2.636 20 5 EFBDHN Cc1c(CC(=O)NC[C@@H](c2ccccc2)N(C)C)cccc1[N+](=O)[O-] ZINC000159303364 239023295 /nfs/dbraw/zinc/02/32/95/239023295.db2.gz KDSFCCLVWZVGEP-SFHVURJKSA-N 0 3 341.411 2.865 20 5 EFBDHN O=[N+]([O-])c1cnc(NCc2ccccc2CN2CCC[C@H]2CO)s1 ZINC000192526116 240050112 /nfs/dbraw/zinc/05/01/12/240050112.db2.gz AXDSWHHAOYJRKT-AWEZNQCLSA-N 0 3 348.428 2.620 20 5 EFBDHN CCOC(=O)N1CC[C@@H](N[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000193300141 240098846 /nfs/dbraw/zinc/09/88/46/240098846.db2.gz UOTUNZATNUSQRL-CZUORRHYSA-N 0 3 333.388 2.793 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCN2C[C@H](O)C[C@H]2c2ccccc2)c1 ZINC000411943016 243036664 /nfs/dbraw/zinc/03/66/64/243036664.db2.gz MLMJDRPXTDTTGO-AEFFLSMTSA-N 0 3 328.368 2.782 20 5 EFBDHN O=C1CCCN1[C@H]1CCCN(CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000412052353 243102258 /nfs/dbraw/zinc/10/22/58/243102258.db2.gz CJFQNOFSVFXISA-INIZCTEOSA-N 0 3 331.416 2.614 20 5 EFBDHN COC1([C@H](C)NCC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CCC1 ZINC000412017945 243071183 /nfs/dbraw/zinc/07/11/83/243071183.db2.gz APEKXQGVEFEGTD-JTQLQIEISA-N 0 3 341.795 2.734 20 5 EFBDHN CCCN(CCN(C)C)C(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000412217855 243209057 /nfs/dbraw/zinc/20/90/57/243209057.db2.gz YFBZMJNZLDQFFS-UHFFFAOYSA-N 0 3 337.420 2.796 20 5 EFBDHN CC(C)N1C[C@H](C)[C@H](NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000246737115 243305718 /nfs/dbraw/zinc/30/57/18/243305718.db2.gz AVCSVBALQNRZQN-MEDUHNTESA-N 0 3 330.388 2.535 20 5 EFBDHN C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412338070 243276228 /nfs/dbraw/zinc/27/62/28/243276228.db2.gz NJYYZIDBEYGQIE-HNONPPJISA-N 0 3 343.427 2.784 20 5 EFBDHN C[C@@H](NCCn1cc([N+](=O)[O-])cn1)c1cccc(N2CCCC2)c1 ZINC000181855796 296127183 /nfs/dbraw/zinc/12/71/83/296127183.db2.gz WGYIRXJSUPSMOA-CQSZACIVSA-N 0 3 329.404 2.742 20 5 EFBDHN CN(C)C(=O)[C@@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000414503025 244198815 /nfs/dbraw/zinc/19/88/15/244198815.db2.gz VINWLZJZVZLLAV-CQSZACIVSA-N 0 3 343.383 2.765 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2ccc(CN[C@@H](CO)[C@H]3CCCOC3)o2)c1 ZINC000414562896 244235010 /nfs/dbraw/zinc/23/50/10/244235010.db2.gz UCGJPIMTHCXAKF-YOEHRIQHSA-N 0 3 346.383 2.732 20 5 EFBDHN CN(C/C=C/c1ccccc1[N+](=O)[O-])C(C)(C)CN1CCOCC1 ZINC000414564392 244236279 /nfs/dbraw/zinc/23/62/79/244236279.db2.gz DRVLNBHVEDTZRH-SOFGYWHQSA-N 0 3 333.432 2.651 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H](CO)[C@H]3CCCOC3)o2)cc1 ZINC000414569729 244239329 /nfs/dbraw/zinc/23/93/29/244239329.db2.gz ZSEWNHLCMCTGHN-YOEHRIQHSA-N 0 3 346.383 2.732 20 5 EFBDHN N[C@H](CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccccc1 ZINC000262566963 245037540 /nfs/dbraw/zinc/03/75/40/245037540.db2.gz DQARBHKYLYIUPL-OAHLLOKOSA-N 0 3 340.383 2.599 20 5 EFBDHN COC(=O)c1cc(OCCN(C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000418878943 245305649 /nfs/dbraw/zinc/30/56/49/245305649.db2.gz MOIAPGIDDGRHBI-UHFFFAOYSA-N 0 3 344.367 2.892 20 5 EFBDHN CC[C@@H](NCC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)[C@@H]1CC1(C)C ZINC000419316901 245376491 /nfs/dbraw/zinc/37/64/91/245376491.db2.gz MEVZYCHSGUISJU-WDEREUQCSA-N 0 3 349.387 2.676 20 5 EFBDHN C[C@H](NCCn1cc([N+](=O)[O-])ccc1=O)c1ccc(C2CC2)cc1 ZINC000419337213 245385433 /nfs/dbraw/zinc/38/54/33/245385433.db2.gz KTSUHZSWTGHNRH-ZDUSSCGKSA-N 0 3 327.384 2.985 20 5 EFBDHN C[C@@H](CNC(=O)Cc1ccccc1[N+](=O)[O-])N(C)Cc1ccccc1 ZINC000110351110 220031235 /nfs/dbraw/zinc/03/12/35/220031235.db2.gz DKROFCFHGMCPAZ-HNNXBMFYSA-N 0 3 341.411 2.774 20 5 EFBDHN CCN1CCCC[C@H]1CNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000110597177 220046428 /nfs/dbraw/zinc/04/64/28/220046428.db2.gz REZXKRFXJMAQSL-ZDUSSCGKSA-N 0 3 332.404 2.766 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCCN2CCC(n3ccnc3)CC2)cc1 ZINC000111244115 220122756 /nfs/dbraw/zinc/12/27/56/220122756.db2.gz UUPQGSXMLTXMIZ-UHFFFAOYSA-N 0 3 330.388 2.897 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCCN1C1CC1 ZINC000421893535 246155463 /nfs/dbraw/zinc/15/54/63/246155463.db2.gz MIAJIAAJPBUPHO-OAHLLOKOSA-N 0 3 331.416 2.958 20 5 EFBDHN O=[N+]([O-])c1cnc(N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)c(F)c1 ZINC000425274161 247025272 /nfs/dbraw/zinc/02/52/72/247025272.db2.gz KSVWJYOFJPSOEW-WMLDXEAASA-N 0 3 342.374 2.840 20 5 EFBDHN C[C@H]1CN(Cc2ccc(Br)cc2[N+](=O)[O-])[C@@H](C)CN1C ZINC000425419752 247078008 /nfs/dbraw/zinc/07/80/08/247078008.db2.gz LKFXXEFYJFWYNN-QWRGUYRKSA-N 0 3 342.237 2.882 20 5 EFBDHN CC[C@@H]1CCCCN1CCNC(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000264994712 247121155 /nfs/dbraw/zinc/12/11/55/247121155.db2.gz RPOAOKJEWRYBCE-CQSZACIVSA-N 0 3 335.404 2.598 20 5 EFBDHN CC[C@H]1CCCCN1CCNC(=O)c1cc(OC)ccc1[N+](=O)[O-] ZINC000265003619 247127687 /nfs/dbraw/zinc/12/76/87/247127687.db2.gz TUGUTYXFHQLXEI-ZDUSSCGKSA-N 0 3 335.404 2.598 20 5 EFBDHN COC(=O)COc1ccc(CN(C)[C@@H]2CC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000433054348 248008412 /nfs/dbraw/zinc/00/84/12/248008412.db2.gz UTTLBUUMIZUCDN-GXTWGEPZSA-N 0 3 336.388 2.767 20 5 EFBDHN COC(=O)COc1ccc(CN(C)[C@@H]2CC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000433054351 248008991 /nfs/dbraw/zinc/00/89/91/248008991.db2.gz UTTLBUUMIZUCDN-TZMCWYRMSA-N 0 3 336.388 2.767 20 5 EFBDHN CN(CCOc1cccc([N+](=O)[O-])c1)C[C@H](O)Cc1ccccc1 ZINC000433071205 248011550 /nfs/dbraw/zinc/01/15/50/248011550.db2.gz XLVCKAKEVNOGLK-QGZVFWFLSA-N 0 3 330.384 2.509 20 5 EFBDHN CCc1ccc([C@@H]2CCN(CCn3cc([N+](=O)[O-])ccc3=O)C2)cc1 ZINC000433075177 248012377 /nfs/dbraw/zinc/01/23/77/248012377.db2.gz JVWPUIPZBUVLDX-QGZVFWFLSA-N 0 3 341.411 2.808 20 5 EFBDHN COCCN(CCOc1cccc([N+](=O)[O-])c1)[C@@H]1CCCSC1 ZINC000433193205 248026219 /nfs/dbraw/zinc/02/62/19/248026219.db2.gz JAIQHDWBPCSCKG-OAHLLOKOSA-N 0 3 340.445 2.818 20 5 EFBDHN C[C@H](N[C@@H](C)[C@@H]1CCOC1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000266299889 248233552 /nfs/dbraw/zinc/23/35/52/248233552.db2.gz MEIJUMYVBIZKQH-GMXVVIOVSA-N 0 3 332.360 2.720 20 5 EFBDHN CCN(C[C@H]1CCN(Cc2ccccc2)C1)c1c([N+](=O)[O-])ncn1C ZINC000266441026 248303069 /nfs/dbraw/zinc/30/30/69/248303069.db2.gz GSQYSZVNBBBSSD-INIZCTEOSA-N 0 3 343.431 2.677 20 5 EFBDHN Cc1ccc(CN(C)C[C@H](O)COCc2ccccc2)cc1[N+](=O)[O-] ZINC000092472215 218143041 /nfs/dbraw/zinc/14/30/41/218143041.db2.gz CKWXWTOZKQLSAT-SFHVURJKSA-N 0 3 344.411 2.913 20 5 EFBDHN Cc1ccc(CN(C)C[C@@H](O)COCc2ccccc2)cc1[N+](=O)[O-] ZINC000092472216 218143070 /nfs/dbraw/zinc/14/30/70/218143070.db2.gz CKWXWTOZKQLSAT-GOSISDBHSA-N 0 3 344.411 2.913 20 5 EFBDHN CC(C)c1ccc(CN2CCN(C[C@H]3CCOC3)CC2)cc1[N+](=O)[O-] ZINC000093817734 218252439 /nfs/dbraw/zinc/25/24/39/218252439.db2.gz BHMZBAWNGXLEHV-QGZVFWFLSA-N 0 3 347.459 2.872 20 5 EFBDHN CN(CCOCC1CC1)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000093818457 218252823 /nfs/dbraw/zinc/25/28/23/218252823.db2.gz KZNRORMTFSRTCM-UHFFFAOYSA-N 0 3 344.415 2.854 20 5 EFBDHN C[C@](CO)(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CCCCC1 ZINC000444637987 250321537 /nfs/dbraw/zinc/32/15/37/250321537.db2.gz JMVUKXAVXPPKAE-QGZVFWFLSA-N 0 3 332.404 2.892 20 5 EFBDHN COC(=O)[C@@H]1CCCC[C@@]1(C)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444668825 250325485 /nfs/dbraw/zinc/32/54/85/250325485.db2.gz ZREFKJHSYWDKFP-YVEFUNNKSA-N 0 3 346.387 2.683 20 5 EFBDHN Cc1c(Br)c(N(CCN(C)C)C(C)C)ncc1[N+](=O)[O-] ZINC000444825884 250354488 /nfs/dbraw/zinc/35/44/88/250354488.db2.gz DPDXXQLAMDAWCV-UHFFFAOYSA-N 0 3 345.241 2.837 20 5 EFBDHN Cc1cc(CN(C)C[C@@H](O)COc2cccc([N+](=O)[O-])c2)ccc1F ZINC000444739259 250337557 /nfs/dbraw/zinc/33/75/57/250337557.db2.gz VSDWXPONBQCAFT-MRXNPFEDSA-N 0 3 348.374 2.914 20 5 EFBDHN CCc1nn(C)c(NC[C@@H](c2ccco2)N(CC)CC)c1[N+](=O)[O-] ZINC000094151002 218266538 /nfs/dbraw/zinc/26/65/38/218266538.db2.gz CHLZACACDQXXHU-ZDUSSCGKSA-N 0 3 335.408 2.979 20 5 EFBDHN C[C@H](CNC(=O)CCc1cccc([N+](=O)[O-])c1)N1CCCC[C@H]1C ZINC000445822302 250428844 /nfs/dbraw/zinc/42/88/44/250428844.db2.gz QKDBGOAXSXZJGA-HUUCEWRRSA-N 0 3 333.432 2.907 20 5 EFBDHN CC(C)c1ccc(CN[C@@H]2CCCN(CCCO)C2)cc1[N+](=O)[O-] ZINC000449399125 251015512 /nfs/dbraw/zinc/01/55/12/251015512.db2.gz XRBDNZVZKSFWIE-MRXNPFEDSA-N 0 3 335.448 2.655 20 5 EFBDHN O=[N+]([O-])c1cc(CN2CCC[C@@H]2[C@H]2CCC[C@@H]2O)c2c(c1)COCO2 ZINC000449477935 251041369 /nfs/dbraw/zinc/04/13/69/251041369.db2.gz XLWKEVFMOQSBCZ-ZACQAIPSSA-N 0 3 348.399 2.587 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)CCN1Cc1ccccc1 ZINC000267459485 251076735 /nfs/dbraw/zinc/07/67/35/251076735.db2.gz RFGQTSWFDPPBLC-DZGCQCFKSA-N 0 3 342.399 2.706 20 5 EFBDHN C[C@@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)CCN1Cc1ccccc1 ZINC000267459486 251076855 /nfs/dbraw/zinc/07/68/55/251076855.db2.gz RFGQTSWFDPPBLC-HIFRSBDPSA-N 0 3 342.399 2.706 20 5 EFBDHN CCN1CCCC[C@H]1CNc1ccc([N+](=O)[O-])cc1N1CCOC1=O ZINC000267525666 251127442 /nfs/dbraw/zinc/12/74/42/251127442.db2.gz NXNHLOUTGOBIOW-AWEZNQCLSA-N 0 3 348.403 2.838 20 5 EFBDHN CC[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C(=O)NC ZINC000449782747 251153757 /nfs/dbraw/zinc/15/37/57/251153757.db2.gz YWOBTDXFXBHPBF-CQSZACIVSA-N 0 3 333.413 2.938 20 5 EFBDHN COC(=O)[C@H]1CN(Cc2ccccc2[N+](=O)[O-])C[C@@H]1c1ccccc1 ZINC000449755819 251143035 /nfs/dbraw/zinc/14/30/35/251143035.db2.gz PCODKBHPIURJIR-SJORKVTESA-N 0 3 340.379 2.983 20 5 EFBDHN CCN(CC)CCN(CCOC)c1ccc(C(C)=O)cc1[N+](=O)[O-] ZINC000267557668 251152078 /nfs/dbraw/zinc/15/20/78/251152078.db2.gz UHTGWVFROQIDNF-UHFFFAOYSA-N 0 3 337.420 2.592 20 5 EFBDHN Cc1nc(N[C@@H]2CCN([C@H](C)c3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000450273274 251323911 /nfs/dbraw/zinc/32/39/11/251323911.db2.gz GEEUHHFPKUUHDI-UKRRQHHQSA-N 0 3 327.388 2.941 20 5 EFBDHN Cc1nc(Nc2cccc3c2OCC[C@@H]3N(C)C)ncc1[N+](=O)[O-] ZINC000450491221 251397589 /nfs/dbraw/zinc/39/75/89/251397589.db2.gz OBFWSXZGKBQOEE-ZDUSSCGKSA-N 0 3 329.360 2.822 20 5 EFBDHN Cc1cccc(OC[C@H](O)CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000268853582 252300962 /nfs/dbraw/zinc/30/09/62/252300962.db2.gz QIBKITBDHMNJSG-WMLDXEAASA-N 0 3 330.384 2.994 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)c1 ZINC000164270042 533008355 /nfs/dbraw/zinc/00/83/55/533008355.db2.gz KNUZYVPYNTZQRQ-IUODEOHRSA-N 0 3 349.456 2.873 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2noc(N3CCN(C4CCCC4)CC3)n2)cc1 ZINC000362739775 285106928 /nfs/dbraw/zinc/10/69/28/285106928.db2.gz FDCSLLIQELXOTF-UHFFFAOYSA-N 0 3 343.387 2.709 20 5 EFBDHN COCCCN1CCC(Nc2ncc(Cl)cc2[N+](=O)[O-])CC1 ZINC000153681586 224141896 /nfs/dbraw/zinc/14/18/96/224141896.db2.gz RFLYQDFYXBVSPG-UHFFFAOYSA-N 0 3 328.800 2.556 20 5 EFBDHN CC(C)C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1Cl)N(C)C ZINC000112560661 220350779 /nfs/dbraw/zinc/35/07/79/220350779.db2.gz BGTBXSUBCKWEJD-LBPRGKRZSA-N 0 3 327.812 2.954 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CCC[C@@H]2C[C@H](O)c2ccc(F)cc2)n1 ZINC000134788849 285168000 /nfs/dbraw/zinc/16/80/00/285168000.db2.gz VANXIFHJSBPKJM-CVEARBPZSA-N 0 3 348.378 2.519 20 5 EFBDHN O=[N+]([O-])c1cnc(N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)s1 ZINC000425271863 285179552 /nfs/dbraw/zinc/17/95/52/285179552.db2.gz DQFUXLNLJTVZFD-UONOGXRCSA-N 0 3 330.413 2.762 20 5 EFBDHN COC(=O)COc1ccc(CN(C)C2CC(C)(C)C2)cc1[N+](=O)[O-] ZINC000459746918 255927740 /nfs/dbraw/zinc/92/77/40/255927740.db2.gz ZHFQWWFTJUQRST-UHFFFAOYSA-N 0 3 336.388 2.767 20 5 EFBDHN C[C@@H](CN1CCCCC1)NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000117754820 221086279 /nfs/dbraw/zinc/08/62/79/221086279.db2.gz ZOTKQWPPUNIJFL-LBPRGKRZSA-N 0 3 339.823 2.781 20 5 EFBDHN CCOC(=O)c1cc(NCCN2CCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000467745895 256012067 /nfs/dbraw/zinc/01/20/67/256012067.db2.gz GYSOZBBUQPTLMC-CYBMUJFWSA-N 0 3 335.404 2.915 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CNC[C@@H]1CN(CC(C)C)CCO1 ZINC000468650444 256017677 /nfs/dbraw/zinc/01/76/77/256017677.db2.gz HFHHBGKEWBBMSE-SCFJZMLDSA-N 0 3 347.459 2.945 20 5 EFBDHN COc1ccc(CCNCc2ccc(OC)c([N+](=O)[O-])c2)cc1OC ZINC000119397916 221311571 /nfs/dbraw/zinc/31/15/71/221311571.db2.gz YMTPFEKCYLJQGH-UHFFFAOYSA-N 0 3 346.383 2.953 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC[C@@H](n2ccnn2)C1 ZINC000425346700 533382604 /nfs/dbraw/zinc/38/26/04/533382604.db2.gz GIAMJWBTTCWNMF-OOXMNIKJSA-N 0 3 327.388 2.927 20 5 EFBDHN C[C@@H](NCCn1cc([N+](=O)[O-])cn1)c1ccc(Br)cc1 ZINC000178399678 533406783 /nfs/dbraw/zinc/40/67/83/533406783.db2.gz FCKKOXJVRNBMGG-SNVBAGLBSA-N 0 3 339.193 2.905 20 5 EFBDHN CC(=O)N1CCC(NCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000340473483 141803811 /nfs/dbraw/zinc/80/38/11/141803811.db2.gz RWSTZHOZUSULGZ-UHFFFAOYSA-N 0 3 343.383 2.955 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)CCN1C ZINC000343452120 142000471 /nfs/dbraw/zinc/00/04/71/142000471.db2.gz RCLQQNKREGUWGQ-DZGCQCFKSA-N 0 3 346.431 2.752 20 5 EFBDHN CO[C@@H]1[C@H](C)[C@H](N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1(C)C ZINC000344485847 142026171 /nfs/dbraw/zinc/02/61/71/142026171.db2.gz YEZJINXIYMJGRP-AVRGHOLYSA-N 0 3 349.431 2.879 20 5 EFBDHN Cn1ccc(CNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000344603360 142047257 /nfs/dbraw/zinc/04/72/57/142047257.db2.gz OVEWGYOPZHMSBQ-UHFFFAOYSA-N 0 3 325.372 2.624 20 5 EFBDHN CCCN(CCN1CCCC1)C(=O)c1ccc(NCC)c([N+](=O)[O-])c1 ZINC000344737965 142070534 /nfs/dbraw/zinc/07/05/34/142070534.db2.gz ARGIHVRASWWIDE-UHFFFAOYSA-N 0 3 348.447 2.975 20 5 EFBDHN CCCN(CCN(C)C)C(=O)c1ccc(SC)c([N+](=O)[O-])c1 ZINC000344887568 142092867 /nfs/dbraw/zinc/09/28/67/142092867.db2.gz TVUNSTZUSVORAO-UHFFFAOYSA-N 0 3 325.434 2.731 20 5 EFBDHN Cc1ccc(C(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000346135960 142152297 /nfs/dbraw/zinc/15/22/97/142152297.db2.gz LHRPWAKAVMLNLV-IVMMDQJWSA-N 0 3 331.416 2.706 20 5 EFBDHN Cc1ccc(C(=O)N2CCN([C@@H]3C[C@H]3C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000346135961 142152648 /nfs/dbraw/zinc/15/26/48/142152648.db2.gz LHRPWAKAVMLNLV-JGGQBBKZSA-N 0 3 331.416 2.706 20 5 EFBDHN Cc1cc(C(=O)N2CCN([C@@H]3C[C@H]3C)C[C@@H](C)C2)cc([N+](=O)[O-])c1 ZINC000346242187 142175137 /nfs/dbraw/zinc/17/51/37/142175137.db2.gz RTSLTGMXTNXODY-CKEIUWERSA-N 0 3 331.416 2.706 20 5 EFBDHN Cc1ccc(NCCCNC(=O)CN2[C@H](C)CC[C@H]2C)c([N+](=O)[O-])c1 ZINC000346400906 142199789 /nfs/dbraw/zinc/19/97/89/142199789.db2.gz YDSVMKRGGYCYOP-HUUCEWRRSA-N 0 3 348.447 2.694 20 5 EFBDHN CN(CCn1ccc([N+](=O)[O-])n1)[C@H]1C[C@H](Oc2ccccc2)C1(C)C ZINC000347484593 142224317 /nfs/dbraw/zinc/22/43/17/142224317.db2.gz WNXXWZVGWLFOBA-HOTGVXAUSA-N 0 3 344.415 2.969 20 5 EFBDHN CC1(C)CCCN(CCNC(=O)CCc2cccc([N+](=O)[O-])c2)C1 ZINC000347492400 142225859 /nfs/dbraw/zinc/22/58/59/142225859.db2.gz VFAIYIZNQNJURT-UHFFFAOYSA-N 0 3 333.432 2.766 20 5 EFBDHN C[C@H](NCCc1ccccc1[N+](=O)[O-])c1ccc(S(C)(=O)=O)cc1 ZINC000348074882 142317286 /nfs/dbraw/zinc/31/72/86/142317286.db2.gz LJRSRBXMMBRQNS-ZDUSSCGKSA-N 0 3 348.424 2.892 20 5 EFBDHN CCO[C@@H]1C[C@H](N(C)CCn2cc([N+](=O)[O-])cn2)C12CCCCC2 ZINC000350039517 142393728 /nfs/dbraw/zinc/39/37/28/142393728.db2.gz IDMSNYCSDGSMHP-JKSUJKDBSA-N 0 3 336.436 2.851 20 5 EFBDHN C[C@@H]1C[C@H](NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)CCN1C ZINC000341166983 145004622 /nfs/dbraw/zinc/00/46/22/145004622.db2.gz OEDYRMUFYHRYBM-GDBMZVCRSA-N 0 3 348.447 2.699 20 5 EFBDHN CC[C@H]1CCCCN1CCNC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000341171001 145005259 /nfs/dbraw/zinc/00/52/59/145005259.db2.gz SUDOHGRVMQGBPB-INIZCTEOSA-N 0 3 348.447 2.701 20 5 EFBDHN COc1ccc([C@H](C)NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC000341203263 145012018 /nfs/dbraw/zinc/01/20/18/145012018.db2.gz CBJPBHAFMAJVGR-XJKSGUPXSA-N 0 3 346.383 2.694 20 5 EFBDHN COC1CCN(C(C)(C)CNC(=O)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000341287412 145027015 /nfs/dbraw/zinc/02/70/15/145027015.db2.gz MEDGSDNHHALKPZ-UHFFFAOYSA-N 0 3 349.431 2.522 20 5 EFBDHN COC1CCN(C(C)(C)CNC(=O)c2cc(C)cc([N+](=O)[O-])c2)CC1 ZINC000341299001 145028576 /nfs/dbraw/zinc/02/85/76/145028576.db2.gz VOPSBUGOIIFHDI-UHFFFAOYSA-N 0 3 349.431 2.522 20 5 EFBDHN COc1cc(C[NH2+]CCc2ccc3c[nH]nc3c2)c([N+](=O)[O-])cc1[O-] ZINC000341385501 145043815 /nfs/dbraw/zinc/04/38/15/145043815.db2.gz OMGNWTRZEKHJHA-UHFFFAOYSA-N 0 3 342.355 2.518 20 5 EFBDHN O=[N+]([O-])c1ccc(S(=O)(=O)CCNCCC2CCCCC2)cc1 ZINC000342353831 145107259 /nfs/dbraw/zinc/10/72/59/145107259.db2.gz HKUOEXWEJISLAQ-UHFFFAOYSA-N 0 3 340.445 2.929 20 5 EFBDHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000342361681 145108883 /nfs/dbraw/zinc/10/88/83/145108883.db2.gz LRWJQUMSDWSMKB-WBMJQRKESA-N 0 3 346.431 2.612 20 5 EFBDHN C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)CSc1ccccc1[N+](=O)[O-] ZINC000342446526 145128041 /nfs/dbraw/zinc/12/80/41/145128041.db2.gz SCWPRQHWWWAAGI-ZIAGYGMSSA-N 0 3 349.456 2.772 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CNC1(c2ccc(F)cc2)CC1 ZINC000342745321 145183669 /nfs/dbraw/zinc/18/36/69/145183669.db2.gz ZHQGNFZMQRKXBA-OAHLLOKOSA-N 0 3 346.358 2.753 20 5 EFBDHN C[C@H](CN1CCC[C@H](C)C1)NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000342889751 145215832 /nfs/dbraw/zinc/21/58/32/145215832.db2.gz ZMEMNAVJDVGIEJ-QWHCGFSZSA-N 0 3 344.415 2.926 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN1CCC2(CCCC2)CC1 ZINC000343558105 145237608 /nfs/dbraw/zinc/23/76/08/145237608.db2.gz SHYPSNOWUJLZGV-HNNXBMFYSA-N 0 3 334.416 2.991 20 5 EFBDHN CCCN1CCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000343583292 145244877 /nfs/dbraw/zinc/24/48/77/145244877.db2.gz YHMPVMBIPSPYLZ-LBPRGKRZSA-N 0 3 325.796 2.852 20 5 EFBDHN CCN(CCN1CCCCCC1)c1ccc(C(=O)NC)cc1[N+](=O)[O-] ZINC000343792869 145295913 /nfs/dbraw/zinc/29/59/13/145295913.db2.gz SIRLHFUDBGXIRY-UHFFFAOYSA-N 0 3 348.447 2.657 20 5 EFBDHN Cc1occc1CN(C)CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000343902603 145320768 /nfs/dbraw/zinc/32/07/68/145320768.db2.gz CLMSWXMOHZEQSA-UHFFFAOYSA-N 0 3 345.355 2.926 20 5 EFBDHN C[C@@H](NCc1ccncc1OCCN(C)C)c1cccc([N+](=O)[O-])c1 ZINC000344010041 145344748 /nfs/dbraw/zinc/34/47/48/145344748.db2.gz ZYLQNUWWSVIQCT-CQSZACIVSA-N 0 3 344.415 2.781 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN(C)C1CCC(NC(C)=O)CC1 ZINC000344134785 145376657 /nfs/dbraw/zinc/37/66/57/145376657.db2.gz ZOVIAESZNZDJGO-UHFFFAOYSA-N 0 3 349.431 2.873 20 5 EFBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])N[C@@H]1CCCN(C)C1=O ZINC000349201479 146065754 /nfs/dbraw/zinc/06/57/54/146065754.db2.gz LANLXKBYJZENNW-QWHCGFSZSA-N 0 3 337.445 2.676 20 5 EFBDHN O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2NCc2ccc3c(c2)OCO3)n1 ZINC000351516435 146136353 /nfs/dbraw/zinc/13/63/53/146136353.db2.gz JRMJEGWOROYUCC-KBPBESRZSA-N 0 3 344.371 2.794 20 5 EFBDHN C[C@@H]1CC[C@@H](C)N1CC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000351614910 146159306 /nfs/dbraw/zinc/15/93/06/146159306.db2.gz KDNZNXXEAFUCIQ-VXGBXAGGSA-N 0 3 339.823 2.780 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2ccc(CNCCC3(O)CCOCC3)o2)c1 ZINC000353030661 146380356 /nfs/dbraw/zinc/38/03/56/146380356.db2.gz APBFZUPYCCUSMR-UHFFFAOYSA-N 0 3 346.383 2.876 20 5 EFBDHN CCOc1cc(N2CCN(CC[C@@H]3CCOC3)CC2)ccc1[N+](=O)[O-] ZINC000355527584 146986107 /nfs/dbraw/zinc/98/61/07/146986107.db2.gz IBUFQFZXZBPESB-OAHLLOKOSA-N 0 3 349.431 2.542 20 5 EFBDHN COC(=O)COc1ccc(CN2CCC[C@@H]3CCC[C@@H]32)cc1[N+](=O)[O-] ZINC000355599734 147008376 /nfs/dbraw/zinc/00/83/76/147008376.db2.gz NZZZSZLBTYDHOM-GJZGRUSLSA-N 0 3 348.399 2.911 20 5 EFBDHN COC(=O)COc1ccc(CN2CC[C@H](C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000355779267 147061404 /nfs/dbraw/zinc/06/14/04/147061404.db2.gz ZHEQXECWSDHUHY-STQMWFEESA-N 0 3 336.388 2.625 20 5 EFBDHN COc1c(C(=O)N(CCN(C)C)C2CCCC2)cccc1[N+](=O)[O-] ZINC000356093430 147145445 /nfs/dbraw/zinc/14/54/45/147145445.db2.gz KOWNIQUQEYLLFC-UHFFFAOYSA-N 0 3 335.404 2.550 20 5 EFBDHN C[C@@H](C(=O)N1CC[C@@]2(C1)CCCN(C)C2)c1ccc([N+](=O)[O-])cc1F ZINC000356295674 147204439 /nfs/dbraw/zinc/20/44/39/147204439.db2.gz UXAXNLNJYYYFHY-ACJLOTCBSA-N 0 3 349.406 2.782 20 5 EFBDHN COc1c(C(=O)N[C@H](C)CN2CCCCCC2)cccc1[N+](=O)[O-] ZINC000356813586 147343534 /nfs/dbraw/zinc/34/35/34/147343534.db2.gz GRHVFEHMFSNTFT-CYBMUJFWSA-N 0 3 335.404 2.598 20 5 EFBDHN O=C(CC(F)(F)F)N1CCC(NCc2ccccc2[N+](=O)[O-])CC1 ZINC000356885933 147362672 /nfs/dbraw/zinc/36/26/72/147362672.db2.gz XSOOPVCYUHPSRO-UHFFFAOYSA-N 0 3 345.321 2.628 20 5 EFBDHN COC1CCN(C(C)(C)CNC(=O)c2cccc(C)c2[N+](=O)[O-])CC1 ZINC000341307218 292169021 /nfs/dbraw/zinc/16/90/21/292169021.db2.gz GFTGJDBGAQJKRZ-UHFFFAOYSA-N 0 3 349.431 2.522 20 5 EFBDHN C[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C(=O)N(C)C ZINC000359812777 148195798 /nfs/dbraw/zinc/19/57/98/148195798.db2.gz XGJPJJKUBOVOIW-LLVKDONJSA-N 0 3 333.413 2.890 20 5 EFBDHN Cc1c(CNCc2cn(C)nc2-c2ccncc2)cccc1[N+](=O)[O-] ZINC000359809898 148195936 /nfs/dbraw/zinc/19/59/36/148195936.db2.gz UECSZIUFMPCNIA-UHFFFAOYSA-N 0 3 337.383 2.989 20 5 EFBDHN Cc1cc(N2CCN(C3CCOCC3)C[C@H]2C)c(F)cc1[N+](=O)[O-] ZINC000360046090 148259305 /nfs/dbraw/zinc/25/93/05/148259305.db2.gz FQLNODVZVSTCPM-CYBMUJFWSA-N 0 3 337.395 2.732 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)NCCN2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000175781080 292193484 /nfs/dbraw/zinc/19/34/84/292193484.db2.gz RHGNODVFZKOJRK-OAHLLOKOSA-N 0 3 348.447 2.995 20 5 EFBDHN CC(C)(C(=O)N1CC[C@H](N2CCCC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000364026452 149050517 /nfs/dbraw/zinc/05/05/17/149050517.db2.gz HAGIYJYZXQSSOQ-AWEZNQCLSA-N 0 3 349.406 2.708 20 5 EFBDHN Cc1cc(NC(=O)N2CCCC23CCN(C)CC3)ccc1[N+](=O)[O-] ZINC000364221547 149095917 /nfs/dbraw/zinc/09/59/17/149095917.db2.gz SMHVOEHJIFVJGX-UHFFFAOYSA-N 0 3 332.404 2.995 20 5 EFBDHN Cc1ccccc1OCCN1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000365122359 149322761 /nfs/dbraw/zinc/32/27/61/149322761.db2.gz KXNMPIKBHJMMNB-UHFFFAOYSA-N 0 3 330.388 2.816 20 5 EFBDHN O=C1Nc2ccccc2[C@]12CCN(Cc1ccc([N+](=O)[O-])c(F)c1)C2 ZINC000368484114 150129297 /nfs/dbraw/zinc/12/92/97/150129297.db2.gz RACMLUCIUQBOOY-GOSISDBHSA-N 0 3 341.342 2.830 20 5 EFBDHN CC1(C)CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H]1[C@H]1CCCO1 ZINC000368694365 150184575 /nfs/dbraw/zinc/18/45/75/150184575.db2.gz YSYWFIPHKCMXEC-WBVHZDCISA-N 0 3 347.415 2.813 20 5 EFBDHN CC(C)NC(=O)c1ccc(N2CC[C@@H]([C@@H]3CCOC3)C2)c([N+](=O)[O-])c1 ZINC000371005369 150710625 /nfs/dbraw/zinc/71/06/25/150710625.db2.gz OKIXHLYLBSZADQ-HUUCEWRRSA-N 0 3 347.415 2.596 20 5 EFBDHN COc1cc(C[NH2+]CC[C@@H]2C[C@@H](C)O[C@@H](C)C2)c([N+](=O)[O-])cc1[O-] ZINC000338477648 286221645 /nfs/dbraw/zinc/22/16/45/286221645.db2.gz OAJOSALDCYCCEC-CLLJXQQHSA-N 0 3 338.404 2.992 20 5 EFBDHN O=[N+]([O-])c1c(NC2CCN([C@@H]3CCOC3)CC2)ccc2ncccc21 ZINC000372858477 151071651 /nfs/dbraw/zinc/07/16/51/151071651.db2.gz RSVSRNAXAIXLEN-CQSZACIVSA-N 0 3 342.399 2.808 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCCC12CCN(C)CC2 ZINC000373448058 151172053 /nfs/dbraw/zinc/17/20/53/151172053.db2.gz MKIIXCGKPOGOQV-UHFFFAOYSA-N 0 3 348.403 2.696 20 5 EFBDHN Cn1cc(CN2CCCOC(C)(C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000378345567 152062957 /nfs/dbraw/zinc/06/29/57/152062957.db2.gz LSANFGUVOKBUTE-UHFFFAOYSA-N 0 3 344.415 2.996 20 5 EFBDHN C[C@@H](CN1CCCCC1)NC(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175467506 286833161 /nfs/dbraw/zinc/83/31/61/286833161.db2.gz DWMUHOZYVRJEIU-NSHDSACASA-N 0 3 325.796 2.852 20 5 EFBDHN C[C@]1(c2ccccc2)CCCN(CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000159826704 225285339 /nfs/dbraw/zinc/28/53/39/225285339.db2.gz UQAIFMQWMABVPE-IBGZPJMESA-N 0 3 341.411 2.810 20 5 EFBDHN C[C@H](CNC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)N(C)C1CC1 ZINC000185823529 265048648 /nfs/dbraw/zinc/04/86/48/265048648.db2.gz CRKJLHFSAIZRKA-SNVBAGLBSA-N 0 3 340.811 2.530 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@@H](CO)Cc1cccc(C)c1 ZINC000189011193 265167123 /nfs/dbraw/zinc/16/71/23/265167123.db2.gz ABHUESLMMVHVRH-QGZVFWFLSA-N 0 3 344.411 2.995 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@H](CO)Cc1cccc(C)c1 ZINC000189011168 265167474 /nfs/dbraw/zinc/16/74/74/265167474.db2.gz ABHUESLMMVHVRH-KRWDZBQOSA-N 0 3 344.411 2.995 20 5 EFBDHN COC(=O)[C@@](C)(CNCc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000191591514 265269807 /nfs/dbraw/zinc/26/98/07/265269807.db2.gz BXBGLLFFYVMZDA-INIZCTEOSA-N 0 3 334.397 2.877 20 5 EFBDHN C[C@H](CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-])N1CCC(C)CC1 ZINC000194473662 265371945 /nfs/dbraw/zinc/37/19/45/265371945.db2.gz AUAXOZSDWVDHNH-OAHLLOKOSA-N 0 3 348.447 2.857 20 5 EFBDHN C[C@@H](CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-])N1CCC(C)CC1 ZINC000194473643 265372599 /nfs/dbraw/zinc/37/25/99/265372599.db2.gz AUAXOZSDWVDHNH-HNNXBMFYSA-N 0 3 348.447 2.857 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)[C@@H](CN)c2ccccc2)cc1[N+](=O)[O-] ZINC000237655448 265461435 /nfs/dbraw/zinc/46/14/35/265461435.db2.gz RONSAWACUXLRDT-CJNGLKHVSA-N 0 3 327.384 2.823 20 5 EFBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])NCC1(C)OCCO1 ZINC000271479846 265987967 /nfs/dbraw/zinc/98/79/67/265987967.db2.gz JLYMKYVAAFWLAI-LBPRGKRZSA-N 0 3 326.418 2.818 20 5 EFBDHN COc1cc(CN[C@H]2CCO[C@H](C(C)C)C2)c([N+](=O)[O-])cc1OC ZINC000271535678 266003067 /nfs/dbraw/zinc/00/30/67/266003067.db2.gz OURYBBPPYSTCIT-ZFWWWQNUSA-N 0 3 338.404 2.905 20 5 EFBDHN COc1cc(C[NH2+][C@H]2CCO[C@H](CC(C)C)C2)c([N+](=O)[O-])cc1[O-] ZINC000272045922 266134556 /nfs/dbraw/zinc/13/45/56/266134556.db2.gz WXJWPWBQXDUEPX-UONOGXRCSA-N 0 3 338.404 2.992 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N2CC[C@H]3CCN(C)C[C@@H]32)cc1[N+](=O)[O-] ZINC000272416670 266258433 /nfs/dbraw/zinc/25/84/33/266258433.db2.gz AQJUZUUPLVDTPB-VBQJREDUSA-N 0 3 346.431 2.700 20 5 EFBDHN C[C@H](NC(=O)N1CCC[C@H]2CN(C)CC[C@@H]21)c1ccccc1[N+](=O)[O-] ZINC000272593850 266319253 /nfs/dbraw/zinc/31/92/53/266319253.db2.gz OGFPNEWHDJAZFV-DZKIICNBSA-N 0 3 346.431 2.782 20 5 EFBDHN COC(=O)C1=C(C)O[C@@H](CN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000272609274 266327109 /nfs/dbraw/zinc/32/71/09/266327109.db2.gz WMHCZTDUADXZCN-SMDDNHRTSA-N 0 3 334.372 2.790 20 5 EFBDHN C[C@H](NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1)C1=CCN(C)CC1 ZINC000272625248 266330621 /nfs/dbraw/zinc/33/06/21/266330621.db2.gz APBNCEUGRHAWHK-ZDUSSCGKSA-N 0 3 331.416 2.639 20 5 EFBDHN COc1ccc(NC(=O)[C@H]2CCCN2C2CCCC2)cc1[N+](=O)[O-] ZINC000272815549 266389753 /nfs/dbraw/zinc/38/97/53/266389753.db2.gz CHSFIATZWSRSNA-CQSZACIVSA-N 0 3 333.388 2.949 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@@H](C)C[S@@](C)=O ZINC000273257475 266474033 /nfs/dbraw/zinc/47/40/33/266474033.db2.gz MDBUJMTUOJWMPF-QLMNROTDSA-N 0 3 330.475 2.822 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@H](C)C[S@](C)=O ZINC000273257478 266474236 /nfs/dbraw/zinc/47/42/36/266474236.db2.gz MDBUJMTUOJWMPF-ZSMADZGOSA-N 0 3 330.475 2.822 20 5 EFBDHN C[C@@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cn2)CCN1Cc1ccccc1 ZINC000273959014 266586690 /nfs/dbraw/zinc/58/66/90/266586690.db2.gz NSSGUWISJHITMS-HIFRSBDPSA-N 0 3 327.388 2.850 20 5 EFBDHN C[C@@H](CO)N(Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CCCC1 ZINC000276418091 266984662 /nfs/dbraw/zinc/98/46/62/266984662.db2.gz HYMWOIZKFLSVDF-LBPRGKRZSA-N 0 3 336.388 2.587 20 5 EFBDHN CS[C@H]1CN(c2nc3ccccc3cc2[N+](=O)[O-])C[C@H]1N(C)C ZINC000276683650 267035538 /nfs/dbraw/zinc/03/55/38/267035538.db2.gz VGYIYNZFPOJHFC-CABCVRRESA-N 0 3 332.429 2.625 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@H]1CN1CCCCC1 ZINC000276977124 267090461 /nfs/dbraw/zinc/09/04/61/267090461.db2.gz AVUJINAAUSYWQR-HNNXBMFYSA-N 0 3 347.415 2.694 20 5 EFBDHN CCOc1cccc(NCCCN2CCCO[C@@H](C)C2)c1[N+](=O)[O-] ZINC000277640480 267220027 /nfs/dbraw/zinc/22/00/27/267220027.db2.gz NNYCSDCYQSOZIN-AWEZNQCLSA-N 0 3 337.420 2.906 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)N(CCN(C)C)c1ccccc1 ZINC000277677483 267231641 /nfs/dbraw/zinc/23/16/41/267231641.db2.gz YFAGAPIJZSDTTR-UHFFFAOYSA-N 0 3 343.383 2.812 20 5 EFBDHN C[C@H]1CN(CCCNc2c(F)cc([N+](=O)[O-])cc2F)CCCO1 ZINC000277966142 267309598 /nfs/dbraw/zinc/30/95/98/267309598.db2.gz JHWNIMYSSYRUFQ-NSHDSACASA-N 0 3 329.347 2.786 20 5 EFBDHN COCCN1CCC(Nc2cc(C(F)(F)F)ncc2[N+](=O)[O-])CC1 ZINC000278182479 267362759 /nfs/dbraw/zinc/36/27/59/267362759.db2.gz DEACQMRDDNRWBB-UHFFFAOYSA-N 0 3 348.325 2.531 20 5 EFBDHN Cc1cc(N2CC[S@@](=O)C[C@H](C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000278255116 267382398 /nfs/dbraw/zinc/38/23/98/267382398.db2.gz VBBMVBZYJIZTAN-QVQLBTGDSA-N 0 3 333.413 2.656 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)NCCN2CCCCC2)cc1[N+](=O)[O-] ZINC000175648490 273030117 /nfs/dbraw/zinc/03/01/17/273030117.db2.gz MTFVYOJTPZOLPW-CQSZACIVSA-N 0 3 334.420 2.749 20 5 EFBDHN Cc1cc(NCCN2CCCOCC2)c2cccc([N+](=O)[O-])c2n1 ZINC000188497525 273057215 /nfs/dbraw/zinc/05/72/15/273057215.db2.gz BIXLHVNDJSNJNJ-UHFFFAOYSA-N 0 3 330.388 2.586 20 5 EFBDHN C[C@H](NC(=O)N(C)[C@@H]1CCN(C)C[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000246164540 273074206 /nfs/dbraw/zinc/07/42/06/273074206.db2.gz FHDXWLSXEDIWIJ-HEHGZKQESA-N 0 3 334.420 2.637 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[C@@H]2CCN(C)C[C@@H]21 ZINC000274268705 273128642 /nfs/dbraw/zinc/12/86/42/273128642.db2.gz MEGDPUDSHFDLIF-BBRMVZONSA-N 0 3 332.404 2.770 20 5 EFBDHN CC(C)O[C@@H]1C[C@@H](NCC(=O)Nc2ccccc2[N+](=O)[O-])C1(C)C ZINC000274308307 273131580 /nfs/dbraw/zinc/13/15/80/273131580.db2.gz SSBZUCNVKAIXIV-HUUCEWRRSA-N 0 3 335.404 2.715 20 5 EFBDHN O=C(NC[C@H]1CCCCN1C1CC1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000277427202 273154395 /nfs/dbraw/zinc/15/43/95/273154395.db2.gz DJRZUSUZPLKFOW-CQSZACIVSA-N 0 3 342.399 2.823 20 5 EFBDHN C[C@H](CN1CCCC1=O)N[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000278989612 273163803 /nfs/dbraw/zinc/16/38/03/273163803.db2.gz DSRBRFWIRSNIEX-MLGOLLRUSA-N 0 3 331.416 2.918 20 5 EFBDHN Cc1nc2n(n1)C[C@H](N[C@H]1CC(C)(C)c3ccc([N+](=O)[O-])cc31)CC2 ZINC000279044397 273169943 /nfs/dbraw/zinc/16/99/43/273169943.db2.gz JPDFBJCVTBLJPF-WBMJQRKESA-N 0 3 341.415 2.822 20 5 EFBDHN COCCN1CC[C@@H](N[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000279079935 273174340 /nfs/dbraw/zinc/17/43/40/273174340.db2.gz MMMNNNDJBZFPKX-CXAGYDPISA-N 0 3 333.432 2.628 20 5 EFBDHN CC1(C)C[C@@H](N[C@@H]2CC(=O)N(C3CC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000279126094 273179501 /nfs/dbraw/zinc/17/95/01/273179501.db2.gz QPXKKKWPHSZZFB-BDJLRTHQSA-N 0 3 329.400 2.670 20 5 EFBDHN COc1ccc(OCCN2CCCC[C@@H]2C[C@H](C)O)c([N+](=O)[O-])c1 ZINC000279745589 273248771 /nfs/dbraw/zinc/24/87/71/273248771.db2.gz KXTDXXWWRKIKHT-UONOGXRCSA-N 0 3 338.404 2.608 20 5 EFBDHN CC(=O)N1CCC[C@@H](CNCc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000279922904 273269715 /nfs/dbraw/zinc/26/97/15/273269715.db2.gz XMNGFEBADVEVMH-LBPRGKRZSA-N 0 3 325.796 2.596 20 5 EFBDHN CCn1nc(C)c([N+](=O)[O-])c1N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000280054644 273285601 /nfs/dbraw/zinc/28/56/01/273285601.db2.gz NTCMENHNDAKTKS-OAHLLOKOSA-N 0 3 329.404 2.806 20 5 EFBDHN COC(=O)C[C@@H]1CC[C@@H](NCc2cc([N+](=O)[O-])ccc2OC)[C@@H]1C ZINC000280769879 273364827 /nfs/dbraw/zinc/36/48/27/273364827.db2.gz FBCCCJJDSHGGRT-TYNCELHUSA-N 0 3 336.388 2.671 20 5 EFBDHN CN(C)CC1(NC(=O)/C=C/c2ccc(Cl)c([N+](=O)[O-])c2)CCC1 ZINC000281078859 273398388 /nfs/dbraw/zinc/39/83/88/273398388.db2.gz NQVKMQLLEGRFGW-FNORWQNLSA-N 0 3 337.807 2.862 20 5 EFBDHN O=[N+]([O-])c1ccc(CCN2CC[C@H](OCc3ccncc3)C2)cc1 ZINC000281079975 273398542 /nfs/dbraw/zinc/39/85/42/273398542.db2.gz UKWAVZPITDFQHX-SFHVURJKSA-N 0 3 327.384 2.823 20 5 EFBDHN CSc1ccc([C@@H](C)NCCn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC000281413297 273432977 /nfs/dbraw/zinc/43/29/77/273432977.db2.gz OGHZEQWXJGSGTR-GFCCVEGCSA-N 0 3 333.413 2.829 20 5 EFBDHN CC(C)[C@H](C(=O)NCCc1ccc([N+](=O)[O-])cc1)N1CCCCC1 ZINC000354730133 273551702 /nfs/dbraw/zinc/55/17/02/273551702.db2.gz ZGNPSYQPTGQKEC-QGZVFWFLSA-N 0 3 333.432 2.764 20 5 EFBDHN CCOc1ccc([C@H](C)NCC2([S@@](C)=O)CC2)cc1[N+](=O)[O-] ZINC000282476950 273568383 /nfs/dbraw/zinc/56/83/83/273568383.db2.gz WRKKQIASHXKGPX-KPWVOAKYSA-N 0 3 326.418 2.555 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](CC(C)C)N(C)C)c1 ZINC000284085284 273795148 /nfs/dbraw/zinc/79/51/48/273795148.db2.gz SIYVBUAEABQLQE-CYBMUJFWSA-N 0 3 337.420 2.700 20 5 EFBDHN CN(C)[C@H]1Cc2ccccc2N(C(=O)Cc2ccccc2[N+](=O)[O-])C1 ZINC000067203669 273820065 /nfs/dbraw/zinc/82/00/65/273820065.db2.gz HFGZREVBJYFSQP-INIZCTEOSA-N 0 3 339.395 2.657 20 5 EFBDHN C[C@H](NC[C@@H]1COC2(CCCCC2)O1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000285054153 273933569 /nfs/dbraw/zinc/93/35/69/273933569.db2.gz IOICPUPBQJLQJC-GXTWGEPZSA-N 0 3 335.404 2.903 20 5 EFBDHN C[C@@H](NC[C@@](C)(O)c1ccc(F)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000285078981 273938244 /nfs/dbraw/zinc/93/82/44/273938244.db2.gz JMAJBWLIJRSYKE-PIGZYNQJSA-N 0 3 333.363 2.874 20 5 EFBDHN Cc1cccc(C[C@@H](CO)N[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000285324095 273979701 /nfs/dbraw/zinc/97/97/01/273979701.db2.gz TZSGTMOSNJHMSH-CJNGLKHVSA-N 0 3 329.400 2.740 20 5 EFBDHN CCC[C@@]1(NCC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CCOC1 ZINC000285435371 273999073 /nfs/dbraw/zinc/99/90/73/273999073.db2.gz FKHWNELMNRHIJU-OAHLLOKOSA-N 0 3 341.795 2.736 20 5 EFBDHN CCS[C@@H]1CCC[C@@H]1NCC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000286193427 274151152 /nfs/dbraw/zinc/15/11/52/274151152.db2.gz PSUUYOGNODAYRQ-GOEBONIOSA-N 0 3 349.456 2.748 20 5 EFBDHN COc1ccccc1CN(CCO)CCc1ccc([N+](=O)[O-])cc1 ZINC000103143852 274157360 /nfs/dbraw/zinc/15/73/60/274157360.db2.gz IYOIEGDWHGMAPU-UHFFFAOYSA-N 0 3 330.384 2.640 20 5 EFBDHN CCCN(CCN1CCCC1)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000287026914 274325015 /nfs/dbraw/zinc/32/50/15/274325015.db2.gz DTYGESPDSHOCRZ-UHFFFAOYSA-N 0 3 348.447 2.655 20 5 EFBDHN C[C@@H]1CN(C)CC[C@@H]1N(C)c1ncc([N+](=O)[O-])cc1Br ZINC000268162498 274334884 /nfs/dbraw/zinc/33/48/84/274334884.db2.gz OUWKYCCWVAKXPE-SKDRFNHKSA-N 0 3 343.225 2.529 20 5 EFBDHN CS[C@@H]1CN(c2c(F)cccc2[N+](=O)[O-])C[C@@H]1N1CCCC1 ZINC000287107549 274344469 /nfs/dbraw/zinc/34/44/69/274344469.db2.gz ZLOBGVCQSWODIC-UONOGXRCSA-N 0 3 325.409 2.750 20 5 EFBDHN C[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CCN1C ZINC000341286067 274388560 /nfs/dbraw/zinc/38/85/60/274388560.db2.gz PYIDGYURCKGHFT-HIFRSBDPSA-N 0 3 326.400 2.973 20 5 EFBDHN COc1ccc(CN[C@@H]2CCO[C@H](C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000287826265 274491635 /nfs/dbraw/zinc/49/16/35/274491635.db2.gz VKZHIVWXNSAPMJ-MFKMUULPSA-N 0 3 334.294 2.803 20 5 EFBDHN C[C@@H]1[C@H](N2CCCC2)CCN1C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000288108726 274528807 /nfs/dbraw/zinc/52/88/07/274528807.db2.gz IOZMGSHBKZIRHR-IAQYHMDHSA-N 0 3 337.807 2.947 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](N3CCCC3)C[C@@H]2C)c1 ZINC000288264792 274559853 /nfs/dbraw/zinc/55/98/53/274559853.db2.gz GQROWFNNBQNNEX-UONOGXRCSA-N 0 3 347.415 2.692 20 5 EFBDHN C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000288389060 274583003 /nfs/dbraw/zinc/58/30/03/274583003.db2.gz MDJVOWQJZOFACH-WCQYABFASA-N 0 3 337.807 2.947 20 5 EFBDHN C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000288564639 274619160 /nfs/dbraw/zinc/61/91/60/274619160.db2.gz WKTIYMYXCIBRBI-VXGBXAGGSA-N 0 3 337.807 2.947 20 5 EFBDHN C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000289695579 274805429 /nfs/dbraw/zinc/80/54/29/274805429.db2.gz NNKVYICOZUMZIS-WDEREUQCSA-N 0 3 339.342 2.572 20 5 EFBDHN O=C(NCCN1CCCCC1)Nc1cccc([N+](=O)[O-])c1Cl ZINC000289716415 274809179 /nfs/dbraw/zinc/80/91/79/274809179.db2.gz PDYDPHQFWPFVDD-UHFFFAOYSA-N 0 3 326.784 2.856 20 5 EFBDHN O=C1C[C@]2(CCN(Cc3cc(=O)oc4ccc5ccccc5c34)C2)CN1 ZINC000278888584 275021284 /nfs/dbraw/zinc/02/12/84/275021284.db2.gz NZJIDMDQANSTNQ-OAQYLSRUSA-N 0 3 348.402 2.658 20 5 EFBDHN CCS(=O)(=O)CCCN[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000414332411 276387528 /nfs/dbraw/zinc/38/75/28/276387528.db2.gz DRZOIJUISCCNAZ-OAHLLOKOSA-N 0 3 340.445 2.732 20 5 EFBDHN CN(C)C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])s2)c2ccccc2O1 ZINC000371212239 276798455 /nfs/dbraw/zinc/79/84/55/276798455.db2.gz IHOGQYHJUVHSKM-LLVKDONJSA-N 0 3 347.396 2.626 20 5 EFBDHN CN(C)[C@@H]1Cc2ccccc2N(C(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000067205877 276846848 /nfs/dbraw/zinc/84/68/48/276846848.db2.gz XXUZFABRYIGZEM-GFCCVEGCSA-N 0 3 331.397 2.789 20 5 EFBDHN CNC(=O)[C@@H]1CCC[C@@H]1N[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433281431 277243555 /nfs/dbraw/zinc/24/35/55/277243555.db2.gz JECWGOYSLXSMST-KCXAZCMYSA-N 0 3 331.416 2.822 20 5 EFBDHN C[C@@H](C(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1)N1CCCCCC1 ZINC000359630455 278194699 /nfs/dbraw/zinc/19/46/99/278194699.db2.gz FNRNENXBHSNKRH-AWEZNQCLSA-N 0 3 347.415 2.580 20 5 EFBDHN C[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)[C@H](c1ccccc1)N(C)C ZINC000187222268 278322529 /nfs/dbraw/zinc/32/25/29/278322529.db2.gz DZSUFKHDJRWQMB-AUUYWEPGSA-N 0 3 341.411 2.945 20 5 EFBDHN C[C@H]1C[C@H](N2CCCC2)CN1C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000370636273 278492499 /nfs/dbraw/zinc/49/24/99/278492499.db2.gz SJHAMXRBVKHXDC-AAEUAGOBSA-N 0 3 337.807 2.947 20 5 EFBDHN C[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000182073399 279283690 /nfs/dbraw/zinc/28/36/90/279283690.db2.gz IEEZIVSMBVWBGM-CYBMUJFWSA-N 0 3 345.374 2.984 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N[C@H](C)C(=O)N1CCCC[C@@H]1C ZINC000449112430 279382528 /nfs/dbraw/zinc/38/25/28/279382528.db2.gz CIIJBTVFOGSZAX-QLFBSQMISA-N 0 3 333.432 2.905 20 5 EFBDHN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CC[C@@H](N2CCCCC2)C1 ZINC000264616087 280184073 /nfs/dbraw/zinc/18/40/73/280184073.db2.gz QRPUNWHRXRJXHG-CYBMUJFWSA-N 0 3 337.807 2.949 20 5 EFBDHN CC[C@@H](c1ccccc1OC)N(C)CCn1cc([N+](=O)[O-])ccc1=O ZINC000347556464 280219501 /nfs/dbraw/zinc/21/95/01/280219501.db2.gz IDTCHTKDRDDQJY-INIZCTEOSA-N 0 3 345.399 2.848 20 5 EFBDHN CC[C@H](O)[C@@H]1CCCCN1CCOc1ccc(OC)cc1[N+](=O)[O-] ZINC000173778686 281003722 /nfs/dbraw/zinc/00/37/22/281003722.db2.gz YQLLWGQLCFSILZ-HOCLYGCPSA-N 0 3 338.404 2.608 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)n1 ZINC000268817244 281009649 /nfs/dbraw/zinc/00/96/49/281009649.db2.gz NZABXNQBYNBTNT-GJZGRUSLSA-N 0 3 348.447 2.624 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)CN1CCCCC1 ZINC000075942958 292748812 /nfs/dbraw/zinc/74/88/12/292748812.db2.gz NAUGKLCZIHEFDG-GFCCVEGCSA-N 0 3 336.392 2.599 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)N(CCN(C)C)C2CCCC2)c1 ZINC000081551920 292817062 /nfs/dbraw/zinc/81/70/62/292817062.db2.gz DKMJUAPNJKLNIQ-UHFFFAOYSA-N 0 3 335.404 2.550 20 5 EFBDHN CN(C)CCN(C(=O)NCCc1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC000119817358 292915560 /nfs/dbraw/zinc/91/55/60/292915560.db2.gz BWVFAIAPIUUQDS-UHFFFAOYSA-N 0 3 348.447 2.653 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1cccc(OCC(N)=O)c1 ZINC000128854842 293117391 /nfs/dbraw/zinc/11/73/91/293117391.db2.gz GNZTUZKNIKJDKL-CYBMUJFWSA-N 0 3 343.383 2.618 20 5 EFBDHN CCN(CCNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C1CC1 ZINC000129055157 293122870 /nfs/dbraw/zinc/12/28/70/293122870.db2.gz PEAAVMXJHJPXCZ-UHFFFAOYSA-N 0 3 345.321 2.828 20 5 EFBDHN CN(C)Cc1cccc(CNC(=O)c2ccc(F)cc2[N+](=O)[O-])c1 ZINC000132597079 293231417 /nfs/dbraw/zinc/23/14/17/293231417.db2.gz BWEMAHDXQLYUQV-UHFFFAOYSA-N 0 3 331.347 2.726 20 5 EFBDHN CCOc1ccc([C@@H](C)NCCOC[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000153812124 293394733 /nfs/dbraw/zinc/39/47/33/293394733.db2.gz XFTLMROWVFFUBW-HIFRSBDPSA-N 0 3 338.404 2.840 20 5 EFBDHN CN(C)C[C@H](NC(=O)c1csc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000290427277 294084335 /nfs/dbraw/zinc/08/43/35/294084335.db2.gz JXQQGQHTJJLKBO-ZDUSSCGKSA-N 0 3 337.376 2.828 20 5 EFBDHN COCCN(C)CCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000290797164 294188091 /nfs/dbraw/zinc/18/80/91/294188091.db2.gz DUCRYGJOIXJPRN-UHFFFAOYSA-N 0 3 336.219 2.569 20 5 EFBDHN COCCN1CC[C@H](NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000290884783 294211830 /nfs/dbraw/zinc/21/18/30/294211830.db2.gz MINRZBSIVDFJKD-LBPRGKRZSA-N 0 3 348.230 2.712 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CNCC1(COC)CCOCC1 ZINC000291666187 294447653 /nfs/dbraw/zinc/44/76/53/294447653.db2.gz FRIAEFVCAMNFCU-UHFFFAOYSA-N 0 3 338.404 2.526 20 5 EFBDHN CC[C@H](NC[C@@H](O)COCC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000292813026 294793159 /nfs/dbraw/zinc/79/31/59/294793159.db2.gz CLOOUYQHZLMMGA-OLZOCXBDSA-N 0 3 336.310 2.575 20 5 EFBDHN Cc1cc(C(=O)N2CCN(C3CCC3)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000293580238 295004095 /nfs/dbraw/zinc/00/40/95/295004095.db2.gz BADGBORQOQXQCL-ZDUSSCGKSA-N 0 3 331.416 2.850 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)N2CCN(C3CCC3)C[C@H](C)C2)c1 ZINC000293669635 295024258 /nfs/dbraw/zinc/02/42/58/295024258.db2.gz KDIJGZBFBAEKAN-ZDUSSCGKSA-N 0 3 347.415 2.550 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)N2CCN(C3CCC3)C[C@@H](C)C2)c1 ZINC000293669634 295024476 /nfs/dbraw/zinc/02/44/76/295024476.db2.gz KDIJGZBFBAEKAN-CYBMUJFWSA-N 0 3 347.415 2.550 20 5 EFBDHN C[C@H](NC[C@]1(CO)C[C@H]1c1ccccc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294016158 295098380 /nfs/dbraw/zinc/09/83/80/295098380.db2.gz DNUIYTRUNQZZPE-AXHNFQJDSA-N 0 3 341.411 2.994 20 5 EFBDHN C[C@H](N[C@@H]1CCC(=O)N[C@H]1C(C)(C)C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294045186 295102699 /nfs/dbraw/zinc/10/26/99/295102699.db2.gz GIFYKZJOSIWMAS-OWRWGESLSA-N 0 3 334.420 2.521 20 5 EFBDHN CC(C)(NC(=O)C1CCN(C2CC2)CC1)c1ccccc1[N+](=O)[O-] ZINC000294119310 295114079 /nfs/dbraw/zinc/11/40/79/295114079.db2.gz NXTTYUCAGIAUNU-UHFFFAOYSA-N 0 3 331.416 2.821 20 5 EFBDHN CN1CCC[C@@]2(CCN(C(=O)c3ccc(Cl)cc3[N+](=O)[O-])C2)C1 ZINC000294160487 295120623 /nfs/dbraw/zinc/12/06/23/295120623.db2.gz NYCAMXWJNYAIJM-MRXNPFEDSA-N 0 3 337.807 2.806 20 5 EFBDHN CN1CCC[C@@]2(CCN(C(=O)c3cc(Cl)ccc3[N+](=O)[O-])C2)C1 ZINC000294177726 295123040 /nfs/dbraw/zinc/12/30/40/295123040.db2.gz OVCROWXKHRCRQK-MRXNPFEDSA-N 0 3 337.807 2.806 20 5 EFBDHN CC(C)(CCC(=O)NCC(C)(C)N1CCc2ccccc2C1)[N+](=O)[O-] ZINC000294244593 295134252 /nfs/dbraw/zinc/13/42/52/295134252.db2.gz FPFPNIYVMHMPTB-UHFFFAOYSA-N 0 3 347.459 2.775 20 5 EFBDHN CN1CCC[C@]2(CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000294324615 295147764 /nfs/dbraw/zinc/14/77/64/295147764.db2.gz XEIKCOPDEYEYAA-MOTZXUDYSA-N 0 3 329.400 2.552 20 5 EFBDHN CN1CCC[C@@]2(CCN(C(=O)c3cccc(Cl)c3[N+](=O)[O-])C2)C1 ZINC000294332633 295148793 /nfs/dbraw/zinc/14/87/93/295148793.db2.gz XQAFVPZZBZZTOS-MRXNPFEDSA-N 0 3 337.807 2.806 20 5 EFBDHN CC(C)(CCC(=O)N1CCCN(Cc2ccccc2)CC1)[N+](=O)[O-] ZINC000294359028 295153421 /nfs/dbraw/zinc/15/34/21/295153421.db2.gz JOGJFLMKUKGAEN-UHFFFAOYSA-N 0 3 333.432 2.556 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@]3(C2)CCCN(C)C3)c1 ZINC000294363943 295154328 /nfs/dbraw/zinc/15/43/28/295154328.db2.gz ZBKHERXLBYSZDZ-KRWDZBQOSA-N 0 3 349.456 2.875 20 5 EFBDHN C[C@H](CNC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N(C)C1CC1 ZINC000294513097 295178645 /nfs/dbraw/zinc/17/86/45/295178645.db2.gz HPQJICMCQAGAJB-SECBINFHSA-N 0 3 345.321 2.826 20 5 EFBDHN CC[C@H](C)[C@H](CNCc1cc(OC)c(OC)cc1[N+](=O)[O-])OC ZINC000294764286 295222998 /nfs/dbraw/zinc/22/29/98/295222998.db2.gz JJFPQOALHFPEPB-ZBEGNZNMSA-N 0 3 326.393 2.763 20 5 EFBDHN CCN(CC)[C@@H]1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000294792863 295228458 /nfs/dbraw/zinc/22/84/58/295228458.db2.gz BMIUDUIARORULF-MRXNPFEDSA-N 0 3 347.415 2.500 20 5 EFBDHN C[C@@H]1CC[C@H](C)[C@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000294928951 295247138 /nfs/dbraw/zinc/24/71/38/295247138.db2.gz BYJXVYCWDZCVKA-DVOMOZLQSA-N 0 3 340.445 2.783 20 5 EFBDHN Cc1cc(Cl)c(C(=O)N(C)CCN(C)C2CC2)cc1[N+](=O)[O-] ZINC000294962023 295251499 /nfs/dbraw/zinc/25/14/99/295251499.db2.gz KDMNCOHENCBFIY-UHFFFAOYSA-N 0 3 325.796 2.723 20 5 EFBDHN C[C@H](c1ccncc1)N1CCC(NC(=O)CCC(C)(C)[N+](=O)[O-])CC1 ZINC000295007337 295257189 /nfs/dbraw/zinc/25/71/89/295257189.db2.gz BFEKRVMEGQCYFF-CQSZACIVSA-N 0 3 348.447 2.559 20 5 EFBDHN Cc1cc(Cl)c(C(=O)N[C@H]2C[C@@H](C)N(C3CC3)C2)cc1[N+](=O)[O-] ZINC000295055948 295262494 /nfs/dbraw/zinc/26/24/94/295262494.db2.gz GXEVNNVSRFVAHK-MNOVXSKESA-N 0 3 337.807 2.912 20 5 EFBDHN O=C(CCN1CCC(CF)CC1)Nc1cc([N+](=O)[O-])ccc1F ZINC000295095444 295267391 /nfs/dbraw/zinc/26/73/91/295267391.db2.gz GKFIUFAGAGFPTJ-UHFFFAOYSA-N 0 3 327.331 2.744 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)CCC(C)(C)[N+](=O)[O-])CN1Cc1ccccc1 ZINC000295121768 295270739 /nfs/dbraw/zinc/27/07/39/295270739.db2.gz MKZFNYVNOQSRTG-HOCLYGCPSA-N 0 3 333.432 2.601 20 5 EFBDHN C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)CCC(C)(C)[N+](=O)[O-] ZINC000295124852 295271194 /nfs/dbraw/zinc/27/11/94/295271194.db2.gz HLIPLWKORXNSKP-RDJZCZTQSA-N 0 3 347.459 2.849 20 5 EFBDHN CCc1ccc(C(=O)N2CCN(C3CC3)C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000295290864 295294645 /nfs/dbraw/zinc/29/46/45/295294645.db2.gz IPWKPZZDKTVBPD-CYBMUJFWSA-N 0 3 331.416 2.714 20 5 EFBDHN C[C@@H]1CN(C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CCN(C2CC2)C1 ZINC000295330130 295301676 /nfs/dbraw/zinc/30/16/76/295301676.db2.gz LUAQBLSGVSDGQO-LBPRGKRZSA-N 0 3 342.399 2.632 20 5 EFBDHN Cc1cc(Cl)c(C(=O)N(CCN(C)C)C(C)C)cc1[N+](=O)[O-] ZINC000295453193 295323330 /nfs/dbraw/zinc/32/33/30/295323330.db2.gz NVTWXXUWQRXMKS-UHFFFAOYSA-N 0 3 327.812 2.969 20 5 EFBDHN CC(C)C[C@@H](CN1CCCC1)NC(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000295617900 295350145 /nfs/dbraw/zinc/35/01/45/295350145.db2.gz YKQYTPPOOQVCEY-AWEZNQCLSA-N 0 3 337.395 2.974 20 5 EFBDHN Cc1cc(Cl)c(C(=O)N(C)[C@@H]2CCN(C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000295756054 295371396 /nfs/dbraw/zinc/37/13/96/295371396.db2.gz HJGPMKVLDLDGKF-SMDDNHRTSA-N 0 3 339.823 2.969 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)CCC(C)(C)[N+](=O)[O-] ZINC000295862756 295388017 /nfs/dbraw/zinc/38/80/17/295388017.db2.gz OMMPGDPASFQXJP-MRXNPFEDSA-N 0 3 347.459 2.945 20 5 EFBDHN C[C@H](N[C@H]1CCC[C@H](S(C)(=O)=O)C1)c1ccc([N+](=O)[O-])cc1 ZINC000295975993 295405676 /nfs/dbraw/zinc/40/56/76/295405676.db2.gz JAOMUNXUVIOPJM-WHOFXGATSA-N 0 3 326.418 2.601 20 5 EFBDHN C[C@@H]1C[C@@H](c2cccc(F)c2)N(CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000090550817 297293699 /nfs/dbraw/zinc/29/36/99/297293699.db2.gz DZVIKGWUYNTIDO-DYVFJYSZSA-N 0 3 345.374 2.979 20 5 EFBDHN C[C@H](CN1CCCCC1)NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000134593986 310644131 /nfs/dbraw/zinc/64/41/31/310644131.db2.gz MLACHVJLUWSOCW-LLVKDONJSA-N 0 3 325.796 2.852 20 5 EFBDHN CCN(CC)[C@H](CNC(=O)c1ccc([N+](=O)[O-])[nH]1)c1ccsc1 ZINC000298914395 311034225 /nfs/dbraw/zinc/03/42/25/311034225.db2.gz FNPMWRJDUCYLKE-CYBMUJFWSA-N 0 3 336.417 2.797 20 5 EFBDHN C[C@@H](NC(=O)NCCN1CCC(C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000299007331 311041426 /nfs/dbraw/zinc/04/14/26/311041426.db2.gz KUFRGEBVEJVFHV-CQSZACIVSA-N 0 3 334.420 2.687 20 5 EFBDHN Cc1ccc([C@H](CNC(=O)c2ccc(N)c([N+](=O)[O-])c2)N(C)C)cc1 ZINC000299311031 311071474 /nfs/dbraw/zinc/07/14/74/311071474.db2.gz BSPTVBVIKMMGHO-KRWDZBQOSA-N 0 3 342.399 2.518 20 5 EFBDHN COc1ccc(CNC(=O)c2ccc(CN(C)C)cc2)cc1[N+](=O)[O-] ZINC000299672670 311109492 /nfs/dbraw/zinc/10/94/92/311109492.db2.gz POTBXFVRHHNEIM-UHFFFAOYSA-N 0 3 343.383 2.595 20 5 EFBDHN C[C@H](CN1CCCCC1)Nc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000301093088 311118370 /nfs/dbraw/zinc/11/83/70/311118370.db2.gz LVGDLQGDPJCHOJ-LLVKDONJSA-N 0 3 331.376 2.530 20 5 EFBDHN CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H](c1ccccc1)N(C)C ZINC000301129581 311120601 /nfs/dbraw/zinc/12/06/01/311120601.db2.gz ZHRNMXPCVHCPDO-KRWDZBQOSA-N 0 3 342.399 2.669 20 5 EFBDHN CN(CCNc1nc2sccn2c1[N+](=O)[O-])Cc1ccc(F)cc1 ZINC000301521475 311142385 /nfs/dbraw/zinc/14/23/85/311142385.db2.gz GZEKXATTYVFEKJ-UHFFFAOYSA-N 0 3 349.391 2.987 20 5 EFBDHN CCN1CCCC[C@@H]1CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000301573839 311145481 /nfs/dbraw/zinc/14/54/81/311145481.db2.gz ZBNYJXNDQVFQAY-OAHLLOKOSA-N 0 3 346.431 2.773 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(NC[C@H](O)CN2CCc3ccccc3C2)c1 ZINC000301575012 311145650 /nfs/dbraw/zinc/14/56/50/311145650.db2.gz QCQINDIWTYPHGK-KRWDZBQOSA-N 0 3 341.411 2.734 20 5 EFBDHN O=[N+]([O-])c1ccccc1N[C@@H]1CN(Cc2ccccc2)CC[C@H]1CO ZINC000301742463 311155864 /nfs/dbraw/zinc/15/58/64/311155864.db2.gz YSMVNUFAEQSZSD-FUHWJXTLSA-N 0 3 341.411 2.890 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@H]2CN(Cc3ccccc3)CC[C@@H]2CO)cc1 ZINC000302007326 311171537 /nfs/dbraw/zinc/17/15/37/311171537.db2.gz WJVYHJJVXSTMPS-APWZRJJASA-N 0 3 341.411 2.890 20 5 EFBDHN CN(C[C@@H]1CCCN(C)C1)c1ccc([N+](=O)[O-])cc1OC(F)F ZINC000302138184 311179734 /nfs/dbraw/zinc/17/97/34/311179734.db2.gz CFLUEYVCGADTOT-LLVKDONJSA-N 0 3 329.347 2.974 20 5 EFBDHN CCOCCN1CCN(c2cc(C)nc3ccc([N+](=O)[O-])cc32)CC1 ZINC000302137466 311179805 /nfs/dbraw/zinc/17/98/05/311179805.db2.gz DNXQHVHPBCCBGJ-UHFFFAOYSA-N 0 3 344.415 2.610 20 5 EFBDHN CC(C)[C@@H](CNc1ncc([N+](=O)[O-])cn1)N1CCc2ccccc2C1 ZINC000302151349 311180877 /nfs/dbraw/zinc/18/08/77/311180877.db2.gz KPLUENMMTSVTOV-QGZVFWFLSA-N 0 3 341.415 2.880 20 5 EFBDHN Cc1cc(N[C@H](C)[C@@H](C)N2CCOCC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302212665 311184938 /nfs/dbraw/zinc/18/49/38/311184938.db2.gz YYDQZYBDNUARCZ-ZIAGYGMSSA-N 0 3 344.415 2.973 20 5 EFBDHN CCC[C@H]1CN(c2ncc([N+](=O)[O-])cn2)CCN1Cc1ccccc1 ZINC000302232951 311186495 /nfs/dbraw/zinc/18/64/95/311186495.db2.gz STFKHGZGWQLQPN-INIZCTEOSA-N 0 3 341.415 2.876 20 5 EFBDHN CCOc1cccc(N2CCN(c3ccncc3)CC2)c1[N+](=O)[O-] ZINC000302236475 311186842 /nfs/dbraw/zinc/18/68/42/311186842.db2.gz VQRJMMLGDWWMJV-UHFFFAOYSA-N 0 3 328.372 2.715 20 5 EFBDHN Cc1c(CNC[C@@H](O)COc2ccccc2F)cccc1[N+](=O)[O-] ZINC000326467541 311244245 /nfs/dbraw/zinc/24/42/45/311244245.db2.gz SAIUCOQNMCBNJB-CQSZACIVSA-N 0 3 334.347 2.572 20 5 EFBDHN CCN1C[C@@H](C)N(CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C[C@H]1C ZINC000330559382 311321962 /nfs/dbraw/zinc/32/19/62/311321962.db2.gz IGCDXVODJZSDHL-HUUCEWRRSA-N 0 3 348.447 2.646 20 5 EFBDHN CCOc1ccc(C(=O)N2CC[C@@H](N3CCCCC3)C2)cc1[N+](=O)[O-] ZINC000330649023 311326916 /nfs/dbraw/zinc/32/69/16/311326916.db2.gz OCGUGKOZBULEFP-OAHLLOKOSA-N 0 3 347.415 2.694 20 5 EFBDHN CCN1C[C@H](C)N(CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)[C@@H](C)C1 ZINC000330855654 311338864 /nfs/dbraw/zinc/33/88/64/311338864.db2.gz SCGFAXJCGVKGRC-GJZGRUSLSA-N 0 3 348.447 2.646 20 5 EFBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H](c2ccnc(N)n2)C1 ZINC000331495640 311383128 /nfs/dbraw/zinc/38/31/28/311383128.db2.gz GSJWFBPMPXFYND-QWHCGFSZSA-N 0 3 327.388 2.738 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1C[C@H](N2CCCC2)C[C@H]1C ZINC000332083669 311452496 /nfs/dbraw/zinc/45/24/96/311452496.db2.gz PBAZGGIMQLZDIG-HUUCEWRRSA-N 0 3 331.416 2.910 20 5 EFBDHN CC(C)N1C[C@H](N[C@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1=O ZINC000417304160 312206101 /nfs/dbraw/zinc/20/61/01/312206101.db2.gz BMNSDUYNAWMRLC-PBHICJAKSA-N 0 3 331.416 2.961 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](NC[C@@H]1CN(C3CC3)CCO1)CCCC2 ZINC000417311209 312207443 /nfs/dbraw/zinc/20/74/43/312207443.db2.gz OAELQKGCHJFLKY-MJGOQNOKSA-N 0 3 345.443 2.815 20 5 EFBDHN CC(C)COC[C@@H](O)CN[C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417335803 312210744 /nfs/dbraw/zinc/21/07/44/312210744.db2.gz GSIJSWLCDBEXKM-FUHWJXTLSA-N 0 3 336.432 2.985 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](NC[C@@H](O)COCC1CC1)CCCC2 ZINC000417345119 312211863 /nfs/dbraw/zinc/21/18/63/312211863.db2.gz TVFFPPRLGBRDLV-SJLPKXTDSA-N 0 3 334.416 2.739 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@@H]2CCN(CC(F)F)C2)cc1[N+](=O)[O-] ZINC000417397256 312218482 /nfs/dbraw/zinc/21/84/82/312218482.db2.gz XXJCPNNEKQNSDN-WCQYABFASA-N 0 3 343.374 2.984 20 5 EFBDHN CCc1ccccc1[C@H](N)CNC(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000423950504 312487552 /nfs/dbraw/zinc/48/75/52/312487552.db2.gz YLXFSYQYIZSOGU-OAHLLOKOSA-N 0 3 327.384 2.895 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](c2ccccc2F)[C@H](N)C1 ZINC000424035674 312500635 /nfs/dbraw/zinc/50/06/35/312500635.db2.gz FVWIUULHHNJGHE-DOTOQJQBSA-N 0 3 343.358 2.609 20 5 EFBDHN CCO[C@@H]1C[C@H](N[C@@H](C)Cc2ccccc2[N+](=O)[O-])[C@@H]1n1cccn1 ZINC000449343753 312686392 /nfs/dbraw/zinc/68/63/92/312686392.db2.gz MUFFYKGOJOQTRP-PLYYQAHHSA-N 0 3 344.415 2.731 20 5 EFBDHN C[C@H](CCCc1cccnc1)NCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000453123333 312866032 /nfs/dbraw/zinc/86/60/32/312866032.db2.gz QICSUODFRUSLNR-CQSZACIVSA-N 0 3 342.399 2.929 20 5 EFBDHN C[C@@]1(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCC(=O)N1 ZINC000453582086 312911959 /nfs/dbraw/zinc/91/19/59/312911959.db2.gz AZRYVYZJTLBKNO-KRWDZBQOSA-N 0 3 329.356 2.613 20 5 EFBDHN Cc1cc(NC(=O)COc2cccc([N+](=O)[O-])c2)ccc1CN(C)C ZINC000458266138 313098709 /nfs/dbraw/zinc/09/87/09/313098709.db2.gz DQGBXVBYDGCHNA-UHFFFAOYSA-N 0 3 343.383 2.982 20 5 EFBDHN C[C@H]1CC[C@H](C)N1CC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000469671489 313124776 /nfs/dbraw/zinc/12/47/76/313124776.db2.gz SQPQQOXYYSVWIA-GJZGRUSLSA-N 0 3 333.432 2.907 20 5 EFBDHN COc1c(C(=O)N(CCN(C)C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000475392797 313222343 /nfs/dbraw/zinc/22/23/43/313222343.db2.gz UDKLVYNOOKGELH-UHFFFAOYSA-N 0 3 343.383 2.812 20 5 EFBDHN CCN1CCC[C@H]1CN(C)c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000486967783 313353933 /nfs/dbraw/zinc/35/39/33/313353933.db2.gz NNAJKEXWXSRIGL-AWEZNQCLSA-N 0 3 331.376 2.565 20 5 EFBDHN CSc1cccc(C(=O)N[C@@H](C)C2=CCN(C)CC2)c1[N+](=O)[O-] ZINC000487070451 313363465 /nfs/dbraw/zinc/36/34/65/313363465.db2.gz LQWBOLYRDUSFDW-NSHDSACASA-N 0 3 335.429 2.697 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N2CCN(C)CC[C@H]2C)cc1[N+](=O)[O-] ZINC000492964004 314193940 /nfs/dbraw/zinc/19/39/40/314193940.db2.gz UZYVKOLVECRHQU-KGLIPLIRSA-N 0 3 334.420 2.700 20 5 EFBDHN C[C@@H]1CN(C(=O)/C=C\c2cccc([N+](=O)[O-])c2)CCN(C2CC2)C1 ZINC000493169735 314264716 /nfs/dbraw/zinc/26/47/16/314264716.db2.gz HBVTXHXPIXJMNJ-PODYEWJSSA-N 0 3 329.400 2.551 20 5 EFBDHN CN(C[C@H]1CCCN1C)C(=O)/C=C/c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000493456711 314363985 /nfs/dbraw/zinc/36/39/85/314363985.db2.gz SPUOXTIGODHKBC-STMXVASLSA-N 0 3 337.807 2.814 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[C@H](CN2CCOC2=O)C1 ZINC000496362967 315040216 /nfs/dbraw/zinc/04/02/16/315040216.db2.gz NXLALTBIAFSEEJ-KGLIPLIRSA-N 0 3 333.388 2.738 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C(=O)C[C@H](N)Cc1ccccc1 ZINC000516921537 315718054 /nfs/dbraw/zinc/71/80/54/315718054.db2.gz QFIFKMYHFTUWHR-MRXNPFEDSA-N 0 3 327.384 2.513 20 5 EFBDHN CN(C)C[C@H]1CCCCN1C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000519086570 315843911 /nfs/dbraw/zinc/84/39/11/315843911.db2.gz BDMKPAJSRKYIAG-GFCCVEGCSA-N 0 3 325.796 2.805 20 5 EFBDHN Cc1c(CN2CCC(N3CCOC[C@H]3C)CC2)cccc1[N+](=O)[O-] ZINC000521965191 316055371 /nfs/dbraw/zinc/05/53/71/316055371.db2.gz PPPUCLNDVCVABL-CQSZACIVSA-N 0 3 333.432 2.588 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCN(C[C@@H]3C[C@@H]3c3ccccc3)CC2)cn1 ZINC000535785710 317611274 /nfs/dbraw/zinc/61/12/74/317611274.db2.gz BOOTXQAUDMGIJU-FUHWJXTLSA-N 0 3 338.411 2.916 20 5 EFBDHN C[C@H](CS(=O)(=O)c1ccccc1)NCCc1ccccc1[N+](=O)[O-] ZINC000548067207 318069467 /nfs/dbraw/zinc/06/94/67/318069467.db2.gz AHZDYLYYYLYGOY-CQSZACIVSA-N 0 3 348.424 2.589 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN3CCN(C4CCCC4)CC3)nc2c1 ZINC000548180569 318082143 /nfs/dbraw/zinc/08/21/43/318082143.db2.gz LKIUFAYCGGFYAX-UHFFFAOYSA-N 0 3 329.404 2.531 20 5 EFBDHN COc1ccc(CNCCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000548826291 318147722 /nfs/dbraw/zinc/14/77/22/318147722.db2.gz WFROXPJFSPUICS-UHFFFAOYSA-N 0 3 329.356 2.722 20 5 EFBDHN Cc1ccccc1OC[C@H](O)CN(C)CCc1cccc([N+](=O)[O-])c1 ZINC000549173495 318168138 /nfs/dbraw/zinc/16/81/38/318168138.db2.gz RHBKUXLMYDQCMZ-GOSISDBHSA-N 0 3 344.411 2.817 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCc1cccc(Cl)c1 ZINC000551558964 318210124 /nfs/dbraw/zinc/21/01/24/318210124.db2.gz RAAXYNJPPYVGLC-AWEZNQCLSA-N 0 3 336.775 2.778 20 5 EFBDHN O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2NCc2cnc3n2CCCC3)n1 ZINC000551573081 318210245 /nfs/dbraw/zinc/21/02/45/318210245.db2.gz ZRGUJSYMQCQWMR-LSDHHAIUSA-N 0 3 344.419 2.598 20 5 EFBDHN C[C@@H](C(=O)N1CCN([C@H]2C[C@@H]2C)C[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000554113787 318301448 /nfs/dbraw/zinc/30/14/48/318301448.db2.gz XKLNIDURGLVNNL-AFIMGQEJSA-N 0 3 345.443 2.887 20 5 EFBDHN C[C@H](C(=O)NC[C@@H]1CCCCN1C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000555321484 318353004 /nfs/dbraw/zinc/35/30/04/318353004.db2.gz CAAMDXMQTPBQFE-GUYCJALGSA-N 0 3 331.416 2.831 20 5 EFBDHN O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2N[C@@H]2c3ccccc3C[C@@H]2O)n1 ZINC000564812394 318894427 /nfs/dbraw/zinc/89/44/27/318894427.db2.gz MMIMHHZOEAZJSV-NBOOPKSLSA-N 0 3 342.399 2.523 20 5 EFBDHN CCC(CC)Nc1ccncc1NC(=O)c1ccc([N+](=O)[O-])n1C ZINC000565194116 318944804 /nfs/dbraw/zinc/94/48/04/318944804.db2.gz DJHCTPGIVKTBJA-UHFFFAOYSA-N 0 3 331.376 2.603 20 5 EFBDHN C[C@H](c1ccccc1)[C@H](O)CNCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000565300025 318956174 /nfs/dbraw/zinc/95/61/74/318956174.db2.gz MICMRVVSSUCYRT-SJKOYZFVSA-N 0 3 340.383 2.725 20 5 EFBDHN CC[C@H]1CCC[C@@H]1CNCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000565654566 318990144 /nfs/dbraw/zinc/99/01/44/318990144.db2.gz MHXDOSYPTGAOEB-UONOGXRCSA-N 0 3 340.445 2.784 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@H]2CCCc3occc32)c1 ZINC000567464492 319174054 /nfs/dbraw/zinc/17/40/54/319174054.db2.gz VRIJEAXNUJEHMH-CJNGLKHVSA-N 0 3 332.356 2.595 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@@H]2CCCc3occc32)c1 ZINC000567464494 319174062 /nfs/dbraw/zinc/17/40/62/319174062.db2.gz VRIJEAXNUJEHMH-XJKSGUPXSA-N 0 3 332.356 2.595 20 5 EFBDHN C[C@@]1(NC(=O)c2ccc([N+](=O)[O-])cc2)CCN(Cc2ccccc2)C1 ZINC000568891547 319328958 /nfs/dbraw/zinc/32/89/58/319328958.db2.gz UYQSSOCZMFAWGN-LJQANCHMSA-N 0 3 339.395 2.989 20 5 EFBDHN CCO[C@@H]1C[C@H](N[C@@H]2CCc3c2cccc3[N+](=O)[O-])[C@]12CCCO2 ZINC000570650085 319498235 /nfs/dbraw/zinc/49/82/35/319498235.db2.gz OCWWBNXMDAPGFG-BZZMCLGOSA-N 0 3 332.400 2.898 20 5 EFBDHN C[C@@H](CCc1ccccc1[N+](=O)[O-])N[C@H]1CCN(C(C)(C)C)C1=O ZINC000573844807 319804295 /nfs/dbraw/zinc/80/42/95/319804295.db2.gz LQJZGWGRVFHAAG-ZFWWWQNUSA-N 0 3 333.432 2.905 20 5 EFBDHN O=[N+]([O-])c1ccc(S(=O)(=O)CCN[C@@H]2CCCC(F)(F)C2)cc1 ZINC000577622909 320128843 /nfs/dbraw/zinc/12/88/43/320128843.db2.gz XBNXIUMYZBKVIN-LLVKDONJSA-N 0 3 348.371 2.536 20 5 EFBDHN Cc1ccc([C@H](C)NC[C@H](O)COCc2ccco2)cc1[N+](=O)[O-] ZINC000181840278 323253158 /nfs/dbraw/zinc/25/31/58/323253158.db2.gz PZRHUJJGQSGNLR-ZFWWWQNUSA-N 0 3 334.372 2.725 20 5 EFBDHN CC[C@@H](NC[C@@H](O)COc1cccc([N+](=O)[O-])c1)c1c(C)noc1C ZINC000182389018 323280635 /nfs/dbraw/zinc/28/06/35/323280635.db2.gz XFZBJPNIIGWTDD-GDBMZVCRSA-N 0 3 349.387 2.680 20 5 EFBDHN C[S@@](=O)C[C@@H](NCCOc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000183069193 323314730 /nfs/dbraw/zinc/31/47/30/323314730.db2.gz MQPSDGHIDVHZCQ-MZNJEOGPSA-N 0 3 348.424 2.683 20 5 EFBDHN CC(C)CN(CCN(C)C)C(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000185001849 323379933 /nfs/dbraw/zinc/37/99/33/323379933.db2.gz UODZHDHEEYVZIQ-CYBMUJFWSA-N 0 3 339.411 2.884 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H](c1ccccc1)N(C)C ZINC000192902261 323483013 /nfs/dbraw/zinc/48/30/13/323483013.db2.gz QWLRJUZCTPAKMX-INIZCTEOSA-N 0 3 327.384 2.936 20 5 EFBDHN C[C@H](CN1CCCCC1)NC(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000296558652 323555185 /nfs/dbraw/zinc/55/51/85/323555185.db2.gz UJNDMQAKBVIEHO-KGLIPLIRSA-N 0 3 334.420 2.829 20 5 EFBDHN Cc1cccc2c1CC[C@@H]2NC[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000578859593 323826520 /nfs/dbraw/zinc/82/65/20/323826520.db2.gz FFJWFZRPNPTCHY-YOEHRIQHSA-N 0 3 342.395 2.920 20 5 EFBDHN C[C@H]1CN(CCN[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CCO1 ZINC000580390673 324151443 /nfs/dbraw/zinc/15/14/43/324151443.db2.gz WCDMHQCNQSKTAP-GUYCJALGSA-N 0 3 333.432 2.628 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN[C@@H]1C[C@H]1c1ccccc1F ZINC000580554013 324187604 /nfs/dbraw/zinc/18/76/04/324187604.db2.gz LXZZHFBWILEAJF-DUVNUKRYSA-N 0 3 346.358 2.619 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CN[C@H]1CCc2cc(F)ccc21 ZINC000580737434 324224101 /nfs/dbraw/zinc/22/41/01/324224101.db2.gz UCLZAHINEMEBDG-ZBFHGGJFSA-N 0 3 346.358 2.751 20 5 EFBDHN C[C@@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2)CN1Cc1ccccc1 ZINC000137441474 473206254 /nfs/dbraw/zinc/20/62/54/473206254.db2.gz ADMOBDGBBURAIY-PBHICJAKSA-N 0 3 339.395 2.988 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@@H]2CCN(Cc3ccc4c[nH]nc4c3)C2)nc1 ZINC000128901180 472509716 /nfs/dbraw/zinc/50/97/16/472509716.db2.gz HWVANTNZZLTQIL-CQSZACIVSA-N 0 3 338.371 2.553 20 5 EFBDHN CN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000161308713 473225374 /nfs/dbraw/zinc/22/53/74/473225374.db2.gz ZDFBOMJVVWJGMR-TZMCWYRMSA-N 0 3 337.807 2.805 20 5 EFBDHN CCS[C@@H]1CCCCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000112088738 473242284 /nfs/dbraw/zinc/24/22/84/473242284.db2.gz QNQHNIQQYZYRLP-CQSZACIVSA-N 0 3 337.445 2.801 20 5 EFBDHN CCCCN(C)CCNC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000112310049 473254668 /nfs/dbraw/zinc/25/46/68/473254668.db2.gz PCKUNLGSZXBKBQ-CYBMUJFWSA-N 0 3 339.461 2.924 20 5 EFBDHN CCn1ccnc1[C@H]1OCCC[C@@H]1NCc1cccc([N+](=O)[O-])c1 ZINC000190429485 473272007 /nfs/dbraw/zinc/27/20/07/473272007.db2.gz JKMUANYXICVAOP-HOTGVXAUSA-N 0 3 330.388 2.821 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000081995797 473283721 /nfs/dbraw/zinc/28/37/21/473283721.db2.gz QVVAHYUQSOYAMU-UHFFFAOYSA-N 0 3 349.431 2.522 20 5 EFBDHN C[C@@H](CCc1ccccc1[N+](=O)[O-])N[C@@H](C)C(=O)NCc1ccco1 ZINC000162022342 473295789 /nfs/dbraw/zinc/29/57/89/473295789.db2.gz NTKFTAVOQNKZAJ-KBPBESRZSA-N 0 3 345.399 2.803 20 5 EFBDHN CCOC(=O)CCN(Cc1nc2cc([N+](=O)[O-])ccc2o1)CC1CC1 ZINC000083169727 473326640 /nfs/dbraw/zinc/32/66/40/473326640.db2.gz MQKNHWFEBSCTQB-UHFFFAOYSA-N 0 3 347.371 2.901 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)CN1C1CC1 ZINC000177206230 473332583 /nfs/dbraw/zinc/33/25/83/473332583.db2.gz QQBPUMHFFXVEBA-ZFWWWQNUSA-N 0 3 346.431 2.528 20 5 EFBDHN COc1ccc(OC)c([C@@H](O)CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000125031687 473343922 /nfs/dbraw/zinc/34/39/22/473343922.db2.gz DIGHBXPMTHQKGR-SJCJKPOMSA-N 0 3 346.383 2.996 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@H]1CCCC12CCOCC2 ZINC000619723156 479866413 /nfs/dbraw/zinc/86/64/13/479866413.db2.gz OJNFYEQCZAPLHV-INIZCTEOSA-N 0 3 347.415 2.781 20 5 EFBDHN C[C@H](C(=O)N(C)C[C@H]1CCCN(C)C1)c1ccc([N+](=O)[O-])cc1F ZINC000185246584 473376182 /nfs/dbraw/zinc/37/61/82/473376182.db2.gz JWLAIZVJSCUGDX-STQMWFEESA-N 0 3 337.395 2.638 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H](N3CCCC3)C2)c1 ZINC000171445281 473390215 /nfs/dbraw/zinc/39/02/15/473390215.db2.gz WCDCYUKVNZKJSC-LBPRGKRZSA-N 0 3 335.429 2.627 20 5 EFBDHN CSc1ccc(C(=O)N2CC[C@H](N3CCCC3)C2)cc1[N+](=O)[O-] ZINC000171449095 473391574 /nfs/dbraw/zinc/39/15/74/473391574.db2.gz OQBSRSLYHRVZEB-ZDUSSCGKSA-N 0 3 335.429 2.627 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H](N2CCCC2)C1 ZINC000171448059 473391590 /nfs/dbraw/zinc/39/15/90/473391590.db2.gz PVFRZGKALOVDPS-HIFRSBDPSA-N 0 3 349.456 2.772 20 5 EFBDHN CN(CCc1cccc([N+](=O)[O-])c1)C[C@@H]1COc2ccccc2O1 ZINC000619785557 479885469 /nfs/dbraw/zinc/88/54/69/479885469.db2.gz LCVCTXASANOZFH-MRXNPFEDSA-N 0 3 328.368 2.909 20 5 EFBDHN CC(C)[C@@H](CNCc1nc2cc([N+](=O)[O-])ccc2o1)c1ccnn1C ZINC000602630927 479436845 /nfs/dbraw/zinc/43/68/45/479436845.db2.gz PMKFWMXHWHHQNE-CYBMUJFWSA-N 0 3 343.387 2.999 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)N(C)CCN1CCCCC1 ZINC000593882747 479495123 /nfs/dbraw/zinc/49/51/23/479495123.db2.gz LECKJDUUADYWJC-UHFFFAOYSA-N 0 3 335.404 2.551 20 5 EFBDHN CSc1cccc(C(=O)N(C)CCN2CCCCC2)c1[N+](=O)[O-] ZINC000593882921 479495136 /nfs/dbraw/zinc/49/51/36/479495136.db2.gz NPDNDJOKHYMZGF-UHFFFAOYSA-N 0 3 337.445 2.875 20 5 EFBDHN CC(=O)NC1CCC(N(C)Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000612181362 479607399 /nfs/dbraw/zinc/60/73/99/479607399.db2.gz GSNXIUYDMMWUJI-UHFFFAOYSA-N 0 3 346.387 2.615 20 5 EFBDHN Cc1cc(N2C[C@@H](C)S(=O)[C@H](C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000616394515 479898367 /nfs/dbraw/zinc/89/83/67/479898367.db2.gz AADZKPSGDCIGJB-VXGBXAGGSA-N 0 3 333.413 2.797 20 5 EFBDHN Cc1ccc(C(=O)NC[C@H](c2ccccc2)N(C)C)cc1[N+](=O)[O-] ZINC000003294999 471442556 /nfs/dbraw/zinc/44/25/56/471442556.db2.gz LWYPBQSLBNZWSI-QGZVFWFLSA-N 0 3 327.384 2.936 20 5 EFBDHN Cc1ccc([C@H](CNC(=O)Cc2ccccc2[N+](=O)[O-])N(C)C)cc1 ZINC000067269096 472012553 /nfs/dbraw/zinc/01/25/53/472012553.db2.gz YQMMHHSSOWVAIE-SFHVURJKSA-N 0 3 341.411 2.865 20 5 EFBDHN CNC(=O)c1ccc(NC[C@H](C)N2CCCC[C@H]2C)c([N+](=O)[O-])c1 ZINC000053561614 472019652 /nfs/dbraw/zinc/01/96/52/472019652.db2.gz MCCSNDSDJJWQNC-OLZOCXBDSA-N 0 3 334.420 2.629 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)NCC(C)(C)N1CCC[C@@H](C)C1 ZINC000054286727 472073186 /nfs/dbraw/zinc/07/31/86/472073186.db2.gz UUXUFNVKVBGFKW-CYBMUJFWSA-N 0 3 349.431 2.844 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)CN2C[C@H](C)C[C@@H](C)C2)c1 ZINC000067806626 472091556 /nfs/dbraw/zinc/09/15/56/472091556.db2.gz ULZMMYUERSUDCY-MGPQQGTHSA-N 0 3 349.431 2.700 20 5 EFBDHN Cc1c(NC(=O)CCN2CCN(CC(C)C)CC2)cccc1[N+](=O)[O-] ZINC000041894507 472094481 /nfs/dbraw/zinc/09/44/81/472094481.db2.gz BPFIHMLYDVFRCA-UHFFFAOYSA-N 0 3 348.447 2.505 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)NCC(C)(C)N2CCC[C@@H](C)C2)c1 ZINC000067844966 472097641 /nfs/dbraw/zinc/09/76/41/472097641.db2.gz JGIPLVODFKUHHE-CYBMUJFWSA-N 0 3 349.431 2.844 20 5 EFBDHN O=C(CCN1CCc2ccccc2C1)Nc1ccccc1[N+](=O)[O-] ZINC000026156171 472125991 /nfs/dbraw/zinc/12/59/91/472125991.db2.gz JGSAFRXIEQYCKW-UHFFFAOYSA-N 0 3 325.368 2.982 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)CCN(C)Cc1ccoc1C ZINC000055052878 472135942 /nfs/dbraw/zinc/13/59/42/472135942.db2.gz XEMVGJJRJOLOMQ-UHFFFAOYSA-N 0 3 347.371 2.965 20 5 EFBDHN C[C@H]1CCC[C@H](N(C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000026476364 472138332 /nfs/dbraw/zinc/13/83/32/472138332.db2.gz WXMJDZFVWGJXIG-ZFWWWQNUSA-N 0 3 331.416 2.994 20 5 EFBDHN Cc1cc(C(=O)N2CCC[C@@H]2CN2CCCCC2)ccc1[N+](=O)[O-] ZINC000068133648 472140738 /nfs/dbraw/zinc/14/07/38/472140738.db2.gz XYPWEZLTRJMJTR-MRXNPFEDSA-N 0 3 331.416 2.994 20 5 EFBDHN Cc1ccc(CN(C)C[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC000026712580 472145391 /nfs/dbraw/zinc/14/53/91/472145391.db2.gz GAPXALWAIZOPHH-QGZVFWFLSA-N 0 3 330.384 2.775 20 5 EFBDHN CN(C)CCN1CCC(Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000075669256 472178332 /nfs/dbraw/zinc/17/83/32/472178332.db2.gz HCQIPXRQPRXNJN-UHFFFAOYSA-N 0 3 326.828 2.686 20 5 EFBDHN C[C@H](CN1CCC[C@H](C)C1)NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000055405421 472180697 /nfs/dbraw/zinc/18/06/97/472180697.db2.gz BUOQVRGWQBAWGY-QWHCGFSZSA-N 0 3 344.415 2.926 20 5 EFBDHN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)NC1CCN(C2CC2)CC1 ZINC000043331392 472223423 /nfs/dbraw/zinc/22/34/23/472223423.db2.gz JHZSBJFABHIAHS-UHFFFAOYSA-N 0 3 338.795 2.997 20 5 EFBDHN CN(C)[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000043467401 472235276 /nfs/dbraw/zinc/23/52/76/472235276.db2.gz AHOZQIMZRQRCGE-KRWDZBQOSA-N 0 3 342.399 2.889 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCCN(C(C)C)CC2)c1 ZINC000068782279 472241058 /nfs/dbraw/zinc/24/10/58/472241058.db2.gz ZNRHOMHJYCRBTR-UHFFFAOYSA-N 0 3 337.445 2.873 20 5 EFBDHN CC(C)N1CCCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000076032701 472244761 /nfs/dbraw/zinc/24/47/61/472244761.db2.gz MZROITXJJWPYGR-UHFFFAOYSA-N 0 3 345.403 2.561 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)NCCCCN2C[C@@H](C)O[C@H](C)C2)c1 ZINC000085456932 472248724 /nfs/dbraw/zinc/24/87/24/472248724.db2.gz AXEPLDQBQKUWFD-HUUCEWRRSA-N 0 3 349.431 2.522 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[C@H]2CC[C@@H](C1)N2C ZINC000085635998 472262543 /nfs/dbraw/zinc/26/25/43/472262543.db2.gz ROLFGJYTLLJREL-KGLIPLIRSA-N 0 3 332.404 2.912 20 5 EFBDHN CN(C)Cc1ccc(CNC(=O)NCc2ccccc2[N+](=O)[O-])cc1 ZINC000043885266 472272419 /nfs/dbraw/zinc/27/24/19/472272419.db2.gz GMFWZYGVTIPVIZ-UHFFFAOYSA-N 0 3 342.399 2.656 20 5 EFBDHN CC(C)(CNC(=O)CCc1cccc([N+](=O)[O-])c1)N1CCCCC1 ZINC000087001218 472296888 /nfs/dbraw/zinc/29/68/88/472296888.db2.gz LBYOMMVSVDQNSO-UHFFFAOYSA-N 0 3 333.432 2.908 20 5 EFBDHN C[C@@H](CNC(=O)CCc1cccc([N+](=O)[O-])c1)N1CCCC[C@H]1C ZINC000087105637 472305971 /nfs/dbraw/zinc/30/59/71/472305971.db2.gz QKDBGOAXSXZJGA-CABCVRRESA-N 0 3 333.432 2.907 20 5 EFBDHN C[C@@H](CNC(=O)CCc1cccc([N+](=O)[O-])c1)N1CCC(C)CC1 ZINC000087204598 472314809 /nfs/dbraw/zinc/31/48/09/472314809.db2.gz UAFKJAPAUHQTGK-HNNXBMFYSA-N 0 3 333.432 2.764 20 5 EFBDHN O=C(/C=C/c1ccc(F)cc1[N+](=O)[O-])N1CCN(C2CCCC2)CC1 ZINC000069444611 472345938 /nfs/dbraw/zinc/34/59/38/472345938.db2.gz OITPTKPJRPUORH-SOFGYWHQSA-N 0 3 347.390 2.834 20 5 EFBDHN CCN1CCC[C@H]1CNC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000044997516 472362932 /nfs/dbraw/zinc/36/29/32/472362932.db2.gz MGTYIZIEZMHUEH-OCCSQVGLSA-N 0 3 337.445 2.676 20 5 EFBDHN COc1ccc(NC(=O)CN([C@H](C)C2CC2)C2CC2)c([N+](=O)[O-])c1 ZINC000031653782 472386929 /nfs/dbraw/zinc/38/69/29/472386929.db2.gz VGQDUZPIYZCNBB-LLVKDONJSA-N 0 3 333.388 2.805 20 5 EFBDHN CC(C)[C@@H](C(=O)NCCc1cccc([N+](=O)[O-])c1)N1CCCCC1 ZINC000089302720 472409158 /nfs/dbraw/zinc/40/91/58/472409158.db2.gz ADGHDBCWCPWYCG-KRWDZBQOSA-N 0 3 333.432 2.764 20 5 EFBDHN CC(C)(C)N1CCCN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000057617909 472455392 /nfs/dbraw/zinc/45/53/92/472455392.db2.gz KNDGDTZWBSKPIZ-UHFFFAOYSA-N 0 3 348.447 2.653 20 5 EFBDHN CCc1ccc([C@H](CNC(=O)c2ccc([N+](=O)[O-])o2)N(C)C)cc1 ZINC000032735604 472460458 /nfs/dbraw/zinc/46/04/58/472460458.db2.gz VFXZYXOYDUWJML-AWEZNQCLSA-N 0 3 331.372 2.783 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](C)N1CCCC[C@@H]1C ZINC000032733393 472461420 /nfs/dbraw/zinc/46/14/20/472461420.db2.gz UNMLAVZIRQKLDQ-STQMWFEESA-N 0 3 335.404 2.596 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H](C)N(C)C1CC1 ZINC000057716857 472467582 /nfs/dbraw/zinc/46/75/82/472467582.db2.gz HIIOEDKEJPCANG-NWDGAFQWSA-N 0 3 337.445 2.674 20 5 EFBDHN Cc1cc(NC[C@H]2C[C@@H](O)CN2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000089643945 472475924 /nfs/dbraw/zinc/47/59/24/472475924.db2.gz WBTOLJKUSYJWFF-QZTJIDSGSA-N 0 3 341.411 2.951 20 5 EFBDHN CN(C)Cc1cccc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)c1 ZINC000058118789 472504696 /nfs/dbraw/zinc/50/46/96/472504696.db2.gz HMTWWDMPXDCOKJ-UHFFFAOYSA-N 0 3 332.335 2.630 20 5 EFBDHN COc1cccc([C@@H](CNc2c([N+](=O)[O-])ncn2C)N2CCCC2)c1 ZINC000070790989 472512443 /nfs/dbraw/zinc/51/24/43/472512443.db2.gz MMFFZLLCGBMWCC-OAHLLOKOSA-N 0 3 345.403 2.586 20 5 EFBDHN CNC(=O)CCCN(C)Cc1cc(=O)oc2ccc3ccccc3c12 ZINC000155206988 472520278 /nfs/dbraw/zinc/52/02/78/472520278.db2.gz CYEAOQPZGLLAPS-UHFFFAOYSA-N 0 3 338.407 2.904 20 5 EFBDHN CN(C)Cc1ccc(NC(=O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC000046353916 472546469 /nfs/dbraw/zinc/54/64/69/472546469.db2.gz SZZMYZVJRZKYMW-UHFFFAOYSA-N 0 3 329.356 2.674 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@@H](OCC(C)C)C1 ZINC000119791996 472583583 /nfs/dbraw/zinc/58/35/83/472583583.db2.gz XOFNDIJMTSHDBJ-MRXNPFEDSA-N 0 3 349.431 2.979 20 5 EFBDHN CN(C)CCOc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000046721824 472589547 /nfs/dbraw/zinc/58/95/47/472589547.db2.gz BJWOUJLSSHLOKJ-UHFFFAOYSA-N 0 3 329.356 2.788 20 5 EFBDHN COCCN(C)CCNc1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000090089220 472593332 /nfs/dbraw/zinc/59/33/32/472593332.db2.gz HFZICKOUWNXHKO-UHFFFAOYSA-N 0 3 330.388 2.647 20 5 EFBDHN CCN(CCn1cc([N+](=O)[O-])ccc1=O)[C@@H](C)c1cccc(OC)c1 ZINC000090519098 472628924 /nfs/dbraw/zinc/62/89/24/472628924.db2.gz PUWUEHVBHRETKM-AWEZNQCLSA-N 0 3 345.399 2.848 20 5 EFBDHN C[C@@H]1C[C@H](c2cccc(F)c2)N(CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000090550815 472633193 /nfs/dbraw/zinc/63/31/93/472633193.db2.gz DZVIKGWUYNTIDO-CXAGYDPISA-N 0 3 345.374 2.979 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCCN(C3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC000077994988 472650318 /nfs/dbraw/zinc/65/03/18/472650318.db2.gz UJKVKAPGQMUPQQ-UHFFFAOYSA-N 0 3 334.376 2.958 20 5 EFBDHN CC[C@H](NC(=O)N1CCC[C@H](N(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000090688464 472652556 /nfs/dbraw/zinc/65/25/56/472652556.db2.gz QFIKUDVCQOVBST-HOTGVXAUSA-N 0 3 334.420 2.782 20 5 EFBDHN CO[C@@H]1CCCN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000104694649 472684027 /nfs/dbraw/zinc/68/40/27/472684027.db2.gz PDORWEORRGLJAV-OAHLLOKOSA-N 0 3 331.372 2.903 20 5 EFBDHN COC1CCC(N(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000072637314 472691977 /nfs/dbraw/zinc/69/19/77/472691977.db2.gz NSLIIVTWUGJLPK-UHFFFAOYSA-N 0 3 335.404 2.731 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@H]2CCN(CCCOc3ccccc3)C2)nc1 ZINC000072665248 472696567 /nfs/dbraw/zinc/69/65/67/472696567.db2.gz FXHASKSSOFMMSC-HNNXBMFYSA-N 0 3 342.399 2.945 20 5 EFBDHN CN(C)c1cccc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000072665002 472697509 /nfs/dbraw/zinc/69/75/09/472697509.db2.gz QFMHGYORZOSMQR-HNNXBMFYSA-N 0 3 341.415 2.742 20 5 EFBDHN CN(C(=O)c1cc([N+](=O)[O-])c[nH]1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000072733203 472709987 /nfs/dbraw/zinc/70/99/87/472709987.db2.gz FWZFHHCTKAMPTF-HNNXBMFYSA-N 0 3 342.399 2.660 20 5 EFBDHN C[C@@H](CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)N(C)C1CC1 ZINC000120589228 472715328 /nfs/dbraw/zinc/71/53/28/472715328.db2.gz OFGZFKTWURLVKR-ZDUSSCGKSA-N 0 3 346.431 2.752 20 5 EFBDHN CN(C)Cc1cccc(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)c1 ZINC000047460394 472717461 /nfs/dbraw/zinc/71/74/61/472717461.db2.gz VAEQXUYVIKCFJI-UHFFFAOYSA-N 0 3 339.355 2.785 20 5 EFBDHN Cc1ccc(NC(=O)COc2ccc([N+](=O)[O-])cc2)c(CN(C)C)c1 ZINC000072840292 472726323 /nfs/dbraw/zinc/72/63/23/472726323.db2.gz XYBOIQASEDXSTM-UHFFFAOYSA-N 0 3 343.383 2.982 20 5 EFBDHN CO[C@@]1(C)C[C@@H](NCc2cc3c(cc2[N+](=O)[O-])OCCO3)C1(C)C ZINC000072926540 472741671 /nfs/dbraw/zinc/74/16/71/472741671.db2.gz PPNIIEZAFCCXQP-WBVHZDCISA-N 0 3 336.388 2.659 20 5 EFBDHN CN(CCN1CCCC1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000063054973 472752473 /nfs/dbraw/zinc/75/24/73/472752473.db2.gz DVQWNIMFORIDSC-UHFFFAOYSA-N 0 3 328.210 2.889 20 5 EFBDHN CC(C)[C@H](NC/C=C/c1ccccc1[N+](=O)[O-])C(=O)N1CCCC1 ZINC000073011077 472757450 /nfs/dbraw/zinc/75/74/50/472757450.db2.gz ZQFZBMZNRBIUFG-LKUPDRCFSA-N 0 3 331.416 2.845 20 5 EFBDHN Cc1c(CN2CCC[C@@H](C(=O)NCC3CC3)C2)cccc1[N+](=O)[O-] ZINC000047978895 472792541 /nfs/dbraw/zinc/79/25/41/472792541.db2.gz WGTKYDDRFXKYDX-MRXNPFEDSA-N 0 3 331.416 2.641 20 5 EFBDHN C[C@H]1C[C@H](Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)CN1C1CC1 ZINC000133520425 472812483 /nfs/dbraw/zinc/81/24/83/472812483.db2.gz FMYFHCFLFHOEIJ-JQWIXIFHSA-N 0 3 330.388 2.517 20 5 EFBDHN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCN(CC2CCCCC2)CC1 ZINC000064126391 472835202 /nfs/dbraw/zinc/83/52/02/472835202.db2.gz VYESQLSWQZGNNL-UHFFFAOYSA-N 0 3 345.443 2.862 20 5 EFBDHN COc1cc(CN(C)CCO)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000157754729 472853821 /nfs/dbraw/zinc/85/38/21/472853821.db2.gz ZFHGHQNHDHSXFL-UHFFFAOYSA-N 0 3 346.383 2.607 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)N(C)C1CCN(C(C)C)CC1 ZINC000073841272 472886189 /nfs/dbraw/zinc/88/61/89/472886189.db2.gz UIZSKLSNWKYXHU-UHFFFAOYSA-N 0 3 335.404 2.548 20 5 EFBDHN CC1CCN(CCNc2ncc(Br)cc2[N+](=O)[O-])CC1 ZINC000048589439 472891614 /nfs/dbraw/zinc/89/16/14/472891614.db2.gz HFMXMYFCUUQEGA-UHFFFAOYSA-N 0 3 343.225 2.896 20 5 EFBDHN CN(CCNC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C1CC1 ZINC000065124816 472900794 /nfs/dbraw/zinc/90/07/94/472900794.db2.gz REGBHZLFJBJRJF-UHFFFAOYSA-N 0 3 346.412 2.542 20 5 EFBDHN CN(CCOc1ccc([N+](=O)[O-])cc1)Cc1ccc2c(c1)OCO2 ZINC000065208933 472907543 /nfs/dbraw/zinc/90/75/43/472907543.db2.gz ZLPSQEJVJKEQSI-UHFFFAOYSA-N 0 3 330.340 2.834 20 5 EFBDHN CCN(Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C[C@H]1CCCO1 ZINC000092406810 472908894 /nfs/dbraw/zinc/90/88/94/472908894.db2.gz QCHRUQXECSPUCX-QGZVFWFLSA-N 0 3 344.415 2.996 20 5 EFBDHN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCN(c2ccncc2)CC1 ZINC000134515342 472921965 /nfs/dbraw/zinc/92/19/65/472921965.db2.gz WKWIBUIJDRSGFB-UHFFFAOYSA-N 0 3 346.774 2.606 20 5 EFBDHN Cc1cc(C(=O)NC[C@@H](c2ccccc2)N(C)C)cc([N+](=O)[O-])c1 ZINC000121849828 472929299 /nfs/dbraw/zinc/92/92/99/472929299.db2.gz MYDNZAPBFCTVMS-KRWDZBQOSA-N 0 3 327.384 2.936 20 5 EFBDHN CCC[C@H]1CN(CCc2ccc([N+](=O)[O-])cc2)CCN1CCOC ZINC000121957004 472953197 /nfs/dbraw/zinc/95/31/97/472953197.db2.gz LELAEKBIBWVBBR-SFHVURJKSA-N 0 3 335.448 2.570 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CCC[C@@H]2C[C@@H](O)c2ccc(F)cc2)n1 ZINC000134788827 472967177 /nfs/dbraw/zinc/96/71/77/472967177.db2.gz VANXIFHJSBPKJM-HZPDHXFCSA-N 0 3 348.378 2.519 20 5 EFBDHN CN(C)CCOc1ccc(NC(=O)c2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000122247585 472993191 /nfs/dbraw/zinc/99/31/91/472993191.db2.gz HLLDXYVGPFNALO-UHFFFAOYSA-N 0 3 347.346 2.927 20 5 EFBDHN CCN1CCC[C@H]1CNC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000074380879 472998300 /nfs/dbraw/zinc/99/83/00/472998300.db2.gz QVOSBMSBZLLAEH-KRWDZBQOSA-N 0 3 348.447 2.701 20 5 EFBDHN CCc1ccc([C@@H](CNc2c([N+](=O)[O-])c(C)nn2C)N(C)C)cc1 ZINC000051261796 473036484 /nfs/dbraw/zinc/03/64/84/473036484.db2.gz VMQFBEOZDVJCQF-OAHLLOKOSA-N 0 3 331.420 2.914 20 5 EFBDHN O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N1CC[C@H](N2CCCC2)C1 ZINC000066157941 473050449 /nfs/dbraw/zinc/05/04/49/473050449.db2.gz MYRUETURGDTGIE-LBPRGKRZSA-N 0 3 338.795 2.950 20 5 EFBDHN COC(=O)CCN(C/C=C/c1ccccc1[N+](=O)[O-])C[C@@H]1CCCO1 ZINC000093460582 473111698 /nfs/dbraw/zinc/11/16/98/473111698.db2.gz CVTMWMSSTOLBAF-RRGWEWPQSA-N 0 3 348.399 2.652 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000160514300 473135628 /nfs/dbraw/zinc/13/56/28/473135628.db2.gz SFYHNBFYXPSZQB-OLZOCXBDSA-N 0 3 337.807 2.947 20 5 EFBDHN C[C@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cc2Br)CCN1C ZINC000094007926 473166572 /nfs/dbraw/zinc/16/65/72/473166572.db2.gz RQYRVQVSIAMTQP-IUCAKERBSA-N 0 3 329.198 2.647 20 5 EFBDHN CCc1nn(C)c(NC[C@H]2CCCN2Cc2ccccc2)c1[N+](=O)[O-] ZINC000094159531 473183354 /nfs/dbraw/zinc/18/33/54/473183354.db2.gz PARVFEZDVXRREE-OAHLLOKOSA-N 0 3 343.431 2.967 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000110995799 473189653 /nfs/dbraw/zinc/18/96/53/473189653.db2.gz KLDSFJOUPOMZEN-QGZVFWFLSA-N 0 3 348.447 2.778 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCN2CCN(C3CCCCC3)CC2)cc1 ZINC000163101001 473414105 /nfs/dbraw/zinc/41/41/05/473414105.db2.gz XQEAXOBZWSREGH-UHFFFAOYSA-N 0 3 333.432 2.924 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000177763000 473429888 /nfs/dbraw/zinc/42/98/88/473429888.db2.gz LNCDHJMHFVIWRR-OLZOCXBDSA-N 0 3 337.807 2.947 20 5 EFBDHN COc1cc(C(=O)N(CC(C)C)C2CCN(C)CC2)ccc1[N+](=O)[O-] ZINC000114383569 473458791 /nfs/dbraw/zinc/45/87/91/473458791.db2.gz QBUZEYYCNBUNEA-UHFFFAOYSA-N 0 3 349.431 2.796 20 5 EFBDHN Cc1cc(C(F)(F)F)ccc1CNCCn1cc([N+](=O)[O-])cn1 ZINC000191029894 473460311 /nfs/dbraw/zinc/46/03/11/473460311.db2.gz VAYIKHAFPZFCPY-UHFFFAOYSA-N 0 3 328.294 2.908 20 5 EFBDHN CC[C@@H](NC[C@H]1CN(CC(C)C)CCO1)c1cccc([N+](=O)[O-])c1 ZINC000178331167 473493119 /nfs/dbraw/zinc/49/31/19/473493119.db2.gz PCUDECDIVNUQEI-ZWKOTPCHSA-N 0 3 335.448 2.992 20 5 EFBDHN CSc1ccc(C(=O)N(CCN(C)C)C(C)C)cc1[N+](=O)[O-] ZINC000151893869 473505267 /nfs/dbraw/zinc/50/52/67/473505267.db2.gz KWOIVLSDUWTOQP-UHFFFAOYSA-N 0 3 325.434 2.729 20 5 EFBDHN CCC1(CC)[C@H](NCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@H]1OC ZINC000191367954 473531554 /nfs/dbraw/zinc/53/15/54/473531554.db2.gz FQGPIRACYQOHAT-HZPDHXFCSA-N 0 3 349.431 2.741 20 5 EFBDHN C[C@H](NC(=O)N(C)C[C@H]1CCCN(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000172138964 473531676 /nfs/dbraw/zinc/53/16/76/473531676.db2.gz SPVKVKBZWPYKQF-KBPBESRZSA-N 0 3 334.420 2.639 20 5 EFBDHN CCOC(=O)CCN(C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000178558014 473531787 /nfs/dbraw/zinc/53/17/87/473531787.db2.gz MHJFOAKXTWLBLL-UHFFFAOYSA-N 0 3 347.371 2.677 20 5 EFBDHN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CC[C@@H](N2CCCC2)C1 ZINC000191395576 473534552 /nfs/dbraw/zinc/53/45/52/473534552.db2.gz RBGJTTSOJKGDTK-CQSZACIVSA-N 0 3 332.404 2.914 20 5 EFBDHN C[C@H](NCCc1nnc2n1CCCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000126698050 473537919 /nfs/dbraw/zinc/53/79/19/473537919.db2.gz OLHRLMKGXRMMTN-ZDUSSCGKSA-N 0 3 329.404 2.806 20 5 EFBDHN CC[C@H]1CCCCN1CCNC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000172256523 473562503 /nfs/dbraw/zinc/56/25/03/473562503.db2.gz LDKRFQKNQGWVML-HNNXBMFYSA-N 0 3 334.420 2.659 20 5 EFBDHN CC(C)N1CCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000127001864 473568114 /nfs/dbraw/zinc/56/81/14/473568114.db2.gz XLJOFKXSPDIRJO-UHFFFAOYSA-N 0 3 343.431 2.521 20 5 EFBDHN CSc1ccc(C(=O)N(C)C[C@@H]2CCCN(C)C2)cc1[N+](=O)[O-] ZINC000115442573 473570879 /nfs/dbraw/zinc/57/08/79/473570879.db2.gz LFJZXEZQQFGQFN-GFCCVEGCSA-N 0 3 337.445 2.731 20 5 EFBDHN CCC[C@H](N[C@H](C)CCS(C)(=O)=O)c1cccc([N+](=O)[O-])c1 ZINC000127307543 473598364 /nfs/dbraw/zinc/59/83/64/473598364.db2.gz MRRMGXQUKBYFCS-DOMZBBRYSA-N 0 3 328.434 2.849 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN[C@H]2CCO[C@@H]2c2ccc(Cl)cc2)n1 ZINC000192029295 473610670 /nfs/dbraw/zinc/61/06/70/473610670.db2.gz RVXYLZGHKQEOHL-DZGCQCFKSA-N 0 3 336.779 2.565 20 5 EFBDHN O=C1C[C@@H](CNCc2csc([N+](=O)[O-])c2)CN1Cc1ccccc1 ZINC000179056973 473619627 /nfs/dbraw/zinc/61/96/27/473619627.db2.gz GKCPBOFDJHFYNC-AWEZNQCLSA-N 0 3 345.424 2.795 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC(Cn2cncn2)CC1 ZINC000186228637 473622287 /nfs/dbraw/zinc/62/22/87/473622287.db2.gz ZNRRGIIHBBDZIL-AWEZNQCLSA-N 0 3 329.404 2.968 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)CN1CCCCCC1 ZINC000186268874 473633603 /nfs/dbraw/zinc/63/36/03/473633603.db2.gz FKYFSNMUKWMZFT-CYBMUJFWSA-N 0 3 335.404 2.598 20 5 EFBDHN Cc1cc(OC[C@H](O)CN(C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000153623875 473633751 /nfs/dbraw/zinc/63/37/51/473633751.db2.gz YAFGSHBGTGYCCZ-MRXNPFEDSA-N 0 3 330.384 2.775 20 5 EFBDHN Cc1ccc(OC[C@@H](O)CN(C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000154064727 473665147 /nfs/dbraw/zinc/66/51/47/473665147.db2.gz UBZFGBADGHHDNI-INIZCTEOSA-N 0 3 330.384 2.775 20 5 EFBDHN O=C(NCC1CC1)[C@@H]1CCCN(C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000179341043 473676693 /nfs/dbraw/zinc/67/66/93/473676693.db2.gz ZDGFIQNLHCYETF-ZNNBYXKUSA-N 0 3 343.427 2.846 20 5 EFBDHN Cc1ccc(CN2CCC[C@H](C(=O)NCC3CC3)C2)cc1[N+](=O)[O-] ZINC000179341727 473677013 /nfs/dbraw/zinc/67/70/13/473677013.db2.gz CQEOXERKUPCGRG-INIZCTEOSA-N 0 3 331.416 2.641 20 5 EFBDHN C[C@@H]1CN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CCCO1 ZINC000179393864 473683506 /nfs/dbraw/zinc/68/35/06/473683506.db2.gz JWPOCMJYIGFEFF-CYBMUJFWSA-N 0 3 330.388 2.606 20 5 EFBDHN CCN1CCN(c2cccc(Nc3ncc([N+](=O)[O-])s3)c2)CC1 ZINC000192535403 473689377 /nfs/dbraw/zinc/68/93/77/473689377.db2.gz CYHSAMQOOZMOHP-UHFFFAOYSA-N 0 3 333.417 2.937 20 5 EFBDHN C[C@@H]1CN(CC2CCN(c3cc(N)ccc3[N+](=O)[O-])CC2)C[C@H](C)O1 ZINC000192788838 473726347 /nfs/dbraw/zinc/72/63/47/473726347.db2.gz KYLFOYJGBCIWDS-OKILXGFUSA-N 0 3 348.447 2.503 20 5 EFBDHN Cc1c(CC(=O)NC[C@@H](C)N2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000245972958 473768697 /nfs/dbraw/zinc/76/86/97/473768697.db2.gz WGNGESZVXYDEAA-ZIAGYGMSSA-N 0 3 333.432 2.682 20 5 EFBDHN CC(C)N(CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)CC1CCC1 ZINC000193212838 473775527 /nfs/dbraw/zinc/77/55/27/473775527.db2.gz IBYHCDFNHDAOJW-UHFFFAOYSA-N 0 3 331.416 2.994 20 5 EFBDHN CN1CCN(CCNc2ccc3ncccc3c2[N+](=O)[O-])CC1(C)C ZINC000281604529 473780299 /nfs/dbraw/zinc/78/02/99/473780299.db2.gz ILWRLFVLTOBEBH-UHFFFAOYSA-N 0 3 343.431 2.581 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN(Cc2ccc(F)cc2)C2CCOCC2)c1 ZINC000287871323 473783537 /nfs/dbraw/zinc/78/35/37/473783537.db2.gz SJAPTYLHSAUFIU-UHFFFAOYSA-N 0 3 348.378 2.612 20 5 EFBDHN CCc1nn(C)c(NCC2CCN(c3ccncc3)CC2)c1[N+](=O)[O-] ZINC000180045833 473785367 /nfs/dbraw/zinc/78/53/67/473785367.db2.gz GUGNQNUEKFJIEI-UHFFFAOYSA-N 0 3 344.419 2.614 20 5 EFBDHN COc1cc(CNCCc2ccc(O)cc2)c([N+](=O)[O-])cc1OC ZINC000263649015 473791021 /nfs/dbraw/zinc/79/10/21/473791021.db2.gz CUFJQBALKWFGLG-UHFFFAOYSA-N 0 3 332.356 2.650 20 5 EFBDHN CC(=O)c1cc(NCCCN2CCCO[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000287932035 473801669 /nfs/dbraw/zinc/80/16/69/473801669.db2.gz XHQCHCSRAFBEPS-CYBMUJFWSA-N 0 3 335.404 2.710 20 5 EFBDHN CN1CCN(CCNc2nc3ccccc3cc2[N+](=O)[O-])CC1(C)C ZINC000281673605 473802130 /nfs/dbraw/zinc/80/21/30/473802130.db2.gz PYWPTAOEMPAZDF-UHFFFAOYSA-N 0 3 343.431 2.581 20 5 EFBDHN O=C1CCc2cc([N+](=O)[O-])c(NC3CCN(C4CC4)CC3)cc2N1 ZINC000193754923 473806407 /nfs/dbraw/zinc/80/64/07/473806407.db2.gz KZMBQLCIIOWQQG-UHFFFAOYSA-N 0 3 330.388 2.518 20 5 EFBDHN C[C@H](NCCNC(=O)c1ccccc1F)c1cccc([N+](=O)[O-])c1 ZINC000173342513 473809748 /nfs/dbraw/zinc/80/97/48/473809748.db2.gz DBWHOKIRZRLXTE-LBPRGKRZSA-N 0 3 331.347 2.815 20 5 EFBDHN O=[N+]([O-])c1cnc(N2C[C@H]3CN(Cc4ccccc4)C[C@H]3C2)s1 ZINC000281749026 473826293 /nfs/dbraw/zinc/82/62/93/473826293.db2.gz BUGLGCWICGYKAY-OKILXGFUSA-N 0 3 330.413 2.620 20 5 EFBDHN C[C@@H]1CN(CC2CCN(Cc3ccccc3[N+](=O)[O-])CC2)C[C@H](C)O1 ZINC000263739051 473829671 /nfs/dbraw/zinc/82/96/71/473829671.db2.gz NEAHHEQMGTVEJE-IYBDPMFKSA-N 0 3 347.459 2.916 20 5 EFBDHN C[C@@H]1CN(CC2CCN(c3ccccc3[N+](=O)[O-])CC2)C[C@H](C)O1 ZINC000263766786 473840279 /nfs/dbraw/zinc/84/02/79/473840279.db2.gz RSTLWVMPPBCQJR-GASCZTMLSA-N 0 3 333.432 2.920 20 5 EFBDHN CN(C)Cc1ccccc1CNC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000263829038 473866068 /nfs/dbraw/zinc/86/60/68/473866068.db2.gz XZBAPUJMCHYANE-UHFFFAOYSA-N 0 3 327.384 2.515 20 5 EFBDHN C[C@@H](NC[C@H](O)COc1ccccc1F)c1cccc([N+](=O)[O-])c1 ZINC000180393129 473866233 /nfs/dbraw/zinc/86/62/33/473866233.db2.gz AFGAAVKLGMIZLN-DOMZBBRYSA-N 0 3 334.347 2.824 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](N3CCCC3)C[C@H]2C)c1 ZINC000288264797 473891557 /nfs/dbraw/zinc/89/15/57/473891557.db2.gz GQROWFNNBQNNEX-ZIAGYGMSSA-N 0 3 347.415 2.692 20 5 EFBDHN C[C@H]1C[C@H](N2CCCC2)CN1C(=O)c1cc(F)c([N+](=O)[O-])cc1F ZINC000288360225 473919819 /nfs/dbraw/zinc/91/98/19/473919819.db2.gz KOTXAZNREBNRGA-QWRGUYRKSA-N 0 3 339.342 2.572 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C/CN[C@@H](CO)C[C@H](O)c1ccccc1 ZINC000269934071 473923310 /nfs/dbraw/zinc/92/33/10/473923310.db2.gz NRUQSHUOWVFTEN-UXYGNLPZSA-N 0 3 342.395 2.682 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C/CN[C@H](CO)C[C@@H](O)c1ccccc1 ZINC000269934074 473924149 /nfs/dbraw/zinc/92/41/49/473924149.db2.gz NRUQSHUOWVFTEN-YOZTWPGBSA-N 0 3 342.395 2.682 20 5 EFBDHN C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000288462654 473948720 /nfs/dbraw/zinc/94/87/20/473948720.db2.gz QBLFDIUCUUYEIF-DGCLKSJQSA-N 0 3 337.807 2.947 20 5 EFBDHN COc1cc(CNC[C@@H]2CCCSC2)c([N+](=O)[O-])cc1OC ZINC000288479289 473955162 /nfs/dbraw/zinc/95/51/62/473955162.db2.gz PRZRACSGBCWLIN-NSHDSACASA-N 0 3 326.418 2.845 20 5 EFBDHN CN(C)C1(CN(C)C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CCC1 ZINC000188049312 473962786 /nfs/dbraw/zinc/96/27/86/473962786.db2.gz QADDFYGDDVVLBO-UHFFFAOYSA-N 0 3 344.415 2.561 20 5 EFBDHN CC(C)(CNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)OCCO ZINC000288510760 473965280 /nfs/dbraw/zinc/96/52/80/473965280.db2.gz SWDUNFQKUNMCCJ-UHFFFAOYSA-N 0 3 334.372 2.732 20 5 EFBDHN C[C@H](C(=O)N(C)CC1(N(C)C)CCC1)c1ccc([N+](=O)[O-])cc1F ZINC000188072943 473972835 /nfs/dbraw/zinc/97/28/35/473972835.db2.gz JCKXACZODNBHRZ-LBPRGKRZSA-N 0 3 337.395 2.780 20 5 EFBDHN CSc1ccc(C(=O)N(C)CC2(N(C)C)CCC2)cc1[N+](=O)[O-] ZINC000188079955 473976108 /nfs/dbraw/zinc/97/61/08/473976108.db2.gz GBIKZWUWXMRENS-UHFFFAOYSA-N 0 3 337.445 2.873 20 5 EFBDHN CSc1cccc(C(=O)N(C)CC2CCN(C)CC2)c1[N+](=O)[O-] ZINC000188134319 473995649 /nfs/dbraw/zinc/99/56/49/473995649.db2.gz QMQFJGCQSHXVOI-UHFFFAOYSA-N 0 3 337.445 2.731 20 5 EFBDHN CN(CCc1cccs1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000174154699 473996905 /nfs/dbraw/zinc/99/69/05/473996905.db2.gz VGSFTUOSKUCCOG-CQSZACIVSA-N 0 3 336.413 2.571 20 5 EFBDHN COc1cc(CNC[C@@H]2COc3ccccc32)c([N+](=O)[O-])cc1OC ZINC000288635567 474005928 /nfs/dbraw/zinc/00/59/28/474005928.db2.gz TVNBCBDKNHWDNI-CYBMUJFWSA-N 0 3 344.367 2.878 20 5 EFBDHN COc1cc(CNC[C@H]2COc3ccccc32)c([N+](=O)[O-])cc1OC ZINC000288635569 474006660 /nfs/dbraw/zinc/00/66/60/474006660.db2.gz TVNBCBDKNHWDNI-ZDUSSCGKSA-N 0 3 344.367 2.878 20 5 EFBDHN O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CC[C@@H](N2CCCCC2)C1 ZINC000264488884 474010800 /nfs/dbraw/zinc/01/08/00/474010800.db2.gz IYKWYLANWKDPSP-CQSZACIVSA-N 0 3 342.399 2.777 20 5 EFBDHN C[S@](=O)C1(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000282336748 474027503 /nfs/dbraw/zinc/02/75/03/474027503.db2.gz LVKWZNDVBZKYTA-QHCPKHFHSA-N 0 3 334.397 2.856 20 5 EFBDHN O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CC[C@H](N2CCCCC2)C1 ZINC000264543944 474031541 /nfs/dbraw/zinc/03/15/41/474031541.db2.gz OBPDLIVBRFNLBR-FDMDGMSGSA-N 0 3 329.400 2.695 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@@H](CCO)C1CCCCC1 ZINC000181504122 474042026 /nfs/dbraw/zinc/04/20/26/474042026.db2.gz KHMFZAWJFIUBKV-KRWDZBQOSA-N 0 3 349.431 2.763 20 5 EFBDHN C[C@H](NCCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1cccc(O)c1 ZINC000181521434 474043947 /nfs/dbraw/zinc/04/39/47/474043947.db2.gz ZBKLBQYEPQBYRD-LBPRGKRZSA-N 0 3 329.356 2.980 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N[C@H]2C[C@@H](C)N(C3CC3)C2)cc1[N+](=O)[O-] ZINC000247038186 474044771 /nfs/dbraw/zinc/04/47/71/474044771.db2.gz ULZUEVFEXWPSMS-IPYPFGDCSA-N 0 3 346.431 2.889 20 5 EFBDHN C[C@H]1NC(=O)CC[C@@H]1NCc1cc(=O)oc2ccc3ccccc3c12 ZINC000282416960 474057781 /nfs/dbraw/zinc/05/77/81/474057781.db2.gz QMVNFNASCDUXIH-WBMJQRKESA-N 0 3 336.391 2.703 20 5 EFBDHN C[C@@H](CNc1ccc(C(N)=O)cc1[N+](=O)[O-])N(C)Cc1ccccc1 ZINC000264684117 474086427 /nfs/dbraw/zinc/08/64/27/474086427.db2.gz APIZDRMIWCLIAK-ZDUSSCGKSA-N 0 3 342.399 2.626 20 5 EFBDHN CN(CCc1cccc([N+](=O)[O-])c1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000282566076 474112174 /nfs/dbraw/zinc/11/21/74/474112174.db2.gz ZAQOTHRLPWMXHK-KRWDZBQOSA-N 0 3 345.355 2.711 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000264796800 474130599 /nfs/dbraw/zinc/13/05/99/474130599.db2.gz BOUHROGNUKMPHS-LBPRGKRZSA-N 0 3 325.796 2.852 20 5 EFBDHN CO[C@@H]1CCCC[C@H]1NCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000275299840 474135559 /nfs/dbraw/zinc/13/55/59/474135559.db2.gz ZIBQVCUJCQBPHX-TZMCWYRMSA-N 0 3 341.795 2.734 20 5 EFBDHN CN(C)Cc1ccc(CNC(=O)/C=C\c2ccccc2[N+](=O)[O-])cc1 ZINC000214393534 474136309 /nfs/dbraw/zinc/13/63/09/474136309.db2.gz ULARHIXOIMMFCR-QXMHVHEDSA-N 0 3 339.395 2.986 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CCN(C)C[C@@H]2C)c1 ZINC000247419270 474143642 /nfs/dbraw/zinc/14/36/42/474143642.db2.gz NUQJJRVSENFZDI-SMDDNHRTSA-N 0 3 337.445 2.729 20 5 EFBDHN CC(C)OCCN1CCC(Nc2c3c(ccc2[N+](=O)[O-])NCC3)CC1 ZINC000275356975 474156801 /nfs/dbraw/zinc/15/68/01/474156801.db2.gz KRWSSIZBBHVIAT-UHFFFAOYSA-N 0 3 348.447 2.864 20 5 EFBDHN Cc1nn(C)c(C)c1[C@H]1OCC[C@@H]1NCc1ccc([N+](=O)[O-])cc1C ZINC000275377230 474164505 /nfs/dbraw/zinc/16/45/05/474164505.db2.gz YGAYATPAQCFLPA-WMZOPIPTSA-N 0 3 344.415 2.873 20 5 EFBDHN Cc1ccc([C@H](C)NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1 ZINC000182394273 474165103 /nfs/dbraw/zinc/16/51/03/474165103.db2.gz HBHXYUBKTGALCP-HOCLYGCPSA-N 0 3 330.384 2.994 20 5 EFBDHN Cc1ccc([C@@H](C)NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1 ZINC000182394254 474165265 /nfs/dbraw/zinc/16/52/65/474165265.db2.gz HBHXYUBKTGALCP-ZBFHGGJFSA-N 0 3 330.384 2.994 20 5 EFBDHN C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000247520674 474171471 /nfs/dbraw/zinc/17/14/71/474171471.db2.gz WKSJSZZNUJTDPV-MLGOLLRUSA-N 0 3 346.431 2.581 20 5 EFBDHN CN(C)CCOc1cc(CNc2cccc(F)c2[N+](=O)[O-])ccn1 ZINC000270618334 474192542 /nfs/dbraw/zinc/19/25/42/474192542.db2.gz BQYOWOVOXMMFAS-UHFFFAOYSA-N 0 3 334.351 2.681 20 5 EFBDHN COCCn1cc(CN[C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cn1 ZINC000282825794 474209630 /nfs/dbraw/zinc/20/96/30/474209630.db2.gz RZYIGGWCXGDKIU-KRWDZBQOSA-N 0 3 344.415 2.549 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@@H](C)C(=O)NCCF ZINC000282842239 474215367 /nfs/dbraw/zinc/21/53/67/474215367.db2.gz SUFLKTFUKSQZLN-NWDGAFQWSA-N 0 3 343.424 2.529 20 5 EFBDHN CC(=O)c1ccc(NC2CCN(C[C@H]3CCOC3)CC2)c([N+](=O)[O-])c1 ZINC000265503897 474237328 /nfs/dbraw/zinc/23/73/28/474237328.db2.gz NPHQFSGBKMFURN-CQSZACIVSA-N 0 3 347.415 2.710 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@@H]3CN(C)CC[C@@H]32)c1 ZINC000282947034 474250870 /nfs/dbraw/zinc/25/08/70/474250870.db2.gz YWJLHNIZTJAAEL-CJNGLKHVSA-N 0 3 347.415 2.550 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@@H](N2CCCCC2)C1 ZINC000275610323 474251103 /nfs/dbraw/zinc/25/11/03/474251103.db2.gz IILDIIWRKWRFFR-OAHLLOKOSA-N 0 3 332.404 2.995 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC[C@H](Cn2cncn2)C1 ZINC000182790644 474255446 /nfs/dbraw/zinc/25/54/46/474255446.db2.gz GXPSBBMWUJAUTP-GJZGRUSLSA-N 0 3 329.404 2.968 20 5 EFBDHN O=[N+]([O-])c1ccc(OC2CCN(CCCn3ccnc3)CC2)cc1 ZINC000182803137 474259691 /nfs/dbraw/zinc/25/96/91/474259691.db2.gz XRVMOSWEJYDPIU-UHFFFAOYSA-N 0 3 330.388 2.725 20 5 EFBDHN CN(C)[C@H](CNc1nc2sccn2c1[N+](=O)[O-])Cc1ccccc1 ZINC000248146040 474269536 /nfs/dbraw/zinc/26/95/36/474269536.db2.gz VWJUBLXOSXJLCC-ZDUSSCGKSA-N 0 3 345.428 2.889 20 5 EFBDHN C[C@H]1C[C@@H](N(C)c2c([N+](=O)[O-])ncn2C)CCN1Cc1ccccc1 ZINC000265624416 474272851 /nfs/dbraw/zinc/27/28/51/474272851.db2.gz YMESTFKSJKOAKB-HOCLYGCPSA-N 0 3 343.431 2.818 20 5 EFBDHN CN(C)CCN(Cc1cccs1)C(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000175655057 474275144 /nfs/dbraw/zinc/27/51/44/474275144.db2.gz CGTZYRHFCQYEQU-UHFFFAOYSA-N 0 3 347.440 2.789 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CNCCN3CCCOCC3)o2)cc1 ZINC000289451342 474276090 /nfs/dbraw/zinc/27/60/90/474276090.db2.gz NDQWBRCMGFWQJT-UHFFFAOYSA-N 0 3 345.399 2.667 20 5 EFBDHN O=C(CCN1CCC([C@@H]2CCCO2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000189137502 474303656 /nfs/dbraw/zinc/30/36/56/474303656.db2.gz MRCGSVNKTFKSCS-KRWDZBQOSA-N 0 3 347.415 2.814 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)NCCN2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000175781102 474306346 /nfs/dbraw/zinc/30/63/46/474306346.db2.gz RHGNODVFZKOJRK-HNNXBMFYSA-N 0 3 348.447 2.995 20 5 EFBDHN CNC(=O)CC[C@H]1CCCCN1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000289532372 474310507 /nfs/dbraw/zinc/31/05/07/474310507.db2.gz HSHMPDSRWQPRRL-IQIBNGDESA-N 0 3 331.416 2.989 20 5 EFBDHN O=C(c1cc(F)ccc1[N+](=O)[O-])N1CCCN(C2CCCC2)CC1 ZINC000265728427 474312027 /nfs/dbraw/zinc/31/20/27/474312027.db2.gz PPSRISVRHWMUAR-UHFFFAOYSA-N 0 3 335.379 2.824 20 5 EFBDHN C[C@@H]1CN(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)[C@H]2CCCC[C@@H]12 ZINC000248417176 474315514 /nfs/dbraw/zinc/31/55/14/474315514.db2.gz JHPIIKDHHKWCBP-COXVUDFISA-N 0 3 343.427 2.994 20 5 EFBDHN CN(C)C1(CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)CCC1 ZINC000275847838 474340479 /nfs/dbraw/zinc/34/04/79/474340479.db2.gz HOSKHQAPFQOXBY-UHFFFAOYSA-N 0 3 337.395 2.612 20 5 EFBDHN C[C@@H]1CCCN(CCNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000265825746 474352520 /nfs/dbraw/zinc/35/25/20/474352520.db2.gz RYCWOHKUMPNHRS-CQSZACIVSA-N 0 3 333.432 2.721 20 5 EFBDHN C[C@H](C(=O)N1CCC[C@H]2CN(C)CC[C@H]21)c1ccc([N+](=O)[O-])cc1F ZINC000248550997 474353566 /nfs/dbraw/zinc/35/35/66/474353566.db2.gz GOIRZPLRVAKOSR-GDZNZVCISA-N 0 3 349.406 2.780 20 5 EFBDHN C[C@H](CN1CCCCC1)NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000265834619 474354914 /nfs/dbraw/zinc/35/49/14/474354914.db2.gz UCDNTJJQVMKQHX-CQSZACIVSA-N 0 3 333.432 2.863 20 5 EFBDHN C[C@H](C(=O)N1C[C@@H]2CCCN2C[C@@H]1C)c1ccc([N+](=O)[O-])cc1F ZINC000248585850 474366491 /nfs/dbraw/zinc/36/64/91/474366491.db2.gz PWYYVGRQRBJEBX-OBJOEFQTSA-N 0 3 335.379 2.533 20 5 EFBDHN CC1(C)CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1[C@H]1CCCO1 ZINC000289667841 474370116 /nfs/dbraw/zinc/37/01/16/474370116.db2.gz GZQNOKSSPFAYOK-NVXWUHKLSA-N 0 3 347.415 2.813 20 5 EFBDHN CC1(C)CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1[C@@H]1CCCO1 ZINC000289667837 474370288 /nfs/dbraw/zinc/37/02/88/474370288.db2.gz GZQNOKSSPFAYOK-DOTOQJQBSA-N 0 3 347.415 2.813 20 5 EFBDHN Cn1cc(CN2CC[C@H](O)C(C)(C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000275976265 474377841 /nfs/dbraw/zinc/37/78/41/474377841.db2.gz MBOQVVFASXOTEL-INIZCTEOSA-N 0 3 344.415 2.588 20 5 EFBDHN Cc1c2ccccc2oc1[C@H](C)NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000183536345 474389806 /nfs/dbraw/zinc/38/98/06/474389806.db2.gz YHBJYQHLBNTRNR-JSGCOSHPSA-N 0 3 344.371 2.558 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])o2)CCN1Cc1ccccc1 ZINC000176126965 474390809 /nfs/dbraw/zinc/39/08/09/474390809.db2.gz PNILHWGXUBTCTA-DZGCQCFKSA-N 0 3 343.383 2.971 20 5 EFBDHN C[C@H]1CN(CC(C)(C)O)CCN1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000189434121 474394998 /nfs/dbraw/zinc/39/49/98/474394998.db2.gz STDNHUKSWBUWLS-LBPRGKRZSA-N 0 3 341.839 2.525 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CCC(Nc3ccc(F)cc3)CC2)n1 ZINC000176225003 474413779 /nfs/dbraw/zinc/41/37/79/474413779.db2.gz UKJSOBKDQISYAK-UHFFFAOYSA-N 0 3 333.367 2.507 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])NCC(=O)NC(C)C ZINC000271168668 474416403 /nfs/dbraw/zinc/41/64/03/474416403.db2.gz TUYKMIDAENIKTQ-GFCCVEGCSA-N 0 3 325.434 2.580 20 5 EFBDHN CCS[C@@H]1CCCC[C@H]1NCc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000189489885 474417417 /nfs/dbraw/zinc/41/74/17/474417417.db2.gz UHDNMWHOOTXDLT-UKRRQHHQSA-N 0 3 337.445 2.848 20 5 EFBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])NC[C@@H](O)C(F)(F)F ZINC000271173822 474420970 /nfs/dbraw/zinc/42/09/70/474420970.db2.gz UTQHFZUKEADJRC-JOYOIKCWSA-N 0 3 338.351 2.978 20 5 EFBDHN COC[C@]1(CNCc2ccc([N+](=O)[O-])cc2)OCCc2ccccc21 ZINC000289780422 474424796 /nfs/dbraw/zinc/42/47/96/474424796.db2.gz JNHTUPMFSPIHQY-IBGZPJMESA-N 0 3 342.395 2.799 20 5 EFBDHN C[C@H](N[C@@H](C)[C@@H]1CCOC1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000266280932 474428080 /nfs/dbraw/zinc/42/80/80/474428080.db2.gz GMTVTIGOHLHYIE-GARJFASQSA-N 0 3 341.795 2.590 20 5 EFBDHN COc1cc(CN2CC[C@@H](N3CCCCC3)C2)c([N+](=O)[O-])cc1OC ZINC000271185360 474428549 /nfs/dbraw/zinc/42/85/49/474428549.db2.gz ZEONWYFHPGHCEL-OAHLLOKOSA-N 0 3 349.431 2.672 20 5 EFBDHN C[C@@H](CCc1ccccc1[N+](=O)[O-])NCc1nnc2n1CCCC2 ZINC000183871225 474439687 /nfs/dbraw/zinc/43/96/87/474439687.db2.gz KRPOJGZMOHXMES-ZDUSSCGKSA-N 0 3 329.404 2.634 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@H]1CN(C2CC2)C[C@H]1C ZINC000271230142 474452988 /nfs/dbraw/zinc/45/29/88/474452988.db2.gz CYONAWOCDOGREQ-DOMZBBRYSA-N 0 3 331.416 2.733 20 5 EFBDHN Cc1nn(C)c2ncc(CNCCc3ccccc3[N+](=O)[O-])cc12 ZINC000237849922 474487033 /nfs/dbraw/zinc/48/70/33/474487033.db2.gz VLUGRNKOEFZDSR-UHFFFAOYSA-N 0 3 325.372 2.517 20 5 EFBDHN Cc1nc([C@H]2CCCN(CC=Cc3ccccc3[N+](=O)[O-])C2)n[nH]1 ZINC000271341618 474499876 /nfs/dbraw/zinc/49/98/76/474499876.db2.gz OLGRDYSRTOUTBY-SZTZYQKNSA-N 0 3 327.388 2.914 20 5 EFBDHN Cc1n[nH]c([C@H]2CCCN(CC=Cc3ccccc3[N+](=O)[O-])C2)n1 ZINC000271341618 474499883 /nfs/dbraw/zinc/49/98/83/474499883.db2.gz OLGRDYSRTOUTBY-SZTZYQKNSA-N 0 3 327.388 2.914 20 5 EFBDHN Cc1nnc([C@H]2CCCN(CC=Cc3ccccc3[N+](=O)[O-])C2)[nH]1 ZINC000271341618 474499891 /nfs/dbraw/zinc/49/98/91/474499891.db2.gz OLGRDYSRTOUTBY-SZTZYQKNSA-N 0 3 327.388 2.914 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N(C)C[C@H]2CCCN(C)C2)cc1[N+](=O)[O-] ZINC000176720438 474520162 /nfs/dbraw/zinc/52/01/62/474520162.db2.gz YTAUULFGDGJPEX-GJZGRUSLSA-N 0 3 348.447 2.947 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N(C)CC2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000176721185 474520314 /nfs/dbraw/zinc/52/03/14/474520314.db2.gz BFKDKKDNDRCAGI-AWEZNQCLSA-N 0 3 348.447 2.947 20 5 EFBDHN N[C@@H](CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccccc1 ZINC000238041094 474525357 /nfs/dbraw/zinc/52/53/57/474525357.db2.gz DQARBHKYLYIUPL-HNNXBMFYSA-N 0 3 340.383 2.599 20 5 EFBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CNCC2(O)CCCCC2)c1 ZINC000238133544 474538009 /nfs/dbraw/zinc/53/80/09/474538009.db2.gz RGHPRNFJMXHSAS-UHFFFAOYSA-N 0 3 330.331 2.981 20 5 EFBDHN COC[C@@H](Cc1ccccc1)NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000266937347 474538179 /nfs/dbraw/zinc/53/81/79/474538179.db2.gz BGHLSYAASDUXIC-MRXNPFEDSA-N 0 3 330.384 2.951 20 5 EFBDHN Cn1cccc1[C@@H]1CCCN1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000249330243 474557650 /nfs/dbraw/zinc/55/76/50/474557650.db2.gz OTZKATLGKXCUDX-QAPCUYQASA-N 0 3 345.399 2.510 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](CC(C)C)N(C)C)c1 ZINC000284085289 474568726 /nfs/dbraw/zinc/56/87/26/474568726.db2.gz SIYVBUAEABQLQE-ZDUSSCGKSA-N 0 3 337.420 2.700 20 5 EFBDHN CC[C@H](N[C@H]1CCC[C@H](S(C)(=O)=O)C1)c1cccc([N+](=O)[O-])c1 ZINC000271506502 474573878 /nfs/dbraw/zinc/57/38/78/474573878.db2.gz NYOJOLONMJMHMJ-BPUTZDHNSA-N 0 3 340.445 2.991 20 5 EFBDHN COc1ccc([C@H](CN(C)C)NC(=O)c2csc([N+](=O)[O-])c2)cc1 ZINC000284105305 474573963 /nfs/dbraw/zinc/57/39/63/474573963.db2.gz BYGITWYGUZRKLC-AWEZNQCLSA-N 0 3 349.412 2.698 20 5 EFBDHN C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000245393130 474577661 /nfs/dbraw/zinc/57/76/61/474577661.db2.gz VIKHARKQUPZNOM-KGLIPLIRSA-N 0 3 334.420 2.514 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(NC2CCN(CCOC(C)C)CC2)c1 ZINC000267065650 474579615 /nfs/dbraw/zinc/57/96/15/474579615.db2.gz PWXXCDFHWQVELR-UHFFFAOYSA-N 0 3 337.420 2.905 20 5 EFBDHN CN(C)[C@@]1(CNc2ccc([N+](=O)[O-])c3cccnc23)CCSC1 ZINC000267151403 474602688 /nfs/dbraw/zinc/60/26/88/474602688.db2.gz ZYJOLTHGHLPAPE-MRXNPFEDSA-N 0 3 332.429 2.992 20 5 EFBDHN CC(C)C[C@@]1(CO)CCCN1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000284282675 474610395 /nfs/dbraw/zinc/61/03/95/474610395.db2.gz YDIJUZKKOQIOPK-MRXNPFEDSA-N 0 3 337.376 2.876 20 5 EFBDHN C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000249758891 474611929 /nfs/dbraw/zinc/61/19/29/474611929.db2.gz FTIKXTKHZQZMRQ-KGLIPLIRSA-N 0 3 334.420 2.514 20 5 EFBDHN CCNC(=O)C[C@@H]1CCCCN1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000284295360 474612514 /nfs/dbraw/zinc/61/25/14/474612514.db2.gz BGSOMEBESVXPCR-DYLHUKMJSA-N 0 3 331.416 2.989 20 5 EFBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN[C@H]1CCCC[C@H]1C(N)=O ZINC000184828494 474615409 /nfs/dbraw/zinc/61/54/09/474615409.db2.gz FOHLLWMWOXWDLC-CABCVRRESA-N 0 3 335.404 2.516 20 5 EFBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN[C@@H]1CCCC[C@@H]1C(N)=O ZINC000184828436 474615628 /nfs/dbraw/zinc/61/56/28/474615628.db2.gz FOHLLWMWOXWDLC-LSDHHAIUSA-N 0 3 335.404 2.516 20 5 EFBDHN CS[C@@H]1CN(c2c3c(ccc2[N+](=O)[O-])NCC3)C[C@@H]1N1CCCC1 ZINC000278348554 474616874 /nfs/dbraw/zinc/61/68/74/474616874.db2.gz JKYVTZDWPZBIJC-JKSUJKDBSA-N 0 3 348.472 2.579 20 5 EFBDHN Cc1cc(NC[C@@H]2CC(=O)N(C3CC3)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000272884837 474634018 /nfs/dbraw/zinc/63/40/18/474634018.db2.gz WJPXQDMLIPMWNE-LBPRGKRZSA-N 0 3 340.383 2.874 20 5 EFBDHN CC(C)CC[C@@H](C)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000272904529 474637696 /nfs/dbraw/zinc/63/76/96/474637696.db2.gz FAYYONMTUCHHPS-CYBMUJFWSA-N 0 3 328.434 2.783 20 5 EFBDHN CC(C)N1CCCN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])CC1 ZINC000267327185 474649329 /nfs/dbraw/zinc/64/93/29/474649329.db2.gz ABHHPBIGDIIHSF-UHFFFAOYSA-N 0 3 325.796 2.805 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000272957016 474650433 /nfs/dbraw/zinc/65/04/33/474650433.db2.gz NDGXUKOWYGBOPG-QWHCGFSZSA-N 0 3 349.456 2.842 20 5 EFBDHN Cc1cccc(CN(C)C[C@@H](O)COc2ccccc2[N+](=O)[O-])c1 ZINC000272976230 474656269 /nfs/dbraw/zinc/65/62/69/474656269.db2.gz WZCGCBJCPNEYRJ-MRXNPFEDSA-N 0 3 330.384 2.775 20 5 EFBDHN C[C@@H]1CN(CCC2CCN(c3ncccc3[N+](=O)[O-])CC2)C[C@H](C)O1 ZINC000267434822 474669697 /nfs/dbraw/zinc/66/96/97/474669697.db2.gz XNPSTVWMXHAEOD-GASCZTMLSA-N 0 3 348.447 2.706 20 5 EFBDHN CC(C)N(Cc1ccco1)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000273011260 474671113 /nfs/dbraw/zinc/67/11/13/474671113.db2.gz JFVPVSWSIQYPPF-AWEZNQCLSA-N 0 3 334.372 2.838 20 5 EFBDHN Cc1nn(C[C@@H]2CN(Cc3ccccc3)CCCO2)c(C)c1[N+](=O)[O-] ZINC000278510238 474671747 /nfs/dbraw/zinc/67/17/47/474671747.db2.gz DYZNJMDPRFZGRJ-KRWDZBQOSA-N 0 3 344.415 2.699 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN(Cc2ccccc2)CC2(O)CCCC2)c1 ZINC000305054095 474676105 /nfs/dbraw/zinc/67/61/05/474676105.db2.gz INVHMVDFGKDFBP-UHFFFAOYSA-N 0 3 344.415 2.599 20 5 EFBDHN C[C@@H](N[C@@H]1CCCN(c2ccnn2C)C1)c1cccc([N+](=O)[O-])c1 ZINC000278537015 474686998 /nfs/dbraw/zinc/68/69/98/474686998.db2.gz URNMZADBGOOWSY-UKRRQHHQSA-N 0 3 329.404 2.648 20 5 EFBDHN CC(C)(NC[C@@H](O)COc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000273041658 474687067 /nfs/dbraw/zinc/68/70/67/474687067.db2.gz PBVOBXDWGWZLCA-OAHLLOKOSA-N 0 3 330.384 2.859 20 5 EFBDHN C[C@H]1CN(C2CCOCC2)CCN1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000278538676 474689839 /nfs/dbraw/zinc/68/98/39/474689839.db2.gz CJCSELGIFHVJIX-NBUZRDOWSA-N 0 3 345.443 2.793 20 5 EFBDHN COc1cc(C[NH2+]C[C@H](CO)C2CCCCC2)c([N+](=O)[O-])cc1[O-] ZINC000292877905 474690922 /nfs/dbraw/zinc/69/09/22/474690922.db2.gz BUZFWVDBBMHAQX-CQSZACIVSA-N 0 3 338.404 2.587 20 5 EFBDHN CC(C)C[C@H](CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)N(C)C ZINC000344364978 474690992 /nfs/dbraw/zinc/69/09/92/474690992.db2.gz XIZPBFKMTYOYGQ-CYBMUJFWSA-N 0 3 332.404 2.782 20 5 EFBDHN CC(C)[C@H]1N(C[C@H](O)COc2ccccc2[N+](=O)[O-])CC12CCC2 ZINC000291796126 474691929 /nfs/dbraw/zinc/69/19/29/474691929.db2.gz AHDBNTHIBFNIJI-WMLDXEAASA-N 0 3 334.416 2.845 20 5 EFBDHN O=[N+]([O-])c1c(F)cccc1NCc1ccccc1CN1CC[C@@H](O)C1 ZINC000273050947 474693471 /nfs/dbraw/zinc/69/34/71/474693471.db2.gz BNBKVUJSPMTQNZ-OAHLLOKOSA-N 0 3 345.374 2.913 20 5 EFBDHN Cc1ccc([C@H](C)N[C@H]2CCCN(c3ccnn3C)C2)cc1[N+](=O)[O-] ZINC000278549519 474694737 /nfs/dbraw/zinc/69/47/37/474694737.db2.gz VSIKJNSYIPTZLN-HOCLYGCPSA-N 0 3 343.431 2.956 20 5 EFBDHN C[C@@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)C1=CCN(C)CC1 ZINC000273058850 474696668 /nfs/dbraw/zinc/69/66/68/474696668.db2.gz YFCVXAGADJSUDV-LLVKDONJSA-N 0 3 329.356 2.721 20 5 EFBDHN CCN1CCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000292905761 474707093 /nfs/dbraw/zinc/70/70/93/474707093.db2.gz XVZIXSIDKASLOQ-LLVKDONJSA-N 0 3 345.321 2.828 20 5 EFBDHN CO[C@]1(C)C[C@H](N[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1(C)C ZINC000340854697 474718665 /nfs/dbraw/zinc/71/86/65/474718665.db2.gz WHAXNXMMJCGWDO-HYSWKAIVSA-N 0 3 335.404 2.715 20 5 EFBDHN CN1CCN(CCc2ccc([N+](=O)[O-])cc2)C[C@@H]1Cc1ccccc1 ZINC000284679314 474718807 /nfs/dbraw/zinc/71/88/07/474718807.db2.gz GXRBBKFRKNIRKT-FQEVSTJZSA-N 0 3 339.439 2.996 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CC[C@@H](Oc3ccc(Cl)cc3)C2)n1 ZINC000292945683 474727739 /nfs/dbraw/zinc/72/77/39/474727739.db2.gz DNWJYPCTLOCEAL-CQSZACIVSA-N 0 3 336.779 2.598 20 5 EFBDHN CC(C)(CNC(=O)NCCc1ccccc1[N+](=O)[O-])N1CCCCC1 ZINC000340861675 474728010 /nfs/dbraw/zinc/72/80/10/474728010.db2.gz SIPVQZPWXLGRDJ-UHFFFAOYSA-N 0 3 348.447 2.701 20 5 EFBDHN CN(Cc1ccccc1)C[C@@H](O)COc1ccc(F)cc1[N+](=O)[O-] ZINC000305301760 474728884 /nfs/dbraw/zinc/72/88/84/474728884.db2.gz JSFAMNNZLGSZIA-OAHLLOKOSA-N 0 3 334.347 2.606 20 5 EFBDHN Cc1ccc(OC[C@@H](O)CN(C)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000305314611 474729219 /nfs/dbraw/zinc/72/92/19/474729219.db2.gz MNVIZUGQMDIXQQ-INIZCTEOSA-N 0 3 330.384 2.775 20 5 EFBDHN CN(Cc1ccccc1)C[C@H](O)COc1cc(F)cc([N+](=O)[O-])c1 ZINC000305325092 474730758 /nfs/dbraw/zinc/73/07/58/474730758.db2.gz OXRMKZJQRSOQSE-INIZCTEOSA-N 0 3 334.347 2.606 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H](C)CN2CCCCC2)c1 ZINC000344419041 474738294 /nfs/dbraw/zinc/73/82/94/474738294.db2.gz LILLNTWZOZNZJM-OAHLLOKOSA-N 0 3 349.431 2.663 20 5 EFBDHN Cc1cccc([C@@H]2CCN(CCn3cc([N+](=O)[O-])ccc3=O)C2)c1 ZINC000273150240 474742878 /nfs/dbraw/zinc/74/28/78/474742878.db2.gz XIYDBLWTSRSBFA-MRXNPFEDSA-N 0 3 327.384 2.554 20 5 EFBDHN C[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F)N(C)C1CC1 ZINC000293013984 474767377 /nfs/dbraw/zinc/76/73/77/474767377.db2.gz KQTTUPJKXFKGEL-SECBINFHSA-N 0 3 345.321 2.826 20 5 EFBDHN C[C@H]1CN(C(=O)Nc2cccc([N+](=O)[O-])c2)CCN(C2CCC2)C1 ZINC000291969972 474779106 /nfs/dbraw/zinc/77/91/06/474779106.db2.gz XONJJUKCRWHVJI-CYBMUJFWSA-N 0 3 332.404 2.933 20 5 EFBDHN O=C(CCN1CCC(C(F)F)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000337211446 474787278 /nfs/dbraw/zinc/78/72/78/474787278.db2.gz DLCUBDIOKVSGPM-UHFFFAOYSA-N 0 3 327.331 2.901 20 5 EFBDHN COc1ccc([C@H](C)NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1 ZINC000273225398 474788471 /nfs/dbraw/zinc/78/84/71/474788471.db2.gz VNVYMFLHXBKHEN-ZFWWWQNUSA-N 0 3 346.383 2.694 20 5 EFBDHN CO[C@@H](CNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000293056557 474789595 /nfs/dbraw/zinc/78/95/95/474789595.db2.gz RXBUXKUKGSIEOW-INIZCTEOSA-N 0 3 330.388 2.510 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCN2CC[C@@](CO)(c3ccccc3)C2)c1 ZINC000291996714 474793199 /nfs/dbraw/zinc/79/31/99/474793199.db2.gz XCQGVRYAIDESFD-LJQANCHMSA-N 0 3 342.395 2.610 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N[C@@H]2CN(C3CC3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000268096317 474795859 /nfs/dbraw/zinc/79/58/59/474795859.db2.gz CQKUPOYSXXTXBE-DVOMOZLQSA-N 0 3 346.431 2.746 20 5 EFBDHN C[C@@H](CNC(=O)NCCc1ccccc1[N+](=O)[O-])N1CCC[C@@H](C)C1 ZINC000340940345 474800477 /nfs/dbraw/zinc/80/04/77/474800477.db2.gz RBCPWAWBLIOMOC-CABCVRRESA-N 0 3 348.447 2.557 20 5 EFBDHN COc1cccc([C@H](C)NC[C@@H](O)COc2ccccc2[N+](=O)[O-])c1 ZINC000273253616 474805487 /nfs/dbraw/zinc/80/54/87/474805487.db2.gz YPXXNPYLUKMFQS-DZGCQCFKSA-N 0 3 346.383 2.694 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@H](C)C[S@@](C)=O ZINC000273257473 474806522 /nfs/dbraw/zinc/80/65/22/474806522.db2.gz MDBUJMTUOJWMPF-JWCBKOKGSA-N 0 3 330.475 2.822 20 5 EFBDHN NC(=O)CCN(C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000255123907 474808729 /nfs/dbraw/zinc/80/87/29/474808729.db2.gz AIOYAHSDZBNESF-POHAHGRESA-N 0 3 339.395 2.986 20 5 EFBDHN CC(C)[C@@H]1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CCCO1 ZINC000293096573 474811691 /nfs/dbraw/zinc/81/16/91/474811691.db2.gz KSRDOKXKCJVHTJ-INIZCTEOSA-N 0 3 335.404 2.670 20 5 EFBDHN CN(C)CCOc1cccc(NC(=O)Cc2ccccc2[N+](=O)[O-])c1 ZINC000337236843 474812626 /nfs/dbraw/zinc/81/26/26/474812626.db2.gz CMDNWSAHDJHQEY-UHFFFAOYSA-N 0 3 343.383 2.716 20 5 EFBDHN C[C@H]1CN(C2CC2)C[C@H]1NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000268129932 474814430 /nfs/dbraw/zinc/81/44/30/474814430.db2.gz PGIAYDKXCLOTKJ-LKFCYVNXSA-N 0 3 338.795 2.852 20 5 EFBDHN C[C@@]1(CNc2ncc([N+](=O)[O-])cn2)CCN(Cc2ccccc2)C1 ZINC000310330793 474825493 /nfs/dbraw/zinc/82/54/93/474825493.db2.gz ADZJBRQEICAHCA-KRWDZBQOSA-N 0 3 327.388 2.709 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C\CN1CCC(CN2CCOCC2)CC1 ZINC000255294942 474828838 /nfs/dbraw/zinc/82/88/38/474828838.db2.gz FIUCOIORIZAYQW-HYXAFXHYSA-N 0 3 345.443 2.652 20 5 EFBDHN Cc1ccc([C@@H]2C[C@@H](C)N(CCn3cc([N+](=O)[O-])ccc3=O)C2)cc1 ZINC000278809513 474846273 /nfs/dbraw/zinc/84/62/73/474846273.db2.gz ZYYVWLJZFINDRD-NVXWUHKLSA-N 0 3 341.411 2.943 20 5 EFBDHN C[C@H](C1CCN(C)CC1)N(C)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000273383582 474872399 /nfs/dbraw/zinc/87/23/99/474872399.db2.gz ISUSMLWTRIBCHV-CQSZACIVSA-N 0 3 348.447 2.509 20 5 EFBDHN O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CCC[C@@H]1CN1CCCC1 ZINC000273456978 474908090 /nfs/dbraw/zinc/90/80/90/474908090.db2.gz MBPDVLMLCFVQKB-CYBMUJFWSA-N 0 3 336.367 2.826 20 5 EFBDHN CCc1[n-]nc(-c2nc(-c3ccc(C[NH+](C)C)cc3)no2)c1[N+](=O)[O-] ZINC000278912773 474910616 /nfs/dbraw/zinc/91/06/16/474910616.db2.gz JRMMVZCAOFTOBJ-UHFFFAOYSA-N 0 3 342.359 2.659 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)NCCN1CCCCCC1 ZINC000337353283 474928863 /nfs/dbraw/zinc/92/88/63/474928863.db2.gz BGIDQCZFTWMOBG-UHFFFAOYSA-N 0 3 336.392 2.601 20 5 EFBDHN CN(CCc1ccccc1[N+](=O)[O-])C[C@@H](O)COc1ccccc1 ZINC000285229390 474936729 /nfs/dbraw/zinc/93/67/29/474936729.db2.gz FWETZYFMBQDOPR-MRXNPFEDSA-N 0 3 330.384 2.509 20 5 EFBDHN CC[C@H](NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)c1ccc(Cl)s1 ZINC000273513354 474939114 /nfs/dbraw/zinc/93/91/14/474939114.db2.gz PAVFPWOJPKXJRQ-MNOVXSKESA-N 0 3 344.824 2.608 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000273516789 474940945 /nfs/dbraw/zinc/94/09/45/474940945.db2.gz XVHJLJZOQMWNGY-YPMHNXCESA-N 0 3 336.367 2.824 20 5 EFBDHN CS[C@H]1CN(C(=O)c2ccc(C)c([N+](=O)[O-])c2)C[C@@H]1N1CCCC1 ZINC000273545218 474956178 /nfs/dbraw/zinc/95/61/78/474956178.db2.gz UNKISNZTVXEPJI-HOTGVXAUSA-N 0 3 349.456 2.555 20 5 EFBDHN Cc1ccc(OC[C@H](O)CNCc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000324597559 474972437 /nfs/dbraw/zinc/97/24/37/474972437.db2.gz HLCONEYJBRKSKV-QGZVFWFLSA-N 0 3 330.384 2.741 20 5 EFBDHN CCN(CC)[C@H](CNc1ncc([N+](=O)[O-])cn1)c1cccc(OC)c1 ZINC000273601635 474983918 /nfs/dbraw/zinc/98/39/18/474983918.db2.gz JOXFZZHCQFNTIT-MRXNPFEDSA-N 0 3 345.403 2.888 20 5 EFBDHN CN(CCN(C)C1CC1)C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000293477483 474999284 /nfs/dbraw/zinc/99/92/84/474999284.db2.gz LEWYOMYNONVVSA-UHFFFAOYSA-N 0 3 345.321 2.780 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)CC[C@H]1Nc1ncc([N+](=O)[O-])cn1 ZINC000273665830 475004966 /nfs/dbraw/zinc/00/49/66/475004966.db2.gz WXFNJBZKTBVMRX-CZUORRHYSA-N 0 3 327.388 2.707 20 5 EFBDHN Cc1nc(N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)ccc1[N+](=O)[O-] ZINC000268515248 475026733 /nfs/dbraw/zinc/02/67/33/475026733.db2.gz SZNXSXYWOSBYNQ-ZIAGYGMSSA-N 0 3 348.447 2.624 20 5 EFBDHN Cc1nc(N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)ccc1[N+](=O)[O-] ZINC000268515243 475027043 /nfs/dbraw/zinc/02/70/43/475027043.db2.gz SZNXSXYWOSBYNQ-OKILXGFUSA-N 0 3 348.447 2.624 20 5 EFBDHN C[C@H](NC(=O)NC(C)(C)c1ccccc1[N+](=O)[O-])C1=CCN(C)CC1 ZINC000292443030 475028963 /nfs/dbraw/zinc/02/89/63/475028963.db2.gz XEWMIVPKGSGAAR-ZDUSSCGKSA-N 0 3 346.431 2.780 20 5 EFBDHN CCN1CCCN(c2cc(Cl)c(C(=O)OC)cc2[N+](=O)[O-])CC1 ZINC000268808298 475043807 /nfs/dbraw/zinc/04/38/07/475043807.db2.gz LIMKWZIKBROXDC-UHFFFAOYSA-N 0 3 341.795 2.567 20 5 EFBDHN Cc1cc(N2CCN(C3CCOCC3)C[C@@H]2C)c(F)cc1[N+](=O)[O-] ZINC000292500613 475059039 /nfs/dbraw/zinc/05/90/39/475059039.db2.gz FQLNODVZVSTCPM-ZDUSSCGKSA-N 0 3 337.395 2.732 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCN1CCCC[C@@H]1c1ccccc1 ZINC000273839847 475075327 /nfs/dbraw/zinc/07/53/27/475075327.db2.gz JFUQJBQYGXRGKP-QGZVFWFLSA-N 0 3 327.384 2.984 20 5 EFBDHN C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000273886010 475100433 /nfs/dbraw/zinc/10/04/33/475100433.db2.gz UHWBXPLRBOIFFN-ZBEGNZNMSA-N 0 3 349.406 2.610 20 5 EFBDHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000273886002 475101931 /nfs/dbraw/zinc/10/19/31/475101931.db2.gz UHWBXPLRBOIFFN-BDJLRTHQSA-N 0 3 349.406 2.610 20 5 EFBDHN C[C@@H](CN(C)C)NC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1 ZINC000287347386 475106699 /nfs/dbraw/zinc/10/66/99/475106699.db2.gz ZIVRIBOVZQYHQP-AWEZNQCLSA-N 0 3 348.447 2.511 20 5 EFBDHN COc1cc(CN[C@H]2CCOC3(CCC3)C2)c([N+](=O)[O-])cc1OC ZINC000268999175 475120520 /nfs/dbraw/zinc/12/05/20/475120520.db2.gz ZAFWRNXYVQJHNL-ZDUSSCGKSA-N 0 3 336.388 2.803 20 5 EFBDHN Cc1ccc([C@H](O)CN[C@H](C)CC(=O)Nc2cccc([N+](=O)[O-])c2)o1 ZINC000269003464 475122553 /nfs/dbraw/zinc/12/25/53/475122553.db2.gz PURIXINPNRWBQL-IAQYHMDHSA-N 0 3 347.371 2.537 20 5 EFBDHN O=C([N-]c1ncc(C2CC[NH2+]CC2)s1)c1ccc([N+](=O)[O-])s1 ZINC000262055892 475160067 /nfs/dbraw/zinc/16/00/67/475160067.db2.gz NFBCGAYANGLLAQ-UHFFFAOYSA-N 0 3 338.414 2.832 20 5 EFBDHN CC[C@@H]1CN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CCCO1 ZINC000281332259 475175202 /nfs/dbraw/zinc/17/52/02/475175202.db2.gz JMPOIACFSNKDFG-CYBMUJFWSA-N 0 3 339.367 2.563 20 5 EFBDHN CC(C)O[C@@H]1C[C@@H](NCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1(C)C ZINC000296183208 475217447 /nfs/dbraw/zinc/21/74/47/475217447.db2.gz LKBUZVDRKCJOKN-HZPDHXFCSA-N 0 3 349.431 2.739 20 5 EFBDHN C[C@@H](C(=O)NC[C@H]1CCCCN1C1CC1)c1ccc([N+](=O)[O-])cc1F ZINC000347328433 475236681 /nfs/dbraw/zinc/23/66/81/475236681.db2.gz AHUWBESNACVISU-IUODEOHRSA-N 0 3 349.406 2.971 20 5 EFBDHN COc1ccc(OCCN2CC[C@@H](OC)C(C)(C)C2)c([N+](=O)[O-])c1 ZINC000296279344 475250322 /nfs/dbraw/zinc/25/03/22/475250322.db2.gz YZHXLMNMVIEHDP-MRXNPFEDSA-N 0 3 338.404 2.729 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC(n2cncn2)CC1 ZINC000347353748 475260349 /nfs/dbraw/zinc/26/03/49/475260349.db2.gz HBKFNEOOPLMBHW-NTEUORMPSA-N 0 3 327.388 2.927 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC[C@@]2(CNC(=O)C2)C1 ZINC000347367814 475271171 /nfs/dbraw/zinc/27/11/71/475271171.db2.gz MSSFVIMAYXHZCY-ODHXBGJQSA-N 0 3 329.400 2.600 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC[C@@H](CCC(N)=O)C1 ZINC000347371717 475272686 /nfs/dbraw/zinc/27/26/86/475272686.db2.gz VSXVOPUKJWFXBX-IPJDOKCGSA-N 0 3 331.416 2.976 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCN(C)[C@@H](C)C1 ZINC000361213222 475273914 /nfs/dbraw/zinc/27/39/14/475273914.db2.gz QEPJPUGYMNXEEY-IMJJTQAJSA-N 0 3 333.432 2.762 20 5 EFBDHN C[C@H](NC(=O)N[C@H]1C[C@H](C)N(C2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000296590059 475385092 /nfs/dbraw/zinc/38/50/92/475385092.db2.gz WZBMFWCTCNKYEH-OBJOEFQTSA-N 0 3 332.404 2.580 20 5 EFBDHN C[C@H](NC(=O)N(C)CC1(N(C)C)CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000296595717 475387477 /nfs/dbraw/zinc/38/74/77/475387477.db2.gz CWZMMTOSHABMAC-ZDUSSCGKSA-N 0 3 334.420 2.782 20 5 EFBDHN C[C@@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCCOC1 ZINC000348140342 475421199 /nfs/dbraw/zinc/42/11/99/475421199.db2.gz BBHVWTOZGYHIIU-GHMZBOCLSA-N 0 3 341.795 2.591 20 5 EFBDHN CCN(CC)[C@H](CNc1cccc(C(N)=O)c1[N+](=O)[O-])c1ccco1 ZINC000341932257 475425183 /nfs/dbraw/zinc/42/51/83/475425183.db2.gz SBVHJVCUIFVMSG-CQSZACIVSA-N 0 3 346.387 2.782 20 5 EFBDHN C[C@H]1[C@H](NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)CCCN1C ZINC000345763175 475430504 /nfs/dbraw/zinc/43/05/04/475430504.db2.gz XJBLDGLVTDSOAY-SUMWQHHRSA-N 0 3 346.431 2.752 20 5 EFBDHN COc1cc(CN2CCN(C3CC3)C[C@H](C)C2)c([N+](=O)[O-])cc1F ZINC000296707646 475440365 /nfs/dbraw/zinc/44/03/65/475440365.db2.gz LOSFPAXFJYFTCS-GFCCVEGCSA-N 0 3 337.395 2.659 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN[C@@H](C(C)C)C1(CO)CCC1 ZINC000339726797 475447166 /nfs/dbraw/zinc/44/71/66/475447166.db2.gz AFHWNCDWWBABIX-KRWDZBQOSA-N 0 3 349.431 2.619 20 5 EFBDHN CC(C)[C@H](NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1(CO)CCC1 ZINC000339727821 475447423 /nfs/dbraw/zinc/44/74/23/475447423.db2.gz NYJGSKGFOOIUOH-INIZCTEOSA-N 0 3 332.404 2.748 20 5 EFBDHN CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000345817966 475479835 /nfs/dbraw/zinc/47/98/35/475479835.db2.gz QKWBWCGXGPTSPN-KRWDZBQOSA-N 0 3 344.415 2.809 20 5 EFBDHN CNC(=O)[C@@H]1CCC[C@H]1NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000345824529 475484257 /nfs/dbraw/zinc/48/42/57/475484257.db2.gz WZUBHVANKLAKAK-HZPDHXFCSA-N 0 3 343.383 2.859 20 5 EFBDHN Cc1cc(NC(=O)N2CC[C@]3(C2)CCCN(C)C3)ccc1[N+](=O)[O-] ZINC000296837204 475498668 /nfs/dbraw/zinc/49/86/68/475498668.db2.gz NSMDCHRPNIHQAI-QGZVFWFLSA-N 0 3 332.404 2.853 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@H]2CCC[C@@H]2C(=O)NC)cc1[N+](=O)[O-] ZINC000358231726 475512239 /nfs/dbraw/zinc/51/22/39/475512239.db2.gz ASKYEOBLFAVDHI-UBHSHLNASA-N 0 3 335.404 2.559 20 5 EFBDHN Cc1cc(F)c(NC(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000296926875 475538527 /nfs/dbraw/zinc/53/85/27/475538527.db2.gz ZNHDSRREFHZXSQ-SMDDNHRTSA-N 0 3 338.383 2.893 20 5 EFBDHN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NCCN(C)C1CC1 ZINC000342065296 475542374 /nfs/dbraw/zinc/54/23/74/475542374.db2.gz GHMMKMAWJQLCDS-UHFFFAOYSA-N 0 3 337.445 2.919 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@@H]2CCOC[C@H]2OCC)cc1[N+](=O)[O-] ZINC000354968405 475566799 /nfs/dbraw/zinc/56/67/99/475566799.db2.gz AIGXEPQBBPYCTB-DXCKQFNASA-N 0 3 338.404 2.838 20 5 EFBDHN C[C@H](CN(C)C)NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000346176832 475567571 /nfs/dbraw/zinc/56/75/71/475567571.db2.gz ZYBDSKZADRDYMM-CQSZACIVSA-N 0 3 348.447 2.511 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@]2(C1)CCCN(C)C2 ZINC000296997899 475568908 /nfs/dbraw/zinc/56/89/08/475568908.db2.gz UUOMDNNRIPEIHM-QGZVFWFLSA-N 0 3 348.403 2.553 20 5 EFBDHN CC(C)(NC[C@H](O)COc1cccc([N+](=O)[O-])c1)c1cccs1 ZINC000348310760 475583183 /nfs/dbraw/zinc/58/31/83/475583183.db2.gz RFCDVERARWNLBG-ZDUSSCGKSA-N 0 3 336.413 2.921 20 5 EFBDHN COc1cc(CN2CCC[C@H](Cc3nccn3C)C2)ccc1[N+](=O)[O-] ZINC000352777906 475613386 /nfs/dbraw/zinc/61/33/86/475613386.db2.gz IHKKTWUTSCFIGO-CQSZACIVSA-N 0 3 344.415 2.792 20 5 EFBDHN COC(=O)COc1ccc(CN2CC[C@@H]3CCC[C@H]32)cc1[N+](=O)[O-] ZINC000355034383 475613610 /nfs/dbraw/zinc/61/36/10/475613610.db2.gz HCWBDZARJMMTDD-UONOGXRCSA-N 0 3 334.372 2.521 20 5 EFBDHN COc1ccc(OCCN2C[C@@H]3CCCCN3C[C@H]2C)c([N+](=O)[O-])c1 ZINC000332423287 475633106 /nfs/dbraw/zinc/63/31/06/475633106.db2.gz AQWQHRKPSXTMDG-CABCVRRESA-N 0 3 349.431 2.541 20 5 EFBDHN CCC[C@@H]1CN(Cc2ccc(C)c([N+](=O)[O-])c2)CCN1CCOC ZINC000355115415 475677162 /nfs/dbraw/zinc/67/71/62/475677162.db2.gz RORJBUUGYAMTBH-QGZVFWFLSA-N 0 3 335.448 2.836 20 5 EFBDHN CCS[C@@H]1CCC[C@H]1N[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000348471370 475685849 /nfs/dbraw/zinc/68/58/49/475685849.db2.gz UKUGBFYMZJMXFX-OWCLPIDISA-N 0 3 349.456 2.964 20 5 EFBDHN COc1ccc(CNC[C@@](C)(CO)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000361734293 475706899 /nfs/dbraw/zinc/70/68/99/475706899.db2.gz OVLYMZGCDNJKLA-IBGZPJMESA-N 0 3 344.411 2.934 20 5 EFBDHN C[C@H](N[C@H]1CCC[C@@H]1OC(F)F)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000348531970 475731360 /nfs/dbraw/zinc/73/13/60/475731360.db2.gz MXJUWPRMHLQHGA-XDTLVQLUSA-N 0 3 343.330 2.672 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@@H]1CCC[C@@H]1OC(F)F ZINC000348538665 475738745 /nfs/dbraw/zinc/73/87/45/475738745.db2.gz UPSFNBNPILZABE-OLZOCXBDSA-N 0 3 343.330 2.592 20 5 EFBDHN Cc1ccc(NC[C@@]2(O)CCN(Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000338285097 475747431 /nfs/dbraw/zinc/74/74/31/475747431.db2.gz MYNAMJVADSLZSF-IBGZPJMESA-N 0 3 341.411 2.952 20 5 EFBDHN NC(=O)[C@H](CNCc1ccc([N+](=O)[O-])cc1)Cc1ccccc1Cl ZINC000346680894 475759184 /nfs/dbraw/zinc/75/91/84/475759184.db2.gz XZQPSBOROLMMPF-AWEZNQCLSA-N 0 3 347.802 2.682 20 5 EFBDHN COCCN(CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C1CC1 ZINC000355261102 475786216 /nfs/dbraw/zinc/78/62/16/475786216.db2.gz IWYUZNWLIZMTPI-UHFFFAOYSA-N 0 3 331.372 2.903 20 5 EFBDHN CN(C)[C@]1(CNc2nccc3cc([N+](=O)[O-])ccc32)CCSC1 ZINC000297575025 475813106 /nfs/dbraw/zinc/81/31/06/475813106.db2.gz SIDRHGKWHQXTDA-INIZCTEOSA-N 0 3 332.429 2.992 20 5 EFBDHN CSC1(CNC(=O)Nc2ccc([N+](=O)[O-])cc2)CCN(C)CC1 ZINC000353325019 475870594 /nfs/dbraw/zinc/87/05/94/475870594.db2.gz YVVJLPJNJYRVQB-UHFFFAOYSA-N 0 3 338.433 2.544 20 5 EFBDHN C[C@H](NC(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21)c1ccc([N+](=O)[O-])cc1 ZINC000297816765 475894775 /nfs/dbraw/zinc/89/47/75/475894775.db2.gz ZBCGLDSVDOMZKU-LXZKKBNFSA-N 0 3 346.431 2.782 20 5 EFBDHN CCSCCN1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000358825906 475969000 /nfs/dbraw/zinc/96/90/00/475969000.db2.gz OLCJIQGEOMCTKK-UHFFFAOYSA-N 0 3 349.460 2.736 20 5 EFBDHN CCOc1cc(N2CCN(CC[C@H]3CCOC3)CC2)ccc1[N+](=O)[O-] ZINC000355527579 476010072 /nfs/dbraw/zinc/01/00/72/476010072.db2.gz IBUFQFZXZBPESB-HNNXBMFYSA-N 0 3 349.431 2.542 20 5 EFBDHN COC(=O)COc1ccc(CN(C)[C@@H](C)C2(C)CC2)cc1[N+](=O)[O-] ZINC000355754937 476059265 /nfs/dbraw/zinc/05/92/65/476059265.db2.gz ILZYSGPRIRJNIN-LBPRGKRZSA-N 0 3 336.388 2.767 20 5 EFBDHN Cn1nc(CCNCc2ccc([N+](=O)[O-])cc2F)c2ccccc21 ZINC000358962388 476072744 /nfs/dbraw/zinc/07/27/44/476072744.db2.gz HAEYEOCUKDSJBF-UHFFFAOYSA-N 0 3 328.347 2.953 20 5 EFBDHN COC(=O)C1CCN(CCCNc2cccc(C)c2[N+](=O)[O-])CC1 ZINC000338648172 476084275 /nfs/dbraw/zinc/08/42/75/476084275.db2.gz VCRDPRRZCVMDSO-UHFFFAOYSA-N 0 3 335.404 2.590 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCN1C ZINC000334041509 476096230 /nfs/dbraw/zinc/09/62/30/476096230.db2.gz JHWZSEBBBOLQMP-ONGXEEELSA-N 0 3 345.321 2.826 20 5 EFBDHN CCN(CC)[C@H](CNC(=O)c1ccc([N+](=O)[O-])[nH]1)c1ccccc1 ZINC000340549612 476100447 /nfs/dbraw/zinc/10/04/47/476100447.db2.gz MQWXYIPKHXINRQ-OAHLLOKOSA-N 0 3 330.388 2.736 20 5 EFBDHN CCN(CC)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])[nH]1)c1ccccc1 ZINC000340549611 476100768 /nfs/dbraw/zinc/10/07/68/476100768.db2.gz MQWXYIPKHXINRQ-HNNXBMFYSA-N 0 3 330.388 2.736 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCN1C ZINC000334086688 476108235 /nfs/dbraw/zinc/10/82/35/476108235.db2.gz GIKWNQXQXGPSLV-CABZTGNLSA-N 0 3 345.321 2.826 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)N(CC(C)C)C1CCN(C)CC1 ZINC000362246470 476110397 /nfs/dbraw/zinc/11/03/97/476110397.db2.gz QTDZSDHASNNTNB-UHFFFAOYSA-N 0 3 349.431 2.796 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(NC[C@H]2C[C@H](O)CN2Cc2ccccc2)c1 ZINC000340573731 476115466 /nfs/dbraw/zinc/11/54/66/476115466.db2.gz MTFJCZTXIFVUSB-SJORKVTESA-N 0 3 341.411 2.951 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N[C@H]2CCCN(C)[C@H]2C)cc1[N+](=O)[O-] ZINC000343971018 476141058 /nfs/dbraw/zinc/14/10/58/476141058.db2.gz KISNGQRWVJRIBH-YDHLFZDLSA-N 0 3 334.420 2.746 20 5 EFBDHN O=[N+]([O-])c1ccc(S(=O)(=O)CCNCC2CCCCCC2)cc1 ZINC000350361824 476154993 /nfs/dbraw/zinc/15/49/93/476154993.db2.gz WWDXVRHKRCXIBR-UHFFFAOYSA-N 0 3 340.445 2.929 20 5 EFBDHN COc1c(C(=O)NCc2ccccc2CN(C)C)cccc1[N+](=O)[O-] ZINC000353656612 476161651 /nfs/dbraw/zinc/16/16/51/476161651.db2.gz LOPAEIMJBHVDHX-UHFFFAOYSA-N 0 3 343.383 2.595 20 5 EFBDHN C[C@@H]1[C@H](C)N(C)CCN1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000357031884 476174813 /nfs/dbraw/zinc/17/48/13/476174813.db2.gz CTZDTNLJNQNNQG-UONOGXRCSA-N 0 3 344.415 2.817 20 5 EFBDHN CN1CCCN(c2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)CC1 ZINC000362348816 476187452 /nfs/dbraw/zinc/18/74/52/476187452.db2.gz NOKHJPLMWRQQNT-UHFFFAOYSA-N 0 3 330.363 2.938 20 5 EFBDHN CC[C@H](NC(=O)N[C@@H]1CCCN(C)[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000344285400 476216769 /nfs/dbraw/zinc/21/67/69/476216769.db2.gz KKYDUDWDQBFGCO-VBNZEHGJSA-N 0 3 334.420 2.828 20 5 EFBDHN CN(C)[C@@H]1Cc2ccccc2N(C(=O)c2cc(F)cc([N+](=O)[O-])c2)C1 ZINC000344285460 476217429 /nfs/dbraw/zinc/21/74/29/476217429.db2.gz RMBGMLYZSILYIS-MRXNPFEDSA-N 0 3 343.358 2.867 20 5 EFBDHN O=C(Nc1cc(F)cc([N+](=O)[O-])c1)N1CCC(N2CC=CC2)CC1 ZINC000347294257 476237153 /nfs/dbraw/zinc/23/71/53/476237153.db2.gz WQGRVXXUVVGBAO-UHFFFAOYSA-N 0 3 334.351 2.602 20 5 EFBDHN O=[N+]([O-])c1ccc(NC[C@]2(O)CCN(Cc3ccccc3)C2)cc1 ZINC000359482133 476238404 /nfs/dbraw/zinc/23/84/04/476238404.db2.gz OYSFZPPCGOLJAN-GOSISDBHSA-N 0 3 327.384 2.644 20 5 EFBDHN CCN(CCN1CCCCCC1)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000347299061 476242431 /nfs/dbraw/zinc/24/24/31/476242431.db2.gz XYCBURMJXKBHJP-UHFFFAOYSA-N 0 3 348.447 2.731 20 5 EFBDHN CCc1ccc(C(=O)NC[C@H]2NCCc3ccccc32)cc1[N+](=O)[O-] ZINC000357243830 476302665 /nfs/dbraw/zinc/30/26/65/476302665.db2.gz RGWQBZOIQNPJBL-QGZVFWFLSA-N 0 3 339.395 2.774 20 5 EFBDHN O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2NCc2cnn3ccccc23)n1 ZINC000353864436 476305376 /nfs/dbraw/zinc/30/53/76/476305376.db2.gz IZMZKMVHDGKHIK-HOCLYGCPSA-N 0 3 340.387 2.713 20 5 EFBDHN COC(=O)[C@@H]1CC12CCN(C/C=C\c1ccccc1[N+](=O)[O-])CC2 ZINC000353898719 476317293 /nfs/dbraw/zinc/31/72/93/476317293.db2.gz KRTPQYKWOCBYRA-VOKGJARPSA-N 0 3 330.384 2.883 20 5 EFBDHN CN(Cc1ccccc1)[C@H](CNC(=O)c1ccc([N+](=O)[O-])[nH]1)C1CC1 ZINC000357307278 476324218 /nfs/dbraw/zinc/32/42/18/476324218.db2.gz QRYFHUHDHWHWOJ-MRXNPFEDSA-N 0 3 342.399 2.563 20 5 EFBDHN O=C(N[C@H]1CCN(C2CCCC2)C1)c1ccc([N+](=O)[O-])cc1Cl ZINC000363389448 476359695 /nfs/dbraw/zinc/35/96/95/476359695.db2.gz COXZNBLGDHARIR-NSHDSACASA-N 0 3 337.807 2.995 20 5 EFBDHN C[C@@H](CN1CCC[C@H](C)C1)NC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000357458252 476396845 /nfs/dbraw/zinc/39/68/45/476396845.db2.gz YWEMTTCZUQEEDS-STQMWFEESA-N 0 3 337.395 2.513 20 5 EFBDHN C[C@@H]1CCN(C)CCN1c1ccc(Br)cc1[N+](=O)[O-] ZINC000354083381 476413614 /nfs/dbraw/zinc/41/36/14/476413614.db2.gz BSKDRZAOAPEYJN-SNVBAGLBSA-N 0 3 328.210 2.888 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccccc1CCN(C)C ZINC000354177108 476483369 /nfs/dbraw/zinc/48/33/69/476483369.db2.gz ZHMSUAXLBUHFRN-UHFFFAOYSA-N 0 3 343.383 2.960 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1N1CCC(C)(CN2CCN(C)CC2)CC1 ZINC000360970930 476514967 /nfs/dbraw/zinc/51/49/67/476514967.db2.gz XAXPIKVVMIFYFO-UHFFFAOYSA-N 0 3 346.475 2.757 20 5 EFBDHN COC1CC(N(C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000352203771 476549219 /nfs/dbraw/zinc/54/92/19/476549219.db2.gz VHDSCSSSELCHMA-UHFFFAOYSA-N 0 3 331.372 2.902 20 5 EFBDHN Cn1nccc1[C@@H]1CCCN(CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000363074106 476550020 /nfs/dbraw/zinc/55/00/20/476550020.db2.gz JWSDXMYOPYIBIY-CQSZACIVSA-N 0 3 330.388 2.587 20 5 EFBDHN C[C@H]1C[C@H](N2CCCC2)CN1C(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000354287994 476562361 /nfs/dbraw/zinc/56/23/61/476562361.db2.gz ASUJCSHGUDHYNU-GJZGRUSLSA-N 0 3 345.443 2.958 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](C)N2CCCC[C@H]2C)c1 ZINC000354343020 476598327 /nfs/dbraw/zinc/59/83/27/476598327.db2.gz HWNQKGPQORXBMW-CHWSQXEVSA-N 0 3 335.404 2.596 20 5 EFBDHN CC(C)NC(=O)c1ccc(N[C@H]2CCN(C)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000361100199 476601443 /nfs/dbraw/zinc/60/14/43/476601443.db2.gz XYMQOHYMXHPLJV-OCCSQVGLSA-N 0 3 334.420 2.628 20 5 EFBDHN C[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)CCN1C ZINC000361113569 476609790 /nfs/dbraw/zinc/60/97/90/476609790.db2.gz ZNZRZJSLUOIBOC-ZFWWWQNUSA-N 0 3 346.431 2.725 20 5 EFBDHN CCc1cnccc1[C@@H](C)NC[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000361129205 476621590 /nfs/dbraw/zinc/62/15/90/476621590.db2.gz DKOGCHYGNBRRJV-CJNGLKHVSA-N 0 3 345.399 2.643 20 5 EFBDHN CCCN(CCN(C)C)C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000357834470 476638185 /nfs/dbraw/zinc/63/81/85/476638185.db2.gz FIKSYTASOWSDPI-UHFFFAOYSA-N 0 3 339.411 2.812 20 5 EFBDHN C[C@H]1[C@H](NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)CCCN1C ZINC000357853604 476649433 /nfs/dbraw/zinc/64/94/33/476649433.db2.gz ZNDBFTKGZPXOSM-XHDPSFHLSA-N 0 3 337.395 2.610 20 5 EFBDHN C[C@@H]1[C@@H](NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)CCCN1C ZINC000357853601 476649565 /nfs/dbraw/zinc/64/95/65/476649565.db2.gz ZNDBFTKGZPXOSM-ABAIWWIYSA-N 0 3 337.395 2.610 20 5 EFBDHN Cn1ccnc1[C@H]1CCCN(CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000365622363 476651938 /nfs/dbraw/zinc/65/19/38/476651938.db2.gz FKGKTHVSOJBASP-HNNXBMFYSA-N 0 3 344.415 2.977 20 5 EFBDHN Cc1ccccc1[C@H]([C@@H](C)NC(=O)c1ccc([N+](=O)[O-])n1C)N(C)C ZINC000357860822 476654734 /nfs/dbraw/zinc/65/47/34/476654734.db2.gz XATHFQGEWVKNPP-DYVFJYSZSA-N 0 3 344.415 2.663 20 5 EFBDHN C[C@@H]1CCCN(CCNC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])C1 ZINC000429844524 476702294 /nfs/dbraw/zinc/70/22/94/476702294.db2.gz VRIYMWWHWYBDAC-CQSZACIVSA-N 0 3 333.432 2.721 20 5 EFBDHN COc1cc(C(=O)N[C@@H]2CCN(C3CCCC3)C2)cc([N+](=O)[O-])c1C ZINC000370229461 476711040 /nfs/dbraw/zinc/71/10/40/476711040.db2.gz BKYNCLZCBWZIPX-CQSZACIVSA-N 0 3 347.415 2.659 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H](C)[C@H](N)c1ccccc1 ZINC000429966115 476726127 /nfs/dbraw/zinc/72/61/27/476726127.db2.gz DVUGZIHUBHXSHB-PXAZEXFGSA-N 0 3 343.383 2.556 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCN(CC)CC1 ZINC000370386139 476784072 /nfs/dbraw/zinc/78/40/72/476784072.db2.gz DKHSHUUWLPSKDW-MRXNPFEDSA-N 0 3 333.432 2.718 20 5 EFBDHN CC(C)(CN1CCCC1)NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000457028005 476835594 /nfs/dbraw/zinc/83/55/94/476835594.db2.gz JPDUKPJJGFKJOK-UHFFFAOYSA-N 0 3 337.445 2.678 20 5 EFBDHN CC1(C)CCCN1CCNC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000457048936 476846072 /nfs/dbraw/zinc/84/60/72/476846072.db2.gz FABWTQMYWRBBNY-UHFFFAOYSA-N 0 3 325.796 2.852 20 5 EFBDHN CC(C)(C(=O)NCCN1CCCC1(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000457066304 476856038 /nfs/dbraw/zinc/85/60/38/476856038.db2.gz YKSZRVVXCQWBNT-UHFFFAOYSA-N 0 3 333.432 2.863 20 5 EFBDHN CC(C)N1CC[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000457078030 476862411 /nfs/dbraw/zinc/86/24/11/476862411.db2.gz AIHBICXQDWIVGI-ZDUSSCGKSA-N 0 3 342.399 2.698 20 5 EFBDHN C[C@H]1CN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CCN(C2CC2)C1 ZINC000452173548 476868609 /nfs/dbraw/zinc/86/86/09/476868609.db2.gz NEMXEGIBDQCWKP-LLVKDONJSA-N 0 3 337.807 2.805 20 5 EFBDHN C[C@@H](C(=O)N1CCN(C2CC2)C[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1F ZINC000452174021 476868804 /nfs/dbraw/zinc/86/88/04/476868804.db2.gz OQFSEQAMBKLBHH-CHWSQXEVSA-N 0 3 349.406 2.780 20 5 EFBDHN CC(C)N1CC[C@H](N(C)C(=O)C(C)(C)c2ccccc2[N+](=O)[O-])C1 ZINC000457089205 476869330 /nfs/dbraw/zinc/86/93/30/476869330.db2.gz LCAGFMNLJPSUNN-AWEZNQCLSA-N 0 3 333.432 2.814 20 5 EFBDHN CC(C)N1CC[C@@H](N(C)C(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000457094566 476871815 /nfs/dbraw/zinc/87/18/15/476871815.db2.gz ZQXZRTMRKUBVMC-CQSZACIVSA-N 0 3 337.445 2.628 20 5 EFBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])N[C@@H](C)C(=O)NC(C)C ZINC000414332884 476880290 /nfs/dbraw/zinc/88/02/90/476880290.db2.gz FFJFYGYALSZVFK-STQMWFEESA-N 0 3 339.461 2.968 20 5 EFBDHN CC(C)N1CC[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000457137159 476897866 /nfs/dbraw/zinc/89/78/66/476897866.db2.gz XBMMJBICOPGMOS-GFCCVEGCSA-N 0 3 325.796 2.803 20 5 EFBDHN Cc1cc(N)cc(CN[C@H](C)CC(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000414958424 476902639 /nfs/dbraw/zinc/90/26/39/476902639.db2.gz CZRDIYFKBXHFTC-CYBMUJFWSA-N 0 3 342.399 2.992 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H](N)CC1CCCCC1 ZINC000423058148 476910331 /nfs/dbraw/zinc/91/03/31/476910331.db2.gz BKGIFNPXIJDRKK-HNNXBMFYSA-N 0 3 335.404 2.517 20 5 EFBDHN Cc1cc(OCC(=O)NC[C@@H]2N(C)CCCC2(C)C)ccc1[N+](=O)[O-] ZINC000430833417 476924077 /nfs/dbraw/zinc/92/40/77/476924077.db2.gz OXRPHBUDGCFBTK-INIZCTEOSA-N 0 3 349.431 2.519 20 5 EFBDHN C[C@@H]1CN[C@@H](C)CN1C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000415429210 476925105 /nfs/dbraw/zinc/92/51/05/476925105.db2.gz AXLSQKPKLJHGCA-DTWKUNHWSA-N 0 3 346.309 2.828 20 5 EFBDHN COc1cccc(C[C@@H](C)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)n1 ZINC000446841533 476927537 /nfs/dbraw/zinc/92/75/37/476927537.db2.gz QTXVUBPGIFLTMG-LLVKDONJSA-N 0 3 341.371 2.596 20 5 EFBDHN C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCNCc2ccccc21 ZINC000430926229 476936404 /nfs/dbraw/zinc/93/64/04/476936404.db2.gz NANARVPYRKJOOF-ZDUSSCGKSA-N 0 3 340.383 2.532 20 5 EFBDHN COC(=O)[C@@](C)(CNCc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000447059542 476946386 /nfs/dbraw/zinc/94/63/86/476946386.db2.gz LKSHIISBUDKMJT-SFHVURJKSA-N 0 3 346.358 2.954 20 5 EFBDHN COC1(CO)CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000447074152 476949493 /nfs/dbraw/zinc/94/94/93/476949493.db2.gz CMUOPLVPQWJYHM-UHFFFAOYSA-N 0 3 346.383 2.828 20 5 EFBDHN Cc1c(CNC(=O)Nc2ccc3c(c2)CNCC3)cccc1[N+](=O)[O-] ZINC000415897269 476962245 /nfs/dbraw/zinc/96/22/45/476962245.db2.gz PJISUKJTFATJLV-UHFFFAOYSA-N 0 3 340.383 2.871 20 5 EFBDHN O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2NCc2cccc3c2OCO3)n1 ZINC000447541981 477008250 /nfs/dbraw/zinc/00/82/50/477008250.db2.gz NMGNSZLLSXRWMI-UONOGXRCSA-N 0 3 344.371 2.794 20 5 EFBDHN Cc1cc(OCC(=O)NC[C@H](C)N2CCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000431576086 477055261 /nfs/dbraw/zinc/05/52/61/477055261.db2.gz SMGJAWFLGMDVPD-HIFRSBDPSA-N 0 3 349.431 2.519 20 5 EFBDHN O=[N+]([O-])c1ccccc1CNC[C@H]1CC[C@@H](c2nc(C3CC3)no2)O1 ZINC000431676796 477073866 /nfs/dbraw/zinc/07/38/66/477073866.db2.gz ARBXDXWEYKDZNM-HIFRSBDPSA-N 0 3 344.371 2.865 20 5 EFBDHN Cc1c([C@H]2OCC[C@@H]2NCc2ccc([N+](=O)[O-])cc2C)cnn1C ZINC000431706315 477079522 /nfs/dbraw/zinc/07/95/22/477079522.db2.gz BJRHGZZJFKAAHH-DLBZAZTESA-N 0 3 330.388 2.565 20 5 EFBDHN O=[N+]([O-])c1ccc2oc(CN3CC[C@H](C4CCOCC4)C3)nc2c1 ZINC000371065453 477106387 /nfs/dbraw/zinc/10/63/87/477106387.db2.gz OZKGROFHOHGXBL-ZDUSSCGKSA-N 0 3 331.372 2.985 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H](CO)[C@H]2CCCO2)s1 ZINC000447990196 477110886 /nfs/dbraw/zinc/11/08/86/477110886.db2.gz RDDVGRAFVFGCGZ-GOEBONIOSA-N 0 3 348.424 2.953 20 5 EFBDHN CC[C@H]1CCCCN1CCNC(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000432001426 477136856 /nfs/dbraw/zinc/13/68/56/477136856.db2.gz XJYHIGCBQQKCKK-HNNXBMFYSA-N 0 3 349.431 2.663 20 5 EFBDHN CC(C)Oc1cc(C(=O)N[C@@H](C)CN2CCCCC2)ccc1[N+](=O)[O-] ZINC000411381793 477211646 /nfs/dbraw/zinc/21/16/46/477211646.db2.gz FLGYAGHYECVDSM-AWEZNQCLSA-N 0 3 349.431 2.986 20 5 EFBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])N[C@@H]1CC(=O)N(CC)C1 ZINC000453352636 477212256 /nfs/dbraw/zinc/21/22/56/477212256.db2.gz JYHWDFNRXLWJJH-QWHCGFSZSA-N 0 3 337.445 2.676 20 5 EFBDHN O=C(NCCN1CCCCCC1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411383566 477213303 /nfs/dbraw/zinc/21/33/03/477213303.db2.gz GRYHSKRAAKRLSR-DLBZAZTESA-N 0 3 331.416 2.691 20 5 EFBDHN CCc1ccccc1[C@@H](N)CNC(=O)c1cc([N+](=O)[O-])ccc1C ZINC000423986124 477246768 /nfs/dbraw/zinc/24/67/68/477246768.db2.gz VSICQAXUFBFCKN-KRWDZBQOSA-N 0 3 327.384 2.895 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](c2cccc(F)c2)[C@H](N)C1 ZINC000424007405 477258764 /nfs/dbraw/zinc/25/87/64/477258764.db2.gz GBFRBTRGSGHMQO-DLBZAZTESA-N 0 3 343.358 2.609 20 5 EFBDHN CC(C)c1ccc(CN(C)[C@@H](C)CN2CCOCC2)cc1[N+](=O)[O-] ZINC000435058068 477344635 /nfs/dbraw/zinc/34/46/35/477344635.db2.gz SGJDILIBBIDUCG-HNNXBMFYSA-N 0 3 335.448 2.871 20 5 EFBDHN O=C(CCN1CCC(c2cn[nH]c2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000376484055 477357505 /nfs/dbraw/zinc/35/75/05/477357505.db2.gz KSXUXKWUJPRTJQ-UHFFFAOYSA-N 0 3 343.387 2.526 20 5 EFBDHN CC(=O)c1ccc([N+](=O)[O-])cc1N1CC[C@H](C2CCN(C)CC2)C1 ZINC000367285987 477432900 /nfs/dbraw/zinc/43/29/00/477432900.db2.gz HYLJTZMXBARWSZ-HNNXBMFYSA-N 0 3 331.416 2.966 20 5 EFBDHN CCN1CCN([C@@H](C)CNc2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413049793 477486695 /nfs/dbraw/zinc/48/66/95/477486695.db2.gz CLBHYPCAVXFANK-AWEZNQCLSA-N 0 3 343.431 2.581 20 5 EFBDHN CC[C@@H](NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C1CCC1 ZINC000449239537 477501711 /nfs/dbraw/zinc/50/17/11/477501711.db2.gz VTXVXAWNFZBHEW-OAHLLOKOSA-N 0 3 326.418 2.537 20 5 EFBDHN Cc1c(CNC(=O)N2CCN(C3CC3)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000458695689 477551361 /nfs/dbraw/zinc/55/13/61/477551361.db2.gz QDWVFTGNYZXMIU-ZDUSSCGKSA-N 0 3 346.431 2.529 20 5 EFBDHN CN(C)[C@@]1(CNc2nccc3ccc([N+](=O)[O-])cc32)CCSC1 ZINC000413168906 477551545 /nfs/dbraw/zinc/55/15/45/477551545.db2.gz KHIIJAQWDVYKID-MRXNPFEDSA-N 0 3 332.429 2.992 20 5 EFBDHN CCO[C@@H]1C[C@H](N[C@H](C)Cc2ccccc2[N+](=O)[O-])[C@@H]1n1cccn1 ZINC000449343754 477555622 /nfs/dbraw/zinc/55/56/22/477555622.db2.gz MUFFYKGOJOQTRP-SIUPPRGNSA-N 0 3 344.415 2.731 20 5 EFBDHN CS[C@@H]1CN(c2nccc3ccc([N+](=O)[O-])cc32)C[C@@H]1N(C)C ZINC000413204825 477568957 /nfs/dbraw/zinc/56/89/57/477568957.db2.gz JMSWARIGVRQNKP-LSDHHAIUSA-N 0 3 332.429 2.625 20 5 EFBDHN CN1CCN(CCNc2nccc3c2cccc3[N+](=O)[O-])CC1(C)C ZINC000450504020 477609986 /nfs/dbraw/zinc/60/99/86/477609986.db2.gz ZDYBSNUQLUFLDF-UHFFFAOYSA-N 0 3 343.431 2.581 20 5 EFBDHN CC(C)N1CC[C@@H](N(C)C(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000458893655 477646097 /nfs/dbraw/zinc/64/60/97/477646097.db2.gz WRIMQEHROHLZRJ-XJKSGUPXSA-N 0 3 334.420 2.780 20 5 EFBDHN Cc1cc(N2CCNC(C)(C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000420283064 477661684 /nfs/dbraw/zinc/66/16/84/477661684.db2.gz SQVBETPWJDOCEB-UHFFFAOYSA-N 0 3 327.388 2.548 20 5 EFBDHN C[C@H]1CN(CCC2CCN(c3ccc([N+](=O)[O-])nc3)CC2)C[C@H](C)O1 ZINC000426417592 477709608 /nfs/dbraw/zinc/70/96/08/477709608.db2.gz BQQROTGQCRUZKJ-GJZGRUSLSA-N 0 3 348.447 2.706 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCN2CCNC[C@H]2c2ccccc2)cc1 ZINC000420406378 477752066 /nfs/dbraw/zinc/75/20/66/477752066.db2.gz NUYPHNKTZJHZDE-SFHVURJKSA-N 0 3 327.384 2.620 20 5 EFBDHN C[C@@H](C1CCN(C)CC1)N(C)C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000413669322 477774182 /nfs/dbraw/zinc/77/41/82/477774182.db2.gz LOEONUSNHQZLRX-DOPJRALCSA-N 0 3 345.443 2.887 20 5 EFBDHN CCOc1ccc([C@@H](C)N[C@@H]2CCn3ccnc3C2)cc1[N+](=O)[O-] ZINC000427881903 477783333 /nfs/dbraw/zinc/78/33/33/477783333.db2.gz KJAIQKKBFHBWRZ-TZMCWYRMSA-N 0 3 330.388 2.856 20 5 EFBDHN C[C@@H]1C[C@@H](NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)CCN1C ZINC000437984751 477784178 /nfs/dbraw/zinc/78/41/78/477784178.db2.gz KCPWOWHGLLFHAD-HIFRSBDPSA-N 0 3 346.431 2.752 20 5 EFBDHN CNc1nc(C(=O)Nc2cc(CN(C)C)ccc2C)ccc1[N+](=O)[O-] ZINC000455933908 477787745 /nfs/dbraw/zinc/78/77/45/477787745.db2.gz VZBNBXARIREGMN-UHFFFAOYSA-N 0 3 343.387 2.654 20 5 EFBDHN C[C@@H]1CN(C(=O)/C=C/c2ccc(F)cc2[N+](=O)[O-])CCN(C2CC2)C1 ZINC000493790331 477824657 /nfs/dbraw/zinc/82/46/57/477824657.db2.gz YEVLRYUBVPKANI-MXPWBENCSA-N 0 3 347.390 2.690 20 5 EFBDHN CC(C)c1ccc(CN2CCN(CC(C)(C)O)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000438336959 477828586 /nfs/dbraw/zinc/82/85/86/477828586.db2.gz CYXHEQLLIIVVRN-OAHLLOKOSA-N 0 3 349.475 2.995 20 5 EFBDHN Cc1ccccc1OC[C@@H](O)CN[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000451109688 477829458 /nfs/dbraw/zinc/82/94/58/477829458.db2.gz YFBKEJBWDGXYBG-YOEHRIQHSA-N 0 3 330.384 2.994 20 5 EFBDHN CN(C)CC(C)(C)NC(=O)/C=C\c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000493821850 477843061 /nfs/dbraw/zinc/84/30/61/477843061.db2.gz MGRIYTCNNIIXTK-VURMDHGXSA-N 0 3 325.796 2.718 20 5 EFBDHN CN1CCC(N(Cc2ccccc2)C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 ZINC000438559910 477864213 /nfs/dbraw/zinc/86/42/13/477864213.db2.gz COCYIUKHDAZTGE-UHFFFAOYSA-N 0 3 342.399 2.660 20 5 EFBDHN O=C(CCNCCOc1ccccc1F)Nc1ccccc1[N+](=O)[O-] ZINC000558573404 477889873 /nfs/dbraw/zinc/88/98/73/477889873.db2.gz GZPVIPRFSKUMCM-UHFFFAOYSA-N 0 3 347.346 2.731 20 5 EFBDHN Cc1c(CC(=O)NC[C@@H](C)N2CCCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000438903072 477902250 /nfs/dbraw/zinc/90/22/50/477902250.db2.gz PQWZGTJPVIHERJ-ZIAGYGMSSA-N 0 3 333.432 2.825 20 5 EFBDHN COC(=O)[C@@]1(c2ccccc2)CCN(Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000428787091 477982035 /nfs/dbraw/zinc/98/20/35/477982035.db2.gz UFGVDLBSJXIQBG-IBGZPJMESA-N 0 3 340.379 2.912 20 5 EFBDHN CO[C@@H]1C[C@@H](N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1(C)C ZINC000439510609 477994224 /nfs/dbraw/zinc/99/42/24/477994224.db2.gz GZKIURKRTJNTKG-NILFDRSVSA-N 0 3 335.404 2.633 20 5 EFBDHN C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000451418723 478005161 /nfs/dbraw/zinc/00/51/61/478005161.db2.gz MWDUEKDNFHNUOO-YYQUZTFQSA-N 0 3 347.415 2.547 20 5 EFBDHN C[C@H](N[C@@H]1[C@H]2CCCO[C@H]2C1(C)C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000439617447 478007999 /nfs/dbraw/zinc/00/79/99/478007999.db2.gz YORLJMPAICDLOE-UAXWRAGISA-N 0 3 347.415 2.715 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CNC[C@@H](O)[C@H](C)c1ccccc1 ZINC000516921933 478012384 /nfs/dbraw/zinc/01/23/84/478012384.db2.gz XTTWTWPLTGORTC-CXAGYDPISA-N 0 3 330.384 2.858 20 5 EFBDHN CC(C)CN1CCCC[C@H]1CNC(=O)c1csc([N+](=O)[O-])c1 ZINC000439697019 478017185 /nfs/dbraw/zinc/01/71/85/478017185.db2.gz RQKZQTOFKRAGDW-ZDUSSCGKSA-N 0 3 325.434 2.897 20 5 EFBDHN CC(C)(C)CCCNCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000517025482 478037954 /nfs/dbraw/zinc/03/79/54/478037954.db2.gz UWAFYNHZQICFNE-UHFFFAOYSA-N 0 3 328.434 2.784 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@@H]1[C@H]2CCCO[C@@H]2C1(C)C ZINC000451477144 478038034 /nfs/dbraw/zinc/03/80/34/478038034.db2.gz HGIFYXQJBLEBJI-XYPHTWIQSA-N 0 3 347.415 2.635 20 5 EFBDHN CCO[C@@H]1C[C@@H](N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C12CCC2 ZINC000451480015 478039943 /nfs/dbraw/zinc/03/99/43/478039943.db2.gz NZFXERLCAIUDPG-DAXOMENPSA-N 0 3 347.415 2.859 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCN(C)[C@H](C)C1 ZINC000439875319 478042277 /nfs/dbraw/zinc/04/22/77/478042277.db2.gz RZIXGNBBZOGOFL-VXGBXAGGSA-N 0 3 336.392 2.598 20 5 EFBDHN C[C@H]1CCCN(CCNC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])C1 ZINC000487861897 478079162 /nfs/dbraw/zinc/07/91/62/478079162.db2.gz TWUUKUANGVVRFQ-AWEZNQCLSA-N 0 3 348.447 2.861 20 5 EFBDHN CCO[C@H]1CCN(CCOc2ccc(OC)cc2[N+](=O)[O-])C[C@@H]1C ZINC000451550039 478084809 /nfs/dbraw/zinc/08/48/09/478084809.db2.gz WJFBMAMWMKOZFG-BBRMVZONSA-N 0 3 338.404 2.729 20 5 EFBDHN CCO[C@@H]1CCN(CCOc2ccc(OC)cc2[N+](=O)[O-])C[C@@H]1C ZINC000451550042 478084829 /nfs/dbraw/zinc/08/48/29/478084829.db2.gz WJFBMAMWMKOZFG-XJKSGUPXSA-N 0 3 338.404 2.729 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N[C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000459796381 478097133 /nfs/dbraw/zinc/09/71/33/478097133.db2.gz YMOSVCLUTPCVQJ-UZGDPCLZSA-N 0 3 333.388 2.709 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N[C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000459796379 478097611 /nfs/dbraw/zinc/09/76/11/478097611.db2.gz YMOSVCLUTPCVQJ-MHDGFBEUSA-N 0 3 333.388 2.709 20 5 EFBDHN Cc1c(NC(=O)[C@H](C)N2CCN(C)[C@H](C(C)C)C2)cccc1[N+](=O)[O-] ZINC000487987738 478101278 /nfs/dbraw/zinc/10/12/78/478101278.db2.gz KWEFRTPKMYFSEM-YOEHRIQHSA-N 0 3 348.447 2.502 20 5 EFBDHN COCCN(CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@H]1CCC[C@H]1C ZINC000488039853 478109418 /nfs/dbraw/zinc/10/94/18/478109418.db2.gz CZSKESKSKIFBCU-DYVFJYSZSA-N 0 3 349.431 2.979 20 5 EFBDHN O=[N+]([O-])c1cc(F)c(CN[C@@H]([C@@H](CO)C2CC2)C2CC2)c(F)c1 ZINC000451593588 478113920 /nfs/dbraw/zinc/11/39/20/478113920.db2.gz CWKQBEOPNOWMRA-XJKSGUPXSA-N 0 3 326.343 2.760 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCN(C)[C@H](C(C)C)C1 ZINC000488073961 478114651 /nfs/dbraw/zinc/11/46/51/478114651.db2.gz MPMIISQCPQSQQU-KRWDZBQOSA-N 0 3 348.447 2.504 20 5 EFBDHN COC(=O)[C@H]1CCN(Cc2ccc([N+](=O)[O-])cc2OC)[C@H]1C(C)C ZINC000429361204 478122137 /nfs/dbraw/zinc/12/21/37/478122137.db2.gz IVSBDAJVGXIUEP-HOCLYGCPSA-N 0 3 336.388 2.623 20 5 EFBDHN CN(C)C[C@H]1CCCCN1C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000517802429 478125025 /nfs/dbraw/zinc/12/50/25/478125025.db2.gz XUVUMAQKSFRVHB-QGZVFWFLSA-N 0 3 348.447 2.730 20 5 EFBDHN CC(=O)c1ccc([N+](=O)[O-])cc1N1CCN([C@@H]2C[C@@H]2C)C[C@@H](C)C1 ZINC000488722699 478174374 /nfs/dbraw/zinc/17/43/74/478174374.db2.gz VOWFNEJGBVSKMJ-IIYDPXPESA-N 0 3 331.416 2.964 20 5 EFBDHN COC(=O)c1ccc([N+](=O)[O-])c(N2CCN([C@@H]3C[C@@H]3C)C[C@@H](C)C2)c1 ZINC000488763650 478181064 /nfs/dbraw/zinc/18/10/64/478181064.db2.gz JSXKSTKVZSRSFZ-DVOMOZLQSA-N 0 3 347.415 2.548 20 5 EFBDHN Cc1cc(OCC(=O)Nc2ccccc2CN(C)C)ccc1[N+](=O)[O-] ZINC000518952981 478200664 /nfs/dbraw/zinc/20/06/64/478200664.db2.gz GFZOKGNPGDJQGN-UHFFFAOYSA-N 0 3 343.383 2.982 20 5 EFBDHN COC(=O)N1CCC[C@@H]([C@H](C)NCc2ccc([N+](=O)[O-])cc2F)C1 ZINC000495567057 478232154 /nfs/dbraw/zinc/23/21/54/478232154.db2.gz SKVTUXPVYSELOY-WCQYABFASA-N 0 3 339.367 2.690 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])CCN1C ZINC000489401655 478241482 /nfs/dbraw/zinc/24/14/82/478241482.db2.gz LKMPWSBHVQFQPV-STQMWFEESA-N 0 3 334.420 2.612 20 5 EFBDHN Cc1cc(OCC(=O)N2CCCN(C(C)(C)C)CC2)ccc1[N+](=O)[O-] ZINC000562400871 478243807 /nfs/dbraw/zinc/24/38/07/478243807.db2.gz BCSPHFIHSUTQIM-UHFFFAOYSA-N 0 3 349.431 2.615 20 5 EFBDHN O=[N+]([O-])c1ccc([C@H]2CCCN(CCOC[C@@H]3CCCO3)C2)cc1 ZINC000562545299 478266261 /nfs/dbraw/zinc/26/62/61/478266261.db2.gz RVRRMOOHPGQACF-WMZOPIPTSA-N 0 3 334.416 2.970 20 5 EFBDHN O=C(CCN[C@H]1CCCc2ccc([N+](=O)[O-])cc21)Nc1ccccn1 ZINC000562592735 478275381 /nfs/dbraw/zinc/27/53/81/478275381.db2.gz VFRMHGUTZCBHLN-INIZCTEOSA-N 0 3 340.383 2.986 20 5 EFBDHN COCC1(CNCc2cc3c(cc2[N+](=O)[O-])OCCO3)CCCC1 ZINC000590663626 478278932 /nfs/dbraw/zinc/27/89/32/478278932.db2.gz XQMYXTGZCFPLOL-UHFFFAOYSA-N 0 3 336.388 2.662 20 5 EFBDHN CN(C)CCn1cc(Nc2nccc3c2cccc3[N+](=O)[O-])cn1 ZINC000590687338 478289501 /nfs/dbraw/zinc/28/95/01/478289501.db2.gz RJBXCGMLONQWBM-UHFFFAOYSA-N 0 3 326.360 2.645 20 5 EFBDHN CC(C)[C@@H](C(=O)NCCOc1ccc([N+](=O)[O-])cc1)N1CCCCC1 ZINC000520270485 478293531 /nfs/dbraw/zinc/29/35/31/478293531.db2.gz QMENYLIXEJMDJH-KRWDZBQOSA-N 0 3 349.431 2.600 20 5 EFBDHN O=[N+]([O-])c1cccc2c1ccnc2NC1CCN([C@H]2CCOC2)CC1 ZINC000590694411 478294990 /nfs/dbraw/zinc/29/49/90/478294990.db2.gz JMBBSFWHMKNZEM-AWEZNQCLSA-N 0 3 342.399 2.808 20 5 EFBDHN O=[N+]([O-])c1ccc2oc(CN[C@@H]([C@@H](CO)C3CC3)C3CC3)nc2c1 ZINC000590758055 478322996 /nfs/dbraw/zinc/32/29/96/478322996.db2.gz BSWXLPFZROUYTQ-SUMWQHHRSA-N 0 3 331.372 2.623 20 5 EFBDHN C[C@@H](C(=O)NC[C@@H](C)N1CCC[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000570505427 478375138 /nfs/dbraw/zinc/37/51/38/478375138.db2.gz DOWKEOSHQPAUET-RBSFLKMASA-N 0 3 333.432 2.935 20 5 EFBDHN O=C(N[C@@H]1CCCN2CCCC[C@@H]12)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000594419133 478375559 /nfs/dbraw/zinc/37/55/59/478375559.db2.gz NOIQGYXGYBBVQX-HIFRSBDPSA-N 0 3 342.399 2.823 20 5 EFBDHN CC(COC(=O)CN(C(=O)OC(C)(C)C)c1ccccc1)[N+](=O)[O-] ZINC000495902931 478399455 /nfs/dbraw/zinc/39/94/55/478399455.db2.gz KVYIOQMYCGYVFB-LBPRGKRZSA-N 0 3 338.360 2.637 20 5 EFBDHN O=C1NCCC[C@H]1CNCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000590971657 478423139 /nfs/dbraw/zinc/42/31/39/478423139.db2.gz CXQLCBZKAXISGE-LBPRGKRZSA-N 0 3 345.424 2.939 20 5 EFBDHN O=C(Nc1ccc([N+](=O)[O-])cc1F)N[C@H]1CCCN2CCCC[C@H]12 ZINC000594524857 478426681 /nfs/dbraw/zinc/42/66/81/478426681.db2.gz MCWHJAIWOFKHIK-LSDHHAIUSA-N 0 3 336.367 2.872 20 5 EFBDHN CC[C@H]1CN(C)CCCN1C(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000597605704 478431157 /nfs/dbraw/zinc/43/11/57/478431157.db2.gz SBIHMZOIBDLODA-OLZOCXBDSA-N 0 3 337.395 2.780 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@@H]1[C@@H]1CCCOC1 ZINC000581882195 478457739 /nfs/dbraw/zinc/45/77/39/478457739.db2.gz IOAVCTNMZUBNRK-RHSMWYFYSA-N 0 3 347.415 2.733 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC[C@@]2(CCN(C)C2)C1 ZINC000597710531 478474472 /nfs/dbraw/zinc/47/44/72/478474472.db2.gz OVCXEQSBELSNFK-SFHVURJKSA-N 0 3 331.416 2.770 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@@]2(CCN(C)C2)C1 ZINC000597709932 478474986 /nfs/dbraw/zinc/47/49/86/478474986.db2.gz DCDNEZFJPNEAIK-SFHVURJKSA-N 0 3 347.415 2.551 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@]3(CCN(C)C3)C2)c1 ZINC000597717052 478478104 /nfs/dbraw/zinc/47/81/04/478478104.db2.gz XNIWPMQPVUXRPA-QGZVFWFLSA-N 0 3 349.456 2.875 20 5 EFBDHN COC(=O)[C@@H]1CCCC[C@]1(C)NCc1cc([N+](=O)[O-])ccc1OC ZINC000540578307 478481771 /nfs/dbraw/zinc/48/17/71/478481771.db2.gz WNFXLISCTOBIMB-YOEHRIQHSA-N 0 3 336.388 2.815 20 5 EFBDHN O=C(NCCc1cccc([N+](=O)[O-])c1)Nc1cccc2c1CCNC2 ZINC000591310382 478516854 /nfs/dbraw/zinc/51/68/54/478516854.db2.gz IDHHWQDPKDREKW-UHFFFAOYSA-N 0 3 340.383 2.605 20 5 EFBDHN COCc1csc(CNCCC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000594733295 478520344 /nfs/dbraw/zinc/52/03/44/478520344.db2.gz UTQXANPQWDVOID-UHFFFAOYSA-N 0 3 349.412 2.921 20 5 EFBDHN COc1ccc(OCCN[C@H](CO)c2ccccc2C)c([N+](=O)[O-])c1 ZINC000541053125 478532139 /nfs/dbraw/zinc/53/21/39/478532139.db2.gz FCPLUSMPKDPJQG-MRXNPFEDSA-N 0 3 346.383 2.614 20 5 EFBDHN CC(C)(C)N1CC[C@H](NC(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000597922559 478576355 /nfs/dbraw/zinc/57/63/55/478576355.db2.gz GDWSEBPOVNGARL-LBPRGKRZSA-N 0 3 337.445 2.676 20 5 EFBDHN CC(C)(C)N1CC[C@H](NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C1 ZINC000597923664 478578066 /nfs/dbraw/zinc/57/80/66/478578066.db2.gz NWBQEZOBVJVOMU-NSHDSACASA-N 0 3 330.388 2.679 20 5 EFBDHN CC(C)(C)N1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000597923692 478578385 /nfs/dbraw/zinc/57/83/85/478578385.db2.gz OLWTTXNTIKZXBD-LBPRGKRZSA-N 0 3 342.399 2.746 20 5 EFBDHN CCOc1ccc(C(=O)N[C@@H]2CCN(C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000597926255 478580459 /nfs/dbraw/zinc/58/04/59/478580459.db2.gz WVZFIGGQCIXEFZ-CYBMUJFWSA-N 0 3 335.404 2.596 20 5 EFBDHN CC(C)[C@@H]1CCC[C@@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000541741822 478586057 /nfs/dbraw/zinc/58/60/57/478586057.db2.gz ZDBVJGRJEDURSJ-HOTGVXAUSA-N 0 3 340.445 2.783 20 5 EFBDHN CC(C)(C(=O)Nc1cnc2c(c1)CNCC2)c1ccc([N+](=O)[O-])cc1 ZINC000591681336 478605387 /nfs/dbraw/zinc/60/53/87/478605387.db2.gz ILGZWNKFQQAZJA-UHFFFAOYSA-N 0 3 340.383 2.552 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@@H]2CSc3ccccc32)c1 ZINC000591740791 478616836 /nfs/dbraw/zinc/61/68/36/478616836.db2.gz HTXLWMIIOLBGLC-CZUORRHYSA-N 0 3 346.408 2.771 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCCCOC[C@H]1CCCO1 ZINC000595003152 478626127 /nfs/dbraw/zinc/62/61/27/478626127.db2.gz FHEUHIIZXPMQOM-UKRRQHHQSA-N 0 3 338.404 2.840 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@H]1CCC[C@@H](C(=O)N(C)C)C1 ZINC000595007345 478627111 /nfs/dbraw/zinc/62/71/11/478627111.db2.gz HJVOKZCCQRWFON-MJBXVCDLSA-N 0 3 349.431 2.901 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H]1CCN(CC(F)(F)F)C1 ZINC000595017521 478629128 /nfs/dbraw/zinc/62/91/28/478629128.db2.gz WGXJANGATDKZNA-WDEREUQCSA-N 0 3 347.337 2.891 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@@]1(N(C)C)CCSC1 ZINC000595014271 478630110 /nfs/dbraw/zinc/63/01/10/478630110.db2.gz WAOHSQUNAOXOMQ-LRDDRELGSA-N 0 3 339.461 2.691 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)N[C@@H](CO)Cc1ccc(F)cc1 ZINC000595036594 478636807 /nfs/dbraw/zinc/63/68/07/478636807.db2.gz SMCGUIQBWJIGCZ-IUODEOHRSA-N 0 3 348.374 2.997 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@]1(O)CCN(Cc2ccccc2)C1 ZINC000601068835 478639937 /nfs/dbraw/zinc/63/99/37/478639937.db2.gz IWJYCHQXRPITNU-SFHVURJKSA-N 0 3 328.368 2.611 20 5 EFBDHN O=[N+]([O-])c1cc(F)ccc1OC[C@]1(O)CCN(Cc2ccccc2)C1 ZINC000601068610 478640045 /nfs/dbraw/zinc/64/00/45/478640045.db2.gz IDPBSZNKHMUHHZ-SFHVURJKSA-N 0 3 346.358 2.750 20 5 EFBDHN CS[C@H]1CN(c2ccnc3ccc([N+](=O)[O-])cc32)C[C@@H]1N(C)C ZINC000601134402 478678880 /nfs/dbraw/zinc/67/88/80/478678880.db2.gz BPAULNPHAVVQLV-HOTGVXAUSA-N 0 3 332.429 2.625 20 5 EFBDHN CCOC(=O)Cc1ccc(N[C@@H]2CCN(C)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000591914920 478701222 /nfs/dbraw/zinc/70/12/22/478701222.db2.gz LNMKBSOCZIQERL-GXTWGEPZSA-N 0 3 335.404 2.595 20 5 EFBDHN CCOC(=O)Cc1ccc(N[C@H]2CCN(C)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000591914922 478701755 /nfs/dbraw/zinc/70/17/55/478701755.db2.gz LNMKBSOCZIQERL-JSGCOSHPSA-N 0 3 335.404 2.595 20 5 EFBDHN Cc1c(CNC(=O)C[C@H]2NCc3ccccc32)cccc1[N+](=O)[O-] ZINC000595254721 478702676 /nfs/dbraw/zinc/70/26/76/478702676.db2.gz VNLDALCNJUSQSQ-MRXNPFEDSA-N 0 3 325.368 2.754 20 5 EFBDHN CCOC(=O)Cc1ccc(N[C@H]2C[C@@H](C)N(C3CC3)C2)c([N+](=O)[O-])c1 ZINC000591926909 478710819 /nfs/dbraw/zinc/71/08/19/478710819.db2.gz WUVWKYWFDCYLSN-OCCSQVGLSA-N 0 3 347.415 2.738 20 5 EFBDHN CC(C)c1n[nH]c(C(=O)N[C@@H]2CCN(C3CCCCC3)C2)c1[N+](=O)[O-] ZINC000598220948 478711489 /nfs/dbraw/zinc/71/14/89/478711489.db2.gz SAYZLHGRVUPOSM-GFCCVEGCSA-N 0 3 349.435 2.578 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCN(C3CCCCC3)C2)c1 ZINC000598222085 478712719 /nfs/dbraw/zinc/71/27/19/478712719.db2.gz ZYQWJWHJJGUUIK-ZDUSSCGKSA-N 0 3 347.415 2.740 20 5 EFBDHN COc1cccc(C(=O)N[C@H]2CCN(C3CCCCC3)C2)c1[N+](=O)[O-] ZINC000598221506 478713681 /nfs/dbraw/zinc/71/36/81/478713681.db2.gz WICDVIDCOUYLTQ-ZDUSSCGKSA-N 0 3 347.415 2.740 20 5 EFBDHN CN(C)Cc1ccccc1CNC(=O)/C=C\c1ccccc1[N+](=O)[O-] ZINC000491875227 478718925 /nfs/dbraw/zinc/71/89/25/478718925.db2.gz XQQUMJNDNHJWIX-QXMHVHEDSA-N 0 3 339.395 2.986 20 5 EFBDHN C[C@@H](CN1CCC(C)CC1)NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000598261550 478730120 /nfs/dbraw/zinc/73/01/20/478730120.db2.gz GZYXQENHRWZWAC-HNNXBMFYSA-N 0 3 349.431 2.600 20 5 EFBDHN C[C@H](CN1CCC(C)CC1)NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000598262003 478730357 /nfs/dbraw/zinc/73/03/57/478730357.db2.gz WUUUPUMLJYHYTP-HUUCEWRRSA-N 0 3 333.432 2.935 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@@H](C)CN1CCC(C)CC1 ZINC000598260216 478730630 /nfs/dbraw/zinc/73/06/30/478730630.db2.gz IQYKVZLQTNSQQT-AWEZNQCLSA-N 0 3 349.431 2.844 20 5 EFBDHN C[C@H](CN1CCC(C)CC1)NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000598266534 478733420 /nfs/dbraw/zinc/73/34/20/478733420.db2.gz ZBXSPYIEBBCDDC-OAHLLOKOSA-N 0 3 348.447 2.633 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N(CC)C[C@H]2CCCN2CC)c1 ZINC000572069790 478742429 /nfs/dbraw/zinc/74/24/29/478742429.db2.gz ZBPPKIFIWYPNDN-CQSZACIVSA-N 0 3 349.431 2.940 20 5 EFBDHN CN1CCC[C@H](CNc2nc(-c3ccc([N+](=O)[O-])cc3)cs2)C1 ZINC000583124500 478767686 /nfs/dbraw/zinc/76/76/86/478767686.db2.gz BZFNVRRQCCZVLB-GFCCVEGCSA-N 0 3 332.429 2.894 20 5 EFBDHN CCN(C[C@H]1CCCN1CC)C(=O)c1cccc([N+](=O)[O-])c1NC ZINC000572195136 478773596 /nfs/dbraw/zinc/77/35/96/478773596.db2.gz MKQNDWDYMZYOCC-CYBMUJFWSA-N 0 3 334.420 2.583 20 5 EFBDHN CCCN1CC[C@H](NC(=O)[C@H](CC)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000598341446 478775791 /nfs/dbraw/zinc/77/57/91/478775791.db2.gz BODFIBRNBZRHIT-CVEARBPZSA-N 0 3 333.432 2.764 20 5 EFBDHN CCCN1CC[C@H](NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000598342479 478776595 /nfs/dbraw/zinc/77/65/95/478776595.db2.gz IZRZJEFIDMEYJX-STQMWFEESA-N 0 3 337.445 2.676 20 5 EFBDHN CCCN1CC[C@H](NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000598343167 478777818 /nfs/dbraw/zinc/77/78/18/478777818.db2.gz TWRSLWPDHPZJFA-LBPRGKRZSA-N 0 3 337.395 2.612 20 5 EFBDHN CN1CCC[C@@H](CNC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC000583184665 478783188 /nfs/dbraw/zinc/78/31/88/478783188.db2.gz DOTRPXIUBICWDB-JTQLQIEISA-N 0 3 345.321 2.685 20 5 EFBDHN C[C@@H](CN1CCC(C)CC1)NC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000595453076 478792559 /nfs/dbraw/zinc/79/25/59/478792559.db2.gz ORGXTLNWLXEOPF-AWEZNQCLSA-N 0 3 334.420 2.514 20 5 EFBDHN Cc1noc(CN2C[C@H](c3ccccc3)[C@@H]3COCC[C@@H]32)c1[N+](=O)[O-] ZINC000595493555 478818379 /nfs/dbraw/zinc/81/83/79/478818379.db2.gz SHQGAQJULHJKNV-PMPSAXMXSA-N 0 3 343.383 2.896 20 5 EFBDHN NCc1cccc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c1 ZINC000592285033 478853496 /nfs/dbraw/zinc/85/34/96/478853496.db2.gz VBLAHTCWEKGCIL-UHFFFAOYSA-N 0 3 340.383 2.906 20 5 EFBDHN CC(=Cc1cccc([N+](=O)[O-])c1)CN1CCC2(COC(=O)N2)CC1 ZINC000492186491 478865663 /nfs/dbraw/zinc/86/56/63/478865663.db2.gz CBTVTYXTKPORQU-UKTHLTGXSA-N 0 3 331.372 2.573 20 5 EFBDHN C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)NCc1ccc(CO)cc1 ZINC000592392953 478882636 /nfs/dbraw/zinc/88/26/36/478882636.db2.gz KYXOMPXTYZEBGB-CYBMUJFWSA-N 0 3 343.383 2.594 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCN1CC[C@@H](C)C1 ZINC000545201455 478897504 /nfs/dbraw/zinc/89/75/04/478897504.db2.gz BQNDMOUJIPNAES-GDBMZVCRSA-N 0 3 333.432 2.622 20 5 EFBDHN CS[C@@H]1CN(Cc2c(Cl)cccc2[N+](=O)[O-])C[C@@H]1N(C)C ZINC000492262590 478899016 /nfs/dbraw/zinc/89/90/16/478899016.db2.gz XMAQMIDWXOPWSW-UONOGXRCSA-N 0 3 329.853 2.726 20 5 EFBDHN CN1CCC2(CCCN2C(=O)/C=C\c2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000492323383 478931183 /nfs/dbraw/zinc/93/11/83/478931183.db2.gz YSCUNMAJYRDPAA-XQRVVYSFSA-N 0 3 347.390 2.834 20 5 EFBDHN CCCN1CCC[C@H]1CNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000511918333 478985846 /nfs/dbraw/zinc/98/58/46/478985846.db2.gz CZLKOBNHBBDJEI-KRWDZBQOSA-N 0 3 348.447 2.653 20 5 EFBDHN CSc1cccc(C(=O)N2[C@@H]3CC[C@H]2CCN(C)C3)c1[N+](=O)[O-] ZINC000573107060 478993626 /nfs/dbraw/zinc/99/36/26/478993626.db2.gz PTCLUUVNFRZIMX-NWDGAFQWSA-N 0 3 335.429 2.625 20 5 EFBDHN C[C@H](CN1CCC(C)CC1)NC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000595787409 478998131 /nfs/dbraw/zinc/99/81/31/478998131.db2.gz OXWBYHIAOPOMKG-OAHLLOKOSA-N 0 3 348.447 2.857 20 5 EFBDHN CC(C)Oc1cc(C(=O)N2CC[C@@H](N3CCCC3)C2)ccc1[N+](=O)[O-] ZINC000584099456 479013940 /nfs/dbraw/zinc/01/39/40/479013940.db2.gz DLRSONRRXBCUPU-OAHLLOKOSA-N 0 3 347.415 2.692 20 5 EFBDHN CCCN(C(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)[C@@H]1CCN(C)C1 ZINC000592828033 479063572 /nfs/dbraw/zinc/06/35/72/479063572.db2.gz ADLILAVYQJGXPD-GXTWGEPZSA-N 0 3 337.395 2.780 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1[C@@H]2CC[C@H]1CCN(C)C2 ZINC000584241701 479065933 /nfs/dbraw/zinc/06/59/33/479065933.db2.gz SAAQCAIUWLHXDC-SOLBZPMBSA-N 0 3 345.443 2.859 20 5 EFBDHN O=C(/C=C\c1cccc([N+](=O)[O-])c1)NC[C@H]1CCCCN1C1CC1 ZINC000493615057 479083194 /nfs/dbraw/zinc/08/31/94/479083194.db2.gz FMQDNRDNWRBYMW-CGQZWFTASA-N 0 3 329.400 2.741 20 5 EFBDHN O=C(/C=C\c1ccc([N+](=O)[O-])cc1)NC[C@@H]1CCCCN1C1CC1 ZINC000493635956 479093251 /nfs/dbraw/zinc/09/32/51/479093251.db2.gz XGANYNLFNBHGDP-KOJMWDNASA-N 0 3 329.400 2.741 20 5 EFBDHN C[C@H](CNc1cc[nH]c(=O)c1[N+](=O)[O-])N1CCc2ccccc2C1 ZINC000596075724 479123629 /nfs/dbraw/zinc/12/36/29/479123629.db2.gz PDEJKEMJVHGGQE-GFCCVEGCSA-N 0 3 328.372 2.554 20 5 EFBDHN O=c1[n-]ccc(NCc2cccc(C[NH+]3CCCC3)c2)c1[N+](=O)[O-] ZINC000596079002 479125027 /nfs/dbraw/zinc/12/50/27/479125027.db2.gz YWSNWTBJSFLNDT-UHFFFAOYSA-N 0 3 328.372 2.903 20 5 EFBDHN C[C@@H](CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-])N1CCCC[C@H]1C ZINC000593027962 479131870 /nfs/dbraw/zinc/13/18/70/479131870.db2.gz HKNQPTMBXOHRAC-OLZOCXBDSA-N 0 3 337.395 2.656 20 5 EFBDHN CCn1nncc1CN[C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000599061202 479144383 /nfs/dbraw/zinc/14/43/83/479144383.db2.gz LLLZXTOVQHEYHG-BBRMVZONSA-N 0 3 329.404 2.707 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@@H]1CCCN1CC(F)F ZINC000599066075 479145682 /nfs/dbraw/zinc/14/56/82/479145682.db2.gz ONMLWCILKBSXNV-AAEUAGOBSA-N 0 3 343.374 2.984 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@@H]1CCCN1CC(F)F ZINC000599066078 479145877 /nfs/dbraw/zinc/14/58/77/479145877.db2.gz ONMLWCILKBSXNV-YPMHNXCESA-N 0 3 343.374 2.984 20 5 EFBDHN CC(C)O[C@@H]1CCCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000593055595 479147001 /nfs/dbraw/zinc/14/70/01/479147001.db2.gz MRIOWMXXRLBEEQ-CQSZACIVSA-N 0 3 335.404 2.813 20 5 EFBDHN CN(C)C/C=C\C(=O)N[C@@H](c1cccc([N+](=O)[O-])c1F)C(F)(F)F ZINC000493759961 479149164 /nfs/dbraw/zinc/14/91/64/479149164.db2.gz RYABGMHBVHYHMB-IRBQFCFKSA-N 0 3 349.284 2.571 20 5 EFBDHN CCc1cc(N2C[C@@H](C)N[C@@H](C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000599104788 479162739 /nfs/dbraw/zinc/16/27/39/479162739.db2.gz NXPADZITJCVVGE-BETUJISGSA-N 0 3 341.415 2.801 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)N(C)[C@H](C)C1CCN(C)CC1 ZINC000584532135 479168416 /nfs/dbraw/zinc/16/84/16/479168416.db2.gz ZVCCZWFEGRZFEP-CYBMUJFWSA-N 0 3 349.431 2.796 20 5 EFBDHN C[C@H]1C[C@@H](Nc2cc[n-]c(=O)c2[N+](=O)[O-])C[N@@H+]1Cc1ccccc1 ZINC000596163373 479172493 /nfs/dbraw/zinc/17/24/93/479172493.db2.gz SNMGZPJCDOCIAU-GXTWGEPZSA-N 0 3 328.372 2.770 20 5 EFBDHN C[C@H]1C[C@@H](Nc2cc[n-]c(=O)c2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000596163373 479172500 /nfs/dbraw/zinc/17/25/00/479172500.db2.gz SNMGZPJCDOCIAU-GXTWGEPZSA-N 0 3 328.372 2.770 20 5 EFBDHN O=c1[n-]ccc(N2CCC(CCC[NH+]3CCCC3)CC2)c1[N+](=O)[O-] ZINC000596174096 479179951 /nfs/dbraw/zinc/17/99/51/479179951.db2.gz ARZHXBDQVWAGCO-UHFFFAOYSA-N 0 3 334.420 2.788 20 5 EFBDHN CN(CCN1CCCCC1)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000593111786 479180850 /nfs/dbraw/zinc/18/08/50/479180850.db2.gz APDMMYJSYDHDLU-UHFFFAOYSA-N 0 3 345.403 2.563 20 5 EFBDHN CN(CCN1CCCCC1)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000593112215 479180896 /nfs/dbraw/zinc/18/08/96/479180896.db2.gz MXQDAQSJPOTDRY-UHFFFAOYSA-N 0 3 345.403 2.563 20 5 EFBDHN O=[N+]([O-])c1ccc(CCN2CC[C@@H](OCc3ccccn3)C2)cc1 ZINC000610765520 479181322 /nfs/dbraw/zinc/18/13/22/479181322.db2.gz DDIRFERRBHSCDJ-GOSISDBHSA-N 0 3 327.384 2.823 20 5 EFBDHN C[C@H](CN(C)Cc1ccccc1)Nc1ccc([N+](=O)[O-])c(C(N)=O)c1 ZINC000596187238 479187215 /nfs/dbraw/zinc/18/72/15/479187215.db2.gz XEKRZRQBHQDLMU-CYBMUJFWSA-N 0 3 342.399 2.626 20 5 EFBDHN CCOc1cc(CN2C[C@@H](C(=O)OC)[C@H](C3CC3)C2)ccc1[N+](=O)[O-] ZINC000593129627 479194464 /nfs/dbraw/zinc/19/44/64/479194464.db2.gz DYOMAQZBSDXVQI-LSDHHAIUSA-N 0 3 348.399 2.625 20 5 EFBDHN O=c1[n-]ccc(NC[C@H]2CC[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000596222038 479209045 /nfs/dbraw/zinc/20/90/45/479209045.db2.gz IRLPUAIEQYNYEA-CQSZACIVSA-N 0 3 328.372 2.629 20 5 EFBDHN O=c1[n-]ccc(NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000596222038 479209053 /nfs/dbraw/zinc/20/90/53/479209053.db2.gz IRLPUAIEQYNYEA-CQSZACIVSA-N 0 3 328.372 2.629 20 5 EFBDHN CC(C)N1CCCC[C@H]1Cn1cnc2sc([N+](=O)[O-])cc2c1=O ZINC000596280319 479236933 /nfs/dbraw/zinc/23/69/33/479236933.db2.gz CBXJJXZKOUYSSJ-NSHDSACASA-N 0 3 336.417 2.629 20 5 EFBDHN COC(=O)Cc1ccc(N[C@H]2CCN(C(C)(C)C)C2)c([N+](=O)[O-])c1 ZINC000596335730 479258296 /nfs/dbraw/zinc/25/82/96/479258296.db2.gz HREDFWHTDXYAIA-ZDUSSCGKSA-N 0 3 335.404 2.595 20 5 EFBDHN C[C@@H]1[C@H](C)N(Cc2ccccc2)[C@@H](C)CN1c1ncc([N+](=O)[O-])cn1 ZINC000585090420 479278701 /nfs/dbraw/zinc/27/87/01/479278701.db2.gz LUZLHCKTXNGPAX-SOUVJXGZSA-N 0 3 341.415 2.873 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC[C@H]1[C@H]1CCCOC1 ZINC000574397584 479279305 /nfs/dbraw/zinc/27/93/05/479279305.db2.gz VISSPDDMSGHNFF-YOEHRIQHSA-N 0 3 347.415 2.733 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC[C@@H]1[C@H]1CCCOC1 ZINC000574397583 479279556 /nfs/dbraw/zinc/27/95/56/479279556.db2.gz VISSPDDMSGHNFF-WMLDXEAASA-N 0 3 347.415 2.733 20 5 EFBDHN Cc1c(CN2CCC[C@H](N3CCOCC3)CC2)cccc1[N+](=O)[O-] ZINC000585718321 479315752 /nfs/dbraw/zinc/31/57/52/479315752.db2.gz CKORFFGVTRVEDT-KRWDZBQOSA-N 0 3 333.432 2.590 20 5 EFBDHN CC(C)(C)[C@H](N)c1cn(Cc2c(F)cc([N+](=O)[O-])cc2F)nn1 ZINC000603246678 479319604 /nfs/dbraw/zinc/31/96/04/479319604.db2.gz FSDWVBZFRBWKSV-CYBMUJFWSA-N 0 3 325.319 2.559 20 5 EFBDHN COc1ccc(CN[C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cc1O ZINC000574633132 479320209 /nfs/dbraw/zinc/32/02/09/479320209.db2.gz DAKKRUYMCYVVAU-ZIAGYGMSSA-N 0 3 346.387 2.779 20 5 EFBDHN CN(C)Cc1cccc(CNC(=O)Cc2ccc(F)cc2[N+](=O)[O-])c1 ZINC000593396547 479324901 /nfs/dbraw/zinc/32/49/01/479324901.db2.gz ASBGVENNYLRQBP-UHFFFAOYSA-N 0 3 345.374 2.654 20 5 EFBDHN C[C@H](CN1CCC[C@H](C)C1)NC(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000593419317 479333093 /nfs/dbraw/zinc/33/30/93/479333093.db2.gz FKLZBYLQFUZMGS-QWHCGFSZSA-N 0 3 337.395 2.513 20 5 EFBDHN CCOCCN(CCn1cc([N+](=O)[O-])cn1)[C@H]1CCc2ccccc21 ZINC000599626726 479358698 /nfs/dbraw/zinc/35/86/98/479358698.db2.gz ZDGANQAJXWYUIG-SFHVURJKSA-N 0 3 344.415 2.817 20 5 EFBDHN C[C@@H](NC[C@@H](O)CN(C)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000611383426 479363183 /nfs/dbraw/zinc/36/31/83/479363183.db2.gz KHIWOZKOOAOOIQ-DNVCBOLYSA-N 0 3 343.427 2.738 20 5 EFBDHN C[C@@H](NC1CCN(c2ccc([N+](=O)[O-])nc2)CC1)c1ccccn1 ZINC000602501238 479370893 /nfs/dbraw/zinc/37/08/93/479370893.db2.gz BWNXCCDPZZFXAI-CYBMUJFWSA-N 0 3 327.388 2.704 20 5 EFBDHN Cc1cc(N(C)CCCN(C)Cc2ccncc2)ncc1[N+](=O)[O-] ZINC000603400900 479371287 /nfs/dbraw/zinc/37/12/87/479371287.db2.gz NMBNVKSBLRQRSY-UHFFFAOYSA-N 0 3 329.404 2.652 20 5 EFBDHN O=[N+]([O-])c1ccsc1NC[C@]1(O)CCN(Cc2ccccc2)C1 ZINC000611413146 479372276 /nfs/dbraw/zinc/37/22/76/479372276.db2.gz UNUXTDMONQDAJC-MRXNPFEDSA-N 0 3 333.413 2.705 20 5 EFBDHN Cc1cc(C)n(CCCNCc2nc3cc([N+](=O)[O-])ccc3o2)n1 ZINC000602506619 479373824 /nfs/dbraw/zinc/37/38/24/479373824.db2.gz FFMDOAMHKAIHFL-UHFFFAOYSA-N 0 3 329.360 2.729 20 5 EFBDHN CN(C)C[C@@H]1CN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CCO1 ZINC000587970211 479377600 /nfs/dbraw/zinc/37/76/00/479377600.db2.gz NISLHTXXTGIDLW-SNVBAGLBSA-N 0 3 334.203 2.668 20 5 EFBDHN O=[N+]([O-])c1sc(CNC[C@@H]2CCCOC2)cc1Br ZINC000602518458 479378715 /nfs/dbraw/zinc/37/87/15/479378715.db2.gz NPGOOTWRSCZVIQ-QMMMGPOBSA-N 0 3 335.223 2.935 20 5 EFBDHN C[C@H](CN1CCC[C@H](C)C1)NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602524511 479381085 /nfs/dbraw/zinc/38/10/85/479381085.db2.gz KVJHZCMUFBHBGP-QWHCGFSZSA-N 0 3 332.404 2.946 20 5 EFBDHN C[C@@H](CN1CCC[C@@H](C)C1)NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602524510 479381700 /nfs/dbraw/zinc/38/17/00/479381700.db2.gz KVJHZCMUFBHBGP-OLZOCXBDSA-N 0 3 332.404 2.946 20 5 EFBDHN O=[N+]([O-])c1sc(CNCC2CCOCC2)cc1Br ZINC000602529732 479383070 /nfs/dbraw/zinc/38/30/70/479383070.db2.gz QWGLAVSIYUXTTR-UHFFFAOYSA-N 0 3 335.223 2.935 20 5 EFBDHN CCN(CCNCc1cc(Br)c([N+](=O)[O-])s1)C1CC1 ZINC000602528251 479383357 /nfs/dbraw/zinc/38/33/57/479383357.db2.gz QUJJITAMEZDQBH-UHFFFAOYSA-N 0 3 348.266 2.993 20 5 EFBDHN CN1CCC[C@@H]1CNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602533910 479386524 /nfs/dbraw/zinc/38/65/24/479386524.db2.gz ZKUWWOZRRCUOSE-MRVPVSSYSA-N 0 3 334.239 2.603 20 5 EFBDHN COC[C@@H](C)N(CCn1cc([N+](=O)[O-])cn1)[C@H]1CCc2ccccc21 ZINC000599682508 479388347 /nfs/dbraw/zinc/38/83/47/479388347.db2.gz KVRNIQQDJAQTJH-KDOFPFPSSA-N 0 3 344.415 2.816 20 5 EFBDHN COC[C@H](C)N(CCn1ccc([N+](=O)[O-])n1)[C@@H]1CCc2ccccc21 ZINC000599683262 479388655 /nfs/dbraw/zinc/38/86/55/479388655.db2.gz PTEIKXWCQRFFEO-WMLDXEAASA-N 0 3 344.415 2.816 20 5 EFBDHN COC[C@@H](C)N(CCn1ccc([N+](=O)[O-])n1)[C@H]1CCc2ccccc21 ZINC000599683260 479388741 /nfs/dbraw/zinc/38/87/41/479388741.db2.gz PTEIKXWCQRFFEO-PBHICJAKSA-N 0 3 344.415 2.816 20 5 EFBDHN Cc1nccn1CCCCNCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602552393 479393837 /nfs/dbraw/zinc/39/38/37/479393837.db2.gz VGIVRLCZXJOJNI-UHFFFAOYSA-N 0 3 329.360 2.811 20 5 EFBDHN C[C@H](CC[S@](C)=O)NCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602569271 479401962 /nfs/dbraw/zinc/40/19/62/479401962.db2.gz OQKNLSLGCYRIDN-CLTRCRFRSA-N 0 3 338.351 2.860 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCN1CCC[C@@H]1/C=C\c1ccccc1 ZINC000611554811 479413177 /nfs/dbraw/zinc/41/31/77/479413177.db2.gz XRMIMTZPEWEQJI-XZVRFQMRSA-N 0 3 339.395 2.934 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNCCN1CC=CCC1 ZINC000602639738 479443073 /nfs/dbraw/zinc/44/30/73/479443073.db2.gz ZEFKMKANKGDFLN-UHFFFAOYSA-N 0 3 329.322 2.965 20 5 EFBDHN CC[C@H]1CN(C)CCCN1C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000588821395 479444521 /nfs/dbraw/zinc/44/45/21/479444521.db2.gz FQEMCDJAXZLYKD-ZDUSSCGKSA-N 0 3 325.796 2.805 20 5 EFBDHN CN(C)CC1(NCc2cc(Br)c([N+](=O)[O-])s2)CCC1 ZINC000602649554 479447902 /nfs/dbraw/zinc/44/79/02/479447902.db2.gz WDSWJSRLYVQUNO-UHFFFAOYSA-N 0 3 348.266 2.993 20 5 EFBDHN O=[N+]([O-])c1ccc2ncnc(N3CC[C@@H](N4CCCCC4)C3)c2c1 ZINC000611706374 479451604 /nfs/dbraw/zinc/45/16/04/479451604.db2.gz JIVGLXQNEUFTTK-CQSZACIVSA-N 0 3 327.388 2.603 20 5 EFBDHN CC(C)[C@H](CO)CNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602653460 479451698 /nfs/dbraw/zinc/45/16/98/479451698.db2.gz IEIHRDXVFAPVAY-QMMMGPOBSA-N 0 3 337.239 2.773 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNCCC1(O)CCOCC1 ZINC000602660451 479455802 /nfs/dbraw/zinc/45/58/02/479455802.db2.gz CWCQFNSTFIJCPE-UHFFFAOYSA-N 0 3 348.321 2.635 20 5 EFBDHN CCCN1CC[C@H](NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)C1 ZINC000596879487 479470294 /nfs/dbraw/zinc/47/02/94/479470294.db2.gz BJGMLEJHMYDMDM-HNNXBMFYSA-N 0 3 346.431 2.753 20 5 EFBDHN O=[N+]([O-])c1sc(CNCCC2(CO)CC2)cc1Br ZINC000602685099 479475758 /nfs/dbraw/zinc/47/57/58/479475758.db2.gz YGMFEMSJGBTGQF-UHFFFAOYSA-N 0 3 335.223 2.671 20 5 EFBDHN CCN(C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)C1CCN(C)CC1 ZINC000599985591 479486734 /nfs/dbraw/zinc/48/67/34/479486734.db2.gz HEYOYZHNHFNOPF-UHFFFAOYSA-N 0 3 330.388 2.632 20 5 EFBDHN CCN(C(=O)CSc1ccc([N+](=O)[O-])cc1)C1CCN(C)CC1 ZINC000599986740 479488500 /nfs/dbraw/zinc/48/85/00/479488500.db2.gz YSMJPANMDLNLSU-UHFFFAOYSA-N 0 3 337.445 2.630 20 5 EFBDHN O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CCC[C@@H](N2CCCC2)C1 ZINC000604265757 479493550 /nfs/dbraw/zinc/49/35/50/479493550.db2.gz FTDBRLLTHZHADW-CQSZACIVSA-N 0 3 342.399 2.777 20 5 EFBDHN CCN1C[C@@H](CNCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1=O ZINC000602709098 479493551 /nfs/dbraw/zinc/49/35/51/479493551.db2.gz AIIUIASPFGZFOV-SNVBAGLBSA-N 0 3 345.321 2.572 20 5 EFBDHN O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2NCc2ccccc2CO)n1 ZINC000618564659 479494058 /nfs/dbraw/zinc/49/40/58/479494058.db2.gz BJDRXOMGGFLQOM-HOTGVXAUSA-N 0 3 330.388 2.557 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1ccc(OC)c([N+](=O)[O-])c1 ZINC000611825642 479494227 /nfs/dbraw/zinc/49/42/27/479494227.db2.gz FUBZHMVUEUBGOR-KGLIPLIRSA-N 0 3 348.403 2.694 20 5 EFBDHN COC(=O)CC1CCN(CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000604274095 479494822 /nfs/dbraw/zinc/49/48/22/479494822.db2.gz JEKQAQDGZYYNIV-UHFFFAOYSA-N 0 3 336.388 2.639 20 5 EFBDHN CCCN1CC[C@H](NCc2cc(Br)c([N+](=O)[O-])s2)C1 ZINC000602713388 479496840 /nfs/dbraw/zinc/49/68/40/479496840.db2.gz MIGDPBOEGRSIQO-VIFPVBQESA-N 0 3 348.266 2.993 20 5 EFBDHN CC(C)Oc1cc(C(=O)N(C)CCN2CCCCC2)ccc1[N+](=O)[O-] ZINC000593884555 479497350 /nfs/dbraw/zinc/49/73/50/479497350.db2.gz YYCLAANYJACSGF-UHFFFAOYSA-N 0 3 349.431 2.940 20 5 EFBDHN COC(=O)C[C@@H]1CCCCN1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000604305050 479499380 /nfs/dbraw/zinc/49/93/80/479499380.db2.gz QGEKATVUQIAGIR-HNNXBMFYSA-N 0 3 336.388 2.781 20 5 EFBDHN COc1ccc([C@@H]2CCN(CCn3c(C)ncc3[N+](=O)[O-])C2)cc1 ZINC000602770144 479541068 /nfs/dbraw/zinc/54/10/68/479541068.db2.gz NANBIQAFVOQKCO-OAHLLOKOSA-N 0 3 330.388 2.598 20 5 EFBDHN COC(=O)CC1CCC(NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000600157096 479549684 /nfs/dbraw/zinc/54/96/84/479549684.db2.gz ZNQGKJGZVHDXMC-UHFFFAOYSA-N 0 3 346.387 2.683 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN1CC[C@H](COCc2ccccc2)C1 ZINC000602785351 479551307 /nfs/dbraw/zinc/55/13/07/479551307.db2.gz TVBHNFKPFPCTEW-KRWDZBQOSA-N 0 3 344.415 2.638 20 5 EFBDHN Cc1nc2c(s1)[C@@H](N(C)CCn1c(C)ncc1[N+](=O)[O-])CCC2 ZINC000602790008 479555157 /nfs/dbraw/zinc/55/51/57/479555157.db2.gz DONJSWWRIWJIOC-ZDUSSCGKSA-N 0 3 335.433 2.874 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2NC[C@@H](O)COc1ccccc1 ZINC000576172092 479557190 /nfs/dbraw/zinc/55/71/90/479557190.db2.gz DBBXVXMFZPRJJU-DYVFJYSZSA-N 0 3 328.368 2.612 20 5 EFBDHN CC[C@@H](NCCn1c(C)ncc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000602802970 479564356 /nfs/dbraw/zinc/56/43/56/479564356.db2.gz SYKFPVITTRIJTQ-CQSZACIVSA-N 0 3 346.387 2.612 20 5 EFBDHN CN(Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@H]1CCC(=O)N(C)C1 ZINC000600178218 479565110 /nfs/dbraw/zinc/56/51/10/479565110.db2.gz HTDMOUSYCRGBDW-HNNXBMFYSA-N 0 3 343.383 2.907 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCCN2CCCC[C@H]12 ZINC000594056128 479570170 /nfs/dbraw/zinc/57/01/70/479570170.db2.gz RCBQSDSWSGSVFF-UKRRQHHQSA-N 0 3 348.403 2.742 20 5 EFBDHN CCOc1cc(N2CCN(C[C@@H]3CCO[C@@H]3C)CC2)ccc1[N+](=O)[O-] ZINC000602822087 479576754 /nfs/dbraw/zinc/57/67/54/479576754.db2.gz RKQOSIKULOUXMP-CABCVRRESA-N 0 3 349.431 2.541 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN(C)CCCOCc1ccccc1 ZINC000602831124 479581379 /nfs/dbraw/zinc/58/13/79/479581379.db2.gz YZPWGQJNGMRCBK-UHFFFAOYSA-N 0 3 332.404 2.638 20 5 EFBDHN CN(C)c1cccc(CN2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1 ZINC000618761675 479583817 /nfs/dbraw/zinc/58/38/17/479583817.db2.gz BXXWMYKZTUYKNQ-UHFFFAOYSA-N 0 3 329.404 2.694 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1CCCN2CCCC[C@H]12 ZINC000594094442 479585914 /nfs/dbraw/zinc/58/59/14/479585914.db2.gz JYGLEVMELYPWLM-UKRRQHHQSA-N 0 3 348.403 2.742 20 5 EFBDHN O=[N+]([O-])c1cc(F)ccc1CN1CCCN(c2ccncc2)CC1 ZINC000602846293 479589974 /nfs/dbraw/zinc/58/99/74/479589974.db2.gz FDPXJGBKBKNQBJ-UHFFFAOYSA-N 0 3 330.363 2.841 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CN1CCCN(c2ccncc2)CC1 ZINC000602845951 479590542 /nfs/dbraw/zinc/59/05/42/479590542.db2.gz NRWYSEKYOLZANR-UHFFFAOYSA-N 0 3 342.399 2.711 20 5 EFBDHN O=C(N[C@H]1CCCN2CCCC[C@@H]12)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000594195112 479625498 /nfs/dbraw/zinc/62/54/98/479625498.db2.gz CCGQMLURLYMMEX-MHORFTMASA-N 0 3 343.427 2.831 20 5 EFBDHN O=C(CSc1ccccc1[N+](=O)[O-])N[C@H]1CCCN2CCCC[C@@H]12 ZINC000594196151 479626807 /nfs/dbraw/zinc/62/68/07/479626807.db2.gz LBVTWOWHLLUBPO-KBPBESRZSA-N 0 3 349.456 2.820 20 5 EFBDHN O=C(CSc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCCN2CCCC[C@H]12 ZINC000594197189 479628137 /nfs/dbraw/zinc/62/81/37/479628137.db2.gz AVOBTWQILAGKSR-HZPDHXFCSA-N 0 3 349.456 2.820 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC[C@@H](CN2CCCC2=O)C1 ZINC000597228826 479631752 /nfs/dbraw/zinc/63/17/52/479631752.db2.gz OZDWPRTYMDKJPQ-XBNGYDHASA-N 0 3 343.427 2.942 20 5 EFBDHN COC(=O)[C@H]1C[C@H](NCc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000597241486 479639584 /nfs/dbraw/zinc/63/95/84/479639584.db2.gz GJUNPCPPWPKZOH-HAQNSBGRSA-N 0 3 330.340 2.896 20 5 EFBDHN CC(C)(CO)[C@@H](NCCOc1cccc([N+](=O)[O-])c1)c1cccnc1 ZINC000590600328 479666824 /nfs/dbraw/zinc/66/68/24/479666824.db2.gz JQZQOVGBQPUBIK-KRWDZBQOSA-N 0 3 345.399 2.718 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCN([C@@H]2CCC[C@H]2O)CC1 ZINC000615835571 479765595 /nfs/dbraw/zinc/76/55/95/479765595.db2.gz RRLQGHDRIDFZAR-QOZZVNKNSA-N 0 3 345.443 2.529 20 5 EFBDHN O=[N+]([O-])c1cc2ccccc2nc1N1CCN(c2ccncc2)CC1 ZINC000616052813 479816288 /nfs/dbraw/zinc/81/62/88/479816288.db2.gz ODHFONHNYFNGSO-UHFFFAOYSA-N 0 3 335.367 2.865 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1CN[C@H](CO)[C@@H](C)c1ccccc1 ZINC000619532019 479820505 /nfs/dbraw/zinc/82/05/05/479820505.db2.gz XNRXCWQQFCJRAM-SUMWQHHRSA-N 0 3 330.384 2.858 20 5 EFBDHN COC(=O)CC1(NCc2ccc([N+](=O)[O-])cc2OC)CCCCC1 ZINC000619531805 479820918 /nfs/dbraw/zinc/82/09/18/479820918.db2.gz ZDAGFRZSRMNRHI-UHFFFAOYSA-N 0 3 336.388 2.959 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1CN[C@@H](CO)[C@H](C)c1ccccc1 ZINC000619532017 479821104 /nfs/dbraw/zinc/82/11/04/479821104.db2.gz XNRXCWQQFCJRAM-DYVFJYSZSA-N 0 3 330.384 2.858 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1CN1CCc2ccc(O)cc2CC1 ZINC000619531780 479821192 /nfs/dbraw/zinc/82/11/92/479821192.db2.gz MDODYGBLAUKYDZ-UHFFFAOYSA-N 0 3 328.368 2.910 20 5 EFBDHN CC[C@H]1CN(C)CCCN1C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000619567061 479829884 /nfs/dbraw/zinc/82/98/84/479829884.db2.gz MIKOHKIRDHRGEJ-LBPRGKRZSA-N 0 3 330.388 2.632 20 5 EFBDHN Cc1cc(OC[C@@H](O)CN(C)Cc2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000614066796 480179748 /nfs/dbraw/zinc/17/97/48/480179748.db2.gz PRAAEFIGXDDZJY-HNNXBMFYSA-N 0 3 348.374 2.914 20 5 EFBDHN CC[C@H](CN1CCCC1)NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000609833677 480210925 /nfs/dbraw/zinc/21/09/25/480210925.db2.gz SWXXOOIROGETQV-OAHLLOKOSA-N 0 3 344.415 2.540 20 5 EFBDHN CC[C@@H](CN1CCCC1)NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000609877264 480215289 /nfs/dbraw/zinc/21/52/89/480215289.db2.gz LBRQCPNTGKBLRD-ZDUSSCGKSA-N 0 3 339.823 2.781 20 5 EFBDHN Cn1cnc([N+](=O)[O-])c1NC[C@@H]1CCCN(C)[C@H]1c1cccs1 ZINC000610281309 480271074 /nfs/dbraw/zinc/27/10/74/480271074.db2.gz HTKSTDQPXAFBTP-WCQYABFASA-N 0 3 335.433 2.885 20 5 EFBDHN O=[N+]([O-])c1ncccc1NCc1ccccc1CN1CCC(O)CC1 ZINC000610283101 480271377 /nfs/dbraw/zinc/27/13/77/480271377.db2.gz ZTHKBMHLEAJIIK-UHFFFAOYSA-N 0 3 342.399 2.559 20 5 EFBDHN CCc1ccc(C(=O)N2CCN(c3ccncc3)CC2)cc1[N+](=O)[O-] ZINC000610435836 480305480 /nfs/dbraw/zinc/30/54/80/480305480.db2.gz MAEFGIJRSRPIAD-UHFFFAOYSA-N 0 3 340.383 2.515 20 5 EFBDHN CC(C)[C@@H]1CN(C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CCN1 ZINC000621156694 480365717 /nfs/dbraw/zinc/36/57/17/480365717.db2.gz GGOSENTURXBMNI-IBGZPJMESA-N 0 3 349.434 2.751 20 5 EFBDHN C[C@H](c1ccccc1)[C@@H](CO)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000618306372 480614216 /nfs/dbraw/zinc/61/42/16/480614216.db2.gz AKRAMMUHMJOGPM-SJKOYZFVSA-N 0 3 340.383 2.725 20 5 EFBDHN C[C@@H](O)C[C@@H]1CCCN1[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000152925976 533745409 /nfs/dbraw/zinc/74/54/09/533745409.db2.gz PCOSQFACMHWONQ-XUJVJEKNSA-N 0 3 346.387 2.941 20 5 EFBDHN COc1cc(CN2CCN(CC(C)C)CC2)c([N+](=O)[O-])cc1F ZINC000184222368 533811406 /nfs/dbraw/zinc/81/14/06/533811406.db2.gz OFBVIOCHAGLLCP-UHFFFAOYSA-N 0 3 325.384 2.516 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)CCN(C)C1CC1 ZINC000186752834 534006475 /nfs/dbraw/zinc/00/64/75/534006475.db2.gz JPNAYWDZGFVTRX-GFCCVEGCSA-N 0 3 337.445 2.628 20 5 EFBDHN COc1ccc(NC(=O)CCN[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000181785151 534069927 /nfs/dbraw/zinc/06/99/27/534069927.db2.gz ATDDPMDDGTZPLE-GFCCVEGCSA-N 0 3 344.371 2.678 20 5 EFBDHN CCn1cc([C@@H](C)NCCC(=O)Nc2cc([N+](=O)[O-])ccc2C)cn1 ZINC000296088161 517881530 /nfs/dbraw/zinc/88/15/30/517881530.db2.gz POZWWYBALZOOTO-CYBMUJFWSA-N 0 3 345.403 2.799 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCN(CCc1cccc(F)c1)C1CC1 ZINC000159828455 534320796 /nfs/dbraw/zinc/32/07/96/534320796.db2.gz YXFOSLJRNGILEY-UHFFFAOYSA-N 0 3 345.374 2.603 20 5 EFBDHN NC(=O)[C@@H]1CCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000155029586 534426037 /nfs/dbraw/zinc/42/60/37/534426037.db2.gz MMRRDUZEFQDAGO-GFCCVEGCSA-N 0 3 329.356 2.552 20 5 EFBDHN CC(C)[C@H]1CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCS1 ZINC000072836409 519826682 /nfs/dbraw/zinc/82/66/82/519826682.db2.gz IPSLVKPBTAYKPF-OAHLLOKOSA-N 0 3 337.445 2.997 20 5 EFBDHN CCOc1ccc(C(=O)NC[C@H](CC(C)C)N(C)C)cc1[N+](=O)[O-] ZINC000075851012 520911855 /nfs/dbraw/zinc/91/18/55/520911855.db2.gz HFSJICJSZXKSEF-AWEZNQCLSA-N 0 3 337.420 2.700 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)/C=C/c1cccc([N+](=O)[O-])c1 ZINC000177809684 521721656 /nfs/dbraw/zinc/72/16/56/521721656.db2.gz JJQINMTYSZWZAP-QDTKCAEZSA-N 0 3 329.400 2.693 20 5 EFBDHN CN(C)CCNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000119302627 521785016 /nfs/dbraw/zinc/78/50/16/521785016.db2.gz NHNIMMZLMCRJLX-UHFFFAOYSA-N 0 3 329.356 2.679 20 5 EFBDHN CN(C)Cc1cccc(NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)c1 ZINC000180366256 521926570 /nfs/dbraw/zinc/92/65/70/521926570.db2.gz NCMJLLAYCKOFCV-UHFFFAOYSA-N 0 3 343.339 2.637 20 5 EFBDHN COC1(CNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000181075594 522633561 /nfs/dbraw/zinc/63/35/61/522633561.db2.gz XALYNKOXELQQBK-UHFFFAOYSA-N 0 3 330.388 2.654 20 5 EFBDHN COc1ccc(-c2ccc(CNCCn3cccn3)o2)c([N+](=O)[O-])c1 ZINC000237428248 523132570 /nfs/dbraw/zinc/13/25/70/523132570.db2.gz MVWCFQKRUHOSJQ-UHFFFAOYSA-N 0 3 342.355 2.850 20 5 EFBDHN CC[C@H](C)CN(CC)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000177849371 523879029 /nfs/dbraw/zinc/87/90/29/523879029.db2.gz DECIFQDGQXUNPN-NSHDSACASA-N 0 3 337.376 2.630 20 5 EFBDHN CN(C)CCN(C(=O)COc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000063829291 524058564 /nfs/dbraw/zinc/05/85/64/524058564.db2.gz CLDRRXPVLWHKEF-UHFFFAOYSA-N 0 3 343.383 2.568 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccccc1[N+](=O)[O-] ZINC000119852533 525011918 /nfs/dbraw/zinc/01/19/18/525011918.db2.gz GMRJOBWJJPHRHL-PBHICJAKSA-N 0 3 339.395 2.845 20 5 EFBDHN Cc1cc(NC[C@@H](O)COCC(C)C)c2cc([N+](=O)[O-])ccc2n1 ZINC000181456775 525273299 /nfs/dbraw/zinc/27/32/99/525273299.db2.gz MKDBTIMBYBNVOC-CQSZACIVSA-N 0 3 333.388 2.897 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1CN1CCC[C@H](c2nc(N(C)C)no2)C1 ZINC000194936965 525564068 /nfs/dbraw/zinc/56/40/68/525564068.db2.gz DIHJQIJACIXPDA-AWEZNQCLSA-N 0 3 345.403 2.732 20 5 EFBDHN Cc1ccc(C(=O)NCCN[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000120919407 526168314 /nfs/dbraw/zinc/16/83/14/526168314.db2.gz JUUCRUPOEAEEPK-CQSZACIVSA-N 0 3 327.384 2.984 20 5 EFBDHN O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CCC[C@@H](N2CCCC2)C1 ZINC000077510559 526609968 /nfs/dbraw/zinc/60/99/68/526609968.db2.gz ZINRFIURHAVYCI-CYBMUJFWSA-N 0 3 337.807 2.949 20 5 EFBDHN O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CCC[C@@H]1CN1CCCCC1 ZINC000152020300 527247042 /nfs/dbraw/zinc/24/70/42/527247042.db2.gz GYOFQCBWDMDUMR-MRXNPFEDSA-N 0 3 349.406 2.753 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2nc(CN3CC[C@@H](N4CCCC4)C3)co2)cc1 ZINC000089892674 527342811 /nfs/dbraw/zinc/34/28/11/527342811.db2.gz RUHODRXIAAIMRI-QGZVFWFLSA-N 0 3 342.399 2.920 20 5 EFBDHN O=[N+]([O-])c1ccc(CCN2CCC(OC[C@H]3CCCO3)CC2)cc1 ZINC000083405920 527346845 /nfs/dbraw/zinc/34/68/45/527346845.db2.gz KOUNGMGOZVVYDH-GOSISDBHSA-N 0 3 334.416 2.797 20 5 EFBDHN O=C(NCCCCc1ccc([N+](=O)[O-])cc1)NCCN1CCCCC1 ZINC000172464296 527655504 /nfs/dbraw/zinc/65/55/04/527655504.db2.gz URJHQILLVJWRPQ-UHFFFAOYSA-N 0 3 348.447 2.703 20 5 EFBDHN CC(C)[C@@H](C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)N(C)C ZINC000155282365 528352935 /nfs/dbraw/zinc/35/29/35/528352935.db2.gz SXKIMOHOLLIZAY-KRWDZBQOSA-N 0 3 349.431 2.551 20 5 EFBDHN CC(C)[C@@H](CN[C@H](C)c1cccc([N+](=O)[O-])c1)N1CCN(C)CC1 ZINC000132351542 528464844 /nfs/dbraw/zinc/46/48/44/528464844.db2.gz DJJLJIWLMYIKRH-CRAIPNDOSA-N 0 3 334.464 2.517 20 5 EFBDHN CCOc1ccc([C@@H](C)NCCC(=O)N[C@@H](C)CC)cc1[N+](=O)[O-] ZINC000153244705 528595402 /nfs/dbraw/zinc/59/54/02/528595402.db2.gz KRYOYYOYWNSIOK-QWHCGFSZSA-N 0 3 337.420 2.949 20 5 EFBDHN CCN(CCn1cc([N+](=O)[O-])ccc1=O)[C@H](C)Cc1ccsc1 ZINC000187790534 528611995 /nfs/dbraw/zinc/61/19/95/528611995.db2.gz RHOPQXZDESCLAG-CYBMUJFWSA-N 0 3 335.429 2.771 20 5 EFBDHN CCOC[C@@H](N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C)C(C)C ZINC000189804198 528896959 /nfs/dbraw/zinc/89/69/59/528896959.db2.gz LZXRDYLBIOBZCY-DZGCQCFKSA-N 0 3 337.420 2.881 20 5 EFBDHN CCOC[C@@H](N[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C)C(C)C ZINC000189804235 528899295 /nfs/dbraw/zinc/89/92/95/528899295.db2.gz LZXRDYLBIOBZCY-UKRRQHHQSA-N 0 3 337.420 2.881 20 5 EFBDHN CCOC[C@H](N[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C)C(C)C ZINC000189804216 528994903 /nfs/dbraw/zinc/99/49/03/528994903.db2.gz LZXRDYLBIOBZCY-HIFRSBDPSA-N 0 3 337.420 2.881 20 5 EFBDHN CC(C)Oc1cc(C(=O)N2CCC[C@H](N(C)C)C2)ccc1[N+](=O)[O-] ZINC000411932640 534945204 /nfs/dbraw/zinc/94/52/04/534945204.db2.gz CHRRNCUHLUVXLW-AWEZNQCLSA-N 0 3 335.404 2.548 20 5 EFBDHN CC(C)Oc1cc(C(=O)N[C@@H]2C[C@H](C)N(C3CC3)C2)ccc1[N+](=O)[O-] ZINC000412181939 534949490 /nfs/dbraw/zinc/94/94/90/534949490.db2.gz YVZBPKIVXHLXJG-GXTWGEPZSA-N 0 3 347.415 2.737 20 5 EFBDHN CC(C)Oc1cc(C(=O)N[C@H]2C[C@H](C)N(C3CC3)C2)ccc1[N+](=O)[O-] ZINC000412181942 534951564 /nfs/dbraw/zinc/95/15/64/534951564.db2.gz YVZBPKIVXHLXJG-JSGCOSHPSA-N 0 3 347.415 2.737 20 5 EFBDHN CC(C)[C@@H](C(=O)NCCc1ccccc1[N+](=O)[O-])N1CCCCC1 ZINC000359522468 535135782 /nfs/dbraw/zinc/13/57/82/535135782.db2.gz XQQNOBMZJAJIBK-KRWDZBQOSA-N 0 3 333.432 2.764 20 5 EFBDHN CCO[C@@H]1C[C@H](O)C12CCN(Cc1cccc([N+](=O)[O-])c1C)CC2 ZINC000266019952 535522899 /nfs/dbraw/zinc/52/28/99/535522899.db2.gz RAJZTHWTZPFRSC-DLBZAZTESA-N 0 3 334.416 2.655 20 5 EFBDHN CCOC(=O)c1cc(NCCN2CCC(C)CC2)ccc1[N+](=O)[O-] ZINC000433707870 535680838 /nfs/dbraw/zinc/68/08/38/535680838.db2.gz FIQPSLQPOSPVMG-UHFFFAOYSA-N 0 3 335.404 2.915 20 5 EFBDHN CC[C@@H](NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CC1(C)C ZINC000414124020 535803972 /nfs/dbraw/zinc/80/39/72/535803972.db2.gz BQTJADXJILWWST-LSDHHAIUSA-N 0 3 340.445 2.783 20 5 EFBDHN CN(C)CCN(C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)C1CC1 ZINC000356294450 535846485 /nfs/dbraw/zinc/84/64/85/535846485.db2.gz SUUKHNTWJTUIHF-UHFFFAOYSA-N 0 3 333.413 2.976 20 5 EFBDHN CC[C@H](NCCC(C)(C)S(C)(=O)=O)c1cccc([N+](=O)[O-])c1 ZINC000414250999 535899181 /nfs/dbraw/zinc/89/91/81/535899181.db2.gz ICYHEISTNHOUPF-AWEZNQCLSA-N 0 3 328.434 2.849 20 5 EFBDHN CN(C)Cc1ccc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)cc1 ZINC000342395445 536015493 /nfs/dbraw/zinc/01/54/93/536015493.db2.gz QVEMSIBEKKEAMK-UHFFFAOYSA-N 0 3 332.335 2.630 20 5 EFBDHN CN1CCC2(CCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 ZINC000351987002 536348235 /nfs/dbraw/zinc/34/82/35/536348235.db2.gz OUUZQNLDLCUGGW-UHFFFAOYSA-N 0 3 349.456 2.774 20 5 EFBDHN CN1CCC[C@]2(CCN(C(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000412366826 536393263 /nfs/dbraw/zinc/39/32/63/536393263.db2.gz RSYDQJZDWOWVDY-SCTDSRPQSA-N 0 3 343.427 2.643 20 5 EFBDHN CN1CC[C@@H]2[C@@H](CCCN2C(=O)Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC000351621081 536471319 /nfs/dbraw/zinc/47/13/19/536471319.db2.gz PSOKAHACLQENSD-XHDPSFHLSA-N 0 3 336.367 2.682 20 5 EFBDHN COC(=O)c1ccc(OCCN(C)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000430097911 546226032 /nfs/dbraw/zinc/22/60/32/546226032.db2.gz CLBUGEPTHODBHB-UHFFFAOYSA-N 0 3 344.367 2.892 20 5 EFBDHN O=C1CCCCN1CCCNCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761519732 576174148 /nfs/dbraw/zinc/17/41/48/576174148.db2.gz GTCIATYYTXQUKF-UHFFFAOYSA-N 0 3 325.796 2.740 20 5 EFBDHN CCN(CC)C(=O)CN[C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000753940644 575363689 /nfs/dbraw/zinc/36/36/89/575363689.db2.gz UUMKYWJPJVLLFY-HOCLYGCPSA-N 0 3 333.432 2.764 20 5 EFBDHN COC[C@@H](N[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)C(C)C ZINC000754383838 575428391 /nfs/dbraw/zinc/42/83/91/575428391.db2.gz JUAMNGLIIYIFCX-QMTHXVAHSA-N 0 3 343.811 2.836 20 5 EFBDHN C[C@H]1CN(CCCCNc2nc3ccccn3c2[N+](=O)[O-])C[C@H](C)O1 ZINC000754614909 575461841 /nfs/dbraw/zinc/46/18/41/575461841.db2.gz RHKXRVPZSWJFDD-KBPBESRZSA-N 0 3 347.419 2.544 20 5 EFBDHN O=[N+]([O-])c1ccc2c(cnn2CN2CC[C@H](C3CCOCC3)C2)c1 ZINC000754781869 575488685 /nfs/dbraw/zinc/48/86/85/575488685.db2.gz GGYKAZDAKGWEHN-AWEZNQCLSA-N 0 3 330.388 2.651 20 5 EFBDHN O=[N+]([O-])c1ccc2cnn(CN3CC[C@H](C4CCOCC4)C3)c2c1 ZINC000754795980 575492626 /nfs/dbraw/zinc/49/26/26/575492626.db2.gz KPJREGYZEXPPNJ-HNNXBMFYSA-N 0 3 330.388 2.651 20 5 EFBDHN CCOc1cc(CN2CCC[C@@H](C3OCCO3)C2)ccc1[N+](=O)[O-] ZINC000755003816 575528638 /nfs/dbraw/zinc/52/86/38/575528638.db2.gz HHLBNUXHEWIWBY-CQSZACIVSA-N 0 3 336.388 2.578 20 5 EFBDHN CCOc1cc(CN2CCC[C@H](C3OCCO3)C2)ccc1[N+](=O)[O-] ZINC000755003814 575528685 /nfs/dbraw/zinc/52/86/85/575528685.db2.gz HHLBNUXHEWIWBY-AWEZNQCLSA-N 0 3 336.388 2.578 20 5 EFBDHN CC[C@H](C(=O)NCc1cc([N+](=O)[O-])ccc1Cl)N(CC)CC ZINC000756998380 575809382 /nfs/dbraw/zinc/80/93/82/575809382.db2.gz LEHZVZPTKKMNHV-CQSZACIVSA-N 0 3 327.812 2.985 20 5 EFBDHN Cc1nn(CN2CC[C@@H]([C@@H]3CCOC3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761293928 576141502 /nfs/dbraw/zinc/14/15/02/576141502.db2.gz TUMPEEUDBRBMGT-ZIAGYGMSSA-N 0 3 330.388 2.569 20 5 EFBDHN C[C@@H]1CCCN1CCNc1ncc(Br)cc1[N+](=O)[O-] ZINC000761907450 576227505 /nfs/dbraw/zinc/22/75/05/576227505.db2.gz AHMZXUFRTUGQBG-SECBINFHSA-N 0 3 329.198 2.649 20 5 EFBDHN C[C@H](CNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12)N1CCCCC1 ZINC000762957945 576350251 /nfs/dbraw/zinc/35/02/51/576350251.db2.gz DDAJIWXAEGAJGW-GFCCVEGCSA-N 0 3 330.388 2.680 20 5 EFBDHN C[C@@H](CNC(=O)c1cc(F)c([N+](=O)[O-])cc1F)N1CCCC[C@H]1C ZINC000763407603 576376188 /nfs/dbraw/zinc/37/61/88/576376188.db2.gz NOHVOWQUNQKBFB-MNOVXSKESA-N 0 3 341.358 2.866 20 5 EFBDHN C[C@H](C[C@@H](O)c1ccco1)NCc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000763523889 576380094 /nfs/dbraw/zinc/38/00/94/576380094.db2.gz KANIVDYSCZVFHO-BXUZGUMPSA-N 0 3 348.355 2.561 20 5 EFBDHN C[C@@H]1CN(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)Cc2ccccc21 ZINC000763629763 576383267 /nfs/dbraw/zinc/38/32/67/576383267.db2.gz SJCWQHBBSLJMOP-RHSMWYFYSA-N 0 3 342.395 2.954 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(N[C@@H]2CCN(C)[C@H](C)C2)cc1Cl ZINC000765508841 577048649 /nfs/dbraw/zinc/04/86/49/577048649.db2.gz LDCWEKXVSSKNNW-NXEZZACHSA-N 0 3 341.795 2.929 20 5 EFBDHN C[C@H](NC[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc([S@@](C)=O)cc1 ZINC000765848568 577082533 /nfs/dbraw/zinc/08/25/33/577082533.db2.gz HPJXZEDQXKGLCG-KZNWIGSXSA-N 0 3 348.424 2.716 20 5 EFBDHN COc1cccc2c1CC[C@H]2NC[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000765849340 577082996 /nfs/dbraw/zinc/08/29/96/577082996.db2.gz OQDQZLYETSIUNW-SJORKVTESA-N 0 3 328.368 2.914 20 5 EFBDHN CCc1cc(CNC2CCN(c3ccc([N+](=O)[O-])cc3)CC2)on1 ZINC000766135069 577112811 /nfs/dbraw/zinc/11/28/11/577112811.db2.gz JMDHAJICNBCJNY-UHFFFAOYSA-N 0 3 330.388 2.904 20 5 EFBDHN Cc1ccc([C@@H](O)CN[C@@H](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2)o1 ZINC000766141533 577113890 /nfs/dbraw/zinc/11/38/90/577113890.db2.gz MYBJZZHSKQKRRU-NHYWBVRUSA-N 0 3 347.371 2.537 20 5 EFBDHN CC[C@@H](CO)N(Cc1ccccc1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000767820009 577236371 /nfs/dbraw/zinc/23/63/71/577236371.db2.gz OLXHJFCFMITTMW-PKOBYXMFSA-N 0 3 344.411 2.901 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])NCC(=O)N(CC)CC ZINC000768098100 577254343 /nfs/dbraw/zinc/25/43/43/577254343.db2.gz RPSGBGZPLONBTN-CYBMUJFWSA-N 0 3 339.461 2.924 20 5 EFBDHN CN1CC[C@H]2[C@H](CCCN2C(=S)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000768480473 577277648 /nfs/dbraw/zinc/27/76/48/577277648.db2.gz RWMIWLMXPXSSNS-DOMZBBRYSA-N 0 3 334.445 2.708 20 5 EFBDHN CCN1CCCN(Cc2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000771934587 581261635 /nfs/dbraw/zinc/26/16/35/581261635.db2.gz BEQLBPZAYZQTGR-UHFFFAOYSA-N 0 3 342.237 2.885 20 5 EFBDHN COC(=O)N1CCC[C@@H](N[C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000774167432 581486282 /nfs/dbraw/zinc/48/62/82/581486282.db2.gz CZZSTJGTEVFNBY-CJNGLKHVSA-N 0 3 333.388 2.793 20 5 EFBDHN C[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccc(-c2nnn[n-]2)cc1 ZINC000824606214 607983379 /nfs/dbraw/zinc/98/33/79/607983379.db2.gz OTOMYVCFWMTJFA-LBPRGKRZSA-N 0 3 338.371 2.668 20 5 EFBDHN C[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccc(-c2nn[n-]n2)cc1 ZINC000824606214 607983380 /nfs/dbraw/zinc/98/33/80/607983380.db2.gz OTOMYVCFWMTJFA-LBPRGKRZSA-N 0 3 338.371 2.668 20 5 EFBDHN COc1ccc([C@H](O)CN[C@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000850424829 1250481719 /nfs/dbraw/zinc/48/17/19/1250481719.db2.gz MAZKJXWKIINQGQ-SJKOYZFVSA-N 0 3 346.383 2.996 20 5 EFBDHN CC(COC(=O)C1(C(=O)OC(C)(C)C)CCCCCC1)[N+](=O)[O-] ZINC000851035955 1250765708 /nfs/dbraw/zinc/76/57/08/1250765708.db2.gz COKUWRFOIAOHJX-GFCCVEGCSA-N 0 3 329.393 2.877 20 5 EFBDHN CCN(C)C(C)(C)C(=O)NC/C=C\CNc1cc(C)ccc1[N+](=O)[O-] ZINC001107390835 1255705366 /nfs/dbraw/zinc/70/53/66/1255705366.db2.gz ABEARNHVUWAASB-FPLPWBNLSA-N 0 3 348.447 2.718 20 5 EFBDHN CN(CC(=O)NC/C=C\CNc1ccc([N+](=O)[O-])cc1)CC(C)(C)C ZINC001107513699 1256021511 /nfs/dbraw/zinc/02/15/11/1256021511.db2.gz JTRZCCBVDJDURD-WAYWQWQTSA-N 0 3 348.447 2.657 20 5 EFBDHN O=C(NCCNCc1cccc([N+](=O)[O-])c1)c1sccc1Cl ZINC001127850476 1256646705 /nfs/dbraw/zinc/64/67/05/1256646705.db2.gz HQHQFBQSQGRMBU-UHFFFAOYSA-N 0 3 339.804 2.829 20 5 EFBDHN CN(Cc1ccc(Br)c([N+](=O)[O-])c1)C[C@@H](O)C1CC1 ZINC000708550635 1259765749 /nfs/dbraw/zinc/76/57/49/1259765749.db2.gz KLZPXGKUTUDSIT-CYBMUJFWSA-N 0 3 329.194 2.560 20 5 EFBDHN O=[N+]([O-])c1ccc(CNC[C@@H]2CCCN2CC(F)(F)F)c(F)c1 ZINC000922708297 1266630055 /nfs/dbraw/zinc/63/00/55/1266630055.db2.gz GLZZIHYJXNKVLM-LBPRGKRZSA-N 0 3 335.301 2.850 20 5 EFBDHN C[C@H](CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1)N1CCCCC1 ZINC000739700266 1268736279 /nfs/dbraw/zinc/73/62/79/1268736279.db2.gz FLTTTXTWXPQQGQ-CQSZACIVSA-N 0 3 333.432 2.863 20 5 EFBDHN O=[N+]([O-])c1ccc2oc(=S)n(CN3CC[C@H](N4CC=CC4)C3)c2c1 ZINC000742164055 1269908585 /nfs/dbraw/zinc/90/85/85/1269908585.db2.gz XDHPGJDTGCFCCS-ZDUSSCGKSA-N 0 3 346.412 2.776 20 5 EFBDHN Cc1cocc1C(=O)NC[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001086169577 1270319962 /nfs/dbraw/zinc/31/99/62/1270319962.db2.gz XZJTWOJAWNBARO-OTVXOJSOSA-N 0 3 343.383 2.794 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2cnn(CN3CCC4(C3)CCOCC4)c2)cc1 ZINC000743406301 1270576157 /nfs/dbraw/zinc/57/61/57/1270576157.db2.gz UFDKYOFMLYIOPX-UHFFFAOYSA-N 0 3 342.399 2.918 20 5 EFBDHN O=C(NC[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1)C1CC=CC1 ZINC001086330909 1271010021 /nfs/dbraw/zinc/01/00/21/1271010021.db2.gz UEVXAEZMBWBHQV-SAZUREKKSA-N 0 3 329.400 2.545 20 5 EFBDHN Cc1cc(C(=O)NC[C@H]2C[C@H](NCc3ccccc3[N+](=O)[O-])C2)co1 ZINC001086347767 1271097497 /nfs/dbraw/zinc/09/74/97/1271097497.db2.gz VPEMXAYLBIVQNB-SAZUREKKSA-N 0 3 343.383 2.794 20 5 EFBDHN CCOc1ccccc1N1CCN([C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169006195 1272581565 /nfs/dbraw/zinc/58/15/65/1272581565.db2.gz FZAPSPMEDJQFAM-HOTGVXAUSA-N 0 3 333.432 2.653 20 5 EFBDHN CC(C)(C)OC(=O)N1CC2(C1)CCCN2[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169011347 1272584885 /nfs/dbraw/zinc/58/48/85/1272584885.db2.gz KABSSAJQINCGNP-KBPBESRZSA-N 0 3 339.436 2.517 20 5 EFBDHN O=c1[nH]c2ccccc2n1C1CCN([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169012420 1272585797 /nfs/dbraw/zinc/58/57/97/1272585797.db2.gz QAKHLYNOILAQRJ-DZGCQCFKSA-N 0 3 344.415 2.824 20 5 EFBDHN CC[C@H]1CN([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CCN1C(=O)OC(C)(C)C ZINC001169034584 1272597509 /nfs/dbraw/zinc/59/75/09/1272597509.db2.gz IAYMXWPTDIBTGT-SOUVJXGZSA-N 0 3 341.452 2.763 20 5 EFBDHN CC(C)(C)OC(=O)N1CCN([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC12CC2 ZINC001169036457 1272600620 /nfs/dbraw/zinc/60/06/20/1272600620.db2.gz OLWSKCASRLIRTP-UONOGXRCSA-N 0 3 339.436 2.517 20 5 EFBDHN C[C@@H]1CN([C@H]2CC[C@H](C[N+](=O)[O-])C2)C[C@H](C)N1C(=O)OC(C)(C)C ZINC001169037543 1272603219 /nfs/dbraw/zinc/60/32/19/1272603219.db2.gz SEDOFOLAONWQEW-XGUBFFRZSA-N 0 3 341.452 2.762 20 5 EFBDHN CC(C)(C)OC(=O)N1CCN([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1(C)C ZINC001169038366 1272606711 /nfs/dbraw/zinc/60/67/11/1272606711.db2.gz YIBQLMKMLPQPOV-ZIAGYGMSSA-N 0 3 341.452 2.763 20 5 EFBDHN CC(C)N(C)Cc1cnc2n1CCN([C@@H]1CC[C@H](C[N+](=O)[O-])C1)[C@H]2C ZINC001169025755 1272621994 /nfs/dbraw/zinc/62/19/94/1272621994.db2.gz UTFUHWNZPNVFMJ-HRCADAONSA-N 0 3 349.479 2.545 20 5 EFBDHN CC(C)N(C)Cc1cnc2n1CCN([C@@H]1CC[C@H](C[N+](=O)[O-])C1)[C@@H]2C ZINC001169025757 1272622563 /nfs/dbraw/zinc/62/25/63/1272622563.db2.gz UTFUHWNZPNVFMJ-OWCLPIDISA-N 0 3 349.479 2.545 20 5 EFBDHN C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H](C)N1[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169047915 1272627553 /nfs/dbraw/zinc/62/75/53/1272627553.db2.gz SMQFMRJTCYXZEM-KBXIAJHMSA-N 0 3 341.452 2.762 20 5 EFBDHN C[C@H](c1ccc(F)cc1)N1CCN([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169056795 1272633050 /nfs/dbraw/zinc/63/30/50/1272633050.db2.gz SOWAWFFDLTUABG-RVKKMQEKSA-N 0 3 335.423 2.950 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1N[C@H]1CCc3ccccc3[C@@H]1O)CNC2 ZINC001169619180 1273059824 /nfs/dbraw/zinc/05/98/24/1273059824.db2.gz HWQFSNRIRFWSAG-YJBOKZPZSA-N 0 3 325.368 2.658 20 5 EFBDHN CCC(=O)N1CCC2(CCN(Cc3ccccc3[N+](=O)[O-])C2)CC1 ZINC001035146767 1273636476 /nfs/dbraw/zinc/63/64/76/1273636476.db2.gz NKHMDKASOUSJNH-UHFFFAOYSA-N 0 3 331.416 2.819 20 5 EFBDHN Cc1ccc(NCCCN(C)C(=O)CN(C)C2CCC2)c([N+](=O)[O-])c1 ZINC001109653234 1274522077 /nfs/dbraw/zinc/52/20/77/1274522077.db2.gz PJFKIHQWAXLHPU-UHFFFAOYSA-N 0 3 348.447 2.648 20 5 EFBDHN CC(C)(NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CCOCC1 ZINC000786156815 1275314953 /nfs/dbraw/zinc/31/49/53/1275314953.db2.gz LQJCTPUAASOWOL-UHFFFAOYSA-N 0 3 346.387 2.940 20 5 EFBDHN COc1ccc(C[C@H](C)NCc2cccc(OC)n2)c([N+](=O)[O-])c1 ZINC001170312232 1279007689 /nfs/dbraw/zinc/00/76/89/1279007689.db2.gz FJDVUJZSSVPNHL-LBPRGKRZSA-N 0 3 331.372 2.728 20 5 EFBDHN C[C@H](N[C@H]1CCN(C(=O)C2CCCC2)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788634484 1276250489 /nfs/dbraw/zinc/25/04/89/1276250489.db2.gz ZGCPTTBWDRJLAY-WFASDCNBSA-N 0 3 346.431 2.619 20 5 EFBDHN COc1ccc(C[C@H](C)N[C@H](CO)c2ccccc2F)c([N+](=O)[O-])c1 ZINC001170325587 1279017047 /nfs/dbraw/zinc/01/70/47/1279017047.db2.gz WFZYKSDOPCQJJO-YVEFUNNKSA-N 0 3 348.374 2.997 20 5 EFBDHN C[C@H](CN1CCCCC1)NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000075650957 1276432342 /nfs/dbraw/zinc/43/23/42/1276432342.db2.gz XFOBRFKEYOTDIK-LLVKDONJSA-N 0 3 325.796 2.852 20 5 EFBDHN C[C@@H](CN1CCCCC1)NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000075650954 1276432397 /nfs/dbraw/zinc/43/23/97/1276432397.db2.gz XFOBRFKEYOTDIK-NSHDSACASA-N 0 3 325.796 2.852 20 5 EFBDHN CC1(C(=O)NCCCNCc2csc([N+](=O)[O-])c2)CC(F)(F)C1 ZINC001170894135 1276500936 /nfs/dbraw/zinc/50/09/36/1276500936.db2.gz MIYWLRIRPQTVTI-UHFFFAOYSA-N 0 3 347.387 2.688 20 5 EFBDHN CCCOc1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cn1 ZINC000819040354 1276576830 /nfs/dbraw/zinc/57/68/30/1276576830.db2.gz WZYPABAKUYYBCP-MRXNPFEDSA-N 0 3 331.372 2.602 20 5 EFBDHN Cc1cccc(F)c1CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000819113575 1276636879 /nfs/dbraw/zinc/63/68/79/1276636879.db2.gz SEBROFXWFQRVBE-CQSZACIVSA-N 0 3 334.347 2.572 20 5 EFBDHN CCSc1cc(CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)ccn1 ZINC000819244309 1276681951 /nfs/dbraw/zinc/68/19/51/1276681951.db2.gz MTFOPWYVKQQRJB-HNNXBMFYSA-N 0 3 333.413 2.925 20 5 EFBDHN CCSc1cc(CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)ccn1 ZINC000819244310 1276682364 /nfs/dbraw/zinc/68/23/64/1276682364.db2.gz MTFOPWYVKQQRJB-OAHLLOKOSA-N 0 3 333.413 2.925 20 5 EFBDHN CC[C@@H](C)Oc1cc(CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)ccn1 ZINC000819215823 1276692350 /nfs/dbraw/zinc/69/23/50/1276692350.db2.gz OCPONJUGXAYENA-DYVFJYSZSA-N 0 3 345.399 2.990 20 5 EFBDHN COc1ccc2c(c1)[C@@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)CCO2 ZINC000819233905 1276702091 /nfs/dbraw/zinc/70/20/91/1276702091.db2.gz VCBBEFHOZNPKSZ-IRXDYDNUSA-N 0 3 344.367 2.750 20 5 EFBDHN CC[C@H](C)N[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000819386743 1276767677 /nfs/dbraw/zinc/76/76/77/1276767677.db2.gz CJIHEPWWZZHQCK-IAOVAPTHSA-N 0 3 347.415 2.940 20 5 EFBDHN NC(=O)C1=NO[C@@H](CNCc2c3ccccc3cc3ccccc32)C1 ZINC000789562519 1276852780 /nfs/dbraw/zinc/85/27/80/1276852780.db2.gz YHBKJYQVXDYDEW-OAHLLOKOSA-N 0 3 333.391 2.713 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1[C@@H]2CC[C@H]1CN(C)CC2 ZINC000923271613 1277439877 /nfs/dbraw/zinc/43/98/77/1277439877.db2.gz SAAQCAIUWLHXDC-NUJGCVRESA-N 0 3 345.443 2.859 20 5 EFBDHN Cc1cc(F)cc(-n2nc(C(=O)OCC(C)[N+](=O)[O-])c3c2CCC3)c1 ZINC000821167006 1277474162 /nfs/dbraw/zinc/47/41/62/1277474162.db2.gz MRJBRHSXNJFCAJ-LLVKDONJSA-N 0 3 347.346 2.631 20 5 EFBDHN COCCN(Cn1nc(C)c2cc([N+](=O)[O-])cnc21)[C@H]1CC[C@@H](C)C1 ZINC000790476365 1277585687 /nfs/dbraw/zinc/58/56/87/1277585687.db2.gz CITWHNJQANCTHB-OCCSQVGLSA-N 0 3 347.419 2.742 20 5 EFBDHN CCN1CCN([C@@H](C)CNc2cc(Cl)c(F)cc2[N+](=O)[O-])CC1 ZINC000845466975 1279660053 /nfs/dbraw/zinc/66/00/53/1279660053.db2.gz DLLTUOLZRHNSJG-NSHDSACASA-N 0 3 344.818 2.825 20 5 EFBDHN CC(=O)c1cc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])n(C)c1 ZINC000845872903 1279900852 /nfs/dbraw/zinc/90/08/52/1279900852.db2.gz QQSPMPQCWPLFDH-QFYYESIMSA-N 0 3 348.330 2.930 20 5 EFBDHN CCCn1cc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])cn1 ZINC000845875969 1279901731 /nfs/dbraw/zinc/90/17/31/1279901731.db2.gz MIZBCPKNDXXWMF-IAQYHMDHSA-N 0 3 335.335 2.996 20 5 EFBDHN Cc1cc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])cc(=O)[nH]1 ZINC000845874001 1279902026 /nfs/dbraw/zinc/90/20/26/1279902026.db2.gz FTPIVLZANCWOBP-BONVTDFDSA-N 0 3 334.303 2.798 20 5 EFBDHN CCCn1cc(C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])cn1 ZINC000845875967 1279902457 /nfs/dbraw/zinc/90/24/57/1279902457.db2.gz MIZBCPKNDXXWMF-ABAIWWIYSA-N 0 3 335.335 2.996 20 5 EFBDHN CC([C@@H](OC(=O)c1cc(C2CC2)[nH]n1)c1ccccc1F)[N+](=O)[O-] ZINC000845874981 1279902634 /nfs/dbraw/zinc/90/26/34/1279902634.db2.gz KLKFGXZQIJVFBH-RFAUZJTJSA-N 0 3 333.319 2.990 20 5 EFBDHN CC([C@H](OC(=O)CC[C@@H]1CCOC1)c1ccccc1F)[N+](=O)[O-] ZINC000845878797 1279902917 /nfs/dbraw/zinc/90/29/17/1279902917.db2.gz SRZBXMUKJRZAGU-HSMVNMDESA-N 0 3 325.336 2.892 20 5 EFBDHN CC([C@H](OC(=O)COCc1ccccn1)c1ccccc1F)[N+](=O)[O-] ZINC000845878649 1279902943 /nfs/dbraw/zinc/90/29/43/1279902943.db2.gz HYTKANBKZRODSR-SJCJKPOMSA-N 0 3 348.330 2.687 20 5 EFBDHN CC([C@H](OC(=O)[C@@H]1C[C@H]1c1cnn(C)c1)c1ccccc1F)[N+](=O)[O-] ZINC000845877676 1279903276 /nfs/dbraw/zinc/90/32/76/1279903276.db2.gz FZOMMSSPJYOMMM-BWPSIRRCSA-N 0 3 347.346 2.612 20 5 EFBDHN CC([C@H](OC(=O)Cn1cc(Cl)cn1)c1ccccc1F)[N+](=O)[O-] ZINC000845880063 1279904310 /nfs/dbraw/zinc/90/43/10/1279904310.db2.gz KKQSISGURLJIPO-OTYXRUKQSA-N 0 3 341.726 2.625 20 5 EFBDHN CC([C@@H](OC(=O)C[C@@H](C)n1ccnc1)c1ccccc1F)[N+](=O)[O-] ZINC000845882330 1279905058 /nfs/dbraw/zinc/90/50/58/1279905058.db2.gz SRRJKLISPKCXFS-BFQNTYOBSA-N 0 3 335.335 2.923 20 5 EFBDHN CC([C@@H](OC(=O)Cn1cc(Cl)cn1)c1ccccc1F)[N+](=O)[O-] ZINC000845880065 1279905333 /nfs/dbraw/zinc/90/53/33/1279905333.db2.gz KKQSISGURLJIPO-YMTOWFKASA-N 0 3 341.726 2.625 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C)CN1CCOCC1 ZINC000872021371 1287403218 /nfs/dbraw/zinc/40/32/18/1287403218.db2.gz CGZVKUROHOGFJP-STQMWFEESA-N 0 3 339.461 2.688 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCCC(=O)NC(C)C ZINC000872021438 1287403239 /nfs/dbraw/zinc/40/32/39/1287403239.db2.gz PLEQPZQVCDZTEJ-NSHDSACASA-N 0 3 325.434 2.882 20 5 EFBDHN CCC(=O)N1CC[C@H](N[C@H](C)c2cc([N+](=O)[O-])ccc2SC)C1 ZINC000872044386 1287409409 /nfs/dbraw/zinc/40/94/09/1287409409.db2.gz UPFRYGORJZJQTN-NEPJUHHUSA-N 0 3 337.445 2.978 20 5 EFBDHN O=[N+]([O-])c1cc(CN[C@H](C2CC2)[C@@]2(CO)CCCO2)ccc1Cl ZINC000815290620 1287413683 /nfs/dbraw/zinc/41/36/83/1287413683.db2.gz LPHSKYZRCCHSFL-CVEARBPZSA-N 0 3 340.807 2.658 20 5 EFBDHN CO[C@]1(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2SC)CCOC1 ZINC000872062386 1287416195 /nfs/dbraw/zinc/41/61/95/1287416195.db2.gz MKPOGKSWFJNLKL-NHYWBVRUSA-N 0 3 326.418 2.773 20 5 EFBDHN CCN(C)C(C)(C)C(=O)NC[C@H]1C[C@@H](Nc2ccccc2[N+](=O)[O-])C1 ZINC001091380001 1280461745 /nfs/dbraw/zinc/46/17/45/1280461745.db2.gz AAFVGJOXEDIAMS-OKILXGFUSA-N 0 3 348.447 2.632 20 5 EFBDHN Cc1cc(C(=O)NCCNCc2cccc([N+](=O)[O-])c2)c(F)cc1F ZINC001130109156 1280471180 /nfs/dbraw/zinc/47/11/80/1280471180.db2.gz AMPULQYKBDGRPM-UHFFFAOYSA-N 0 3 349.337 2.701 20 5 EFBDHN CN1CCN(C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC12CCCCC2 ZINC000846940462 1280628740 /nfs/dbraw/zinc/62/87/40/1280628740.db2.gz KSERJJDUDWFOSV-KRWDZBQOSA-N 0 3 333.432 2.579 20 5 EFBDHN O=C(NCCNCc1ccc([N+](=O)[O-])cc1)C1(C(F)(F)F)CCC1 ZINC001130316064 1280701596 /nfs/dbraw/zinc/70/15/96/1280701596.db2.gz XNFXNVYHZGKNLY-UHFFFAOYSA-N 0 3 345.321 2.533 20 5 EFBDHN CCN(CC)CC(=O)NC[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(C)c2)C1 ZINC001091459026 1280736432 /nfs/dbraw/zinc/73/64/32/1280736432.db2.gz MVFQMXRPNZESSQ-KOMQPUFPSA-N 0 3 348.447 2.552 20 5 EFBDHN CCc1cc(C)c(C(=O)NCCNCc2cccc([N+](=O)[O-])c2)o1 ZINC001147957656 1281377346 /nfs/dbraw/zinc/37/73/46/1281377346.db2.gz HMXGVGVJGOABES-UHFFFAOYSA-N 0 3 331.372 2.578 20 5 EFBDHN Cc1ccccc1CC(=O)NCCCNCc1ccccc1[N+](=O)[O-] ZINC001175712112 1287524566 /nfs/dbraw/zinc/52/45/66/1287524566.db2.gz OJSYBPGQRWCUQZ-UHFFFAOYSA-N 0 3 341.411 2.742 20 5 EFBDHN CN(C)C[C@@H](CO)Nc1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000809341587 1282159170 /nfs/dbraw/zinc/15/91/70/1282159170.db2.gz TZDWYGMFNZNOJI-ZETCQYMHSA-N 0 3 341.717 2.601 20 5 EFBDHN C[C@H](NCc1cccc(-n2cncn2)c1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815581914 1287612378 /nfs/dbraw/zinc/61/23/78/1287612378.db2.gz SHYBPTZJJJQVRD-LBPRGKRZSA-N 0 3 338.371 2.609 20 5 EFBDHN COc1ccncc1CNC1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000815628773 1287645709 /nfs/dbraw/zinc/64/57/09/1287645709.db2.gz JEUDPZKIZFZOTO-UHFFFAOYSA-N 0 3 342.399 2.757 20 5 EFBDHN CC(C)c1ccoc1C(=O)NCCNCc1cccc([N+](=O)[O-])c1 ZINC001132784345 1284278705 /nfs/dbraw/zinc/27/87/05/1284278705.db2.gz QROHKEAIWOJMLU-UHFFFAOYSA-N 0 3 331.372 2.831 20 5 EFBDHN Cn1ccc(CCNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])n1 ZINC000811490925 1284347678 /nfs/dbraw/zinc/34/76/78/1284347678.db2.gz WCCDVJAALQVTEV-UHFFFAOYSA-N 0 3 329.187 2.967 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2ncn(CN3C[C@@H]4CC=CC[C@@H]4C3)n2)c1 ZINC000872712244 1287754955 /nfs/dbraw/zinc/75/49/55/1287754955.db2.gz KUZNUBOITNNHTF-GASCZTMLSA-N 0 3 325.372 2.709 20 5 EFBDHN Cc1ccc(C)c(CC(=O)NCCNCc2cccc([N+](=O)[O-])c2)c1 ZINC001133300064 1285147653 /nfs/dbraw/zinc/14/76/53/1285147653.db2.gz IQRUQLFNNPIAFH-UHFFFAOYSA-N 0 3 341.411 2.660 20 5 EFBDHN C[C@H]1CCN(Cc2ccccc2)C[C@H]1Nc1ncc([N+](=O)[O-])cn1 ZINC000716203879 1285171787 /nfs/dbraw/zinc/17/17/87/1285171787.db2.gz LVFNPNAASVGEFK-XJKSGUPXSA-N 0 3 327.388 2.707 20 5 EFBDHN C[C@@H]1CCN(Cc2ccccc2)C[C@@H]1Nc1ncc([N+](=O)[O-])cn1 ZINC000716203871 1285172370 /nfs/dbraw/zinc/17/23/70/1285172370.db2.gz LVFNPNAASVGEFK-CJNGLKHVSA-N 0 3 327.388 2.707 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(-n2c(-c3ccccc3)cnc2[C@H](C)N)n1 ZINC001170678893 1285185810 /nfs/dbraw/zinc/18/58/10/1285185810.db2.gz IHELVAPSTJFPCK-NSHDSACASA-N 0 3 339.355 2.871 20 5 EFBDHN COc1ccc(-n2c(-c3ccccc3)cnc2[C@H](C)N)nc1[N+](=O)[O-] ZINC001170679069 1285228537 /nfs/dbraw/zinc/22/85/37/1285228537.db2.gz OFLNAZHRAVSKCN-NSHDSACASA-N 0 3 339.355 2.871 20 5 EFBDHN CCN(C)C(C)(C)C(=O)NCCCNc1ccc([N+](=O)[O-])c(C)c1 ZINC001094640006 1285464797 /nfs/dbraw/zinc/46/47/97/1285464797.db2.gz MEIKOBINCGGIOQ-UHFFFAOYSA-N 0 3 336.436 2.552 20 5 EFBDHN Cc1cccc(-n2ccnc2SCC(=O)OCC(C)[N+](=O)[O-])c1C ZINC000813102430 1285653562 /nfs/dbraw/zinc/65/35/62/1285653562.db2.gz RKZQMUKSCZFYQG-LBPRGKRZSA-N 0 3 349.412 2.790 20 5 EFBDHN Cc1ccc(-n2nc(C(=O)OCC(C)[N+](=O)[O-])c3c2CCC3)c(C)c1 ZINC000813102115 1285653833 /nfs/dbraw/zinc/65/38/33/1285653833.db2.gz NWPUZEBGQDHPOH-CYBMUJFWSA-N 0 3 343.383 2.800 20 5 EFBDHN Cc1ccc(C(=O)OCC(C)[N+](=O)[O-])cc1NC(=O)c1ccco1 ZINC000813105043 1285654335 /nfs/dbraw/zinc/65/43/35/1285654335.db2.gz JIVHGHRAXXTOJR-NSHDSACASA-N 0 3 332.312 2.662 20 5 EFBDHN Cc1cccc(-n2ccnc2SCC(=O)OCC(C)[N+](=O)[O-])c1C ZINC000813102429 1285655032 /nfs/dbraw/zinc/65/50/32/1285655032.db2.gz RKZQMUKSCZFYQG-GFCCVEGCSA-N 0 3 349.412 2.790 20 5 EFBDHN Cc1ccc(-n2nc(C(=O)OCC(C)[N+](=O)[O-])c3c2CCCC3)cc1 ZINC000813102370 1285655128 /nfs/dbraw/zinc/65/51/28/1285655128.db2.gz QAOZJJHQSMQSKL-ZDUSSCGKSA-N 0 3 343.383 2.882 20 5 EFBDHN Cc1nc(C(=O)OCC(C)[N+](=O)[O-])nn1-c1ccccc1C(C)C ZINC000813108985 1285679941 /nfs/dbraw/zinc/67/99/41/1285679941.db2.gz CXYREZFPUSXPDZ-LLVKDONJSA-N 0 3 332.360 2.521 20 5 EFBDHN CSc1ncc(C(=O)OCC(C)[N+](=O)[O-])n1-c1ccc(F)cc1 ZINC000813108171 1285680685 /nfs/dbraw/zinc/68/06/85/1285680685.db2.gz BOFGMIRMEOULBS-VIFPVBQESA-N 0 3 339.348 2.555 20 5 EFBDHN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)OCC(C)[N+](=O)[O-] ZINC000813108414 1285680717 /nfs/dbraw/zinc/68/07/17/1285680717.db2.gz YGPFQAPRUYGJFX-SECBINFHSA-N 0 3 328.346 2.917 20 5 EFBDHN CC(COC(=O)c1ccnc(Oc2ccc(F)cc2F)c1)[N+](=O)[O-] ZINC000813108802 1285681170 /nfs/dbraw/zinc/68/11/70/1285681170.db2.gz LXAZSIVXVHXBMO-SECBINFHSA-N 0 3 338.266 2.974 20 5 EFBDHN Cc1nc(COc2cccc(C(=O)OCC(C)[N+](=O)[O-])c2)cs1 ZINC000813109184 1285682380 /nfs/dbraw/zinc/68/23/80/1285682380.db2.gz PBXIRRFHQGLVOS-SNVBAGLBSA-N 0 3 336.369 2.853 20 5 EFBDHN CC(C)c1c(C(=O)OCC(C)[N+](=O)[O-])cnn1-c1ccc(F)cc1 ZINC000813109445 1285683007 /nfs/dbraw/zinc/68/30/07/1285683007.db2.gz SVVFMQLDQVJMHH-LLVKDONJSA-N 0 3 335.335 2.957 20 5 EFBDHN COc1ccc2nc(C3CC3)cc(C(=O)OCC(C)[N+](=O)[O-])c2c1 ZINC000813114197 1285685383 /nfs/dbraw/zinc/68/53/83/1285685383.db2.gz NFPPNPXBFVXYIL-JTQLQIEISA-N 0 3 330.340 2.943 20 5 EFBDHN Cc1ccc(C(=O)NCCCNCc2csc([N+](=O)[O-])c2)cc1 ZINC001171880660 1285911418 /nfs/dbraw/zinc/91/14/18/1285911418.db2.gz YEWNGUUFIYTHBO-UHFFFAOYSA-N 0 3 333.413 2.874 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)NC2(c3cnn(C)c3)CC2)c1F ZINC001173176522 1286452594 /nfs/dbraw/zinc/45/25/94/1286452594.db2.gz HRPBLVJXHMXFNM-LLVKDONJSA-N 0 3 348.378 2.686 20 5 EFBDHN COC[C@@H]1CCN([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173178312 1286453728 /nfs/dbraw/zinc/45/37/28/1286453728.db2.gz AOIPCRCVPKIUPP-VXGBXAGGSA-N 0 3 326.368 2.642 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CC[C@H](C)[C@@H](O)CC2)c1F ZINC001173178929 1286454021 /nfs/dbraw/zinc/45/40/21/1286454021.db2.gz CFGTUPZVDRVQRF-HUBLWGQQSA-N 0 3 340.395 2.766 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N[C@H](C)c2cnccn2)c1F ZINC001173191446 1286457499 /nfs/dbraw/zinc/45/74/99/1286457499.db2.gz LGXWPRKDPXEDDJ-WDEREUQCSA-N 0 3 334.351 2.814 20 5 EFBDHN Cc1cccc(C)c1C(=O)NCCNCc1cccc([N+](=O)[O-])c1 ZINC001134226270 1286473265 /nfs/dbraw/zinc/47/32/65/1286473265.db2.gz BCWUHXXGMDSLAL-UHFFFAOYSA-N 0 3 327.384 2.731 20 5 EFBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CCCN(C(=O)C2CCC2)CC1 ZINC001173225028 1286479631 /nfs/dbraw/zinc/47/96/31/1286479631.db2.gz AWWAQCVTAIIGDP-HNNXBMFYSA-N 0 3 345.443 2.860 20 5 EFBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)NCc1ccnc(OCC2CC2)n1 ZINC001173225627 1286480718 /nfs/dbraw/zinc/48/07/18/1286480718.db2.gz TWRNKSQRNITGSB-CYBMUJFWSA-N 0 3 342.399 2.894 20 5 EFBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CCC(N2CCCOC2=O)CC1 ZINC001173233423 1286484538 /nfs/dbraw/zinc/48/45/38/1286484538.db2.gz WNMWPPACPPWBSN-AWEZNQCLSA-N 0 3 347.415 2.833 20 5 EFBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CCCc2ccc(CN)nc21 ZINC001173236254 1286485962 /nfs/dbraw/zinc/48/59/62/1286485962.db2.gz ZHUTXKPADHHTGV-ZDUSSCGKSA-N 0 3 326.400 2.832 20 5 EFBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](NC(=O)C2CCC2)C1 ZINC001173238706 1286497837 /nfs/dbraw/zinc/49/78/37/1286497837.db2.gz WDFANWGOWYMSSP-RHSMWYFYSA-N 0 3 345.443 2.907 20 5 EFBDHN CCOc1cccc(C(=O)NCCNCc2cccc([N+](=O)[O-])c2)c1 ZINC001134385361 1286632277 /nfs/dbraw/zinc/63/22/77/1286632277.db2.gz UONPXIITHQUHMZ-UHFFFAOYSA-N 0 3 343.383 2.513 20 5 EFBDHN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)CCC(C)(C)[N+](=O)[O-])C1 ZINC000822712641 1289088959 /nfs/dbraw/zinc/08/89/59/1289088959.db2.gz ZRUIFRQPXMFDKS-GDBMZVCRSA-N 0 3 333.432 2.774 20 5 EFBDHN O=C(NCCNCc1ccc([N+](=O)[O-])cc1)c1ccc2cc[nH]c2c1 ZINC001134368195 1286637066 /nfs/dbraw/zinc/63/70/66/1286637066.db2.gz WZBBQJBXDBJMON-UHFFFAOYSA-N 0 3 338.367 2.596 20 5 EFBDHN CSCC(=O)NCCCCCCNCc1csc([N+](=O)[O-])c1 ZINC001177855802 1288571988 /nfs/dbraw/zinc/57/19/88/1288571988.db2.gz JEBZVIZEWWYANN-UHFFFAOYSA-N 0 3 345.490 2.786 20 5 EFBDHN CCCN1C[C@H](CNCc2cc([N+](=O)[O-])ccc2Cl)CC1=O ZINC000817411502 1288590408 /nfs/dbraw/zinc/59/04/08/1288590408.db2.gz SMWNHZILYSXDJZ-NSHDSACASA-N 0 3 325.796 2.596 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1CNCCNC(=O)c1cccs1 ZINC000873013907 1289519252 /nfs/dbraw/zinc/51/92/52/1289519252.db2.gz JQIBWCARDMXSPB-UHFFFAOYSA-N 0 3 333.413 2.793 20 5 EFBDHN Cc1c(CN[C@H]2CCCN(C(=O)N3CCCC3)C2)cccc1[N+](=O)[O-] ZINC000873125230 1289581141 /nfs/dbraw/zinc/58/11/41/1289581141.db2.gz LCKJYMWABGASQO-INIZCTEOSA-N 0 3 346.431 2.673 20 5 EFBDHN O=C(NCCCNCc1ccccc1[N+](=O)[O-])c1occc1Cl ZINC001166024970 1312719586 /nfs/dbraw/zinc/71/95/86/1312719586.db2.gz IYLRWHYWDCXWKL-UHFFFAOYSA-N 0 3 337.763 2.751 20 5 EFBDHN Cc1ccc(NC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)c(CN(C)C)c1 ZINC000825921470 1291069643 /nfs/dbraw/zinc/06/96/43/1291069643.db2.gz VTOOPJXQWOSITP-KRWDZBQOSA-N 0 3 343.383 2.637 20 5 EFBDHN Cc1c[n+]([O-])c(NC[C@H](c2ccccc2)N2CCCC2)cc1[N+](=O)[O-] ZINC001166864696 1312855831 /nfs/dbraw/zinc/85/58/31/1312855831.db2.gz GQWGDUQIGVNUGQ-QGZVFWFLSA-N 0 3 342.399 2.786 20 5 EFBDHN C[C@H](NCCCS(=O)(=O)C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000878355897 1291643636 /nfs/dbraw/zinc/64/36/36/1291643636.db2.gz OFFLSFYUUUTLOC-LBPRGKRZSA-N 0 3 328.434 2.849 20 5 EFBDHN Cc1ccc(CN(C)[C@@H](CC(N)=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000878541566 1291708470 /nfs/dbraw/zinc/70/84/70/1291708470.db2.gz DDBRFDNMYONXKB-KRWDZBQOSA-N 0 3 327.384 2.952 20 5 EFBDHN CCCN(C)CC(=O)N[C@H]1C[C@H](CNc2ccc(C)cc2[N+](=O)[O-])C1 ZINC001114780393 1291923518 /nfs/dbraw/zinc/92/35/18/1291923518.db2.gz CRPBZJRCBWRGEG-SHTZXODSSA-N 0 3 348.447 2.552 20 5 EFBDHN CN(CCc1ccccc1[N+](=O)[O-])C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000796113918 1291986233 /nfs/dbraw/zinc/98/62/33/1291986233.db2.gz PWFDCAUSKGBYMN-KRWDZBQOSA-N 0 3 345.355 2.711 20 5 EFBDHN COc1cccc([C@H]2CN(Cc3ccc([N+](=O)[O-])c(F)c3)CCN2)c1 ZINC000879525428 1292171400 /nfs/dbraw/zinc/17/14/00/1292171400.db2.gz YHDMWYFOJZZYAF-QGZVFWFLSA-N 0 3 345.374 2.889 20 5 EFBDHN COc1ccc(C2(NC[C@H](O)c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000775411342 1292314911 /nfs/dbraw/zinc/31/49/11/1292314911.db2.gz NWZALBSMZBWTFG-KRWDZBQOSA-N 0 3 328.368 2.916 20 5 EFBDHN Cc1occc1C(=O)NCCCN(C)Cc1cccc([N+](=O)[O-])c1 ZINC001233733389 1312980785 /nfs/dbraw/zinc/98/07/85/1312980785.db2.gz LDNOVDYCDZSDKX-UHFFFAOYSA-N 0 3 331.372 2.748 20 5 EFBDHN CN(CCCNC(=O)c1ccsc1)Cc1cccc([N+](=O)[O-])c1 ZINC001233733650 1312981062 /nfs/dbraw/zinc/98/10/62/1312981062.db2.gz PCHNNLQJMIBNPU-UHFFFAOYSA-N 0 3 333.413 2.908 20 5 EFBDHN Cc1ccoc1C(=O)NCCCN(C)Cc1cccc([N+](=O)[O-])c1 ZINC001233947242 1313023392 /nfs/dbraw/zinc/02/33/92/1313023392.db2.gz NUDAKQKMUMWZIR-UHFFFAOYSA-N 0 3 331.372 2.748 20 5 EFBDHN Cc1ccccc1[C@H](CO)N(C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000886435871 1294966226 /nfs/dbraw/zinc/96/62/26/1294966226.db2.gz KVEWZCHSTZZWRP-ZWKOTPCHSA-N 0 3 330.384 2.602 20 5 EFBDHN CCSCCC(=O)NCCCN(C)Cc1cccc([N+](=O)[O-])c1 ZINC001234432386 1313126825 /nfs/dbraw/zinc/12/68/25/1313126825.db2.gz DFMAGUUBDQMXKK-UHFFFAOYSA-N 0 3 339.461 2.676 20 5 EFBDHN CCCCC(=O)N1CCC(NCc2csc([N+](=O)[O-])c2)CC1 ZINC001199358980 1295495708 /nfs/dbraw/zinc/49/57/08/1295495708.db2.gz DAPYVMJDDYDUHC-UHFFFAOYSA-N 0 3 325.434 2.927 20 5 EFBDHN C[C@@H]1[C@H](C)N(C)CCN1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000775984573 1295571912 /nfs/dbraw/zinc/57/19/12/1295571912.db2.gz GXPULRSHJXABQH-WDEREUQCSA-N 0 3 342.237 2.882 20 5 EFBDHN CC(C)N(CCN(C)C)C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC000889658938 1295790450 /nfs/dbraw/zinc/79/04/50/1295790450.db2.gz ONICSRPDIKBSAK-UHFFFAOYSA-N 0 3 344.415 2.742 20 5 EFBDHN CC1(C)CCN(CCNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC000890078606 1295892550 /nfs/dbraw/zinc/89/25/50/1295892550.db2.gz JEUVKOICWPIQFU-UHFFFAOYSA-N 0 3 330.388 2.538 20 5 EFBDHN Cc1cccc(OCCN(C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000776279822 1297356587 /nfs/dbraw/zinc/35/65/87/1297356587.db2.gz YCAQRSZWQURNNQ-SFHVURJKSA-N 0 3 330.384 2.947 20 5 EFBDHN O=[N+]([O-])c1ccc([C@H](O)CN2CCC[C@H]2C[C@H](O)c2ccco2)cc1 ZINC000776585993 1299650436 /nfs/dbraw/zinc/65/04/36/1299650436.db2.gz GMUOICBOLGMQMR-YESZJQIVSA-N 0 3 346.383 2.809 20 5 EFBDHN Cc1noc(COC(=O)C(C)(C)N(C)C2CCCC2)c1[N+](=O)[O-] ZINC000853907185 1300333824 /nfs/dbraw/zinc/33/38/24/1300333824.db2.gz GSPGVBBHVWVKJI-UHFFFAOYSA-N 0 3 325.365 2.587 20 5 EFBDHN COc1ccccc1[C@H](CO)N[C@@H](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000866298167 1303593585 /nfs/dbraw/zinc/59/35/85/1303593585.db2.gz UIYSAKGVESSQIG-LRDDRELGSA-N 0 3 348.374 2.997 20 5 EFBDHN C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])N[C@H]1CCN(C(C)(C)C)C1=O ZINC000866380876 1303617957 /nfs/dbraw/zinc/61/79/57/1303617957.db2.gz LUAFLQLKUUMANT-RISCZKNCSA-N 0 3 337.395 2.654 20 5 EFBDHN C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])N[C@H]1Cc2ccccc2NC1=O ZINC000866397978 1303622973 /nfs/dbraw/zinc/62/29/73/1303622973.db2.gz LDLGURWTHHFTNW-BZNIZROVSA-N 0 3 343.358 2.818 20 5 EFBDHN Cc1nn(CN(C[C@H]2CCOC2)C2CC2)c2cc([N+](=O)[O-])ccc12 ZINC000121102150 1303670492 /nfs/dbraw/zinc/67/04/92/1303670492.db2.gz OFNPNLLAWZCRBM-CYBMUJFWSA-N 0 3 330.388 2.711 20 5 EFBDHN CN(CC(=O)N[C@H]1C[C@@H](Nc2ccccc2[N+](=O)[O-])C1)CC(C)(C)C ZINC001097255581 1313932226 /nfs/dbraw/zinc/93/22/26/1313932226.db2.gz QOYFSWANKHRODE-OKILXGFUSA-N 0 3 348.447 2.632 20 5 EFBDHN COC(=O)N1CCC(CNCc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000796499907 1304197113 /nfs/dbraw/zinc/19/71/13/1304197113.db2.gz HHVLARFEPLLXEU-UHFFFAOYSA-N 0 3 341.795 2.816 20 5 EFBDHN Cc1ccn(C[C@H](C)C(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])n1 ZINC000870455380 1305331656 /nfs/dbraw/zinc/33/16/56/1305331656.db2.gz YJSGHEKWZQBBFS-RBOXIYTFSA-N 0 3 349.362 2.916 20 5 EFBDHN CN(CC(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1)C1CCC1 ZINC000900837227 1308748686 /nfs/dbraw/zinc/74/86/86/1308748686.db2.gz CQDJKWSGBIOPHF-MRXNPFEDSA-N 0 3 335.429 2.653 20 5 EFBDHN CC(=O)O[C@@H]1C[C@@H]2C[C@H](O[C@H](C)c3cccc([N+](=O)[O-])c3)C[C@H]1N2C ZINC001223427770 1311259350 /nfs/dbraw/zinc/25/93/50/1311259350.db2.gz UTLCLAPNNNOUAM-QBFPWWHVSA-N 0 3 348.399 2.839 20 5 EFBDHN Cc1cnc(CO[C@H]2CC[C@H](N3CCOCC3)CC2)c(C)c1[N+](=O)[O-] ZINC001224185742 1311357326 /nfs/dbraw/zinc/35/73/26/1311357326.db2.gz NKXLLCIJXYONSM-WKILWMFISA-N 0 3 349.431 2.767 20 5 EFBDHN O=C(NCCCNCc1csc([N+](=O)[O-])c1)C1C=CC=CC=C1 ZINC001159026556 1311436073 /nfs/dbraw/zinc/43/60/73/1311436073.db2.gz LBPQKEUKSUBFHX-UHFFFAOYSA-N 0 3 333.413 2.551 20 5 EFBDHN O=[N+]([O-])c1cc([O-])cc(Nc2c(F)cccc2N2CC[NH2+]CC2)c1 ZINC001160057314 1311637303 /nfs/dbraw/zinc/63/73/03/1311637303.db2.gz JQTGKPQWQLOZDH-UHFFFAOYSA-N 0 3 332.335 2.593 20 5 EFBDHN COc1cc(O[C@@H]2CCN(Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC001226577345 1311691467 /nfs/dbraw/zinc/69/14/67/1311691467.db2.gz YXPUGUNRUDJKJW-CQSZACIVSA-N 0 3 329.356 2.652 20 5 EFBDHN CC(C)N1CC[C@@H](Oc2ccc(Br)nc2[N+](=O)[O-])C1 ZINC001227256749 1311783870 /nfs/dbraw/zinc/78/38/70/1311783870.db2.gz NLDMSYJIBYMEDK-SECBINFHSA-N 0 3 330.182 2.614 20 5 EFBDHN CCN1CCC(Oc2ccc(Br)nc2[N+](=O)[O-])CC1 ZINC001227256027 1311783696 /nfs/dbraw/zinc/78/36/96/1311783696.db2.gz AXODAWLTXWCIKC-UHFFFAOYSA-N 0 3 330.182 2.615 20 5 EFBDHN CN1CCC(Oc2cc(F)c(Br)cc2[N+](=O)[O-])CC1 ZINC001227287703 1311789122 /nfs/dbraw/zinc/78/91/22/1311789122.db2.gz VJVZBXCLPHFTOV-UHFFFAOYSA-N 0 3 333.157 2.969 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1Cl)ncnc2O[C@H]1CN2CCC1CC2 ZINC001227365127 1311798286 /nfs/dbraw/zinc/79/82/86/1311798286.db2.gz ZPEVIICWHZDYFJ-AWEZNQCLSA-N 0 3 334.763 2.664 20 5 EFBDHN COc1ccc(C(=O)CNc2cc3c(cc2[N+](=O)[O-])CNC3)cc1 ZINC001161802786 1311976434 /nfs/dbraw/zinc/97/64/34/1311976434.db2.gz OIZWDNBUCULRSF-UHFFFAOYSA-N 0 3 327.340 2.501 20 5 EFBDHN Cc1[nH]c(=O)cc(O[C@@H]2CCN([C@H](C)c3ccccn3)C2)c1[N+](=O)[O-] ZINC001228687728 1311981966 /nfs/dbraw/zinc/98/19/66/1311981966.db2.gz AFMFBYQJAYVMMA-CHWSQXEVSA-N 0 3 344.371 2.613 20 5 EFBDHN Cc1c([N+](=O)[O-])cc[n+]([O-])c1NC[C@@H]1CCCN1Cc1ccccc1 ZINC001161886113 1311995914 /nfs/dbraw/zinc/99/59/14/1311995914.db2.gz RPMRUUGSSITDDZ-INIZCTEOSA-N 0 3 342.399 2.613 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1C[C@@H](C)Oc1ccc2c(c1)CCN(C)C2 ZINC001228936477 1312023306 /nfs/dbraw/zinc/02/33/06/1312023306.db2.gz IPXRDXZBOOWZIE-GFCCVEGCSA-N 0 3 330.388 2.555 20 5 EFBDHN CC(C)(C)CC(=O)N1C[C@H]2CN(Cc3ccc([N+](=O)[O-])cc3)C[C@H]2C1 ZINC001048679999 1312039023 /nfs/dbraw/zinc/03/90/23/1312039023.db2.gz MKZTWDPFQHAMBF-IYBDPMFKSA-N 0 3 345.443 2.921 20 5 EFBDHN CCC(CC)C(=O)N1C[C@H]2CN(Cc3ccc([N+](=O)[O-])cc3)C[C@H]2C1 ZINC001048688307 1312046080 /nfs/dbraw/zinc/04/60/80/1312046080.db2.gz AVHDNYMNYMUBTH-CALCHBBNSA-N 0 3 345.443 2.921 20 5 EFBDHN O=C(CCC1CC1)N1C[C@H]2CN(Cc3ccccc3[N+](=O)[O-])C[C@H]2C1 ZINC001048728764 1312082530 /nfs/dbraw/zinc/08/25/30/1312082530.db2.gz FILXNKFRTGBONQ-CALCHBBNSA-N 0 3 343.427 2.675 20 5 EFBDHN NCc1cn(-c2c3ccc(Br)cc3ncc2[N+](=O)[O-])cn1 ZINC001162302046 1312084723 /nfs/dbraw/zinc/08/47/23/1312084723.db2.gz IYNFNBPDUCHBQY-UHFFFAOYSA-N 0 3 348.160 2.550 20 5 EFBDHN CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3cc(C)c([N+](=O)[O-])c(C)c3)C[C@H]1N2C ZINC001229469444 1312101544 /nfs/dbraw/zinc/10/15/44/1312101544.db2.gz HLSDTAAMRWCQCF-QMCVQRASSA-N 0 3 348.399 2.757 20 5 EFBDHN CN(C)Cc1ccccc1O[C@H]1CCN(c2ccc([N+](=O)[O-])cn2)C1 ZINC001229701009 1312125160 /nfs/dbraw/zinc/12/51/60/1312125160.db2.gz GOXXLDOWIANGFA-INIZCTEOSA-N 0 3 342.399 2.709 20 5 EFBDHN CN1CCC(Oc2c(F)cc([N+](=O)[O-])cc2Br)CC1 ZINC001229899808 1312156414 /nfs/dbraw/zinc/15/64/14/1312156414.db2.gz YGEWTTVIBNTMFI-UHFFFAOYSA-N 0 3 333.157 2.969 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(C)cc1O[C@H]1CCCN(C(C)C)C1 ZINC001229960196 1312163112 /nfs/dbraw/zinc/16/31/12/1312163112.db2.gz IXPBOHBSCFDWNE-ZDUSSCGKSA-N 0 3 336.388 2.941 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(C)cc1O[C@@H]1CCCN(C(C)C)C1 ZINC001229960191 1312163242 /nfs/dbraw/zinc/16/32/42/1312163242.db2.gz IXPBOHBSCFDWNE-CYBMUJFWSA-N 0 3 336.388 2.941 20 5 EFBDHN C[C@H](N)c1nc2ccccc2n1-c1ccc2nsnc2c1[N+](=O)[O-] ZINC001162777560 1312174106 /nfs/dbraw/zinc/17/41/06/1312174106.db2.gz UJSDUBOWSYNJCK-QMMMGPOBSA-N 0 3 340.368 2.958 20 5 EFBDHN COC(=O)Cc1ccc(N[C@H]2CNCc3ccsc32)cc1[N+](=O)[O-] ZINC001163231143 1312270520 /nfs/dbraw/zinc/27/05/20/1312270520.db2.gz URZGODJUNJIUNZ-ZDUSSCGKSA-N 0 3 347.396 2.628 20 5 EFBDHN COC(=O)c1cc(N[C@@H]2CNCc3ccsc32)cc([N+](=O)[O-])c1 ZINC001163230290 1312270536 /nfs/dbraw/zinc/27/05/36/1312270536.db2.gz OBSWNZKKQOSVMJ-CYBMUJFWSA-N 0 3 333.369 2.699 20 5 EFBDHN O=[N+]([O-])c1c2nsnc2ccc1N[C@H]1CNCc2ccsc21 ZINC001163230403 1312270968 /nfs/dbraw/zinc/27/09/68/1312270968.db2.gz WJRMLRVGMIGJPP-JTQLQIEISA-N 0 3 333.398 2.917 20 5 EFBDHN COC(=O)Cc1ccc(N[C@@H]2CNCc3ccsc32)cc1[N+](=O)[O-] ZINC001163231141 1312271063 /nfs/dbraw/zinc/27/10/63/1312271063.db2.gz URZGODJUNJIUNZ-CYBMUJFWSA-N 0 3 347.396 2.628 20 5 EFBDHN O=[N+]([O-])c1c2nsnc2ccc1N[C@@H]1CNCc2ccsc21 ZINC001163230405 1312271071 /nfs/dbraw/zinc/27/10/71/1312271071.db2.gz WJRMLRVGMIGJPP-SNVBAGLBSA-N 0 3 333.398 2.917 20 5 EFBDHN O=C(NCCC1(CNCc2ccccc2[N+](=O)[O-])CC1)c1ccc[nH]1 ZINC001163400502 1312304792 /nfs/dbraw/zinc/30/47/92/1312304792.db2.gz QXWCCPHCGKGPEE-UHFFFAOYSA-N 0 3 342.399 2.613 20 5 EFBDHN CC(C)[C@@H](N[C@H](C)Cc1ccc(F)cc1[N+](=O)[O-])c1nncn1C ZINC000903065649 1312321152 /nfs/dbraw/zinc/32/11/52/1312321152.db2.gz RSFUKYVLFMTHKH-IAQYHMDHSA-N 0 3 335.383 2.780 20 5 EFBDHN O=[N+]([O-])c1cccc2c1ccnc2N[C@H]1CCCC[C@@]12CNCCO2 ZINC001163645802 1312353927 /nfs/dbraw/zinc/35/39/27/1312353927.db2.gz DPKXNMUXECBVPN-FUHWJXTLSA-N 0 3 342.399 2.856 20 5 EFBDHN COc1cc(C)c([N+](=O)[O-])cc1N[C@H]1CCCC[C@@]12CNCCO2 ZINC001163649554 1312354513 /nfs/dbraw/zinc/35/45/13/1312354513.db2.gz AAXGHXURQJJQHU-DLBZAZTESA-N 0 3 335.404 2.625 20 5 EFBDHN CCOC(=O)c1ccc(OC2CCN(C3CC3)CC2)cc1[N+](=O)[O-] ZINC001230913485 1312390801 /nfs/dbraw/zinc/39/08/01/1312390801.db2.gz XUUBZLFELMYPGG-UHFFFAOYSA-N 0 3 334.372 2.777 20 5 EFBDHN CN(CCCNC(=O)c1ccc(F)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC001231218051 1312455636 /nfs/dbraw/zinc/45/56/36/1312455636.db2.gz XJTFVRVVFUFITB-UHFFFAOYSA-N 0 3 345.374 2.986 20 5 EFBDHN CN(CCCNC(=O)Cc1cccs1)Cc1ccc([N+](=O)[O-])cc1 ZINC001231242641 1312462196 /nfs/dbraw/zinc/46/21/96/1312462196.db2.gz FHMPMEMDAAJCRG-UHFFFAOYSA-N 0 3 347.440 2.837 20 5 EFBDHN CN(CCCNC(=O)/C=C\c1ccco1)Cc1cccc([N+](=O)[O-])c1 ZINC001231295150 1312473170 /nfs/dbraw/zinc/47/31/70/1312473170.db2.gz LTYKPWBBTOXTJH-HJWRWDBZSA-N 0 3 343.383 2.839 20 5 EFBDHN CCn1ccc(C(=O)NCCCNCc2ccccc2[N+](=O)[O-])c1C ZINC001164452974 1312516814 /nfs/dbraw/zinc/51/68/14/1312516814.db2.gz NWBXVQIIELDALG-UHFFFAOYSA-N 0 3 344.415 2.634 20 5 EFBDHN O=C(NCCC1(CNCc2csc([N+](=O)[O-])c2)CC1)c1cc[nH]c1 ZINC001164608638 1312549330 /nfs/dbraw/zinc/54/93/30/1312549330.db2.gz MSGAFFVFJYMXCY-UHFFFAOYSA-N 0 3 348.428 2.674 20 5 EFBDHN CN(C)C1(C)CN(c2ccc(-c3ccc(Cl)c([N+](=O)[O-])c3)nn2)C1 ZINC001165120844 1312572016 /nfs/dbraw/zinc/57/20/16/1312572016.db2.gz FEVGRCZVCYKZQW-UHFFFAOYSA-N 0 3 347.806 2.846 20 5 EFBDHN O=[N+]([O-])c1cc2nc(Cl)ccc2cc1-n1ncc2c1CCNC2 ZINC001165223960 1312590482 /nfs/dbraw/zinc/59/04/82/1312590482.db2.gz XLJYAOACTDEOFN-UHFFFAOYSA-N 0 3 329.747 2.628 20 5 EFBDHN Cc1cccc(CC(=O)NCCCNCc2ccccc2[N+](=O)[O-])c1 ZINC001165595730 1312650692 /nfs/dbraw/zinc/65/06/92/1312650692.db2.gz CQPOJHOVQBOPFX-UHFFFAOYSA-N 0 3 341.411 2.742 20 5 EFBDHN c1cnc2c(c1)ccc1ccc(CN3CC[C@@H](N4CCOCC4)C3)nc12 ZINC001232220550 1312651980 /nfs/dbraw/zinc/65/19/80/1312651980.db2.gz AANRFZCMZWQQBO-LJQANCHMSA-N 0 3 348.450 2.690 20 5 EFBDHN O=C(N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1)c1cccc(F)c1 ZINC001019950536 1314547779 /nfs/dbraw/zinc/54/77/79/1314547779.db2.gz AEBOSGSWDALPKZ-WKILWMFISA-N 0 3 343.358 2.785 20 5 EFBDHN Cc1sc(-c2nc(-c3ccc4c(n3)CCNC4)no2)cc1[N+](=O)[O-] ZINC001213996665 1314633351 /nfs/dbraw/zinc/63/33/51/1314633351.db2.gz KBCIUYOYEGXHFJ-UHFFFAOYSA-N 0 3 343.368 2.722 20 5 EFBDHN N[C@@]1(C(F)(F)F)CCN([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001246572991 1314650292 /nfs/dbraw/zinc/65/02/92/1314650292.db2.gz VNWIKKJXXPAHSA-HIFRSBDPSA-N 0 3 343.349 2.808 20 5 EFBDHN N[C@]1(C(F)(F)F)CCN([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001246572994 1314650676 /nfs/dbraw/zinc/65/06/76/1314650676.db2.gz VNWIKKJXXPAHSA-UKRRQHHQSA-N 0 3 343.349 2.808 20 5 EFBDHN O=C(N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1)C12CCC(CC1)C2 ZINC001020298844 1314718120 /nfs/dbraw/zinc/71/81/20/1314718120.db2.gz ZILIHCIBNZAZQA-FVYCFJCHSA-N 0 3 343.427 2.912 20 5 EFBDHN COc1ccc(C[C@@H](C)N2CCNC3=CCCC[C@@H]32)c([N+](=O)[O-])c1 ZINC001246996782 1314727401 /nfs/dbraw/zinc/72/74/01/1314727401.db2.gz PMZVXTVYIDAUCE-DYVFJYSZSA-N 0 3 331.416 2.876 20 5 EFBDHN O=[N+]([O-])c1cc(F)cnc1-c1noc(-c2cc3c(s2)CCNC3)n1 ZINC001217294610 1315056808 /nfs/dbraw/zinc/05/68/08/1315056808.db2.gz IOAMHEQWHSLGMO-UHFFFAOYSA-N 0 3 347.331 2.553 20 5 EFBDHN Cc1cc(O[C@H]2CCNC[C@@H]2F)c([N+](=O)[O-])cc1Br ZINC001218065412 1315141925 /nfs/dbraw/zinc/14/19/25/1315141925.db2.gz FNDZZFRYKULDGT-ONGXEEELSA-N 0 3 333.157 2.745 20 5 EFBDHN Cc1cc(Br)c(O[C@@H]2CCNC[C@H]2F)cc1[N+](=O)[O-] ZINC001218068684 1315142474 /nfs/dbraw/zinc/14/24/74/1315142474.db2.gz FPDBRMQBWWLSHH-MWLCHTKSSA-N 0 3 333.157 2.745 20 5 EFBDHN Cc1cc(Br)c(O[C@@H]2CCNC[C@@H]2F)cc1[N+](=O)[O-] ZINC001218068679 1315142907 /nfs/dbraw/zinc/14/29/07/1315142907.db2.gz FPDBRMQBWWLSHH-GXSJLCMTSA-N 0 3 333.157 2.745 20 5 EFBDHN CC(C)(C)c1cc([N+](=O)[O-])c(O[C@@H]2CCNC[C@H]2F)c([N+](=O)[O-])c1 ZINC001218071893 1315143126 /nfs/dbraw/zinc/14/31/26/1315143126.db2.gz QLGGANCTQLHORE-ZWNOBZJWSA-N 0 3 341.339 2.879 20 5 EFBDHN CC(C)(C)c1cc([N+](=O)[O-])c(O[C@@H]2CCNC[C@@H]2F)c([N+](=O)[O-])c1 ZINC001218071891 1315143379 /nfs/dbraw/zinc/14/33/79/1315143379.db2.gz QLGGANCTQLHORE-GXFFZTMASA-N 0 3 341.339 2.879 20 5 EFBDHN O=[N+]([O-])c1cccc(F)c1N1CC[C@H](Oc2cccc3c2CNC3)C1 ZINC001218383065 1315186679 /nfs/dbraw/zinc/18/66/79/1315186679.db2.gz FOSUAZBEEPNSEP-ZDUSSCGKSA-N 0 3 343.358 2.995 20 5 EFBDHN COC(=O)c1cc(O[C@H]2CNCc3ccccc32)c(F)cc1[N+](=O)[O-] ZINC001218491071 1315204625 /nfs/dbraw/zinc/20/46/25/1315204625.db2.gz VBNOUSUORCJUQV-INIZCTEOSA-N 0 3 346.314 2.744 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCC(NC3(c4cnccn4)CC3)CC2)cc1 ZINC001254470184 1315707098 /nfs/dbraw/zinc/70/70/98/1315707098.db2.gz IFHZKAYNNUGSQK-UHFFFAOYSA-N 0 3 339.399 2.633 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCC(NCc3ccc(Cl)nn3)CC2)cc1 ZINC001254467588 1315707108 /nfs/dbraw/zinc/70/71/08/1315707108.db2.gz COTBLDCBHZIBKY-UHFFFAOYSA-N 0 3 347.806 2.797 20 5 EFBDHN O=C(NCC1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1)C1CCC1 ZINC001001111297 1315713820 /nfs/dbraw/zinc/71/38/20/1315713820.db2.gz YYOCAHUEFBRBDB-UHFFFAOYSA-N 0 3 331.416 2.723 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N1CCCc2ccc(CN)nc21 ZINC001254538764 1315721229 /nfs/dbraw/zinc/72/12/29/1315721229.db2.gz AQYSOYVIKRWHMX-ZDUSSCGKSA-N 0 3 326.400 2.832 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N[C@@H]1Cc2ccccc2NC1=O ZINC001254535816 1315721471 /nfs/dbraw/zinc/72/14/71/1315721471.db2.gz LPNPPPKBDWDDCO-MLGOLLRUSA-N 0 3 325.368 2.679 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N1CCCc2ccc(CN)nc21 ZINC001254538763 1315721509 /nfs/dbraw/zinc/72/15/09/1315721509.db2.gz AQYSOYVIKRWHMX-CYBMUJFWSA-N 0 3 326.400 2.832 20 5 EFBDHN COc1ccc(CN[C@H](C)Cc2ccccc2[N+](=O)[O-])nc1OC ZINC001254544360 1315721786 /nfs/dbraw/zinc/72/17/86/1315721786.db2.gz JEYKVKSGAQETPD-GFCCVEGCSA-N 0 3 331.372 2.728 20 5 EFBDHN COC(=O)C[C@H](N[C@H](C)Cc1ccccc1[N+](=O)[O-])c1cccnc1 ZINC001254542534 1315721945 /nfs/dbraw/zinc/72/19/45/1315721945.db2.gz OUSMKQNKRGRAII-CJNGLKHVSA-N 0 3 343.383 2.815 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])NCC(=O)Nc1ccc(F)cc1 ZINC001254547048 1315722375 /nfs/dbraw/zinc/72/23/75/1315722375.db2.gz UMDVKUNMDUWSHD-LBPRGKRZSA-N 0 3 331.347 2.893 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N1CCCN(c2ncccn2)CC1 ZINC001254560577 1315723255 /nfs/dbraw/zinc/72/32/55/1315723255.db2.gz VUXLCWOKPVBGTI-HNNXBMFYSA-N 0 3 341.415 2.528 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N1CCC(NC(=O)C2CC2)CC1 ZINC001254561118 1315723899 /nfs/dbraw/zinc/72/38/99/1315723899.db2.gz FICNKBGQHOYSLB-ZDUSSCGKSA-N 0 3 331.416 2.516 20 5 EFBDHN Cc1nccnc1O[C@H]1CCN([C@H](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC001254568441 1315724685 /nfs/dbraw/zinc/72/46/85/1315724685.db2.gz FZEHAUOHPDYNRX-CJNGLKHVSA-N 0 3 342.399 2.778 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@H](N[C@@H](CO)c1cc(F)cc(F)c1)C2 ZINC001254588512 1315727822 /nfs/dbraw/zinc/72/78/22/1315727822.db2.gz ZXMWPXFSJPAPPH-WBVHZDCISA-N 0 3 334.322 2.663 20 5 EFBDHN CC(F)(F)c1ncncc1CN[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254587877 1315728080 /nfs/dbraw/zinc/72/80/80/1315728080.db2.gz BWOHMFXHBSTFEN-CYBMUJFWSA-N 0 3 334.326 2.754 20 5 EFBDHN COc1cccc2c1OC[C@@H]2N[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254587907 1315728131 /nfs/dbraw/zinc/72/81/31/1315728131.db2.gz CEORYQAWWZEDFF-CJNGLKHVSA-N 0 3 326.352 2.794 20 5 EFBDHN COC(=O)CCN(Cc1ccco1)[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254597240 1315729133 /nfs/dbraw/zinc/72/91/33/1315729133.db2.gz CAXVSURITNUZAS-MRXNPFEDSA-N 0 3 344.367 2.720 20 5 EFBDHN CN(CCNC(=O)OC(C)(C)C)[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254597351 1315729347 /nfs/dbraw/zinc/72/93/47/1315729347.db2.gz HRTWXSHPGAUTEN-OAHLLOKOSA-N 0 3 335.404 2.519 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@H](N1CC3(CN(Cc4ccccc4)C3)C1)C2 ZINC001254603016 1315729636 /nfs/dbraw/zinc/72/96/36/1315729636.db2.gz KJYVTTSOWVHWAF-HXUWFJFHSA-N 0 3 349.434 2.880 20 5 EFBDHN CCOC(=O)C1(C)CCN([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254602063 1315729987 /nfs/dbraw/zinc/72/99/87/1315729987.db2.gz AEDYJBUEGFIOJK-MRXNPFEDSA-N 0 3 332.400 2.727 20 5 EFBDHN CC(C)CC(=O)NC1CCN([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254601252 1315729993 /nfs/dbraw/zinc/72/99/93/1315729993.db2.gz WSJYNKMXFPAPSH-GOSISDBHSA-N 0 3 345.443 2.689 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@@H](N1CC[C@@H](N3CCCC3)[C@@H](F)C1)C2 ZINC001254610217 1315731180 /nfs/dbraw/zinc/73/11/80/1315731180.db2.gz JGYVKKKZEOPIIC-OKZBNKHCSA-N 0 3 333.407 2.570 20 5 EFBDHN Cc1cccnc1O[C@@H]1CCN([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254612062 1315731668 /nfs/dbraw/zinc/73/16/68/1315731668.db2.gz USWGDGNGRAFCKW-ZWKOTPCHSA-N 0 3 339.395 2.919 20 5 EFBDHN COC(=O)[C@@H]1CCC[C@@H]1NCc1cc([N+](=O)[O-])ccc1OC(F)F ZINC001255734442 1315862668 /nfs/dbraw/zinc/86/26/68/1315862668.db2.gz VZGCVJJWBMJTCC-NEPJUHHUSA-N 0 3 344.314 2.628 20 5 EFBDHN COc1cc(N2CCC(N[C@@H](C)c3ccno3)CC2)ccc1[N+](=O)[O-] ZINC001256095024 1315904515 /nfs/dbraw/zinc/90/45/15/1315904515.db2.gz VKRIAWDNPPQNJJ-LBPRGKRZSA-N 0 3 346.387 2.911 20 5 EFBDHN COc1cc(N2CCC(N3C[C@@H](C)OC[C@@H]3C)CC2)ccc1[N+](=O)[O-] ZINC001256101693 1315905124 /nfs/dbraw/zinc/90/51/24/1315905124.db2.gz QWIFBNLRFXWVNI-UONOGXRCSA-N 0 3 349.431 2.681 20 5 EFBDHN Cc1nccn1-c1ccncc1NC(=O)c1ccc([N+](=O)[O-])cc1F ZINC001318492086 1328617859 /nfs/dbraw/zinc/61/78/59/1328617859.db2.gz ZDYYVYIUPUMIFI-UHFFFAOYSA-N 0 3 341.302 2.875 20 5 EFBDHN Cc1nccn1-c1cc[nH+]cc1[N-]C(=O)c1ccc([N+](=O)[O-])cc1F ZINC001318492086 1328617862 /nfs/dbraw/zinc/61/78/62/1328617862.db2.gz ZDYYVYIUPUMIFI-UHFFFAOYSA-N 0 3 341.302 2.875 20 5 EFBDHN COc1ccc([C@@H](C)NC[C@H](O)c2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC001262563703 1316472295 /nfs/dbraw/zinc/47/22/95/1316472295.db2.gz MFAYERXYZPWEEB-PXAZEXFGSA-N 0 3 346.383 2.996 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@@H](CCO)C2CC2)c(Br)c1 ZINC001320408498 1329126716 /nfs/dbraw/zinc/12/67/16/1329126716.db2.gz KLEUYTOSKICTBC-ZDUSSCGKSA-N 0 3 329.194 2.608 20 5 EFBDHN C[C@@H]1CCCN(C(=O)CCNCc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC001320561334 1329164851 /nfs/dbraw/zinc/16/48/51/1329164851.db2.gz BZQXZPNVDQYIRS-GFCCVEGCSA-N 0 3 339.823 2.986 20 5 EFBDHN COC(=O)[C@H]1CCC[C@H]1NCc1cc([N+](=O)[O-])ccc1OC(C)C ZINC001320947219 1329323147 /nfs/dbraw/zinc/32/31/47/1329323147.db2.gz TWYZUHZWMWYDJJ-LSDHHAIUSA-N 0 3 336.388 2.813 20 5 EFBDHN CN1CCCC(C)(C)[C@@H]1CNC(=O)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001320990670 1329328541 /nfs/dbraw/zinc/32/85/41/1329328541.db2.gz HNTMMPAKBXRYNW-INIZCTEOSA-N 0 3 346.431 2.740 20 5 EFBDHN CN1CCCC(C)(C)[C@H]1CNC(=O)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001320990671 1329328549 /nfs/dbraw/zinc/32/85/49/1329328549.db2.gz HNTMMPAKBXRYNW-MRXNPFEDSA-N 0 3 346.431 2.740 20 5 EFBDHN O=[N+]([O-])c1ccc(Cl)cc1CNC[C@@H](CO)CC1CCOCC1 ZINC001322130561 1329431332 /nfs/dbraw/zinc/43/13/32/1329431332.db2.gz VGAMLDFRGYTANH-ZDUSSCGKSA-N 0 3 342.823 2.763 20 5 EFBDHN CCOC(=O)Cc1ccc(N2CCN(C(C)(C)C)CC2)c([N+](=O)[O-])c1 ZINC001326271448 1329743142 /nfs/dbraw/zinc/74/31/42/1329743142.db2.gz XKPPNEKAMAVIPO-UHFFFAOYSA-N 0 3 349.431 2.621 20 5 EFBDHN Cc1cncc([N+](=O)[O-])c1N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC001326961388 1330391008 /nfs/dbraw/zinc/39/10/08/1330391008.db2.gz YPOVOMONXKADDU-MRXNPFEDSA-N 0 3 326.400 2.797 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CN2CCC[C@](O)(c3ccccc3)C2)c1 ZINC001328882625 1330643064 /nfs/dbraw/zinc/64/30/64/1330643064.db2.gz AYAFGSYUPKUNJN-RBUKOAKNSA-N 0 3 342.395 2.612 20 5 EFBDHN CC1CCN(CCNC(=O)[C@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)CC1 ZINC001332747129 1331015689 /nfs/dbraw/zinc/01/56/89/1331015689.db2.gz XMPGQRUCKAUVAI-SJORKVTESA-N 0 3 331.416 2.546 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)ccc1CNC1CCN(c2cccnn2)CC1 ZINC001335501250 1331361445 /nfs/dbraw/zinc/36/14/45/1331361445.db2.gz OZULEMPPWZDBCE-UHFFFAOYSA-N 0 3 347.806 2.797 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]CCc2sc(C)nc2C)c1[N+](=O)[O-] ZINC001336716159 1331495359 /nfs/dbraw/zinc/49/53/59/1331495359.db2.gz DKRCDHLKYRQHFE-UHFFFAOYSA-N 0 3 337.401 2.715 20 5 EFBDHN COc1ccc([C@@H](C)NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c(OC)c1 ZINC001336762514 1331500570 /nfs/dbraw/zinc/50/05/70/1331500570.db2.gz FVYLPQDOOHZJEP-SJKOYZFVSA-N 0 3 346.383 2.996 20 5 EFBDHN Cc1nn(C)cc1CCC(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC001343829412 1332384585 /nfs/dbraw/zinc/38/45/85/1332384585.db2.gz HLHZOXDSFVBAQN-SJKOYZFVSA-N 0 3 349.362 2.750 20 5 EFBDHN COc1ccc(NC(=O)N(C)CCN2CCCCC2)c([N+](=O)[O-])c1 ZINC001344513169 1332460758 /nfs/dbraw/zinc/46/07/58/1332460758.db2.gz ZOBLPNBUWOYSNX-UHFFFAOYSA-N 0 3 336.392 2.553 20 5 EFBDHN CC([C@@H](OC(=O)COCc1ccncc1)c1ccccc1F)[N+](=O)[O-] ZINC001345037049 1332503792 /nfs/dbraw/zinc/50/37/92/1332503792.db2.gz PUHIJDYVTQIBTE-SJKOYZFVSA-N 0 3 348.330 2.687 20 5 EFBDHN O=[N+]([O-])c1ccc(CNC[C@@H](O)COc2cccc3[nH]ccc32)cc1 ZINC001346110398 1332600063 /nfs/dbraw/zinc/60/00/63/1332600063.db2.gz QGJYCNKSYLKSQD-OAHLLOKOSA-N 0 3 341.367 2.606 20 5 EFBDHN COc1ncccc1C(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC001348939654 1332886299 /nfs/dbraw/zinc/88/62/99/1332886299.db2.gz LISLPWCBZZBHEA-IINYFYTJSA-N 0 3 334.303 2.793 20 5 EFBDHN Cc1cc([N+](=O)[O-])cc(C(=O)N[C@@H]2CCCN3CCCC[C@@H]23)c1F ZINC000847257729 1333453293 /nfs/dbraw/zinc/45/32/93/1333453293.db2.gz YVWMGCCSGGBNGH-CABCVRRESA-N 0 3 335.379 2.789 20 5 EFBDHN CN(CC1CCOCC1)Cn1cc(-c2ccccc2[N+](=O)[O-])cn1 ZINC000848483581 1334740704 /nfs/dbraw/zinc/74/07/04/1334740704.db2.gz KPPVESKPDUMRCM-UHFFFAOYSA-N 0 3 330.388 2.774 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2NC[C@H](O)COc1cccc(F)c1 ZINC000848524277 1334772857 /nfs/dbraw/zinc/77/28/57/1334772857.db2.gz RMYCMBCSIFSVKL-SUMWQHHRSA-N 0 3 346.358 2.751 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2N[C@@H](CO)C[C@H](O)c1ccccc1 ZINC000848537107 1334782414 /nfs/dbraw/zinc/78/24/14/1334782414.db2.gz ZRRCGRRGTDPNMP-LJHODMEESA-N 0 3 342.395 2.656 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2N[C@@H]1COc2ccccc2[C@H]1O ZINC000848550109 1334789641 /nfs/dbraw/zinc/78/96/41/1334789641.db2.gz CMECUEAMYDMTGQ-HDMKZQKVSA-N 0 3 326.352 2.666 20 5 EFBDHN COC(=O)Cc1ccccc1CN[C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000848573593 1334802889 /nfs/dbraw/zinc/80/28/89/1334802889.db2.gz WEBWZVUAGVAQBV-GFCCVEGCSA-N 0 3 343.383 2.743 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)NC[C@@H]2CCCCN2C)cc1[N+](=O)[O-] ZINC001357291337 1335297098 /nfs/dbraw/zinc/29/70/98/1335297098.db2.gz KRUSNTLQRUKEGT-HIFRSBDPSA-N 0 3 334.420 2.748 20 5 EFBDHN O=C(N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1)C1CC2(CCC2)C1 ZINC001020487618 713068316 /nfs/dbraw/zinc/06/83/16/713068316.db2.gz IIVBXAROZWPJDB-WKILWMFISA-N 0 3 343.427 2.912 20 5 EFBDHN Cc1cc(C(=O)N[C@H]2C[C@H](NCc3ccccc3[N+](=O)[O-])C2)c(C)[nH]1 ZINC001020640836 713311672 /nfs/dbraw/zinc/31/16/72/713311672.db2.gz JIOJVTIXCHRQKA-SHTZXODSSA-N 0 3 342.399 2.590 20 5 EFBDHN CC(COC(=O)Cc1c[nH]c2cc(Br)ccc12)[N+](=O)[O-] ZINC000813115402 713643395 /nfs/dbraw/zinc/64/33/95/713643395.db2.gz QWQDEPZCCNNTPF-QMMMGPOBSA-N 0 3 341.161 2.681 20 5 EFBDHN COC(=O)[C@@H]1CCN(CCCOc2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000933165312 714519992 /nfs/dbraw/zinc/51/99/92/714519992.db2.gz KSTUBSFNTXJDEK-ZIAGYGMSSA-N 0 3 336.388 2.637 20 5 EFBDHN Cc1cc(C(=O)N[C@H]2C[C@@H](NCc3ccccc3[N+](=O)[O-])C2)c(C)o1 ZINC001021824634 714537102 /nfs/dbraw/zinc/53/71/02/714537102.db2.gz NXHQWYHZLMNHAU-GASCZTMLSA-N 0 3 343.383 2.855 20 5 EFBDHN CC(C)[C@H](CNCc1ccc(Cl)cc1[N+](=O)[O-])N1CCOCC1 ZINC000892499959 717987950 /nfs/dbraw/zinc/98/79/50/717987950.db2.gz BMPACGGJGAPXCV-INIZCTEOSA-N 0 3 341.839 2.695 20 5 EFBDHN CC1(C)CC(C(=O)N[C@H]2C[C@@H](NCc3ccccc3[N+](=O)[O-])C2)C1 ZINC001022037838 714682556 /nfs/dbraw/zinc/68/25/56/714682556.db2.gz APOHJWSRWUXCQQ-GASCZTMLSA-N 0 3 331.416 2.768 20 5 EFBDHN COc1cccc([C@H](CNc2c([N+](=O)[O-])cnn2C)N2CCCC2)c1 ZINC000891513242 714793069 /nfs/dbraw/zinc/79/30/69/714793069.db2.gz FWSICLTZEAGEHC-HNNXBMFYSA-N 0 3 345.403 2.586 20 5 EFBDHN Cc1coc(C(=O)N[C@H]2C[C@@H](NCc3ccccc3[N+](=O)[O-])C2)c1 ZINC001022572425 715221503 /nfs/dbraw/zinc/22/15/03/715221503.db2.gz AVMVEDHMEPVPTO-OKILXGFUSA-N 0 3 329.356 2.547 20 5 EFBDHN Cn1ncc([N+](=O)[O-])c1Nc1cccc(CN2CCSCC2)c1 ZINC000892320460 715937213 /nfs/dbraw/zinc/93/72/13/715937213.db2.gz XFADBJRQGMUMRW-UHFFFAOYSA-N 0 3 333.417 2.621 20 5 EFBDHN COc1c([O-])ccc(C[N@@H+]2CCC[C@H]2[C@@H]2CCCOC2)c1[N+](=O)[O-] ZINC000895081991 723233523 /nfs/dbraw/zinc/23/35/23/723233523.db2.gz LRQYJCGUGLWVBN-KGLIPLIRSA-N 0 3 336.388 2.700 20 5 EFBDHN COc1c([O-])ccc(C[N@H+]2CCC[C@H]2[C@@H]2CCCOC2)c1[N+](=O)[O-] ZINC000895081991 723233525 /nfs/dbraw/zinc/23/35/25/723233525.db2.gz LRQYJCGUGLWVBN-KGLIPLIRSA-N 0 3 336.388 2.700 20 5 EFBDHN CCCN(C(=O)N[C@H](C)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(C)C1 ZINC000925247310 724487812 /nfs/dbraw/zinc/48/78/12/724487812.db2.gz RDAFXJUICQKPAL-CZUORRHYSA-N 0 3 334.420 2.782 20 5 EFBDHN CC[C@@H](CN1CCCC1)Nc1c2ccccc2n(C)c(=O)c1[N+](=O)[O-] ZINC000892558670 718282411 /nfs/dbraw/zinc/28/24/11/718282411.db2.gz ARXBXSNLXQINQH-ZDUSSCGKSA-N 0 3 344.415 2.733 20 5 EFBDHN COc1cc(CN[C@@H](C)COc2ccccc2)c([N+](=O)[O-])cc1O ZINC000892697046 718768558 /nfs/dbraw/zinc/76/85/58/718768558.db2.gz QXSIGBKDUMWOBO-LBPRGKRZSA-N 0 3 332.356 2.866 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]C[C@@]2(C)CCO[C@@H]2C2CC2)c1[N+](=O)[O-] ZINC000893642223 719009298 /nfs/dbraw/zinc/00/92/98/719009298.db2.gz MTQDJCDCOMQEGX-IAGOWNOFSA-N 0 3 336.388 2.604 20 5 EFBDHN CCOC(=O)c1ncc(CNCCc2ccc([N+](=O)[O-])cc2)s1 ZINC000892938133 719293158 /nfs/dbraw/zinc/29/31/58/719293158.db2.gz YFMXHVDAWCROBF-UHFFFAOYSA-N 0 3 335.385 2.560 20 5 EFBDHN CCO[C@H]1C[C@@H](NCc2ccc(O)c(OC)c2[N+](=O)[O-])C12CCC2 ZINC000892958525 719345979 /nfs/dbraw/zinc/34/59/79/719345979.db2.gz BRHZLEZICDBCHH-KGLIPLIRSA-N 0 3 336.388 2.746 20 5 EFBDHN CCO[C@H]1C[C@@H]([NH2+]Cc2ccc([O-])c(OC)c2[N+](=O)[O-])C12CCC2 ZINC000892958525 719345980 /nfs/dbraw/zinc/34/59/80/719345980.db2.gz BRHZLEZICDBCHH-KGLIPLIRSA-N 0 3 336.388 2.746 20 5 EFBDHN O=C(N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1)C1(C2CC2)CC1 ZINC001020268805 719476730 /nfs/dbraw/zinc/47/67/30/719476730.db2.gz ODDKHYVZZXJJRI-SHTZXODSSA-N 0 3 329.400 2.522 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCCN(C(C)C)CC1 ZINC000122788334 719791148 /nfs/dbraw/zinc/79/11/48/719791148.db2.gz LXFRWPRMNYXXCF-UHFFFAOYSA-N 0 3 336.392 2.551 20 5 EFBDHN C[C@H]1Cc2cc(CN3CCC(n4ccc([N+](=O)[O-])n4)CC3)ccc2O1 ZINC000894078700 720271479 /nfs/dbraw/zinc/27/14/79/720271479.db2.gz LFJIVTDKKAPOKY-ZDUSSCGKSA-N 0 3 342.399 2.952 20 5 EFBDHN C[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N(C)C)N1CCC(C)CC1 ZINC000067272267 721138315 /nfs/dbraw/zinc/13/83/15/721138315.db2.gz XOCAMWMNUVQWCL-AWEZNQCLSA-N 0 3 348.447 2.511 20 5 EFBDHN O=[N+]([O-])c1cc(CNC[C@H]2COCO2)ccc1Oc1ccc(F)cc1 ZINC000894869591 722925691 /nfs/dbraw/zinc/92/56/91/722925691.db2.gz CGSSHPUWLQZHME-HNNXBMFYSA-N 0 3 348.330 2.989 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN1CC[C@@H](C2OCCO2)C1 ZINC000896378133 723275633 /nfs/dbraw/zinc/27/56/33/723275633.db2.gz OBKRWMPTMJYJFX-LLVKDONJSA-N 0 3 346.305 2.808 20 5 EFBDHN CC1(C)CNC(=O)[C@H]1NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000895317446 724022072 /nfs/dbraw/zinc/02/20/72/724022072.db2.gz ODIHGHCDSDMPGA-OAHLLOKOSA-N 0 3 345.424 2.938 20 5 EFBDHN CC1(C)CNC(=O)[C@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000895316878 724023281 /nfs/dbraw/zinc/02/32/81/724023281.db2.gz RXQRELMIOCTHAU-OAHLLOKOSA-N 0 3 345.424 2.938 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1CCC2(CC1)C[C@H](O)CCO2 ZINC000897258016 724138086 /nfs/dbraw/zinc/13/80/86/724138086.db2.gz OVQVLPAHNWEBMR-OAHLLOKOSA-N 0 3 334.416 2.718 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C1CCN(C(=O)/C=C\C2CC2)CC1 ZINC000985358591 724166186 /nfs/dbraw/zinc/16/61/86/724166186.db2.gz ZOBIWQAPGIEPBA-HJWRWDBZSA-N 0 3 343.427 2.984 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C1CCN(C(=O)C2(C)CC2)CC1 ZINC000985443591 724373174 /nfs/dbraw/zinc/37/31/74/724373174.db2.gz WUDZJMGJDMORLD-UHFFFAOYSA-N 0 3 331.416 2.818 20 5 EFBDHN O=[N+]([O-])c1ccc([C@@H](O)CNCc2cccc3c2OCCCO3)cc1 ZINC000731678172 726916746 /nfs/dbraw/zinc/91/67/46/726916746.db2.gz HPVPITRXARIGNU-INIZCTEOSA-N 0 3 344.367 2.579 20 5 EFBDHN CCN1CCCN(C(=O)C(C)(C)c2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000910274062 727426064 /nfs/dbraw/zinc/42/60/64/727426064.db2.gz MKHOLRRBAZIBLC-AWEZNQCLSA-N 0 3 333.432 2.815 20 5 EFBDHN CCN1CCCN(C(=O)c2cccc(SC)c2[N+](=O)[O-])[C@@H](C)C1 ZINC000910280851 727426865 /nfs/dbraw/zinc/42/68/65/727426865.db2.gz SYQZUDUFRCRYOQ-LBPRGKRZSA-N 0 3 337.445 2.873 20 5 EFBDHN CCCN1CC[C@H](NC(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)C1 ZINC000912683423 727734512 /nfs/dbraw/zinc/73/45/12/727734512.db2.gz IZTSLNOBQCCEIO-JTQLQIEISA-N 0 3 329.759 2.601 20 5 EFBDHN CCN1CCN(c2ccc(Nc3cccnc3[N+](=O)[O-])cc2)CC1 ZINC000917003587 727753839 /nfs/dbraw/zinc/75/38/39/727753839.db2.gz NQTAWGFDHBKIOV-UHFFFAOYSA-N 0 3 327.388 2.875 20 5 EFBDHN CN(C)[C@@H](CNc1ccc([N+](=O)[O-])c2nonc21)c1ccc(F)cc1 ZINC000917090393 727766230 /nfs/dbraw/zinc/76/62/30/727766230.db2.gz MNZJNKFGBQUIAX-AWEZNQCLSA-N 0 3 345.334 2.985 20 5 EFBDHN CN(C)[C@H](CNc1ccc([N+](=O)[O-])c2nonc21)c1ccc(F)cc1 ZINC000917090394 727766241 /nfs/dbraw/zinc/76/62/41/727766241.db2.gz MNZJNKFGBQUIAX-CQSZACIVSA-N 0 3 345.334 2.985 20 5 EFBDHN CCOC(=O)CCCCCN1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000172173284 728570806 /nfs/dbraw/zinc/57/08/06/728570806.db2.gz AMOPLNJMQBGPOK-UHFFFAOYSA-N 0 3 349.431 2.840 20 5 EFBDHN COc1ccc(OC)c([C@H](O)CN[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173307996 728622123 /nfs/dbraw/zinc/62/21/23/728622123.db2.gz VPXDWNZCTFIJDM-SJKOYZFVSA-N 0 3 346.383 2.996 20 5 EFBDHN CN(CCNC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000919859109 729098558 /nfs/dbraw/zinc/09/85/58/729098558.db2.gz IDLDCHULVXVUIW-XFXZXTDPSA-N 0 3 339.395 2.856 20 5 EFBDHN CCN1CCN(Cc2cccc([N+](=O)[O-])c2Br)C[C@@H]1C ZINC000233487498 729496084 /nfs/dbraw/zinc/49/60/84/729496084.db2.gz ZGGNWAFHVBBAOR-NSHDSACASA-N 0 3 342.237 2.883 20 5 EFBDHN C[C@@H]1CCCN(CCNC(=O)c2cccc(Cl)c2[N+](=O)[O-])C1 ZINC000175521321 729506880 /nfs/dbraw/zinc/50/68/80/729506880.db2.gz PDEHUYBIJWEMPF-LLVKDONJSA-N 0 3 325.796 2.710 20 5 EFBDHN CC(C)NCC(=O)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 ZINC001575727810 1088649389 /nfs/dbraw/zinc/64/93/89/1088649389.db2.gz RZLNEOACVULLHD-UHFFFAOYSA-N 0 3 341.367 2.762 20 5 EFBDHN CC1(C)CN[C@@H]1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC001576470252 1089276640 /nfs/dbraw/zinc/27/66/40/1089276640.db2.gz YDRIVAULZGHUNJ-GFCCVEGCSA-N 0 3 332.385 2.655 20 5 EFBDHN C[C@@H]1CN[C@@H](C)[C@@H](C)N1C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC001576880894 1089505139 /nfs/dbraw/zinc/50/51/39/1089505139.db2.gz SAPLCIZYMUDRLP-KXUCPTDWSA-N 0 3 345.321 2.825 20 5 EFBDHN C[C@H]1OC(C)(C)N[C@@H]1CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC001576910751 1089524514 /nfs/dbraw/zinc/52/45/14/1089524514.db2.gz WACKGEITHBZFDS-BXKDBHETSA-N 0 3 349.412 2.652 20 5 EFBDHN Cc1cc(F)c([N+](=O)[O-])cc1C(=O)Nc1ccnc([C@@H]2CCCN2)n1 ZINC001579609105 1090642749 /nfs/dbraw/zinc/64/27/49/1090642749.db2.gz ZNCSSLAGSPMANO-LBPRGKRZSA-N 0 3 345.334 2.509 20 5 EFBDHN Cc1ccc(NC(=O)C[C@@H]2NCc3ccccc32)c(N)c1[N+](=O)[O-] ZINC001579715626 1090669219 /nfs/dbraw/zinc/66/92/19/1090669219.db2.gz ZIEDUYGBMUKWOH-AWEZNQCLSA-N 0 3 326.356 2.659 20 5 EFBDHN NCc1cccnc1NC(=O)CCc1c(Cl)cccc1[N+](=O)[O-] ZINC001580347073 1090873037 /nfs/dbraw/zinc/87/30/37/1090873037.db2.gz JXMBPECAKVXTLF-UHFFFAOYSA-N 0 3 334.763 2.673 20 5 EFBDHN O=C(c1cccc([N+](=O)[O-])c1Cl)N1CCNCC12CCCCC2 ZINC001580820969 1091020803 /nfs/dbraw/zinc/02/08/03/1091020803.db2.gz LGAFRXLMRKQZEB-UHFFFAOYSA-N 0 3 337.807 2.997 20 5 EFBDHN CC1(C)C[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])[C@@H]2CCC[C@@H]21 ZINC001590104891 1093270559 /nfs/dbraw/zinc/27/05/59/1093270559.db2.gz XGVFUPFBJZPGBL-DZGCQCFKSA-N 0 3 342.403 2.785 20 5 EFBDHN CC1(C)C[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])[C@@H]2CCC[C@@H]21 ZINC001590104891 1093270565 /nfs/dbraw/zinc/27/05/65/1093270565.db2.gz XGVFUPFBJZPGBL-DZGCQCFKSA-N 0 3 342.403 2.785 20 5 EFBDHN CC1(C)C[N@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])[C@@H]2CCC[C@@H]21 ZINC001590104891 1093270569 /nfs/dbraw/zinc/27/05/69/1093270569.db2.gz XGVFUPFBJZPGBL-DZGCQCFKSA-N 0 3 342.403 2.785 20 5 EFBDHN CC1(C)C[N@@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])[C@@H]2CCC[C@@H]21 ZINC001590104891 1093270578 /nfs/dbraw/zinc/27/05/78/1093270578.db2.gz XGVFUPFBJZPGBL-DZGCQCFKSA-N 0 3 342.403 2.785 20 5 EFBDHN CC1(C2CC2)CC[NH+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC1 ZINC001590121755 1093275603 /nfs/dbraw/zinc/27/56/03/1093275603.db2.gz COXVPZLADHEJMY-UHFFFAOYSA-N 0 3 342.403 2.787 20 5 EFBDHN C[C@@H]1C[C@@H](C)[C@@H](C)[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590189652 1093298910 /nfs/dbraw/zinc/29/89/10/1093298910.db2.gz WLZKOARPGBBJCT-IJLUTSLNSA-N 0 3 330.392 2.641 20 5 EFBDHN C[C@@H]1C[C@@H](C)[C@@H](C)[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590189652 1093298914 /nfs/dbraw/zinc/29/89/14/1093298914.db2.gz WLZKOARPGBBJCT-IJLUTSLNSA-N 0 3 330.392 2.641 20 5 EFBDHN C[C@@H]1C[C@@H](C)[C@@H](C)[N@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590189652 1093298921 /nfs/dbraw/zinc/29/89/21/1093298921.db2.gz WLZKOARPGBBJCT-IJLUTSLNSA-N 0 3 330.392 2.641 20 5 EFBDHN C[C@@H]1C[C@@H](C)[C@@H](C)[N@@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590189652 1093298928 /nfs/dbraw/zinc/29/89/28/1093298928.db2.gz WLZKOARPGBBJCT-IJLUTSLNSA-N 0 3 330.392 2.641 20 5 EFBDHN C/C=C\C[C@H]1CCC[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590352618 1093387747 /nfs/dbraw/zinc/38/77/47/1093387747.db2.gz CGTKBQHKYAHABI-ZRMMWKCHSA-N 0 3 342.403 2.953 20 5 EFBDHN C/C=C\C[C@H]1CCC[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])C1 ZINC001590352618 1093387755 /nfs/dbraw/zinc/38/77/55/1093387755.db2.gz CGTKBQHKYAHABI-ZRMMWKCHSA-N 0 3 342.403 2.953 20 5 EFBDHN C/C=C\C[C@H]1CCC[N@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590352618 1093387763 /nfs/dbraw/zinc/38/77/63/1093387763.db2.gz CGTKBQHKYAHABI-ZRMMWKCHSA-N 0 3 342.403 2.953 20 5 EFBDHN C/C=C\C[C@H]1CCC[N@@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])C1 ZINC001590352618 1093387769 /nfs/dbraw/zinc/38/77/69/1093387769.db2.gz CGTKBQHKYAHABI-ZRMMWKCHSA-N 0 3 342.403 2.953 20 5 EFBDHN CCS[C@@H]1CCC[C@@H]1[NH2+]Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001590849762 1093596828 /nfs/dbraw/zinc/59/68/28/1093596828.db2.gz BVGCHJVWIZVBNM-GXTWGEPZSA-N 0 3 348.432 2.539 20 5 EFBDHN CCS[C@@H]1CCC[C@@H]1[NH2+]Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001590849762 1093596838 /nfs/dbraw/zinc/59/68/38/1093596838.db2.gz BVGCHJVWIZVBNM-GXTWGEPZSA-N 0 3 348.432 2.539 20 5 EFBDHN CC[C@@H]1CCC[C@H](C)[N@@H+]1Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001590857369 1093604235 /nfs/dbraw/zinc/60/42/35/1093604235.db2.gz LRCCGDOSONENFZ-SMDDNHRTSA-N 0 3 330.392 2.928 20 5 EFBDHN CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001590857369 1093604236 /nfs/dbraw/zinc/60/42/36/1093604236.db2.gz LRCCGDOSONENFZ-SMDDNHRTSA-N 0 3 330.392 2.928 20 5 EFBDHN CC[C@@H]1CCC[C@H](C)[N@@H+]1Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001590857369 1093604238 /nfs/dbraw/zinc/60/42/38/1093604238.db2.gz LRCCGDOSONENFZ-SMDDNHRTSA-N 0 3 330.392 2.928 20 5 EFBDHN CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001590857369 1093604241 /nfs/dbraw/zinc/60/42/41/1093604241.db2.gz LRCCGDOSONENFZ-SMDDNHRTSA-N 0 3 330.392 2.928 20 5 EFBDHN C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cc(-c2nnn[n-]2)cs1 ZINC001591121019 1093663692 /nfs/dbraw/zinc/66/36/92/1093663692.db2.gz KZFMEJLXPWEPLY-UHFFFAOYSA-N 0 3 344.400 2.511 20 5 EFBDHN C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cc(-c2nnn[n-]2)cs1 ZINC001591121019 1093663697 /nfs/dbraw/zinc/66/36/97/1093663697.db2.gz KZFMEJLXPWEPLY-UHFFFAOYSA-N 0 3 344.400 2.511 20 5 EFBDHN C[N@H+](Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])[C@H]1CCC(C)(C)C1 ZINC001591137105 1093671027 /nfs/dbraw/zinc/67/10/27/1093671027.db2.gz RQOYDHNZGRIAFJ-ZDUSSCGKSA-N 0 3 330.392 2.785 20 5 EFBDHN C[N@@H+](Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])[C@H]1CCC(C)(C)C1 ZINC001591137105 1093671030 /nfs/dbraw/zinc/67/10/30/1093671030.db2.gz RQOYDHNZGRIAFJ-ZDUSSCGKSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@H]([NH2+]CCc1ccc(-c2nnn[n-]2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC001591770030 1093852904 /nfs/dbraw/zinc/85/29/04/1093852904.db2.gz OIDQRVATELGMSB-LBPRGKRZSA-N 0 3 338.371 2.668 20 5 EFBDHN C[C@H]([NH2+]CCc1ccc(-c2nn[n-]n2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC001591770030 1093852916 /nfs/dbraw/zinc/85/29/16/1093852916.db2.gz OIDQRVATELGMSB-LBPRGKRZSA-N 0 3 338.371 2.668 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[N@@H+]1CCC[C@@H]2CCC[C@H]21 ZINC001593483139 1094327358 /nfs/dbraw/zinc/32/73/58/1094327358.db2.gz VRYFJFRJMKTTET-SMDDNHRTSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[N@H+]1CCC[C@@H]2CCC[C@H]21 ZINC001593483139 1094327367 /nfs/dbraw/zinc/32/73/67/1094327367.db2.gz VRYFJFRJMKTTET-SMDDNHRTSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[N@@H+]1CCC[C@@H]2CCC[C@H]21 ZINC001593483139 1094327374 /nfs/dbraw/zinc/32/73/74/1094327374.db2.gz VRYFJFRJMKTTET-SMDDNHRTSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[N@H+]1CCC[C@@H]2CCC[C@H]21 ZINC001593483139 1094327384 /nfs/dbraw/zinc/32/73/84/1094327384.db2.gz VRYFJFRJMKTTET-SMDDNHRTSA-N 0 3 328.376 2.539 20 5 EFBDHN CC(C)C[C@H]1CCC[N@@H+]1Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001603270893 1096491713 /nfs/dbraw/zinc/49/17/13/1096491713.db2.gz SIMSKJCENFAXKT-CQSZACIVSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)C[C@H]1CCC[N@H+]1Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001603270893 1096491714 /nfs/dbraw/zinc/49/17/14/1096491714.db2.gz SIMSKJCENFAXKT-CQSZACIVSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)C[C@H]1CCC[N@@H+]1Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001603270893 1096491718 /nfs/dbraw/zinc/49/17/18/1096491718.db2.gz SIMSKJCENFAXKT-CQSZACIVSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)C[C@H]1CCC[N@H+]1Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001603270893 1096491723 /nfs/dbraw/zinc/49/17/23/1096491723.db2.gz SIMSKJCENFAXKT-CQSZACIVSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001603884208 1096657972 /nfs/dbraw/zinc/65/79/72/1096657972.db2.gz JKNKZMDGLPRXTH-HBYGRHMLSA-N 0 3 330.392 2.689 20 5 EFBDHN C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001603884208 1096657974 /nfs/dbraw/zinc/65/79/74/1096657974.db2.gz JKNKZMDGLPRXTH-HBYGRHMLSA-N 0 3 330.392 2.689 20 5 EFBDHN C[C@H]1CCCC[C@@H]1[N@H+](C)Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001603891561 1096661720 /nfs/dbraw/zinc/66/17/20/1096661720.db2.gz STQDPUBYFYCEGQ-FZMZJTMJSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001603891561 1096661723 /nfs/dbraw/zinc/66/17/23/1096661723.db2.gz STQDPUBYFYCEGQ-FZMZJTMJSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@H]1CCCC[C@@H]1[N@H+](C)Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001603891561 1096661727 /nfs/dbraw/zinc/66/17/27/1096661727.db2.gz STQDPUBYFYCEGQ-FZMZJTMJSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001603891561 1096661729 /nfs/dbraw/zinc/66/17/29/1096661729.db2.gz STQDPUBYFYCEGQ-FZMZJTMJSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@H]1C[N@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC(C)(C)C1 ZINC001603936556 1096674092 /nfs/dbraw/zinc/67/40/92/1096674092.db2.gz SSAVQBVEZWHUTJ-LLVKDONJSA-N 0 3 330.392 2.643 20 5 EFBDHN C[C@H]1C[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])CC(C)(C)C1 ZINC001603936556 1096674094 /nfs/dbraw/zinc/67/40/94/1096674094.db2.gz SSAVQBVEZWHUTJ-LLVKDONJSA-N 0 3 330.392 2.643 20 5 EFBDHN CC[C@@H]([NH2+]Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])[C@@H]1CC1(C)C ZINC001604063240 1096717249 /nfs/dbraw/zinc/71/72/49/1096717249.db2.gz XCFXAYLMSDCZRY-QWHCGFSZSA-N 0 3 330.392 2.689 20 5 EFBDHN CC[C@@H]([NH2+]Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])[C@@H]1CC1(C)C ZINC001604063240 1096717257 /nfs/dbraw/zinc/71/72/57/1096717257.db2.gz XCFXAYLMSDCZRY-QWHCGFSZSA-N 0 3 330.392 2.689 20 5 EFBDHN CC[C@H]1CCCCC[N@@H+]1Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001604103222 1096737695 /nfs/dbraw/zinc/73/76/95/1096737695.db2.gz RZHRPCLAUPKQBS-AWEZNQCLSA-N 0 3 330.392 2.930 20 5 EFBDHN CC[C@H]1CCCCC[N@H+]1Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001604103222 1096737699 /nfs/dbraw/zinc/73/76/99/1096737699.db2.gz RZHRPCLAUPKQBS-AWEZNQCLSA-N 0 3 330.392 2.930 20 5 EFBDHN CC[C@H]1CCCCC[N@@H+]1Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001604103222 1096737702 /nfs/dbraw/zinc/73/77/02/1096737702.db2.gz RZHRPCLAUPKQBS-AWEZNQCLSA-N 0 3 330.392 2.930 20 5 EFBDHN CC[C@H]1CCCCC[N@H+]1Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001604103222 1096737706 /nfs/dbraw/zinc/73/77/06/1096737706.db2.gz RZHRPCLAUPKQBS-AWEZNQCLSA-N 0 3 330.392 2.930 20 5 EFBDHN CCC[C@@H]([NH2+]Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])C1CCC1 ZINC001604144855 1096751947 /nfs/dbraw/zinc/75/19/47/1096751947.db2.gz NBWFRTIHZLCIIC-CQSZACIVSA-N 0 3 330.392 2.833 20 5 EFBDHN CCC[C@@H]([NH2+]Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])C1CCC1 ZINC001604144855 1096751950 /nfs/dbraw/zinc/75/19/50/1096751950.db2.gz NBWFRTIHZLCIIC-CQSZACIVSA-N 0 3 330.392 2.833 20 5 EFBDHN CC[C@@H]1CC[C@@H](C)[N@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001604487750 1096879077 /nfs/dbraw/zinc/87/90/77/1096879077.db2.gz GTVMAHWADQEFKS-VXGBXAGGSA-N 0 3 330.392 2.785 20 5 EFBDHN CC[C@@H]1CC[C@@H](C)[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001604487750 1096879083 /nfs/dbraw/zinc/87/90/83/1096879083.db2.gz GTVMAHWADQEFKS-VXGBXAGGSA-N 0 3 330.392 2.785 20 5 EFBDHN CC[C@@H]1CC[C@@H](C)[N@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001604487750 1096879092 /nfs/dbraw/zinc/87/90/92/1096879092.db2.gz GTVMAHWADQEFKS-VXGBXAGGSA-N 0 3 330.392 2.785 20 5 EFBDHN CC[C@@H]1CC[C@@H](C)[N@@H+](Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])C1 ZINC001604487750 1096879097 /nfs/dbraw/zinc/87/90/97/1096879097.db2.gz GTVMAHWADQEFKS-VXGBXAGGSA-N 0 3 330.392 2.785 20 5 EFBDHN C[N@H+](Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])[C@H]1CCC(C)(C)C1 ZINC001604794824 1096957213 /nfs/dbraw/zinc/95/72/13/1096957213.db2.gz IXWGIGKIHWUQSC-NSHDSACASA-N 0 3 330.392 2.785 20 5 EFBDHN C[N@@H+](Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])[C@H]1CCC(C)(C)C1 ZINC001604794824 1096957215 /nfs/dbraw/zinc/95/72/15/1096957215.db2.gz IXWGIGKIHWUQSC-NSHDSACASA-N 0 3 330.392 2.785 20 5 EFBDHN C[N@H+](Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])[C@H]1CCC(C)(C)C1 ZINC001604794824 1096957218 /nfs/dbraw/zinc/95/72/18/1096957218.db2.gz IXWGIGKIHWUQSC-NSHDSACASA-N 0 3 330.392 2.785 20 5 EFBDHN C[N@@H+](Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])[C@H]1CCC(C)(C)C1 ZINC001604794824 1096957220 /nfs/dbraw/zinc/95/72/20/1096957220.db2.gz IXWGIGKIHWUQSC-NSHDSACASA-N 0 3 330.392 2.785 20 5 EFBDHN C[N@@H+](Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])C[C@@H]1CC=CCC1 ZINC001604806887 1096961004 /nfs/dbraw/zinc/96/10/04/1096961004.db2.gz AUIZIRCFTKACAV-GFCCVEGCSA-N 0 3 328.376 2.563 20 5 EFBDHN C[N@H+](Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])C[C@@H]1CC=CCC1 ZINC001604806887 1096961008 /nfs/dbraw/zinc/96/10/08/1096961008.db2.gz AUIZIRCFTKACAV-GFCCVEGCSA-N 0 3 328.376 2.563 20 5 EFBDHN CC1(C)CCCC[C@@H]1[NH2+]Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001609145264 1098168043 /nfs/dbraw/zinc/16/80/43/1098168043.db2.gz IAMOXAASVOEOFN-AWEZNQCLSA-N 0 3 330.392 2.833 20 5 EFBDHN CC1(C)CCCC[C@@H]1[NH2+]Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001609145264 1098168047 /nfs/dbraw/zinc/16/80/47/1098168047.db2.gz IAMOXAASVOEOFN-AWEZNQCLSA-N 0 3 330.392 2.833 20 5 EFBDHN CC1CCC([N@H+](C)Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])CC1 ZINC001609161162 1098175432 /nfs/dbraw/zinc/17/54/32/1098175432.db2.gz MRIGHWALQMGKIF-UHFFFAOYSA-N 0 3 330.392 2.785 20 5 EFBDHN CC1CCC([N@@H+](C)Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])CC1 ZINC001609161162 1098175436 /nfs/dbraw/zinc/17/54/36/1098175436.db2.gz MRIGHWALQMGKIF-UHFFFAOYSA-N 0 3 330.392 2.785 20 5 EFBDHN CC1CCC([N@H+](C)Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])CC1 ZINC001609161162 1098175439 /nfs/dbraw/zinc/17/54/39/1098175439.db2.gz MRIGHWALQMGKIF-UHFFFAOYSA-N 0 3 330.392 2.785 20 5 EFBDHN CC1CCC([N@@H+](C)Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])CC1 ZINC001609161162 1098175444 /nfs/dbraw/zinc/17/54/44/1098175444.db2.gz MRIGHWALQMGKIF-UHFFFAOYSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@H]1CCC[C@@H]([N@H+](C)Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001609163426 1098177843 /nfs/dbraw/zinc/17/78/43/1098177843.db2.gz ZMZCRPLMLLXJFA-SMDDNHRTSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@H]1CCC[C@@H]([N@@H+](C)Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001609163426 1098177850 /nfs/dbraw/zinc/17/78/50/1098177850.db2.gz ZMZCRPLMLLXJFA-SMDDNHRTSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@H]([N@H+](C)Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001609163425 1098178162 /nfs/dbraw/zinc/17/81/62/1098178162.db2.gz ZMZCRPLMLLXJFA-RISCZKNCSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@H]([N@@H+](C)Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001609163425 1098178164 /nfs/dbraw/zinc/17/81/64/1098178164.db2.gz ZMZCRPLMLLXJFA-RISCZKNCSA-N 0 3 330.392 2.785 20 5 EFBDHN C[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])[C@H]1C ZINC001609164020 1098178230 /nfs/dbraw/zinc/17/82/30/1098178230.db2.gz KFUGCUCCENGYCB-UHIISALHSA-N 0 3 330.392 2.689 20 5 EFBDHN C[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(-c3nn[n-]n3)cc2[N+](=O)[O-])[C@H]1C ZINC001609164020 1098178232 /nfs/dbraw/zinc/17/82/32/1098178232.db2.gz KFUGCUCCENGYCB-UHIISALHSA-N 0 3 330.392 2.689 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[NH+]1CCC2(CCCC2)CC1 ZINC001609603099 1098396863 /nfs/dbraw/zinc/39/68/63/1098396863.db2.gz ZMKIWJIQWAQBMX-UHFFFAOYSA-N 0 3 342.403 2.931 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[NH+]1CCC2(CCCC2)CC1 ZINC001609603099 1098396868 /nfs/dbraw/zinc/39/68/68/1098396868.db2.gz ZMKIWJIQWAQBMX-UHFFFAOYSA-N 0 3 342.403 2.931 20 5 EFBDHN CN1CCc2c(N(C(=N)N)c3ccc(F)cc3)ccc([N+](=O)[O-])c2C1 ZINC001167994608 1099761171 /nfs/dbraw/zinc/76/11/71/1099761171.db2.gz NXWWYRGRXFIKPC-UHFFFAOYSA-N 0 3 343.362 2.753 20 5 EFBDHN O=C(CCN[C@@H]1CCCc2cccnc21)Nc1ccccc1[N+](=O)[O-] ZINC000905601048 1103352865 /nfs/dbraw/zinc/35/28/65/1103352865.db2.gz CVGHHYBHGAEHFG-OAHLLOKOSA-N 0 3 340.383 2.986 20 5 EFBDHN O=C([C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1)N1CCNC2(CCCCC2)C1 ZINC000906635581 1104387702 /nfs/dbraw/zinc/38/77/02/1104387702.db2.gz ZRTUVRSQDBXJRS-IRXDYDNUSA-N 0 3 343.427 2.833 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCCCN2C2CC2)c1C ZINC000897576739 1105778445 /nfs/dbraw/zinc/77/84/45/1105778445.db2.gz NSKCHYNSNYLXTG-HNNXBMFYSA-N 0 3 331.416 2.958 20 5 EFBDHN CCN(CC)CC(=O)N(CC)CCNc1cc(C)ccc1[N+](=O)[O-] ZINC001106775903 1111822613 /nfs/dbraw/zinc/82/26/13/1111822613.db2.gz LDRDPGJQJHJRLP-UHFFFAOYSA-N 0 3 336.436 2.505 20 5 EFBDHN CCN(CC)CC(=O)N(CC)CCNc1ccc(C)cc1[N+](=O)[O-] ZINC001106775978 1111822730 /nfs/dbraw/zinc/82/27/30/1111822730.db2.gz PMCDTMJBGJVPBN-UHFFFAOYSA-N 0 3 336.436 2.505 20 5 EFBDHN CCN(C)C(C)(C)C(=O)N(CC)CCNc1ccc([N+](=O)[O-])cc1 ZINC001106877941 1111945413 /nfs/dbraw/zinc/94/54/13/1111945413.db2.gz URXTUDYZXYVRHQ-UHFFFAOYSA-N 0 3 336.436 2.586 20 5 EFBDHN CCN(C)C(C)(C)C(=O)N(CC)CCNc1ccccc1[N+](=O)[O-] ZINC001106877612 1111947523 /nfs/dbraw/zinc/94/75/23/1111947523.db2.gz KPUFHPOLSQLSRV-UHFFFAOYSA-N 0 3 336.436 2.586 20 5 EFBDHN CN(C)C[C@@H]1CN(C(=O)c2ccccc2[N+](=O)[O-])c2ccccc2O1 ZINC000370502203 282127259 /nfs/dbraw/zinc/12/72/59/282127259.db2.gz AVGJBDLCBBDWKP-CYBMUJFWSA-N 0 3 341.367 2.564 20 5 EFBDHN COc1ccc(C(=O)N[C@H](C)CN2C[C@H](C)C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000055748528 214340244 /nfs/dbraw/zinc/34/02/44/214340244.db2.gz SYJSCJPMOSPWHZ-MGPQQGTHSA-N 0 3 349.431 2.700 20 5 EFBDHN C[C@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000055749942 214340324 /nfs/dbraw/zinc/34/03/24/214340324.db2.gz XFZANVFTLJAGIJ-FRRDWIJNSA-N 0 3 337.395 2.830 20 5 EFBDHN CSc1cccc(C(=O)N[C@@H](C)CN2CCCCC2)c1[N+](=O)[O-] ZINC000188044559 295680562 /nfs/dbraw/zinc/68/05/62/295680562.db2.gz UGAKUVLSXXXZGG-LBPRGKRZSA-N 0 3 337.445 2.921 20 5 EFBDHN CN(C)[C@@H]1Cc2ccccc2N(C(=O)c2csc([N+](=O)[O-])c2)C1 ZINC000171752108 282228347 /nfs/dbraw/zinc/22/83/47/282228347.db2.gz UKHIOLJMTHFCSE-CYBMUJFWSA-N 0 3 331.397 2.789 20 5 EFBDHN CN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000164127660 529799579 /nfs/dbraw/zinc/79/95/79/529799579.db2.gz BVYPDPJRWMZDRQ-TZMCWYRMSA-N 0 3 337.807 2.805 20 5 EFBDHN CN(C[C@@H]1CCCN(C)C1)C(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000155209317 529948557 /nfs/dbraw/zinc/94/85/57/529948557.db2.gz IUGQZJKBUGPAFN-CYBMUJFWSA-N 0 3 342.399 2.557 20 5 EFBDHN CCCC(=O)NC[C@H]1CCCN(CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000101912167 219172554 /nfs/dbraw/zinc/17/25/54/219172554.db2.gz XWTLFPIQQXGFGD-OAHLLOKOSA-N 0 3 349.431 2.602 20 5 EFBDHN CN(CC1CCN(C)CC1)C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000103453179 219302130 /nfs/dbraw/zinc/30/21/30/219302130.db2.gz VZVKIAOPSNRGOE-UHFFFAOYSA-N 0 3 348.447 2.587 20 5 EFBDHN C[C@H](CN(C)Cc1ccccc1)NC(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000179707922 233350653 /nfs/dbraw/zinc/35/06/53/233350653.db2.gz YWOJTTZNICAKFS-CYBMUJFWSA-N 0 3 345.374 2.984 20 5 EFBDHN CCN1CCC[C@H]1CNc1ncc(Br)cc1[N+](=O)[O-] ZINC000040713364 213373709 /nfs/dbraw/zinc/37/37/09/213373709.db2.gz ZLNSUJUQRCWWGJ-JTQLQIEISA-N 0 3 329.198 2.649 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN1CC[C@@H](c2ccccc2)C1 ZINC000181642907 234264464 /nfs/dbraw/zinc/26/44/64/234264464.db2.gz BOOAMFKYYFRZGR-SJORKVTESA-N 0 3 342.395 2.824 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CN1CCCc2ccccc2C1 ZINC000181860634 234356237 /nfs/dbraw/zinc/35/62/37/234356237.db2.gz RZJCJZRBIGYPQR-QGZVFWFLSA-N 0 3 342.395 2.783 20 5 EFBDHN Cc1c([C@H](C)NCCC(=O)Nc2cccc([N+](=O)[O-])c2C)cnn1C ZINC000183330108 235010389 /nfs/dbraw/zinc/01/03/89/235010389.db2.gz IYRKXAWZEBSQKL-LBPRGKRZSA-N 0 3 345.403 2.625 20 5 EFBDHN CN1CC[C@@H]2[C@@H](CCCN2C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C1 ZINC000342954406 283093991 /nfs/dbraw/zinc/09/39/91/283093991.db2.gz BSKQZGCOKSBVTR-SWLSCSKDSA-N 0 3 342.399 2.632 20 5 EFBDHN Cc1ccc([C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N)N(C)C)cc1 ZINC000184330655 235369028 /nfs/dbraw/zinc/36/90/28/235369028.db2.gz WAMSLNONFJOOTM-QGZVFWFLSA-N 0 3 342.399 2.518 20 5 EFBDHN CNC(=O)[C@@H]1CCC[C@@H]1NCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000345828289 283405165 /nfs/dbraw/zinc/40/51/65/283405165.db2.gz IYIWRSIVVMEIRC-HIFRSBDPSA-N 0 3 343.383 2.859 20 5 EFBDHN Cc1ccc([C@H](CNCc2cccc([N+](=O)[O-])c2)N2CCOCC2)o1 ZINC000073052211 216344625 /nfs/dbraw/zinc/34/46/25/216344625.db2.gz YAGHGKKLCADKJS-KRWDZBQOSA-N 0 3 345.399 2.659 20 5 EFBDHN C[C@@H]1CN(CCN(C)C/C=C/c2ccccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000193398690 240105045 /nfs/dbraw/zinc/10/50/45/240105045.db2.gz OWIVZQIPAPMOTL-JNIGEABNSA-N 0 3 333.432 2.649 20 5 EFBDHN CC(C)[C@H](CCO)NCc1ccc(Br)c([N+](=O)[O-])c1 ZINC000230689302 242262078 /nfs/dbraw/zinc/26/20/78/242262078.db2.gz DNNYOXCUHXLCOT-LBPRGKRZSA-N 0 3 331.210 2.854 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCN1C[C@H](O)C[C@H]1c1ccccc1 ZINC000411919675 243027174 /nfs/dbraw/zinc/02/71/74/243027174.db2.gz BIPLAZXHQOWPJB-WBVHZDCISA-N 0 3 328.368 2.782 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCN2C[C@H](O)C[C@@H]2c2ccccc2)c1 ZINC000411943021 243036198 /nfs/dbraw/zinc/03/61/98/243036198.db2.gz MLMJDRPXTDTTGO-SJLPKXTDSA-N 0 3 328.368 2.782 20 5 EFBDHN COC1([C@H](C)NCC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CCC1 ZINC000412018786 243071492 /nfs/dbraw/zinc/07/14/92/243071492.db2.gz CIJMGIAYBBHHBQ-JTQLQIEISA-N 0 3 341.795 2.734 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@@H](CN2CCOCC2)C1 ZINC000245517213 243121586 /nfs/dbraw/zinc/12/15/86/243121586.db2.gz GWEQRNSGQZEIMN-HOTGVXAUSA-N 0 3 333.432 2.618 20 5 EFBDHN CNc1c(C(=O)N2CCCN(CC3CCC3)CC2)cccc1[N+](=O)[O-] ZINC000412317047 243264637 /nfs/dbraw/zinc/26/46/37/243264637.db2.gz WWSJULKESLFLDY-UHFFFAOYSA-N 0 3 346.431 2.585 20 5 EFBDHN CO[C@@H]([C@H](C)N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C)C1CC1 ZINC000414163017 244027633 /nfs/dbraw/zinc/02/76/33/244027633.db2.gz FLCZCBWDPNOMLL-MKBNYLNASA-N 0 3 335.404 2.633 20 5 EFBDHN CN(C)C(=O)[C@H]1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000414502313 244201269 /nfs/dbraw/zinc/20/12/69/244201269.db2.gz UCGRSKSERBOFNX-ZDUSSCGKSA-N 0 3 343.383 2.765 20 5 EFBDHN CCS(=O)(=O)CCCNCc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000414540992 244220050 /nfs/dbraw/zinc/22/00/50/244220050.db2.gz IFWZUZVQAKPFEP-UHFFFAOYSA-N 0 3 328.434 2.633 20 5 EFBDHN CN(C/C=C\c1ccccc1[N+](=O)[O-])C(C)(C)CN1CCOCC1 ZINC000414564395 244236564 /nfs/dbraw/zinc/23/65/64/244236564.db2.gz DRVLNBHVEDTZRH-VURMDHGXSA-N 0 3 333.432 2.651 20 5 EFBDHN C[C@]1(F)CNCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000414771832 244338889 /nfs/dbraw/zinc/33/88/89/244338889.db2.gz SAOQGMWVRFOVHY-KRWDZBQOSA-N 0 3 333.363 2.988 20 5 EFBDHN C[C@]1(F)CNCCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000414764877 244333278 /nfs/dbraw/zinc/33/32/78/244333278.db2.gz DUYGPAQHJXVZOX-KRWDZBQOSA-N 0 3 333.363 2.988 20 5 EFBDHN C[C@@H](NC(=O)NCc1ccc2c(c1)CNC2)c1cccc([N+](=O)[O-])c1 ZINC000417128853 245035218 /nfs/dbraw/zinc/03/52/18/245035218.db2.gz JLFKEVDKMFJVCO-GFCCVEGCSA-N 0 3 340.383 2.758 20 5 EFBDHN C[C@H](C(=O)N1CCc2c1cccc2[N+](=O)[O-])[C@H](N)c1ccccc1 ZINC000262653459 245096756 /nfs/dbraw/zinc/09/67/56/245096756.db2.gz WHXCVYSXLQXWTQ-SJCJKPOMSA-N 0 3 325.368 2.820 20 5 EFBDHN COC(=O)COc1ccc(CN2C[C@H](C)[C@H](C)[C@@H]2C)cc1[N+](=O)[O-] ZINC000418121917 245112897 /nfs/dbraw/zinc/11/28/97/245112897.db2.gz JFEXONKATDNOEC-AVGNSLFASA-N 0 3 336.388 2.623 20 5 EFBDHN C[C@@H]1[C@H](C)NCCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000262745170 245157955 /nfs/dbraw/zinc/15/79/55/245157955.db2.gz FSOYJVUJEVOTDG-WDEREUQCSA-N 0 3 346.412 2.541 20 5 EFBDHN C[C@@H](NCCn1cc([N+](=O)[O-])ccc1=O)c1ccc(C2CC2)cc1 ZINC000419337200 245385530 /nfs/dbraw/zinc/38/55/30/245385530.db2.gz KTSUHZSWTGHNRH-CYBMUJFWSA-N 0 3 327.384 2.985 20 5 EFBDHN CCN1CCC[C@H]1CNC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000079337970 217211237 /nfs/dbraw/zinc/21/12/37/217211237.db2.gz XURAJPRPFQPIRT-NSHDSACASA-N 0 3 345.321 2.828 20 5 EFBDHN CCC(CC)[C@H](O)CNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000111404198 220151427 /nfs/dbraw/zinc/15/14/27/220151427.db2.gz UZMZYILHEZGZIY-QGZVFWFLSA-N 0 3 346.431 2.882 20 5 EFBDHN CN(C[C@@H]1CCCN1C)C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000421709389 246076626 /nfs/dbraw/zinc/07/66/26/246076626.db2.gz DYSNTSDSPFDCDQ-LBPRGKRZSA-N 0 3 345.321 2.780 20 5 EFBDHN CC1CCN(CCNC(=O)c2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000264953847 247081770 /nfs/dbraw/zinc/08/17/70/247081770.db2.gz VXLAFYZAWJCFKH-UHFFFAOYSA-N 0 3 325.796 2.710 20 5 EFBDHN C[C@]1(CO)CCC[C@@H]1NCc1ccc(Br)cc1[N+](=O)[O-] ZINC000425444133 247088570 /nfs/dbraw/zinc/08/85/70/247088570.db2.gz LVDDHNQQWCVKDO-UONOGXRCSA-N 0 3 343.221 2.998 20 5 EFBDHN C[C@@]1(CO)CCC[C@@H]1NCc1ccc(Br)cc1[N+](=O)[O-] ZINC000425444127 247088964 /nfs/dbraw/zinc/08/89/64/247088964.db2.gz LVDDHNQQWCVKDO-KBPBESRZSA-N 0 3 343.221 2.998 20 5 EFBDHN O=[N+]([O-])c1cc(Br)ccc1CN[C@@H]1CCC[C@H]1CCO ZINC000425468844 247095944 /nfs/dbraw/zinc/09/59/44/247095944.db2.gz DAALANKSJKDZQR-GXFFZTMASA-N 0 3 343.221 2.998 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCC[C@H]2CN(C)C[C@H]21 ZINC000425667854 247162079 /nfs/dbraw/zinc/16/20/79/247162079.db2.gz HAUDZDNFZVSMPC-XJKSGUPXSA-N 0 3 332.404 2.770 20 5 EFBDHN CC(C)[C@H]1N(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC12CCC2 ZINC000427179956 247326502 /nfs/dbraw/zinc/32/65/02/247326502.db2.gz WSRYNNQVBWYQGV-NVXWUHKLSA-N 0 3 334.416 2.845 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H]1CCCCN1CC(C)C ZINC000427031150 247310106 /nfs/dbraw/zinc/31/01/06/247310106.db2.gz PPCHKPYLCPTFEW-OAHLLOKOSA-N 0 3 349.431 2.844 20 5 EFBDHN Cc1cc(NC(=O)c2ccc([N+](=O)[O-])s2)n(C2CCN(C)CC2)n1 ZINC000430452974 247785810 /nfs/dbraw/zinc/78/58/10/247785810.db2.gz CXTGJBOURDYCCO-UHFFFAOYSA-N 0 3 349.416 2.680 20 5 EFBDHN C[C@H]1C[C@H](N(C)C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CCN1C ZINC000266047792 248061621 /nfs/dbraw/zinc/06/16/21/248061621.db2.gz FKXOBBPIROENKJ-NWDGAFQWSA-N 0 3 330.388 2.631 20 5 EFBDHN Cc1c(CNC(=O)NC[C@@H]2CCCCN2C2CC2)cccc1[N+](=O)[O-] ZINC000433905064 248101127 /nfs/dbraw/zinc/10/11/27/248101127.db2.gz BDCRMMJKLCZRJB-INIZCTEOSA-N 0 3 346.431 2.719 20 5 EFBDHN C[C@H]1CCCCN1CCNc1ccc([N+](=O)[O-])cc1N1CCOC1=O ZINC000266189058 248158913 /nfs/dbraw/zinc/15/89/13/248158913.db2.gz BOTPTMYPYPWSSA-ZDUSSCGKSA-N 0 3 348.403 2.838 20 5 EFBDHN CN(C/C=C/c1ccccc1[N+](=O)[O-])CCN1CCOC(C)(C)C1 ZINC000435051458 248207693 /nfs/dbraw/zinc/20/76/93/248207693.db2.gz ZAEHWFUMOSKYCJ-SOFGYWHQSA-N 0 3 333.432 2.651 20 5 EFBDHN C[C@@H]1CN(CCN(C)C/C=C\c2ccccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000435057101 248208653 /nfs/dbraw/zinc/20/86/53/248208653.db2.gz OWIVZQIPAPMOTL-HMDCADFTSA-N 0 3 333.432 2.649 20 5 EFBDHN CCN1CCC(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000266220882 248183332 /nfs/dbraw/zinc/18/33/32/248183332.db2.gz BXYNGPDGJHOZLH-UHFFFAOYSA-N 0 3 345.321 2.828 20 5 EFBDHN CCC1(CNCc2cc(OC)c(OC)cc2[N+](=O)[O-])CCOCC1 ZINC000266623563 248388191 /nfs/dbraw/zinc/38/81/91/248388191.db2.gz MGCBRUZQODEVPE-UHFFFAOYSA-N 0 3 338.404 2.908 20 5 EFBDHN COC[C@@H]1CCCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000093337376 218215594 /nfs/dbraw/zinc/21/55/94/218215594.db2.gz SGEXOPSGGVGZQR-CQSZACIVSA-N 0 3 344.415 2.854 20 5 EFBDHN C[C@H]1CCN(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@@H](C)C1 ZINC000443641850 250214488 /nfs/dbraw/zinc/21/44/88/250214488.db2.gz MOPUIDIMPCYNDH-KBPBESRZSA-N 0 3 331.416 2.852 20 5 EFBDHN C[C@H]1CCN(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@H](C)C1 ZINC000443641852 250215177 /nfs/dbraw/zinc/21/51/77/250215177.db2.gz MOPUIDIMPCYNDH-UONOGXRCSA-N 0 3 331.416 2.852 20 5 EFBDHN NC(=O)[C@H](NCCCCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000151825047 223870788 /nfs/dbraw/zinc/87/07/88/223870788.db2.gz IEJDJXMWQZIDSQ-QGZVFWFLSA-N 0 3 327.384 2.734 20 5 EFBDHN C[C@H]1CN(Cc2c(Cl)cccc2[N+](=O)[O-])CCN1CC(C)(C)O ZINC000444764538 250341975 /nfs/dbraw/zinc/34/19/75/250341975.db2.gz YPKJTELCRSSMET-LBPRGKRZSA-N 0 3 341.839 2.525 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])NCC(=O)N(C)Cc1ccccc1 ZINC000449093116 250912045 /nfs/dbraw/zinc/91/20/45/250912045.db2.gz VLLURQQJSPSJSD-OAHLLOKOSA-N 0 3 341.411 2.774 20 5 EFBDHN COC(=O)COc1ccc(CNCC2=CCCCC2)cc1[N+](=O)[O-] ZINC000449378773 251003987 /nfs/dbraw/zinc/00/39/87/251003987.db2.gz XUURNVWDQAURQI-UHFFFAOYSA-N 0 3 334.372 2.737 20 5 EFBDHN CC(C)c1ccc(CN[C@H]2CCCN(CCCO)C2)cc1[N+](=O)[O-] ZINC000449399124 251015320 /nfs/dbraw/zinc/01/53/20/251015320.db2.gz XRBDNZVZKSFWIE-INIZCTEOSA-N 0 3 335.448 2.655 20 5 EFBDHN CO[C@H]1COCC[C@@H]1CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000449453183 251030442 /nfs/dbraw/zinc/03/04/42/251030442.db2.gz HMIHXJNTLJSUFS-ACJLOTCBSA-N 0 3 346.383 2.996 20 5 EFBDHN COc1cc(C[NH2+]C[C@@H]2CCOC3(CCC3)C2)c([N+](=O)[O-])cc1[O-] ZINC000449473956 251037927 /nfs/dbraw/zinc/03/79/27/251037927.db2.gz IRAOBNCVTHYMFO-GFCCVEGCSA-N 0 3 336.388 2.748 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nc(CN[C@H]3CCC[C@H]3CO)cs2)c1 ZINC000449706618 251124699 /nfs/dbraw/zinc/12/46/99/251124699.db2.gz NWEVBLBBALLPTG-WFASDCNBSA-N 0 3 333.413 2.969 20 5 EFBDHN CN(c1ccccc1)c1ccc(CN[C@H]2C[C@@H](O)C2)cc1[N+](=O)[O-] ZINC000449747644 251141465 /nfs/dbraw/zinc/14/14/65/251141465.db2.gz JUGVZIJDLDKOIK-FZNQNYSPSA-N 0 3 327.384 2.976 20 5 EFBDHN COC(=O)[C@@H]1CN(Cc2cccc([N+](=O)[O-])c2)C[C@@H]1c1ccccc1 ZINC000449754163 251143205 /nfs/dbraw/zinc/14/32/05/251143205.db2.gz KYYCRNQAJXCLDC-QZTJIDSGSA-N 0 3 340.379 2.983 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000267628454 251205871 /nfs/dbraw/zinc/20/58/71/251205871.db2.gz FMYFILWMZRUVJS-OCCSQVGLSA-N 0 3 342.399 2.775 20 5 EFBDHN Cc1nc(NC[C@H]2CCCCN2Cc2ccccc2)ncc1[N+](=O)[O-] ZINC000450291695 251330763 /nfs/dbraw/zinc/33/07/63/251330763.db2.gz YIJLTMVBXFASIY-MRXNPFEDSA-N 0 3 341.415 2.582 20 5 EFBDHN Cc1nc(NC[C@H](c2ccccc2)N2CCCC2)ncc1[N+](=O)[O-] ZINC000450217576 251303590 /nfs/dbraw/zinc/30/35/90/251303590.db2.gz UJRNTWLSIIFCAU-MRXNPFEDSA-N 0 3 327.388 2.942 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CCCCC[C@H]2C[C@H](O)c2ccco2)c1 ZINC000268348705 251845475 /nfs/dbraw/zinc/84/54/75/251845475.db2.gz CRTMXCXJPAGUNL-HOCLYGCPSA-N 0 3 348.403 2.753 20 5 EFBDHN C[C@H](O)C[C@H]1CCCN1[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000152926082 224033325 /nfs/dbraw/zinc/03/33/25/224033325.db2.gz PCOSQFACMHWONQ-SLEUVZQESA-N 0 3 346.387 2.941 20 5 EFBDHN C[C@H](CCc1ccccc1[N+](=O)[O-])N[C@@H]1C[C@H]2CCCCN2C1=O ZINC000453452445 252040196 /nfs/dbraw/zinc/04/01/96/252040196.db2.gz SGXWNFHEOIVZDG-FVQBIDKESA-N 0 3 331.416 2.659 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@H]2CCN(C3CC3)C2)nc1-c1ccc(F)cc1 ZINC000362360462 285109241 /nfs/dbraw/zinc/10/92/41/285109241.db2.gz UKXBQPLONXXCEC-AWEZNQCLSA-N 0 3 342.374 2.866 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@H]2CCN(C(=O)CC)C2)cc1[N+](=O)[O-] ZINC000154265494 224228616 /nfs/dbraw/zinc/22/86/16/224228616.db2.gz ZWHWISMIWZZMLZ-JSGCOSHPSA-N 0 3 335.404 2.655 20 5 EFBDHN COc1ccc(CNC(=O)[C@@H](C)[C@@H](N)c2ccccc2)cc1[N+](=O)[O-] ZINC000269259291 255554612 /nfs/dbraw/zinc/55/46/12/255554612.db2.gz QEEPLGPYINFIJE-YVEFUNNKSA-N 0 3 343.383 2.556 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN[C@H](c2ccccc2)C2(CO)CCCC2)n1 ZINC000459520758 255891681 /nfs/dbraw/zinc/89/16/81/255891681.db2.gz DWNBRJXFXAOGJQ-QGZVFWFLSA-N 0 3 344.415 2.675 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@H]1CC[C@@H](C)C[C@H]1C ZINC000119277338 221283707 /nfs/dbraw/zinc/28/37/07/221283707.db2.gz YPSNCKTVCOQUQR-BZPMIXESSA-N 0 3 335.404 2.956 20 5 EFBDHN C[C@@H](NCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C1CCOCC1 ZINC000179844425 533349987 /nfs/dbraw/zinc/34/99/87/533349987.db2.gz NVBDBHUWBCPYGY-SNVBAGLBSA-N 0 3 341.795 2.591 20 5 EFBDHN C[C@@H](NCCn1ccc([N+](=O)[O-])n1)c1ccc(OC(F)F)cc1 ZINC000179600144 533406514 /nfs/dbraw/zinc/40/65/14/533406514.db2.gz OAEOWXCXOZOUPY-SNVBAGLBSA-N 0 3 326.303 2.744 20 5 EFBDHN COc1ccc(CN2CCC[C@@H](C3(C)OCCO3)C2)cc1[N+](=O)[O-] ZINC000183822357 533557445 /nfs/dbraw/zinc/55/74/45/533557445.db2.gz ZYAMSTPBFDWEIV-CQSZACIVSA-N 0 3 336.388 2.578 20 5 EFBDHN C[C@@H]1C[C@H](NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)CCN1C ZINC000343452124 142000661 /nfs/dbraw/zinc/00/06/61/142000661.db2.gz RCLQQNKREGUWGQ-UKRRQHHQSA-N 0 3 346.431 2.752 20 5 EFBDHN O=C(N[C@H]1CCN(C2CC2)C1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000343452213 142000815 /nfs/dbraw/zinc/00/08/15/142000815.db2.gz RIGYZCUYRCYSJS-AWEZNQCLSA-N 0 3 344.415 2.506 20 5 EFBDHN C[C@@H](NC(C)(C)CNC(=O)c1ccc([N+](=O)[O-])n1C)c1ccccc1 ZINC000344605152 142048100 /nfs/dbraw/zinc/04/81/00/142048100.db2.gz NJTHHJWKXXMVCC-CYBMUJFWSA-N 0 3 344.415 2.793 20 5 EFBDHN COc1ccc(-c2ccc(CN[C@@H](CO)C(C)C)o2)c([N+](=O)[O-])c1 ZINC000344688995 142061393 /nfs/dbraw/zinc/06/13/93/142061393.db2.gz CQWBRCUDBRQOKW-HNNXBMFYSA-N 0 3 334.372 2.970 20 5 EFBDHN C[C@H]1CN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)CCN(C2CCC2)C1 ZINC000344702004 142063534 /nfs/dbraw/zinc/06/35/34/142063534.db2.gz QYZKWVZVJJPHHA-GFCCVEGCSA-N 0 3 335.379 2.680 20 5 EFBDHN COc1c(C(=O)N2CCN(C3CCC3)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000344720818 142067359 /nfs/dbraw/zinc/06/73/59/142067359.db2.gz GZSYEJCIKNWAGV-CYBMUJFWSA-N 0 3 347.415 2.550 20 5 EFBDHN COc1ccc(-c2ccc(CNC[C@H](C)CCO)o2)c([N+](=O)[O-])c1 ZINC000344723157 142067836 /nfs/dbraw/zinc/06/78/36/142067836.db2.gz KAKKWTMBLODDQH-GFCCVEGCSA-N 0 3 334.372 2.972 20 5 EFBDHN C[C@@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)CCN(C2CCC2)C1 ZINC000344740293 142070846 /nfs/dbraw/zinc/07/08/46/142070846.db2.gz LIMZSXZSBKIJJF-ZDUSSCGKSA-N 0 3 349.406 2.609 20 5 EFBDHN CCCCN1CCCC[C@H]1CNC(=O)c1cccc([N+](=O)[O-])c1N ZINC000344932984 142099773 /nfs/dbraw/zinc/09/97/73/142099773.db2.gz DGFCQSBYRZNNTN-ZDUSSCGKSA-N 0 3 334.420 2.561 20 5 EFBDHN C[C@@H]1CC[C@@H](C)N1CC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000345024940 142113086 /nfs/dbraw/zinc/11/30/86/142113086.db2.gz PLABBRUKKPQYEN-GHMZBOCLSA-N 0 3 325.796 2.737 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCN([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000346165842 142158844 /nfs/dbraw/zinc/15/88/44/142158844.db2.gz RHIPCYWWIWVWKC-RVSPLBMKSA-N 0 3 331.416 2.706 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCN([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000346190454 142164472 /nfs/dbraw/zinc/16/44/72/142164472.db2.gz PAKZUDUFGMJTAG-RVSPLBMKSA-N 0 3 331.416 2.706 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCN([C@@H]2C[C@@H]2C)C[C@@H](C)C1 ZINC000346190453 142164547 /nfs/dbraw/zinc/16/45/47/142164547.db2.gz PAKZUDUFGMJTAG-HACGYAERSA-N 0 3 331.416 2.706 20 5 EFBDHN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)CN(C)C ZINC000346221401 142170165 /nfs/dbraw/zinc/17/01/65/142170165.db2.gz LLCDIQICSVKCKE-NSHDSACASA-N 0 3 325.434 2.775 20 5 EFBDHN Cc1cc(C(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@@H](C)C2)cc([N+](=O)[O-])c1 ZINC000346242190 142174979 /nfs/dbraw/zinc/17/49/79/142174979.db2.gz RTSLTGMXTNXODY-JKIFEVAISA-N 0 3 331.416 2.706 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCN([C@@H]3C[C@H]3C)C[C@H](C)C2)c1 ZINC000346253133 142176914 /nfs/dbraw/zinc/17/69/14/142176914.db2.gz ZTOLBCMLXKUKEX-JJRVBVJISA-N 0 3 331.416 2.706 20 5 EFBDHN Cc1cc(C(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000346286918 142183791 /nfs/dbraw/zinc/18/37/91/142183791.db2.gz ZROPILYNSRJDQR-RVSPLBMKSA-N 0 3 331.416 2.706 20 5 EFBDHN CCN(CCN1CCCCCC1)C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000346300523 142185950 /nfs/dbraw/zinc/18/59/50/142185950.db2.gz UCDJPXISOJARJV-UHFFFAOYSA-N 0 3 333.432 2.862 20 5 EFBDHN CCN(CCN1CCCCCC1)C(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000346324922 142190029 /nfs/dbraw/zinc/19/00/29/142190029.db2.gz XSEKYZLONYQDNP-UHFFFAOYSA-N 0 3 349.431 2.942 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@]2(CCN(C)C2)C1 ZINC000346331704 142190579 /nfs/dbraw/zinc/19/05/79/142190579.db2.gz WSGQEHWFAIFOPK-LPHOPBHVSA-N 0 3 345.443 2.718 20 5 EFBDHN O=[N+]([O-])c1cc(CN2CCC[C@@H]2C2CCOCC2)c2c(c1)COCO2 ZINC000347632178 142247715 /nfs/dbraw/zinc/24/77/15/142247715.db2.gz QTNHZTWJHRBMKC-QGZVFWFLSA-N 0 3 348.399 2.852 20 5 EFBDHN C[C@H]1C[C@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000349664510 142345403 /nfs/dbraw/zinc/34/54/03/142345403.db2.gz MBFWLVTZEFUVSG-WDNDVIMCSA-N 0 3 340.445 2.783 20 5 EFBDHN CC[C@@H]1CCCCN1CCNC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000341171004 145005151 /nfs/dbraw/zinc/00/51/51/145005151.db2.gz SUDOHGRVMQGBPB-MRXNPFEDSA-N 0 3 348.447 2.701 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CCN1C ZINC000341194626 145010301 /nfs/dbraw/zinc/01/03/01/145010301.db2.gz HULKDMDYXIXDRB-UWVGGRQHSA-N 0 3 326.784 2.852 20 5 EFBDHN COc1ccc([C@@H](C)NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC000341203256 145012034 /nfs/dbraw/zinc/01/20/34/145012034.db2.gz CBJPBHAFMAJVGR-CJNGLKHVSA-N 0 3 346.383 2.694 20 5 EFBDHN C[C@@H](c1ccccc1)N1CCC(NC(=O)c2cc([N+](=O)[O-])c[nH]2)CC1 ZINC000341403837 145046649 /nfs/dbraw/zinc/04/66/49/145046649.db2.gz RDAXUTLEBNMYHV-ZDUSSCGKSA-N 0 3 342.399 2.878 20 5 EFBDHN C[C@H]1CCC[C@@H](CNCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000342353822 145107256 /nfs/dbraw/zinc/10/72/56/145107256.db2.gz HFTCITMYDOUNEY-UONOGXRCSA-N 0 3 340.445 2.784 20 5 EFBDHN CCN(Cc1cccc(F)c1)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000342354408 145107675 /nfs/dbraw/zinc/10/76/75/145107675.db2.gz IYSPXOQTXYENGY-INIZCTEOSA-N 0 3 348.374 2.996 20 5 EFBDHN C[C@H]1[C@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CCCN1C ZINC000342650346 145165976 /nfs/dbraw/zinc/16/59/76/145165976.db2.gz HQUFVXWWYJVUGJ-IINYFYTJSA-N 0 3 340.811 2.530 20 5 EFBDHN CCCN1CCC[C@@H]1CNC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000343556998 145237701 /nfs/dbraw/zinc/23/77/01/145237701.db2.gz SNIIVTNQPZOQEI-TZMCWYRMSA-N 0 3 337.395 2.828 20 5 EFBDHN CS[C@@H]1CN(Cc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1N(C)C ZINC000343567080 145240372 /nfs/dbraw/zinc/24/03/72/145240372.db2.gz VPERCANMMKJSNE-ZIAGYGMSSA-N 0 3 329.853 2.726 20 5 EFBDHN CC(C)NC(=O)c1ccc(N[C@H]2CCCN(C)[C@H]2C)c([N+](=O)[O-])c1 ZINC000343588247 145245908 /nfs/dbraw/zinc/24/59/08/145245908.db2.gz FOSYGWSHBJKNPC-JSGCOSHPSA-N 0 3 334.420 2.628 20 5 EFBDHN C[C@@H]1[C@@H](NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)CCCN1C ZINC000343764756 145289725 /nfs/dbraw/zinc/28/97/25/145289725.db2.gz WOAWANRJRBVGFW-PBHICJAKSA-N 0 3 348.447 2.699 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CN(C2CC2)C[C@@H]1C ZINC000343896064 145319197 /nfs/dbraw/zinc/31/91/97/145319197.db2.gz MBWIMRZQRTYHEV-XHDPSFHLSA-N 0 3 349.456 2.919 20 5 EFBDHN CNC(=O)CC[C@H]1CCCCN1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000348832219 146010487 /nfs/dbraw/zinc/01/04/87/146010487.db2.gz HSHMPDSRWQPRRL-QKIRZYONSA-N 0 3 331.416 2.989 20 5 EFBDHN C[C@@H]1CC[C@H](C)N1CC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000351614909 146159048 /nfs/dbraw/zinc/15/90/48/146159048.db2.gz KDNZNXXEAFUCIQ-TXEJJXNPSA-N 0 3 339.823 2.780 20 5 EFBDHN CN1CC[C@H]2[C@H](CCCN2C(=O)Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC000351621078 146161289 /nfs/dbraw/zinc/16/12/89/146161289.db2.gz PSOKAHACLQENSD-ABAIWWIYSA-N 0 3 336.367 2.682 20 5 EFBDHN CCCN(CCN1CCCC1)CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000352889599 146342003 /nfs/dbraw/zinc/34/20/03/146342003.db2.gz UMXBAUYYMZKYFK-UHFFFAOYSA-N 0 3 348.447 2.650 20 5 EFBDHN COc1ccc(-c2ccc(CNC[C@@H](CO)C3CC3)o2)c([N+](=O)[O-])c1 ZINC000353103326 146396635 /nfs/dbraw/zinc/39/66/35/146396635.db2.gz COAQWZOADGEIGV-ZDUSSCGKSA-N 0 3 346.383 2.972 20 5 EFBDHN C[C@@H](NCCn1cc([N+](=O)[O-])ccc1=O)c1cc2cccc(F)c2o1 ZINC000355737442 147049579 /nfs/dbraw/zinc/04/95/79/147049579.db2.gz XVXFKBBAMPQREI-LLVKDONJSA-N 0 3 345.330 2.993 20 5 EFBDHN Cc1cc(N2CCN(C)[C@@H](C)[C@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000356790999 147336189 /nfs/dbraw/zinc/33/61/89/147336189.db2.gz IVAKKADADCVELJ-UONOGXRCSA-N 0 3 341.415 2.889 20 5 EFBDHN CC[C@H](C)N[C@@H](CNC(=O)Cc1ccccc1[N+](=O)[O-])c1ccco1 ZINC000359541377 148115486 /nfs/dbraw/zinc/11/54/86/148115486.db2.gz DDPKWUHQHQGOHS-ZFWWWQNUSA-N 0 3 345.399 2.976 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@H](CCO)C2CCOCC2)c(Cl)c1 ZINC000359577819 148127958 /nfs/dbraw/zinc/12/79/58/148127958.db2.gz HIQMHHCLHXDRFF-OAHLLOKOSA-N 0 3 328.796 2.515 20 5 EFBDHN CO[C@]1(CNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCOC1 ZINC000359654527 148153088 /nfs/dbraw/zinc/15/30/88/148153088.db2.gz SHUGZDTVHOUFDI-KRWDZBQOSA-N 0 3 332.356 2.750 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2cnc(CCN3CCOCC4(CC4)C3)o2)c1 ZINC000360096766 148270036 /nfs/dbraw/zinc/27/00/36/148270036.db2.gz HVSQQCHQBNCEQL-UHFFFAOYSA-N 0 3 343.383 2.905 20 5 EFBDHN Cc1cc(OCC(=O)NC[C@@H](C)N2CCCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000360229259 148305292 /nfs/dbraw/zinc/30/52/92/148305292.db2.gz ZYWXFIUHLUUBHN-HUUCEWRRSA-N 0 3 349.431 2.661 20 5 EFBDHN Cc1cc(NC[C@@H]2CN3CCC[C@H]3CO2)c2cccc([N+](=O)[O-])c2n1 ZINC000364031900 149051943 /nfs/dbraw/zinc/05/19/43/149051943.db2.gz CMIOYAUELJDUMG-UONOGXRCSA-N 0 3 342.399 2.727 20 5 EFBDHN COc1cc(CN2CCC(n3ccc([N+](=O)[O-])n3)CC2)ccc1C ZINC000365117792 149321372 /nfs/dbraw/zinc/32/13/72/149321372.db2.gz RQVQRQKJKOYHRH-UHFFFAOYSA-N 0 3 330.388 2.945 20 5 EFBDHN O=[N+]([O-])c1cccnc1N1C[C@H]2CCN(Cc3ccccc3)C[C@H]2C1 ZINC000368592792 150157046 /nfs/dbraw/zinc/15/70/46/150157046.db2.gz MKPYGIUUPANEER-SJORKVTESA-N 0 3 338.411 2.948 20 5 EFBDHN O=[N+]([O-])c1cccnc1N1C[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C1 ZINC000368592787 150157790 /nfs/dbraw/zinc/15/77/90/150157790.db2.gz MKPYGIUUPANEER-DLBZAZTESA-N 0 3 338.411 2.948 20 5 EFBDHN CC1(C)CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H]1[C@H]1CCCO1 ZINC000368694362 150184173 /nfs/dbraw/zinc/18/41/73/150184173.db2.gz YSYWFIPHKCMXEC-NVXWUHKLSA-N 0 3 347.415 2.813 20 5 EFBDHN Cc1ncc2c(n1)CC[C@H](NCc1cc([N+](=O)[O-])ccc1Cl)C2 ZINC000368823763 150214813 /nfs/dbraw/zinc/21/48/13/150214813.db2.gz QBPDQGIUMQULFT-ZDUSSCGKSA-N 0 3 332.791 2.994 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CN2CC[C@@H](Oc3ccccc3)C2)c1 ZINC000372730738 151053430 /nfs/dbraw/zinc/05/34/30/151053430.db2.gz ZRKRWRHGLQTACV-MSOLQXFVSA-N 0 3 328.368 2.782 20 5 EFBDHN CN1CCC2(CCN(Cc3ccc(Cl)c([N+](=O)[O-])c3)CC2)C1=O ZINC000373173828 151126423 /nfs/dbraw/zinc/12/64/23/151126423.db2.gz QYQZLSOSEBNGSF-UHFFFAOYSA-N 0 3 337.807 2.693 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N(C)CCN(C)C2CC2)cc1[N+](=O)[O-] ZINC000185511170 292242255 /nfs/dbraw/zinc/24/22/55/292242255.db2.gz CVSUHUNZGYNKBN-ZDUSSCGKSA-N 0 3 334.420 2.700 20 5 EFBDHN Cc1c(CN2CCC[C@H](c3nc(N(C)C)no3)C2)cccc1[N+](=O)[O-] ZINC000374551010 151368211 /nfs/dbraw/zinc/36/82/11/151368211.db2.gz KKNAUUZWYRXHON-AWEZNQCLSA-N 0 3 345.403 2.732 20 5 EFBDHN COc1cccc([C@H]2C[C@@H](C)CN2CCn2cc([N+](=O)[O-])cn2)c1 ZINC000378641700 152134856 /nfs/dbraw/zinc/13/48/56/152134856.db2.gz DBXHPCBPHIXYPY-CXAGYDPISA-N 0 3 330.388 2.883 20 5 EFBDHN CN1CCN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C2(CCCCC2)C1 ZINC000408345642 152178409 /nfs/dbraw/zinc/17/84/09/152178409.db2.gz CMVYMYCWLVCWAO-UHFFFAOYSA-N 0 3 343.431 2.921 20 5 EFBDHN COc1cccc(C(=O)N[C@H](C)CN2C[C@@H](C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000195450767 286445094 /nfs/dbraw/zinc/44/50/94/286445094.db2.gz WPDOHACISVXPSF-MELADBBJSA-N 0 3 349.431 2.700 20 5 EFBDHN CC[C@@H]1CN([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CCN1C[C@@H](C)O ZINC000182750902 287207550 /nfs/dbraw/zinc/20/75/50/287207550.db2.gz FUVLGVOVVQUHBN-OWCLPIDISA-N 0 3 335.448 2.741 20 5 EFBDHN C[C@@H]1CCCN(CCNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000123495100 222287157 /nfs/dbraw/zinc/28/71/57/222287157.db2.gz SFVCLVLQHVFNSH-CYBMUJFWSA-N 0 3 342.399 2.605 20 5 EFBDHN COC(=O)[C@@](C)(CNCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000191577396 265269075 /nfs/dbraw/zinc/26/90/75/265269075.db2.gz FCGNJRLNGBKELS-SFHVURJKSA-N 0 3 328.368 2.815 20 5 EFBDHN COCCN1CCC(Nc2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000194957459 265398283 /nfs/dbraw/zinc/39/82/83/265398283.db2.gz QDNPCNZPJBCYRY-UHFFFAOYSA-N 0 3 330.388 2.666 20 5 EFBDHN CC(C)N1C[C@H](N[C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1=O ZINC000271536606 266003527 /nfs/dbraw/zinc/00/35/27/266003527.db2.gz SRFVMRWAAOXEJT-CVEARBPZSA-N 0 3 331.416 2.515 20 5 EFBDHN Cc1cc(C2CCN(CCOc3cccc([N+](=O)[O-])c3)CC2)n[nH]1 ZINC000271645749 266030457 /nfs/dbraw/zinc/03/04/57/266030457.db2.gz SUXAKOXCIKSEJO-UHFFFAOYSA-N 0 3 330.388 2.885 20 5 EFBDHN Cc1cc(C2CCN(CCOc3cccc([N+](=O)[O-])c3)CC2)[nH]n1 ZINC000271645749 266030460 /nfs/dbraw/zinc/03/04/60/266030460.db2.gz SUXAKOXCIKSEJO-UHFFFAOYSA-N 0 3 330.388 2.885 20 5 EFBDHN CC[C@H](NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1)c1cccc(Cl)c1 ZINC000271761456 266055374 /nfs/dbraw/zinc/05/53/74/266055374.db2.gz MLQYWGKYUIZIEE-CABCVRRESA-N 0 3 338.795 2.547 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)NCC2=CCN(C)CC2)cc1[N+](=O)[O-] ZINC000271821463 266068915 /nfs/dbraw/zinc/06/89/15/266068915.db2.gz CWIMHSUAWMMLTM-ZDUSSCGKSA-N 0 3 332.404 2.525 20 5 EFBDHN CO[C@@H]1[C@@H](C)[C@@H](NCc2cc([N+](=O)[O-])cc3c2OCOC3)C1(C)C ZINC000271979635 266113314 /nfs/dbraw/zinc/11/33/14/266113314.db2.gz JCUVSGVBBZPDPF-AMKSKSKJSA-N 0 3 336.388 2.610 20 5 EFBDHN CN1CC[C@H]2CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)[C@@H]2C1 ZINC000272370886 266244861 /nfs/dbraw/zinc/24/48/61/266244861.db2.gz GQYPJPQBYQHFRY-IINYFYTJSA-N 0 3 338.795 2.806 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N2CC[C@@H]3CCN(C)C[C@H]32)cc1[N+](=O)[O-] ZINC000272416650 266258805 /nfs/dbraw/zinc/25/88/05/266258805.db2.gz AQJUZUUPLVDTPB-GRDNDAEWSA-N 0 3 346.431 2.700 20 5 EFBDHN CCOCCCNCc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000272447886 266268384 /nfs/dbraw/zinc/26/83/84/266268384.db2.gz PEWYKOUXQMSMEV-UHFFFAOYSA-N 0 3 348.346 2.764 20 5 EFBDHN COc1cc(CN[C@H]2CCSC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000272492402 266281743 /nfs/dbraw/zinc/28/17/43/266281743.db2.gz UOWRUGPBRKVBHB-JTQLQIEISA-N 0 3 348.371 2.842 20 5 EFBDHN COC(=O)C1=C(C)O[C@@H](CN[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000272609271 266326786 /nfs/dbraw/zinc/32/67/86/266326786.db2.gz WMHCZTDUADXZCN-BXUZGUMPSA-N 0 3 334.372 2.790 20 5 EFBDHN CCCCCN(CCCOC)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000272642958 266337263 /nfs/dbraw/zinc/33/72/63/266337263.db2.gz XUYLDHHLVNJQCV-UHFFFAOYSA-N 0 3 337.420 2.722 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000272649967 266339924 /nfs/dbraw/zinc/33/99/24/266339924.db2.gz DWQAZMQVZXXUOV-CYBMUJFWSA-N 0 3 332.404 2.984 20 5 EFBDHN C[C@H](NC(=O)N[C@@H](C)C1=CCN(C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000272724899 266364846 /nfs/dbraw/zinc/36/48/46/266364846.db2.gz JQVSEYZPDWXTLL-STQMWFEESA-N 0 3 332.404 2.605 20 5 EFBDHN CCCCC[C@H](C)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000272911473 266412256 /nfs/dbraw/zinc/41/22/56/266412256.db2.gz GQQACBZEYVIFOB-ZDUSSCGKSA-N 0 3 328.434 2.927 20 5 EFBDHN O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1CN1CCCCC1 ZINC000105199319 273004029 /nfs/dbraw/zinc/00/40/29/273004029.db2.gz VYYZFJARZZMTQY-QGZVFWFLSA-N 0 3 346.431 2.755 20 5 EFBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[C@@H](C(=O)NCC(F)(F)F)C1 ZINC000275141885 266758147 /nfs/dbraw/zinc/75/81/47/266758147.db2.gz VLXKHNFUHITFRM-WDEREUQCSA-N 0 3 345.321 2.656 20 5 EFBDHN CO[C@H]1CCCC[C@H]1NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000275209625 266766851 /nfs/dbraw/zinc/76/68/51/266766851.db2.gz JMCQISHHNZRVJI-KGLIPLIRSA-N 0 3 341.795 2.734 20 5 EFBDHN CN(C)C1(CNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCC1 ZINC000275836052 266883462 /nfs/dbraw/zinc/88/34/62/266883462.db2.gz GMCZCDXLNMLHDN-UHFFFAOYSA-N 0 3 345.321 2.828 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCC1(N(C)C)CCC1 ZINC000276034528 266913314 /nfs/dbraw/zinc/91/33/14/266913314.db2.gz RVLLRWNQWAGVOA-LBPRGKRZSA-N 0 3 337.445 2.676 20 5 EFBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])N[C@@H](C)C(=O)N(C)CC ZINC000276578812 267017250 /nfs/dbraw/zinc/01/72/50/267017250.db2.gz HVRDOHMLBKRGPR-STQMWFEESA-N 0 3 339.461 2.922 20 5 EFBDHN O=[N+]([O-])c1ccc(NC[C@@H]2CN(Cc3ccccc3)CCCO2)nc1 ZINC000277178232 267125114 /nfs/dbraw/zinc/12/51/14/267125114.db2.gz NINNSXIOJLVHEV-QGZVFWFLSA-N 0 3 342.399 2.693 20 5 EFBDHN O=[N+]([O-])c1ccc(NC[C@H]2CN(Cc3ccccc3)CCCO2)nc1 ZINC000277178230 267125148 /nfs/dbraw/zinc/12/51/48/267125148.db2.gz NINNSXIOJLVHEV-KRWDZBQOSA-N 0 3 342.399 2.693 20 5 EFBDHN COc1cc(C(=O)N2CC[C@@H](N3CCCCC3)C2)cc([N+](=O)[O-])c1C ZINC000277221401 267130956 /nfs/dbraw/zinc/13/09/56/267130956.db2.gz IBPNNXBUXFZIHU-OAHLLOKOSA-N 0 3 347.415 2.612 20 5 EFBDHN O=C(/C=C/c1ccccc1[N+](=O)[O-])NC[C@H]1CCCCN1C1CC1 ZINC000277584004 267203765 /nfs/dbraw/zinc/20/37/65/267203765.db2.gz RSFFZBOTEFPFDN-YCABEKBOSA-N 0 3 329.400 2.741 20 5 EFBDHN CCOc1cccc(NCCCN2CCCO[C@H](C)C2)c1[N+](=O)[O-] ZINC000277640481 267220152 /nfs/dbraw/zinc/22/01/52/267220152.db2.gz NNYCSDCYQSOZIN-CQSZACIVSA-N 0 3 337.420 2.906 20 5 EFBDHN CCOC1CC(O)(CNCc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000277731095 267246674 /nfs/dbraw/zinc/24/66/74/267246674.db2.gz ORARONKKORBZKP-UHFFFAOYSA-N 0 3 346.383 2.874 20 5 EFBDHN CCC[C@@]1(CO)CCCN1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000277795498 267265091 /nfs/dbraw/zinc/26/50/91/267265091.db2.gz OYTOHHKMEGWSQS-KRWDZBQOSA-N 0 3 346.387 2.772 20 5 EFBDHN CC(=O)c1ccc(NCCCN2CCCO[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000277854689 267280841 /nfs/dbraw/zinc/28/08/41/267280841.db2.gz CPJCCMQLMNSLMP-CYBMUJFWSA-N 0 3 335.404 2.710 20 5 EFBDHN O=C(NC[C@H]1CCCCN1C1CC1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000277947997 267306292 /nfs/dbraw/zinc/30/62/92/267306292.db2.gz OUHQOQSLFZRJGU-CQSZACIVSA-N 0 3 342.399 2.823 20 5 EFBDHN C[C@H](N[C@H]1CCCN(c2ccnn2C)C1)c1cccc([N+](=O)[O-])c1 ZINC000278537020 267473745 /nfs/dbraw/zinc/47/37/45/267473745.db2.gz URNMZADBGOOWSY-ZFWWWQNUSA-N 0 3 329.404 2.648 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])NCCNC(=O)C(C)C ZINC000271137550 273100961 /nfs/dbraw/zinc/10/09/61/273100961.db2.gz NNFDIDNRZNIAOM-CYBMUJFWSA-N 0 3 339.461 2.827 20 5 EFBDHN COc1ccc([C@H](CNc2ncc([N+](=O)[O-])cn2)N2CCCC2)cc1 ZINC000273637902 273115934 /nfs/dbraw/zinc/11/59/34/273115934.db2.gz RPOJMAZEIWPNIW-INIZCTEOSA-N 0 3 343.387 2.642 20 5 EFBDHN CCO[C@@H]1C[C@H](NC/C=C/c2ccccc2[N+](=O)[O-])[C@]12CCCO2 ZINC000273638698 273116053 /nfs/dbraw/zinc/11/60/53/273116053.db2.gz UFDQREVPNDGJAU-RMFFPGPSSA-N 0 3 332.400 2.924 20 5 EFBDHN CN(C)[C@@H]1CCCN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000273807847 273120218 /nfs/dbraw/zinc/12/02/18/273120218.db2.gz ABKUVPVOQRUPOI-CYBMUJFWSA-N 0 3 337.395 2.564 20 5 EFBDHN C[C@@H]1CC[C@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000274304994 273131220 /nfs/dbraw/zinc/13/12/20/273131220.db2.gz OTPKGHPEFNRMKB-MCIONIFRSA-N 0 3 340.445 2.783 20 5 EFBDHN C[C@H](N[C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])c1ncnn1C ZINC000276737422 273142018 /nfs/dbraw/zinc/14/20/18/273142018.db2.gz YZLHPTBASAFHNO-GUTXKFCHSA-N 0 3 329.404 2.785 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21 ZINC000279915389 273268713 /nfs/dbraw/zinc/26/87/13/273268713.db2.gz FDKZXRSKFGDQSZ-KGLIPLIRSA-N 0 3 347.415 2.550 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21 ZINC000279915396 273268739 /nfs/dbraw/zinc/26/87/39/273268739.db2.gz FDKZXRSKFGDQSZ-ZIAGYGMSSA-N 0 3 347.415 2.550 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@H]2CN(C)CC[C@H]21 ZINC000279915393 273268746 /nfs/dbraw/zinc/26/87/46/273268746.db2.gz FDKZXRSKFGDQSZ-UONOGXRCSA-N 0 3 347.415 2.550 20 5 EFBDHN C[C@@]1(C(N)=O)CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000280109506 273291755 /nfs/dbraw/zinc/29/17/55/273291755.db2.gz AZCOIJCKJHIAHL-QGZVFWFLSA-N 0 3 329.356 2.552 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CNC[C@@H](CO)[C@H]3CCOC3)o2)cc1 ZINC000280290970 273312061 /nfs/dbraw/zinc/31/20/61/273312061.db2.gz MQVBGOUOSKAQAV-GJZGRUSLSA-N 0 3 346.383 2.589 20 5 EFBDHN CN(CCOc1ccccc1[N+](=O)[O-])[C@@H](CC(N)=O)c1ccccc1 ZINC000280606763 273346223 /nfs/dbraw/zinc/34/62/23/273346223.db2.gz VQEZZRHGEUHFMI-INIZCTEOSA-N 0 3 343.383 2.522 20 5 EFBDHN COC(=O)C[C@@H]1CC[C@H](NCc2cc([N+](=O)[O-])ccc2OC)[C@H]1C ZINC000280769871 273364903 /nfs/dbraw/zinc/36/49/03/273364903.db2.gz FBCCCJJDSHGGRT-HUBLWGQQSA-N 0 3 336.388 2.671 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC1(CN(C)C)CCC1 ZINC000281168029 273407229 /nfs/dbraw/zinc/40/72/29/273407229.db2.gz XMELMOYWMOVANW-GFCCVEGCSA-N 0 3 337.445 2.676 20 5 EFBDHN CCC[C@H](NCC1(S(C)(=O)=O)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000281318410 273423124 /nfs/dbraw/zinc/42/31/24/273423124.db2.gz ZRLDYLTUGLLALU-HNNXBMFYSA-N 0 3 340.445 2.993 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(CCN(C)C)C(C)C ZINC000282104577 273514908 /nfs/dbraw/zinc/51/49/08/273514908.db2.gz ZNRUGMWLUGOKJS-UHFFFAOYSA-N 0 3 338.408 2.797 20 5 EFBDHN CC(C)c1ccc([C@@H](N)CNC(=O)c2c(N)cccc2[N+](=O)[O-])cc1 ZINC000422798783 273563541 /nfs/dbraw/zinc/56/35/41/273563541.db2.gz SUWOGODLCHNESW-HNNXBMFYSA-N 0 3 342.399 2.730 20 5 EFBDHN CN(C)CCN(C)C(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000097163474 273795317 /nfs/dbraw/zinc/79/53/17/273795317.db2.gz LFIMFPMOENONJK-UHFFFAOYSA-N 0 3 334.298 2.639 20 5 EFBDHN COc1ccc([C@H](CN(C)C)NC(=O)c2ccc([N+](=O)[O-])s2)cc1 ZINC000284108207 273798220 /nfs/dbraw/zinc/79/82/20/273798220.db2.gz CCXKBOFFJRDDNM-ZDUSSCGKSA-N 0 3 349.412 2.698 20 5 EFBDHN CC[C@H](NCCn1ccc([N+](=O)[O-])n1)c1ccc(OC)c(OC)c1 ZINC000285441086 274000161 /nfs/dbraw/zinc/00/01/61/274000161.db2.gz LITNIOWINOJXPT-ZDUSSCGKSA-N 0 3 334.376 2.549 20 5 EFBDHN COCCCN(C)CCN[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433241448 274019544 /nfs/dbraw/zinc/01/95/44/274019544.db2.gz OVTYCRGKWADETJ-QGZVFWFLSA-N 0 3 335.448 2.875 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)CN([C@@H](C)C1CC1)C1CC1 ZINC000031654272 274099744 /nfs/dbraw/zinc/09/97/44/274099744.db2.gz NLDPXCVYDDZPBT-NSHDSACASA-N 0 3 333.388 2.805 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CNC(=O)c1ccccc1CN(C)C ZINC000362644605 274118686 /nfs/dbraw/zinc/11/86/86/274118686.db2.gz TWUQSJJQXCJVMQ-UHFFFAOYSA-N 0 3 343.383 2.595 20 5 EFBDHN CC(=O)c1cc(NC2CCN(C[C@H]3CCOC3)CC2)ccc1[N+](=O)[O-] ZINC000286021306 274118950 /nfs/dbraw/zinc/11/89/50/274118950.db2.gz ANVQQNAYIHHVSK-CQSZACIVSA-N 0 3 347.415 2.710 20 5 EFBDHN CCn1nc(C)c([N+](=O)[O-])c1N(C)CCCN(C)Cc1ccco1 ZINC000286270386 274166188 /nfs/dbraw/zinc/16/61/88/274166188.db2.gz FOLCBFXNPBMOHM-UHFFFAOYSA-N 0 3 335.408 2.671 20 5 EFBDHN CS[C@@H]1CN(c2nccc3ccc([N+](=O)[O-])cc32)C[C@H]1N(C)C ZINC000413204820 274183457 /nfs/dbraw/zinc/18/34/57/274183457.db2.gz JMSWARIGVRQNKP-HUUCEWRRSA-N 0 3 332.429 2.625 20 5 EFBDHN CCCN(CCN1CCCCC1)C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000286393086 274191721 /nfs/dbraw/zinc/19/17/21/274191721.db2.gz YZAGURKTFWAOPQ-UHFFFAOYSA-N 0 3 334.420 2.515 20 5 EFBDHN CCCN(CCN1CCCCC1)C(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000286395912 274192237 /nfs/dbraw/zinc/19/22/37/274192237.db2.gz ZFTXNOJNUMRVJB-UHFFFAOYSA-N 0 3 349.431 2.942 20 5 EFBDHN O=[N+]([O-])c1cc(F)c(CN2CC[C@@H](N3CCCCC3)C2)c(F)c1 ZINC000286409514 274194989 /nfs/dbraw/zinc/19/49/89/274194989.db2.gz LTWFXLITMAUFMY-GFCCVEGCSA-N 0 3 325.359 2.933 20 5 EFBDHN CN(Cc1ccc(Br)c([N+](=O)[O-])c1)[C@@H]1CCC[C@H]1O ZINC000286661975 274245790 /nfs/dbraw/zinc/24/57/90/274245790.db2.gz UQGHLURHEJTPMR-DGCLKSJQSA-N 0 3 329.194 2.703 20 5 EFBDHN C[C@@H]1CCCN(CCNC(=O)N(C)CCc2ccccc2[N+](=O)[O-])C1 ZINC000286671992 274247786 /nfs/dbraw/zinc/24/77/86/274247786.db2.gz PMCUIQXPNBVJLT-OAHLLOKOSA-N 0 3 348.447 2.511 20 5 EFBDHN CS[C@H]1CN(c2ccc([N+](=O)[O-])cc2C(C)=O)C[C@@H]1N1CCCC1 ZINC000286904900 274297442 /nfs/dbraw/zinc/29/74/42/274297442.db2.gz PGSZNLGYXMXQEO-IRXDYDNUSA-N 0 3 349.456 2.813 20 5 EFBDHN CN(C)C[C@H](NC(=O)Nc1ccncc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000287291558 274386794 /nfs/dbraw/zinc/38/67/94/274386794.db2.gz ZQFBTSPUUONFKJ-AWEZNQCLSA-N 0 3 347.350 2.553 20 5 EFBDHN C[C@@H]1C[C@@H](Nc2ncc(Br)cc2[N+](=O)[O-])CCN1C ZINC000161674045 274395097 /nfs/dbraw/zinc/39/50/97/274395097.db2.gz OUWQLAXZSYIRBD-SCZZXKLOSA-N 0 3 329.198 2.647 20 5 EFBDHN CC(=O)c1cc([N+](=O)[O-])ccc1NC1CCN(C[C@H]2CCOC2)CC1 ZINC000287332716 274396727 /nfs/dbraw/zinc/39/67/27/274396727.db2.gz OKMRJPZVIJUYTL-CQSZACIVSA-N 0 3 347.415 2.710 20 5 EFBDHN C[C@@H]1C[C@H](C)CCN(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000443641853 274398266 /nfs/dbraw/zinc/39/82/66/274398266.db2.gz MOPUIDIMPCYNDH-ZIAGYGMSSA-N 0 3 331.416 2.852 20 5 EFBDHN CC(C)(CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)OCCO ZINC000288447471 274595230 /nfs/dbraw/zinc/59/52/30/274595230.db2.gz MPDQJJRMBGMOIR-UHFFFAOYSA-N 0 3 334.372 2.732 20 5 EFBDHN CCn1c(C)nc([N+](=O)[O-])c1N(CCN(C)C)Cc1ccccc1 ZINC000288564529 274619183 /nfs/dbraw/zinc/61/91/83/274619183.db2.gz DLHDHHSTABFRPS-UHFFFAOYSA-N 0 3 331.420 2.688 20 5 EFBDHN COc1cc(CNCC[C@@H](O)c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000289389669 274752310 /nfs/dbraw/zinc/75/23/10/274752310.db2.gz DTAPHTSVWAFDMP-MRXNPFEDSA-N 0 3 346.383 2.825 20 5 EFBDHN C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000289588428 274787130 /nfs/dbraw/zinc/78/71/30/274787130.db2.gz IFORYXVDERPTIE-YPMHNXCESA-N 0 3 337.807 2.947 20 5 EFBDHN O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCN2CCC[C@H]2C1 ZINC000266314910 275012273 /nfs/dbraw/zinc/01/22/73/275012273.db2.gz GXCFVPPTTWSRKY-NSHDSACASA-N 0 3 343.305 2.534 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CN(CCO)[C@H]2CCc3ccccc32)c1 ZINC000154414262 275039563 /nfs/dbraw/zinc/03/95/63/275039563.db2.gz JBNBWSFGILUZOV-OALUTQOASA-N 0 3 342.395 2.610 20 5 EFBDHN O=[N+]([O-])c1cccnc1N1C[C@H]2CN(Cc3ccccc3)CC[C@@H]2C1 ZINC000368592789 275040329 /nfs/dbraw/zinc/04/03/29/275040329.db2.gz MKPYGIUUPANEER-IAGOWNOFSA-N 0 3 338.411 2.948 20 5 EFBDHN CCN(CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)C1CCCC1 ZINC000052908651 276085707 /nfs/dbraw/zinc/08/57/07/276085707.db2.gz YUMXBCMQQKZLDJ-UHFFFAOYSA-N 0 3 335.360 2.527 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@H](C)C(=O)NC(C)C ZINC000414332880 276573636 /nfs/dbraw/zinc/57/36/36/276573636.db2.gz FFJFYGYALSZVFK-CHWSQXEVSA-N 0 3 339.461 2.968 20 5 EFBDHN COC(=O)[C@@H]1CCN(c2cc(C)nc3ccc([N+](=O)[O-])cc32)[C@H]1C ZINC000344981181 277355019 /nfs/dbraw/zinc/35/50/19/277355019.db2.gz HMMOTPZQXHEYLI-WCQYABFASA-N 0 3 329.356 2.839 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)N(C)C(C)(C)CN1CCCC1 ZINC000416093114 277431612 /nfs/dbraw/zinc/43/16/12/277431612.db2.gz JGQTYHWYWGBZEA-UHFFFAOYSA-N 0 3 335.404 2.550 20 5 EFBDHN COc1cc(CN[C@H]([C@H](CO)C2CC2)C2CC2)c([N+](=O)[O-])cc1F ZINC000451610347 277819634 /nfs/dbraw/zinc/81/96/34/277819634.db2.gz KFPVIPBJHLWMMM-DYVFJYSZSA-N 0 3 338.379 2.629 20 5 EFBDHN C[C@@H]1[C@@H](C)N(Cc2ccc(Br)cc2[N+](=O)[O-])CCN1C ZINC000425454860 278079151 /nfs/dbraw/zinc/07/91/51/278079151.db2.gz GYANVPRAJZIJHH-GHMZBOCLSA-N 0 3 342.237 2.882 20 5 EFBDHN CSC1(CNC(=O)Nc2cccc([N+](=O)[O-])c2)CCN(C)CC1 ZINC000352416571 278124904 /nfs/dbraw/zinc/12/49/04/278124904.db2.gz UZJWOTBPUGAVDU-UHFFFAOYSA-N 0 3 338.433 2.544 20 5 EFBDHN CC(C)(C(=O)N1CC[C@@H](N2CCCCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000265748090 278265956 /nfs/dbraw/zinc/26/59/56/278265956.db2.gz DHTDAJWSYGTGGW-QGZVFWFLSA-N 0 3 345.443 2.959 20 5 EFBDHN C[C@@H]1CN(CC2CCN(c3ccccc3[N+](=O)[O-])CC2)C[C@@H](C)O1 ZINC000263766788 278744422 /nfs/dbraw/zinc/74/44/22/278744422.db2.gz RSTLWVMPPBCQJR-HUUCEWRRSA-N 0 3 333.432 2.920 20 5 EFBDHN C[C@@H]1C[C@@H](N2CCCC2)CN1c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000343593038 278901074 /nfs/dbraw/zinc/90/10/74/278901074.db2.gz PBIMYMXOJCPLJT-IUODEOHRSA-N 0 3 343.387 2.708 20 5 EFBDHN C[C@H]1CN(CC2CCN(c3ccccc3[N+](=O)[O-])CC2)C[C@H](C)O1 ZINC000263766787 279853843 /nfs/dbraw/zinc/85/38/43/279853843.db2.gz RSTLWVMPPBCQJR-GJZGRUSLSA-N 0 3 333.432 2.920 20 5 EFBDHN CCOc1cccc([C@@H](C)NCCn2cc([N+](=O)[O-])ccc2=O)c1 ZINC000180672248 279974445 /nfs/dbraw/zinc/97/44/45/279974445.db2.gz MXMPNSHXLRQFNP-CYBMUJFWSA-N 0 3 331.372 2.506 20 5 EFBDHN Cc1c(NC(=O)N2CCCC23CCN(C)CC3)cccc1[N+](=O)[O-] ZINC000372436382 280242640 /nfs/dbraw/zinc/24/26/40/280242640.db2.gz SHONHDOXTUSIHL-UHFFFAOYSA-N 0 3 332.404 2.995 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)CN2C[C@H](C)C[C@H](C)C2)c1 ZINC000173229549 281008309 /nfs/dbraw/zinc/00/83/09/281008309.db2.gz INDFQVPJDAXFED-ZNMIVQPWSA-N 0 3 333.432 2.999 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCN(C[C@@H]2CCOC2)CC1 ZINC000182829706 281019470 /nfs/dbraw/zinc/01/94/70/281019470.db2.gz TZDOOWGPGFXGSR-CVEARBPZSA-N 0 3 333.432 2.618 20 5 EFBDHN Cc1ccccc1[C@@H]([C@@H](C)NC(=O)c1ccc([N+](=O)[O-])o1)N(C)C ZINC000344270201 281360657 /nfs/dbraw/zinc/36/06/57/281360657.db2.gz MWIHFZIUFASCKB-MLGOLLRUSA-N 0 3 331.372 2.917 20 5 EFBDHN C[C@@H](CNC(=O)NCc1ccccc1[N+](=O)[O-])N1CCC(C)CC1 ZINC000065478693 292683951 /nfs/dbraw/zinc/68/39/51/292683951.db2.gz IOBCXVRVOLEUGG-AWEZNQCLSA-N 0 3 334.420 2.514 20 5 EFBDHN CN(C)CCN(Cc1ccccc1)C(=O)c1ccc([N+](=O)[O-])cc1F ZINC000068310840 292702288 /nfs/dbraw/zinc/70/22/88/292702288.db2.gz UOEGJPXSEBOVAP-UHFFFAOYSA-N 0 3 345.374 2.938 20 5 EFBDHN CC(C)CN(CCN(C)C)C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000080045801 292797570 /nfs/dbraw/zinc/79/75/70/292797570.db2.gz JBAXEOFVWXCSFV-CQSZACIVSA-N 0 3 336.436 2.885 20 5 EFBDHN CNC(=O)c1ccc(CNC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000080346966 292802732 /nfs/dbraw/zinc/80/27/32/292802732.db2.gz KXVNQCUZUIZQKY-UHFFFAOYSA-N 0 3 327.384 2.979 20 5 EFBDHN O=[N+]([O-])c1cccc(Cl)c1CN1CCN(C2CCOCC2)CC1 ZINC000119276447 292904272 /nfs/dbraw/zinc/90/42/72/292904272.db2.gz ZHCQZEGSHZBBEC-UHFFFAOYSA-N 0 3 339.823 2.545 20 5 EFBDHN CCN1CCC[C@@H]1CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000126597610 293044565 /nfs/dbraw/zinc/04/45/65/293044565.db2.gz VFSVMCVVMFTBNX-LLVKDONJSA-N 0 3 326.784 2.854 20 5 EFBDHN CN1CCC[C@H](CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000130236972 293158339 /nfs/dbraw/zinc/15/83/39/293158339.db2.gz RSNFOHVYOVLCDA-SNVBAGLBSA-N 0 3 345.321 2.685 20 5 EFBDHN CCCNC(=O)C1(NCCOc2ccc([N+](=O)[O-])cc2)CCCCC1 ZINC000132311254 293223842 /nfs/dbraw/zinc/22/38/42/293223842.db2.gz KWADLMJMGSCKAB-UHFFFAOYSA-N 0 3 349.431 2.792 20 5 EFBDHN CCOc1ccc([C@H](C)NCCOC[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000153812454 293395542 /nfs/dbraw/zinc/39/55/42/293395542.db2.gz XFTLMROWVFFUBW-DZGCQCFKSA-N 0 3 338.404 2.840 20 5 EFBDHN COc1cc(CN2CCC[C@@]2(C)CCCO)c([N+](=O)[O-])cc1OC ZINC000290301540 294050831 /nfs/dbraw/zinc/05/08/31/294050831.db2.gz BJYKVXRETSKWHK-KRWDZBQOSA-N 0 3 338.404 2.739 20 5 EFBDHN CN(C)C[C@@H](NC(=O)Cc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000290429153 294084368 /nfs/dbraw/zinc/08/43/68/294084368.db2.gz KAQRDZWUGOPBKI-MRXNPFEDSA-N 0 3 345.374 2.696 20 5 EFBDHN CNC(=O)C(C)(C)CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000290550892 294117566 /nfs/dbraw/zinc/11/75/66/294117566.db2.gz AUMQOOZCKJRIFL-UHFFFAOYSA-N 0 3 334.203 2.763 20 5 EFBDHN CN(C)C[C@H](NC(=O)c1ccc([N+](=O)[O-])s1)c1ccc(F)cc1 ZINC000290681824 294156004 /nfs/dbraw/zinc/15/60/04/294156004.db2.gz VNSHLCUWTNFBFH-LBPRGKRZSA-N 0 3 337.376 2.828 20 5 EFBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCCCN1CCOCC1 ZINC000290814813 294193239 /nfs/dbraw/zinc/19/32/39/294193239.db2.gz GMJWYTNGFKEZOP-UHFFFAOYSA-N 0 3 348.230 2.714 20 5 EFBDHN C[C@@H]1C[C@@H](Nc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CN1C1CC1 ZINC000290871274 294208089 /nfs/dbraw/zinc/20/80/89/294208089.db2.gz ZSTQVZSJAGDHPD-BXUZGUMPSA-N 0 3 344.415 2.524 20 5 EFBDHN Cn1cc(CCNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])cn1 ZINC000290954751 294230047 /nfs/dbraw/zinc/23/00/47/294230047.db2.gz VNZFAJDIGHFORF-UHFFFAOYSA-N 0 3 329.187 2.967 20 5 EFBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCCC1(O)CCOCC1 ZINC000291448893 294383888 /nfs/dbraw/zinc/38/38/88/294383888.db2.gz CHYZHOGDNZTBML-UHFFFAOYSA-N 0 3 349.214 2.923 20 5 EFBDHN C[C@@H](NCCN(C)C(=O)OC(C)(C)C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000293620176 295012602 /nfs/dbraw/zinc/01/26/02/295012602.db2.gz HADMFFKIMJCPDP-LLVKDONJSA-N 0 3 338.408 2.695 20 5 EFBDHN C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2F)CCN(C2CCC2)C1 ZINC000293639687 295016763 /nfs/dbraw/zinc/01/67/63/295016763.db2.gz HFQRINKSZWZEIO-GFCCVEGCSA-N 0 3 335.379 2.680 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)N2CCN(C3CCC3)C[C@@H](C)C2)c1 ZINC000293700858 295030736 /nfs/dbraw/zinc/03/07/36/295030736.db2.gz NGRRSUDYRMPVRG-CQSZACIVSA-N 0 3 331.416 2.850 20 5 EFBDHN Cc1cccc(C(=O)NCCN[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000293842792 295062077 /nfs/dbraw/zinc/06/20/77/295062077.db2.gz SYKXQNDMFYIBMP-CYBMUJFWSA-N 0 3 342.399 2.566 20 5 EFBDHN Cc1cccc(OC[C@@H](O)CN[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000293913852 295078186 /nfs/dbraw/zinc/07/81/86/295078186.db2.gz WZYSZGBQVDXBNC-ZFWWWQNUSA-N 0 3 345.399 2.576 20 5 EFBDHN CCc1ccc(C(=O)N2CC[C@]3(C2)CCCN(C)C3)cc1[N+](=O)[O-] ZINC000294257512 295136376 /nfs/dbraw/zinc/13/63/76/295136376.db2.gz SWXANUCEXXZAIW-GOSISDBHSA-N 0 3 331.416 2.715 20 5 EFBDHN Cc1cc(Cl)c(C(=O)NC[C@@H](C)N(C)C2CC2)cc1[N+](=O)[O-] ZINC000294816229 295232477 /nfs/dbraw/zinc/23/24/77/295232477.db2.gz GJTZDJPVMIYEIP-SNVBAGLBSA-N 0 3 325.796 2.769 20 5 EFBDHN Cc1cc(N2CC[C@H](OC(=O)N(C)C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000294882089 295240739 /nfs/dbraw/zinc/24/07/39/295240739.db2.gz FHJUUVNRSFRKKN-ZDUSSCGKSA-N 0 3 344.371 2.728 20 5 EFBDHN Cc1nc(N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)ncc1[N+](=O)[O-] ZINC000294939236 295248439 /nfs/dbraw/zinc/24/84/39/295248439.db2.gz JOKLWZUOESBHAP-WFASDCNBSA-N 0 3 327.388 2.626 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)CCC(C)(C)[N+](=O)[O-])CN1Cc1ccccc1 ZINC000295121767 295270855 /nfs/dbraw/zinc/27/08/55/295270855.db2.gz MKZFNYVNOQSRTG-GOEBONIOSA-N 0 3 333.432 2.601 20 5 EFBDHN Cc1cc(Cl)c(C(=O)N[C@@H]2CN(C3CC3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000295136983 295273141 /nfs/dbraw/zinc/27/31/41/295273141.db2.gz OCUPNOZFXMRLOO-IINYFYTJSA-N 0 3 337.807 2.769 20 5 EFBDHN CCC1(NCC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)CCCC1 ZINC000295138854 295273178 /nfs/dbraw/zinc/27/31/78/295273178.db2.gz BXUMMBWGFRWMFP-UHFFFAOYSA-N 0 3 335.360 2.574 20 5 EFBDHN CCC[C@H](CNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)OC ZINC000295173294 295278154 /nfs/dbraw/zinc/27/81/54/295278154.db2.gz UQQYKMHXEGUURL-MRXNPFEDSA-N 0 3 332.404 2.900 20 5 EFBDHN CCOC(=O)c1cc(CNCCc2cccc([N+](=O)[O-])c2)[nH]c1C ZINC000295386803 295311204 /nfs/dbraw/zinc/31/12/04/295311204.db2.gz KXVCJPDOEVJKPL-UHFFFAOYSA-N 0 3 331.372 2.740 20 5 EFBDHN CC(C)(C[C@H]1CCCN(CCOc2cccc([N+](=O)[O-])c2)C1)C(N)=O ZINC000295412083 295315573 /nfs/dbraw/zinc/31/55/73/295315573.db2.gz BZCMMWQNTRLQDE-CQSZACIVSA-N 0 3 349.431 2.587 20 5 EFBDHN C[C@@H]1[C@H](NC(=O)CCC(C)(C)[N+](=O)[O-])CCN1Cc1ccccc1 ZINC000295412758 295316167 /nfs/dbraw/zinc/31/61/67/295316167.db2.gz UMFHQMSLIOQXIW-GDBMZVCRSA-N 0 3 333.432 2.601 20 5 EFBDHN C[C@H]1CN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CCN(C2CC2)C1 ZINC000295513450 295333493 /nfs/dbraw/zinc/33/34/93/295333493.db2.gz HTLGTTVXBMJUSD-VIIAAUOXSA-N 0 3 329.400 2.551 20 5 EFBDHN C[C@H]1CN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CCN(C2CC2)C1 ZINC000295697803 295362470 /nfs/dbraw/zinc/36/24/70/295362470.db2.gz NVTYYPBNMFDSRQ-CEOUIICOSA-N 0 3 329.400 2.551 20 5 EFBDHN C[C@H]1[C@@H](N2CCCC2)CCN1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000295762723 295372177 /nfs/dbraw/zinc/37/21/77/295372177.db2.gz PFKSWTXONFZDOJ-FZMZJTMJSA-N 0 3 337.807 2.947 20 5 EFBDHN C[C@H](c1ccc(N)c([N+](=O)[O-])c1)N1CCC[C@@H](CC(C)(C)C(N)=O)C1 ZINC000295836781 295383384 /nfs/dbraw/zinc/38/33/84/295383384.db2.gz AGANHCALYUOJTP-OLZOCXBDSA-N 0 3 348.447 2.852 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C\CN[C@H](C1CC1)[C@@]1(CO)CCCO1 ZINC000354720722 304807257 /nfs/dbraw/zinc/80/72/57/304807257.db2.gz PATFTTHRZKYALK-UCJZHXCISA-N 0 3 332.400 2.518 20 5 EFBDHN CSc1ccc(C(=O)N2CCCC[C@@H]2CN(C)C)cc1[N+](=O)[O-] ZINC000171510907 310748559 /nfs/dbraw/zinc/74/85/59/310748559.db2.gz QHKPTSOBPOZKRP-CYBMUJFWSA-N 0 3 337.445 2.873 20 5 EFBDHN CN(C)CCOc1ccc(CNC(=O)c2ccc([N+](=O)[O-])s2)cc1 ZINC000298765534 311021497 /nfs/dbraw/zinc/02/14/97/311021497.db2.gz NOQFOUSKMNLAKU-UHFFFAOYSA-N 0 3 349.412 2.527 20 5 EFBDHN O=C(NC[C@H](c1cccs1)N1CCCC1)c1ccc([N+](=O)[O-])[nH]1 ZINC000298886811 311031894 /nfs/dbraw/zinc/03/18/94/311031894.db2.gz SFZRUYLMNULGEO-GFCCVEGCSA-N 0 3 334.401 2.551 20 5 EFBDHN O=C(NC[C@H](c1cccs1)[NH+]1CCCC1)c1ccc([N+](=O)[O-])[n-]1 ZINC000298886811 311031895 /nfs/dbraw/zinc/03/18/95/311031895.db2.gz SFZRUYLMNULGEO-GFCCVEGCSA-N 0 3 334.401 2.551 20 5 EFBDHN Cc1ccc(CNC[C@@H](CO)Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000299170819 311058552 /nfs/dbraw/zinc/05/85/52/311058552.db2.gz RTTXXAMIJIGGNY-INIZCTEOSA-N 0 3 332.375 2.983 20 5 EFBDHN Cc1ccc(CNC[C@H](CO)Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000299170821 311058738 /nfs/dbraw/zinc/05/87/38/311058738.db2.gz RTTXXAMIJIGGNY-MRXNPFEDSA-N 0 3 332.375 2.983 20 5 EFBDHN C[C@H](CN1CCCCC1)NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000299274419 311068335 /nfs/dbraw/zinc/06/83/35/311068335.db2.gz KFEQEEVHEZBGRB-GFCCVEGCSA-N 0 3 330.388 2.680 20 5 EFBDHN C[C@@H](CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)N1CCC(C)CC1 ZINC000299306258 311071022 /nfs/dbraw/zinc/07/10/22/311071022.db2.gz ANZACPFDZCTIOZ-ZDUSSCGKSA-N 0 3 344.415 2.926 20 5 EFBDHN C[C@H](CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)N1CCC(C)CC1 ZINC000299306256 311071063 /nfs/dbraw/zinc/07/10/63/311071063.db2.gz ANZACPFDZCTIOZ-CYBMUJFWSA-N 0 3 344.415 2.926 20 5 EFBDHN CN(C)CCN(C(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000299407222 311081916 /nfs/dbraw/zinc/08/19/16/311081916.db2.gz PIGQVOJBFSYFJP-UHFFFAOYSA-N 0 3 327.384 2.732 20 5 EFBDHN Cc1ccc([C@H](CNc2ncc([N+](=O)[O-])c(N)n2)N2CCCC2)cc1 ZINC000301100071 311119023 /nfs/dbraw/zinc/11/90/23/311119023.db2.gz KCTAOKKPWNCIRN-AWEZNQCLSA-N 0 3 342.403 2.524 20 5 EFBDHN O=[N+]([O-])c1ccc(NC2CCN([C@@H]3CCOC3)CC2)c2ccncc21 ZINC000301719985 311154698 /nfs/dbraw/zinc/15/46/98/311154698.db2.gz MDQNDYUOWDIAGT-CQSZACIVSA-N 0 3 342.399 2.808 20 5 EFBDHN O=[N+]([O-])c1ccc(NC2CCN([C@H]3CCOC3)CC2)c(Cl)c1 ZINC000301742153 311155868 /nfs/dbraw/zinc/15/58/68/311155868.db2.gz YMHZHHKJEFBSLY-ZDUSSCGKSA-N 0 3 325.796 2.913 20 5 EFBDHN O=[N+]([O-])c1cc(F)ccc1NCc1ccccc1CN1CC[C@H](O)C1 ZINC000302059314 311175432 /nfs/dbraw/zinc/17/54/32/311175432.db2.gz SCWFSKJBXXCUOV-INIZCTEOSA-N 0 3 345.374 2.913 20 5 EFBDHN CN(C[C@]1(O)CCN(Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000302406790 311189325 /nfs/dbraw/zinc/18/93/25/311189325.db2.gz GANBHAQUBLNDSH-LJQANCHMSA-N 0 3 341.411 2.668 20 5 EFBDHN C[C@@H]1CN(CCCCNc2c3c(ccc2[N+](=O)[O-])NCC3)C[C@H](C)O1 ZINC000302458938 311190532 /nfs/dbraw/zinc/19/05/32/311190532.db2.gz QYQVNRNOQZNEFQ-OKILXGFUSA-N 0 3 348.447 2.864 20 5 EFBDHN Cc1cccc(NC[C@H]2C[C@@H](O)CN2Cc2ccccc2)c1[N+](=O)[O-] ZINC000302494361 311191537 /nfs/dbraw/zinc/19/15/37/311191537.db2.gz LIEJVJRHJPDBSP-IAGOWNOFSA-N 0 3 341.411 2.951 20 5 EFBDHN C[C@H](c1cc2ccccc2o1)N(C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000304358609 311212157 /nfs/dbraw/zinc/21/21/57/311212157.db2.gz SVPSJYGSDGEEKR-IUODEOHRSA-N 0 3 344.371 2.591 20 5 EFBDHN CCN1CCC(N(C)C(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000315902243 311234870 /nfs/dbraw/zinc/23/48/70/311234870.db2.gz DCSGSZGFXYHSEY-UHFFFAOYSA-N 0 3 325.796 2.805 20 5 EFBDHN CCc1cccc(OC[C@H](O)CNCc2cccc([N+](=O)[O-])c2C)c1 ZINC000327880270 311245283 /nfs/dbraw/zinc/24/52/83/311245283.db2.gz SQPHOKOXLXAEEA-QGZVFWFLSA-N 0 3 344.411 2.995 20 5 EFBDHN CCN1C[C@@H](C)N(CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C[C@@H]1C ZINC000330559383 311321953 /nfs/dbraw/zinc/32/19/53/311321953.db2.gz IGCDXVODJZSDHL-LSDHHAIUSA-N 0 3 348.447 2.646 20 5 EFBDHN CCN1C[C@H](C)N(CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C[C@@H]1C ZINC000330578817 311322654 /nfs/dbraw/zinc/32/26/54/311322654.db2.gz PIRULCIGHMDPFV-GJZGRUSLSA-N 0 3 348.447 2.646 20 5 EFBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H](c2ccnc(N)n2)C1 ZINC000331495643 311382953 /nfs/dbraw/zinc/38/29/53/311382953.db2.gz GSJWFBPMPXFYND-STQMWFEESA-N 0 3 327.388 2.738 20 5 EFBDHN CN1CCC(C(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000331614575 311397125 /nfs/dbraw/zinc/39/71/25/311397125.db2.gz WODPFYHMNCAXBG-INIZCTEOSA-N 0 3 331.416 2.643 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1C[C@@H](N2CCCC2)C[C@@H]1C ZINC000332083668 311452591 /nfs/dbraw/zinc/45/25/91/311452591.db2.gz PBAZGGIMQLZDIG-GJZGRUSLSA-N 0 3 331.416 2.910 20 5 EFBDHN CC(C)C1CCC(N2CCN(Cc3c([N+](=O)[O-])ncn3C)CC2)CC1 ZINC000332411650 311500625 /nfs/dbraw/zinc/50/06/25/311500625.db2.gz HXFSNKJHLICXBX-UHFFFAOYSA-N 0 3 349.479 2.661 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](N[C@H]1CCN(CC(F)F)C1)CCC2 ZINC000417394625 312217641 /nfs/dbraw/zinc/21/76/41/312217641.db2.gz VNYWWLKTYLQYJD-WFASDCNBSA-N 0 3 325.359 2.901 20 5 EFBDHN C[C@H](NC(=O)NCc1ccc2c(c1)CNC2)c1ccc([N+](=O)[O-])cc1 ZINC000418237760 312352310 /nfs/dbraw/zinc/35/23/10/312352310.db2.gz WNJVRCUQUQGLKC-LBPRGKRZSA-N 0 3 340.383 2.758 20 5 EFBDHN C[C@@H](CNc1c(C(N)=O)cccc1[N+](=O)[O-])N(C)Cc1ccccc1 ZINC000420606143 312375333 /nfs/dbraw/zinc/37/53/33/312375333.db2.gz WRBAXLOJMGQVLO-ZDUSSCGKSA-N 0 3 342.399 2.626 20 5 EFBDHN CN(C[C@@H]1CCCN1C)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000420795391 312391917 /nfs/dbraw/zinc/39/19/17/312391917.db2.gz LUPUGYCVAFUJIS-KRWDZBQOSA-N 0 3 348.447 2.653 20 5 EFBDHN CCc1ccccc1[C@@H](N)CNC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000423969854 312491587 /nfs/dbraw/zinc/49/15/87/312491587.db2.gz FGFOYFYWAHTLMH-INIZCTEOSA-N 0 3 327.384 2.516 20 5 EFBDHN CN(C)CCc1ccccc1NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000438571734 312620468 /nfs/dbraw/zinc/62/04/68/312620468.db2.gz MOWBSBSTSDIEIU-UHFFFAOYSA-N 0 3 328.372 2.533 20 5 EFBDHN CNC(=O)c1ccc(N[C@@H](CC(C)C)CN2CCCC2)c([N+](=O)[O-])c1 ZINC000450595310 312717249 /nfs/dbraw/zinc/71/72/49/312717249.db2.gz MEUFTLYKDDRHEJ-HNNXBMFYSA-N 0 3 348.447 2.877 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC(NC(=O)C2CC2)CC1 ZINC000470172183 313129040 /nfs/dbraw/zinc/12/90/40/313129040.db2.gz SRQNBKJSNQOVTN-KAMYIIQDSA-N 0 3 343.427 2.989 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC(NC(=O)C2CC2)CC1 ZINC000470172184 313129222 /nfs/dbraw/zinc/12/92/22/313129222.db2.gz SRQNBKJSNQOVTN-SDNWHVSQSA-N 0 3 343.427 2.989 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCN(CC(C)(C)O)[C@@H](C)C1 ZINC000470211304 313130114 /nfs/dbraw/zinc/13/01/14/313130114.db2.gz HJEPYSBFBLLSOU-KMPOOHAWSA-N 0 3 347.459 2.775 20 5 EFBDHN CCCCN1CCCC[C@H]1CNC(=O)c1cccc([N+](=O)[O-])c1OC ZINC000475452171 313222855 /nfs/dbraw/zinc/22/28/55/313222855.db2.gz IOGIAZLUSQQKPJ-AWEZNQCLSA-N 0 3 349.431 2.988 20 5 EFBDHN CCCCN1CCCC[C@@H]1CNC(=O)c1cccc([N+](=O)[O-])c1OC ZINC000475452172 313223173 /nfs/dbraw/zinc/22/31/73/313223173.db2.gz IOGIAZLUSQQKPJ-CQSZACIVSA-N 0 3 349.431 2.988 20 5 EFBDHN CCOc1cc(NC[C@@]2(N(C)C)CCSC2)ccc1[N+](=O)[O-] ZINC000486976945 313354868 /nfs/dbraw/zinc/35/48/68/313354868.db2.gz ZUMDFYCVNNRCKW-HNNXBMFYSA-N 0 3 325.434 2.843 20 5 EFBDHN CN(CC[C@H]1CCCCN1C)c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000486985260 313355265 /nfs/dbraw/zinc/35/52/65/313355265.db2.gz VCJXFAFHWNAZIH-CQSZACIVSA-N 0 3 345.403 2.955 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CNCc1ccc(C)n(C)c1=O ZINC000487183781 313373952 /nfs/dbraw/zinc/37/39/52/313373952.db2.gz XAPKSZCTUHJQBM-LCYFTJDESA-N 0 3 327.384 2.795 20 5 EFBDHN CC[C@H]1CN(CCNCc2ccc(C(C)C)c([N+](=O)[O-])c2)CCO1 ZINC000487190900 313374732 /nfs/dbraw/zinc/37/47/32/313374732.db2.gz RLQZKOLGLGLVSV-INIZCTEOSA-N 0 3 335.448 2.919 20 5 EFBDHN CN(C)C1(CN(C)C(=O)/C=C/c2ccc(F)cc2[N+](=O)[O-])CCC1 ZINC000491956580 313822709 /nfs/dbraw/zinc/82/27/09/313822709.db2.gz BFBFXWRZIJKQSM-SOFGYWHQSA-N 0 3 335.379 2.690 20 5 EFBDHN CN1CCC2(CCCN2C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)CC1 ZINC000492261045 313927529 /nfs/dbraw/zinc/92/75/29/313927529.db2.gz DGSUUZBLVSFURF-YVMONPNESA-N 0 3 329.400 2.695 20 5 EFBDHN C[C@H]1CN(C(=O)/C=C\c2cccc([N+](=O)[O-])c2)CCN(C2CCC2)C1 ZINC000492803912 314132456 /nfs/dbraw/zinc/13/24/56/314132456.db2.gz WASZIXUZIDILLL-WHLNPGIBSA-N 0 3 343.427 2.941 20 5 EFBDHN C[C@@H]1C[C@H]1N1CCN(C(=O)/C=C\c2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000492922253 314178326 /nfs/dbraw/zinc/17/83/26/314178326.db2.gz MXXFZJISGOHCRB-TXSJAIKKSA-N 0 3 343.427 2.797 20 5 EFBDHN O=C(/C=C\c1ccccc1[N+](=O)[O-])NC[C@@H]1CCCCN1C1CC1 ZINC000492987240 314202225 /nfs/dbraw/zinc/20/22/25/314202225.db2.gz RSFFZBOTEFPFDN-CLOOOTJHSA-N 0 3 329.400 2.741 20 5 EFBDHN CC[C@@H](NC(=O)N1CCN(C)CC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000493046048 314222097 /nfs/dbraw/zinc/22/20/97/314222097.db2.gz DBLVTFSQKHBCFP-CZUORRHYSA-N 0 3 334.420 2.782 20 5 EFBDHN CN1CCC[C@@]2(CCN(C(=O)/C=C\c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000493170121 314264960 /nfs/dbraw/zinc/26/49/60/314264960.db2.gz XEIKCOPDEYEYAA-GNJLHFKMSA-N 0 3 329.400 2.552 20 5 EFBDHN CN(C[C@@H]1CCCN1C)C(=O)/C=C\c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000493456713 314363844 /nfs/dbraw/zinc/36/38/44/314363844.db2.gz SPUOXTIGODHKBC-WOLRVDTOSA-N 0 3 337.807 2.814 20 5 EFBDHN CN(C[C@@H]1CCCN1C)C(=O)/C=C/c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000493456707 314363893 /nfs/dbraw/zinc/36/38/93/314363893.db2.gz SPUOXTIGODHKBC-CFNZNRNTSA-N 0 3 337.807 2.814 20 5 EFBDHN CN1CCC[C@@]2(CCN(C(=O)/C=C\c3cccc([N+](=O)[O-])c3)C2)C1 ZINC000493487201 314374031 /nfs/dbraw/zinc/37/40/31/314374031.db2.gz MHTFAJDYZSOVMU-HPFMTEOYSA-N 0 3 329.400 2.552 20 5 EFBDHN CSC1(CNC(=O)/C=C\c2cccc([N+](=O)[O-])c2)CCN(C)CC1 ZINC000493559621 314400622 /nfs/dbraw/zinc/40/06/22/314400622.db2.gz WMAYHRGFCFIILO-SREVYHEPSA-N 0 3 349.456 2.552 20 5 EFBDHN CN(C)C/C=C/C(=O)N[C@H](c1cccc([N+](=O)[O-])c1F)C(F)(F)F ZINC000493759964 314470304 /nfs/dbraw/zinc/47/03/04/314470304.db2.gz RYABGMHBVHYHMB-WXJAXGNASA-N 0 3 349.284 2.571 20 5 EFBDHN CC[C@@H]1CN(CCN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CCO1 ZINC000494459335 314591209 /nfs/dbraw/zinc/59/12/09/314591209.db2.gz XHNRJDPZJYMKRE-SJLPKXTDSA-N 0 3 333.432 2.673 20 5 EFBDHN COC(=O)N1CCC[C@@H]([C@@H](C)NCc2ccc([N+](=O)[O-])cc2F)C1 ZINC000495567056 314759054 /nfs/dbraw/zinc/75/90/54/314759054.db2.gz SKVTUXPVYSELOY-DGCLKSJQSA-N 0 3 339.367 2.690 20 5 EFBDHN CC[C@]1(C(C)C)C[C@@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000516276848 315669131 /nfs/dbraw/zinc/66/91/31/315669131.db2.gz OCUPQCUHTNCSBM-JKSUJKDBSA-N 0 3 340.445 2.783 20 5 EFBDHN O=C1CCCN1CCNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000521447149 316024922 /nfs/dbraw/zinc/02/49/22/316024922.db2.gz UWJKDEUKJWJXJZ-UHFFFAOYSA-N 0 3 329.356 2.567 20 5 EFBDHN CC[C@@H]1CCCCN1CCNC(=O)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000522203295 316079845 /nfs/dbraw/zinc/07/98/45/316079845.db2.gz KGZDGBFGHBNBDQ-OAHLLOKOSA-N 0 3 349.431 2.527 20 5 EFBDHN O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CC[C@@H](N2CCCC2)C1 ZINC000524040666 316145280 /nfs/dbraw/zinc/14/52/80/316145280.db2.gz OJJONJQJXHOPCD-CQSZACIVSA-N 0 3 329.356 2.651 20 5 EFBDHN C[C@H]1CCN(C)CCN1C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000525354194 316211593 /nfs/dbraw/zinc/21/15/93/316211593.db2.gz DXMABBMMSMPTHX-HNNXBMFYSA-N 0 3 348.447 2.653 20 5 EFBDHN Cc1c([C@@H](C)NC[C@H](O)COc2ccccc2)cccc1[N+](=O)[O-] ZINC000532453081 317403421 /nfs/dbraw/zinc/40/34/21/317403421.db2.gz URAMVSZFTFFMCN-CABCVRRESA-N 0 3 330.384 2.994 20 5 EFBDHN C[C@@H](CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCCC1 ZINC000533478398 317507065 /nfs/dbraw/zinc/50/70/65/317507065.db2.gz MPVVDTLDZRLVFG-JTQLQIEISA-N 0 3 345.321 2.828 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CNC1CCC(O)(C(F)(F)F)CC1 ZINC000541566268 317780986 /nfs/dbraw/zinc/78/09/86/317780986.db2.gz JJTCZRZHKHGBJI-UHFFFAOYSA-N 0 3 348.321 2.929 20 5 EFBDHN CCc1ccc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)s1 ZINC000549193493 318168384 /nfs/dbraw/zinc/16/83/84/318168384.db2.gz KFRJQIGEOBNIBX-ZDUSSCGKSA-N 0 3 336.413 2.748 20 5 EFBDHN CNc1ccc(C(=O)N2CCN(C3CCC3)C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000553526365 318286299 /nfs/dbraw/zinc/28/62/99/318286299.db2.gz TZHHSQIVKDIXGL-CYBMUJFWSA-N 0 3 346.431 2.583 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2cc3ccccc3o2)c1 ZINC000558752140 318490895 /nfs/dbraw/zinc/49/08/95/318490895.db2.gz DEDAFQJUGSDIKM-OAHLLOKOSA-N 0 3 342.351 2.871 20 5 EFBDHN CCC1(CC)[C@H](NCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](C)[C@H]1OC ZINC000561466920 318604260 /nfs/dbraw/zinc/60/42/60/318604260.db2.gz ARIBFBNELKLXTK-CSMYWGQOSA-N 0 3 349.431 2.963 20 5 EFBDHN C[C@H](C(=O)N1CC[C@H](N2CCCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000562300325 318632442 /nfs/dbraw/zinc/63/24/42/318632442.db2.gz KFEWPJKDSSJQKI-YOEHRIQHSA-N 0 3 331.416 2.785 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@@H]2CCc3ccc(F)cc32)c1 ZINC000564792528 318891970 /nfs/dbraw/zinc/89/19/70/318891970.db2.gz JTGNEGZWEVFIJS-MAUKXSAKSA-N 0 3 346.358 2.751 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CNC[C@@H](O)CCc1ccccc1 ZINC000565828651 319006288 /nfs/dbraw/zinc/00/62/88/319006288.db2.gz XXRNVZWECPXGNZ-KRWDZBQOSA-N 0 3 330.384 2.687 20 5 EFBDHN CCC1(CNCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CCCC1 ZINC000566114135 319034652 /nfs/dbraw/zinc/03/46/52/319034652.db2.gz ATASQGVRXRAFKM-UHFFFAOYSA-N 0 3 340.445 2.929 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN[C@@H]1CSc2ccccc21 ZINC000566116010 319034919 /nfs/dbraw/zinc/03/49/19/319034919.db2.gz MXBSKAXMMMVRAX-GXTWGEPZSA-N 0 3 346.408 2.771 20 5 EFBDHN CN(C)c1ccc(CN[C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cn1 ZINC000568589255 319296764 /nfs/dbraw/zinc/29/67/64/319296764.db2.gz CLCNOMZDWUXESN-CABCVRRESA-N 0 3 344.419 2.526 20 5 EFBDHN CN(C)c1ccc(CN[C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cn1 ZINC000568589259 319297189 /nfs/dbraw/zinc/29/71/89/319297189.db2.gz CLCNOMZDWUXESN-GJZGRUSLSA-N 0 3 344.419 2.526 20 5 EFBDHN Cc1ccc(CNCCC(=O)Nc2ccccc2[N+](=O)[O-])nc1C ZINC000569568912 319392717 /nfs/dbraw/zinc/39/27/17/319392717.db2.gz RXOBIEXRNXQSOB-UHFFFAOYSA-N 0 3 328.372 2.725 20 5 EFBDHN Cc1cccc(OC[C@@H](O)CN[C@@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000577963418 320160695 /nfs/dbraw/zinc/16/06/95/320160695.db2.gz ZCIPBBRCQFIIEN-KBXCAEBGSA-N 0 3 342.395 2.920 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CN[C@@H]1C[C@H]1c1ccc(F)cc1 ZINC000578741248 320234480 /nfs/dbraw/zinc/23/44/80/320234480.db2.gz NFECMDIENCURHY-OWCLPIDISA-N 0 3 346.358 2.619 20 5 EFBDHN CC[C@H](NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CCCO1 ZINC000182367237 323279637 /nfs/dbraw/zinc/27/96/37/323279637.db2.gz JBXSDEGMBBMWMN-SMDDNHRTSA-N 0 3 341.795 2.734 20 5 EFBDHN CC[C@H](NC[C@@H](O)COc1cccc([N+](=O)[O-])c1)c1c(C)noc1C ZINC000182389000 323280115 /nfs/dbraw/zinc/28/01/15/323280115.db2.gz XFZBJPNIIGWTDD-ZBFHGGJFSA-N 0 3 349.387 2.680 20 5 EFBDHN CC[C@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)c1c(C)noc1C ZINC000182388963 323280196 /nfs/dbraw/zinc/28/01/96/323280196.db2.gz XFZBJPNIIGWTDD-HOCLYGCPSA-N 0 3 349.387 2.680 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000192902273 323483433 /nfs/dbraw/zinc/48/34/33/323483433.db2.gz QWLRJUZCTPAKMX-MRXNPFEDSA-N 0 3 327.384 2.936 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CN[C@@H]1C[C@H]1c1ccccc1F ZINC000580554014 324187254 /nfs/dbraw/zinc/18/72/54/324187254.db2.gz LXZZHFBWILEAJF-IVMMDQJWSA-N 0 3 346.358 2.619 20 5 EFBDHN CCn1nc(C)c(CNCCC(=O)Nc2ccccc2[N+](=O)[O-])c1C ZINC000581186216 324322378 /nfs/dbraw/zinc/32/23/78/324322378.db2.gz NISZTZYXWCNZSR-UHFFFAOYSA-N 0 3 345.403 2.546 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2NCCc1cn2c(n1)SCC2 ZINC000583574553 324835628 /nfs/dbraw/zinc/83/56/28/324835628.db2.gz CGZVUMNYFQIPMC-CQSZACIVSA-N 0 3 330.413 2.717 20 5 EFBDHN CC(C)(C)CNC(=O)C(C)(C)NCCOc1ccccc1[N+](=O)[O-] ZINC000155445526 472551179 /nfs/dbraw/zinc/55/11/79/472551179.db2.gz GVLOSGXBDZRHFN-UHFFFAOYSA-N 0 3 337.420 2.504 20 5 EFBDHN CCN(CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1ccccn1 ZINC000161188650 473216234 /nfs/dbraw/zinc/21/62/34/473216234.db2.gz VLTIXTOJLMUWRE-UHFFFAOYSA-N 0 3 328.372 2.841 20 5 EFBDHN O=[N+]([O-])c1ccc(CN2CCC[C@@H](c3nnc4n3CCC4)C2)cc1 ZINC000161399722 473232497 /nfs/dbraw/zinc/23/24/97/473232497.db2.gz XFTFDYJPUUXYFH-CQSZACIVSA-N 0 3 327.388 2.512 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)NCC(C)(C)N2CCCCC2)c1 ZINC000141236240 473252640 /nfs/dbraw/zinc/25/26/40/473252640.db2.gz YIFKXNGJYUGEBL-UHFFFAOYSA-N 0 3 335.404 2.598 20 5 EFBDHN CCCCN(C)CCNC(=O)c1ccc(SC)c([N+](=O)[O-])c1 ZINC000112310888 473254595 /nfs/dbraw/zinc/25/45/95/473254595.db2.gz UFHYGAPWPVRFQV-UHFFFAOYSA-N 0 3 325.434 2.778 20 5 EFBDHN CN(C)CCN(Cc1cccs1)C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000124538026 473258668 /nfs/dbraw/zinc/25/86/68/473258668.db2.gz CZXMVGODZSZHEH-UHFFFAOYSA-N 0 3 349.416 2.647 20 5 EFBDHN CCn1ccnc1[C@H]1OCCC[C@@H]1NCc1ccc([N+](=O)[O-])cc1 ZINC000190427756 473270603 /nfs/dbraw/zinc/27/06/03/473270603.db2.gz IAVKOZWHDDXGOK-HOTGVXAUSA-N 0 3 330.388 2.821 20 5 EFBDHN CN1CCN(CCCCNc2nccc3c2cccc3[N+](=O)[O-])CC1 ZINC000518689674 468123276 /nfs/dbraw/zinc/12/32/76/468123276.db2.gz RUKHZWFPKXEWTI-UHFFFAOYSA-N 0 3 343.431 2.583 20 5 EFBDHN CSc1ccc(C(=O)N[C@@H]2C[C@H](C)N(C3CC3)C2)cc1[N+](=O)[O-] ZINC000177134514 473313704 /nfs/dbraw/zinc/31/37/04/473313704.db2.gz OWEORFDEALYLPJ-CMPLNLGQSA-N 0 3 335.429 2.672 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CN1C1CC1 ZINC000177186477 473327195 /nfs/dbraw/zinc/32/71/95/473327195.db2.gz LXQZNFCZYIJVNF-SMDDNHRTSA-N 0 3 344.415 2.524 20 5 EFBDHN C[C@H](C(=O)N1C[C@H]2CCCN2C[C@H]1C)c1ccc([N+](=O)[O-])cc1F ZINC000185243343 473374383 /nfs/dbraw/zinc/37/43/83/473374383.db2.gz PWYYVGRQRBJEBX-MBNYWOFBSA-N 0 3 335.379 2.533 20 5 EFBDHN O=[N+]([O-])c1ccc2ncnc(NC[C@@H]3CCCCN3C3CC3)c2c1 ZINC000617976655 469862703 /nfs/dbraw/zinc/86/27/03/469862703.db2.gz ISGVHRIRCQQFLD-AWEZNQCLSA-N 0 3 327.388 2.967 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@H](N2CCCC2)C1 ZINC000171448064 473391459 /nfs/dbraw/zinc/39/14/59/473391459.db2.gz PVFRZGKALOVDPS-DZGCQCFKSA-N 0 3 349.456 2.772 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C\CN1CCC[C@@H](CN2CCOCC2)C1 ZINC000619727051 479867804 /nfs/dbraw/zinc/86/78/04/479867804.db2.gz BQJGZBZXJNBOMS-DANOYGIBSA-N 0 3 345.443 2.652 20 5 EFBDHN CN1CCC[C@H](CNC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC000583184666 478784263 /nfs/dbraw/zinc/78/42/63/478784263.db2.gz DOTRPXIUBICWDB-SNVBAGLBSA-N 0 3 345.321 2.685 20 5 EFBDHN CN(CCN1CCCCC1)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000593882956 479495828 /nfs/dbraw/zinc/49/58/28/479495828.db2.gz LWCAXYUCGURMJO-UHFFFAOYSA-N 0 3 346.431 2.727 20 5 EFBDHN O=[N+]([O-])c1ccn(C2CCN(CCc3noc4ccccc43)CC2)n1 ZINC000593981870 479531511 /nfs/dbraw/zinc/53/15/11/479531511.db2.gz WCYNEAUSFFQIKM-UHFFFAOYSA-N 0 3 341.371 2.812 20 5 EFBDHN O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1NC[C@@H](O)C(F)(F)F ZINC000616362978 479889277 /nfs/dbraw/zinc/88/92/77/479889277.db2.gz MROCXCDJZRNSQM-MPKXVKKWSA-N 0 3 332.322 2.819 20 5 EFBDHN C[C@@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000006603054 471554081 /nfs/dbraw/zinc/55/40/81/471554081.db2.gz XFEQPLYOXMIRKI-WBMJQRKESA-N 0 3 334.347 2.824 20 5 EFBDHN CNc1ccc(C(=O)NCc2ccc(CN(C)C)cc2)cc1[N+](=O)[O-] ZINC000006983526 471582083 /nfs/dbraw/zinc/58/20/83/471582083.db2.gz JSKLXLFHCCUGGC-UHFFFAOYSA-N 0 3 342.399 2.628 20 5 EFBDHN CN(CCCNC(=O)c1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000009982000 471724981 /nfs/dbraw/zinc/72/49/81/471724981.db2.gz OEKBVXFYAXLGKN-UHFFFAOYSA-N 0 3 327.384 2.847 20 5 EFBDHN COc1ccc(C(=O)NC[C@H](c2ccccc2)N(C)C)cc1[N+](=O)[O-] ZINC000010442640 471736041 /nfs/dbraw/zinc/73/60/41/471736041.db2.gz LABJGTIDQZMSRV-MRXNPFEDSA-N 0 3 343.383 2.636 20 5 EFBDHN Cc1ccc(C(=O)NCc2ccc(CN(C)C)cc2)cc1[N+](=O)[O-] ZINC000015140602 471891421 /nfs/dbraw/zinc/89/14/21/471891421.db2.gz WOFHWQRGPMLALV-UHFFFAOYSA-N 0 3 327.384 2.895 20 5 EFBDHN CC[C@H](CN1CCCC1)NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000609833655 480211442 /nfs/dbraw/zinc/21/14/42/480211442.db2.gz RMHGYFIHDXRXMJ-LLVKDONJSA-N 0 3 325.796 2.852 20 5 EFBDHN CN(C)[C@@H](CNC(=O)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000016599424 471942543 /nfs/dbraw/zinc/94/25/43/471942543.db2.gz OJNSMUKOUHGJPS-KRWDZBQOSA-N 0 3 327.384 2.556 20 5 EFBDHN O=C(NC[C@@H]1CCCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])o1 ZINC000067361833 472023712 /nfs/dbraw/zinc/02/37/12/472023712.db2.gz JPIVJNJDTMVBCA-HNNXBMFYSA-N 0 3 343.383 2.830 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](C)N2CCCC[C@H]2C)c1 ZINC000067548481 472047564 /nfs/dbraw/zinc/04/75/64/472047564.db2.gz HWNQKGPQORXBMW-OLZOCXBDSA-N 0 3 335.404 2.596 20 5 EFBDHN CN(C)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1F)Cc1ccccc1 ZINC000054059737 472055399 /nfs/dbraw/zinc/05/53/99/472055399.db2.gz QZQKLJCRZIYIPX-OAHLLOKOSA-N 0 3 345.374 2.637 20 5 EFBDHN COc1ccc(C(=O)NCC(C)(C)N2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000054286925 472073254 /nfs/dbraw/zinc/07/32/54/472073254.db2.gz BFSGMJBTTIOTDF-ZDUSSCGKSA-N 0 3 349.431 2.844 20 5 EFBDHN C[C@H](C1CC1)N(CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C1CC1 ZINC000042123587 472116280 /nfs/dbraw/zinc/11/62/80/472116280.db2.gz DQYDBPBKIXMRJF-GFCCVEGCSA-N 0 3 329.400 2.747 20 5 EFBDHN Cc1cccc(C)c1OC[C@H](O)CNCc1cccc([N+](=O)[O-])c1 ZINC000067977085 472118294 /nfs/dbraw/zinc/11/82/94/472118294.db2.gz JKWHNXCRHYJZHT-QGZVFWFLSA-N 0 3 330.384 2.741 20 5 EFBDHN C[C@@H]1CCC[C@@H](N(C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000026476344 472138390 /nfs/dbraw/zinc/13/83/90/472138390.db2.gz WXMJDZFVWGJXIG-UKRRQHHQSA-N 0 3 331.416 2.994 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1CN1CCCCC1 ZINC000068132616 472139274 /nfs/dbraw/zinc/13/92/74/472139274.db2.gz CNFXWWMVPQXMIL-INIZCTEOSA-N 0 3 331.416 2.994 20 5 EFBDHN O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1CN1CCCCC1 ZINC000068134788 472140691 /nfs/dbraw/zinc/14/06/91/472140691.db2.gz MWQJVOCKUCUZSW-QGZVFWFLSA-N 0 3 331.416 2.614 20 5 EFBDHN Cc1c(NC(=O)[C@@H](C)N2CCN(CC(C)C)CC2)cccc1[N+](=O)[O-] ZINC000042507823 472140996 /nfs/dbraw/zinc/14/09/96/472140996.db2.gz SUDQXJPKGGOYMW-OAHLLOKOSA-N 0 3 348.447 2.504 20 5 EFBDHN CCN1CCC(N(C)C(=O)CSc2ccc([N+](=O)[O-])cc2)CC1 ZINC000075604577 472165715 /nfs/dbraw/zinc/16/57/15/472165715.db2.gz UXRDAABQTJUWAN-UHFFFAOYSA-N 0 3 337.445 2.630 20 5 EFBDHN CCN1CCC(N(C)C(=O)CCCNc2ccc([N+](=O)[O-])cc2)CC1 ZINC000075604467 472166248 /nfs/dbraw/zinc/16/62/48/472166248.db2.gz GYSLPFSFEOSHNJ-UHFFFAOYSA-N 0 3 348.447 2.730 20 5 EFBDHN O=C(N[C@@H](CN1CCCCC1)c1ccccc1)c1cc([N+](=O)[O-])c[nH]1 ZINC000075630887 472172649 /nfs/dbraw/zinc/17/26/49/472172649.db2.gz ZAJGPGJGHPERDC-KRWDZBQOSA-N 0 3 342.399 2.880 20 5 EFBDHN C[C@H](CN1CCC[C@@H](C)C1)NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000055405419 472182198 /nfs/dbraw/zinc/18/21/98/472182198.db2.gz BUOQVRGWQBAWGY-CHWSQXEVSA-N 0 3 344.415 2.926 20 5 EFBDHN Cc1c(NC(=O)N2CCN(c3ccncc3)CC2)cccc1[N+](=O)[O-] ZINC000043347741 472226659 /nfs/dbraw/zinc/22/66/59/472226659.db2.gz YMJSHAGSWCDETO-UHFFFAOYSA-N 0 3 341.371 2.652 20 5 EFBDHN O=[N+]([O-])c1cc(CN2CCN(C3CCCC3)CC2)c2c(c1)COCO2 ZINC000028966706 472245473 /nfs/dbraw/zinc/24/54/73/472245473.db2.gz JSFPQYDCBOQEQY-UHFFFAOYSA-N 0 3 347.415 2.522 20 5 EFBDHN CC(C)N1CCCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000068799867 472245428 /nfs/dbraw/zinc/24/54/28/472245428.db2.gz BHMLPLWCIBNQDZ-UHFFFAOYSA-N 0 3 325.796 2.805 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)NCCCCN2C[C@H](C)O[C@@H](C)C2)c1 ZINC000085456933 472248487 /nfs/dbraw/zinc/24/84/87/472248487.db2.gz AXEPLDQBQKUWFD-GJZGRUSLSA-N 0 3 349.431 2.522 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)NCCCCN2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000085456931 472248532 /nfs/dbraw/zinc/24/85/32/472248532.db2.gz AXEPLDQBQKUWFD-GASCZTMLSA-N 0 3 349.431 2.522 20 5 EFBDHN CCOC(=O)[C@@H]1CCCN(CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000055897502 472252824 /nfs/dbraw/zinc/25/28/24/472252824.db2.gz TYWRZTDXPLECSM-CQSZACIVSA-N 0 3 336.388 2.639 20 5 EFBDHN CN(C)[C@@H](CNC(=O)CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000086987112 472295884 /nfs/dbraw/zinc/29/58/84/472295884.db2.gz XIXAPVCRRMLQNI-SFHVURJKSA-N 0 3 341.411 2.947 20 5 EFBDHN CCOc1ccc(C(=O)N[C@@H](C)CN2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000056240550 472297147 /nfs/dbraw/zinc/29/71/47/472297147.db2.gz FEOFPUIWRHJYDZ-KBPBESRZSA-N 0 3 349.431 2.844 20 5 EFBDHN C[C@@H](CN1CCCCC1)NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000087133891 472309142 /nfs/dbraw/zinc/30/91/42/472309142.db2.gz VQTAKAPQCUYNEB-AWEZNQCLSA-N 0 3 346.431 2.537 20 5 EFBDHN CN(C)CCN(Cc1ccco1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000088564003 472373995 /nfs/dbraw/zinc/37/39/95/472373995.db2.gz BQBVQLRYHMIYPH-UHFFFAOYSA-N 0 3 332.360 2.784 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCCN(C(C)C)CC1 ZINC000069611460 472379710 /nfs/dbraw/zinc/37/97/10/472379710.db2.gz IMKNHKUIBPCQGW-UHFFFAOYSA-N 0 3 336.392 2.551 20 5 EFBDHN CN(C)CCN1CCC(Nc2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000076686059 472384936 /nfs/dbraw/zinc/38/49/36/472384936.db2.gz SWBHUWWIAAWSJB-UHFFFAOYSA-N 0 3 343.431 2.581 20 5 EFBDHN CN(C)Cc1cccc(CNC(=O)NCc2ccccc2[N+](=O)[O-])c1 ZINC000045622598 472435360 /nfs/dbraw/zinc/43/53/60/472435360.db2.gz LKPGJTZXWJXUPJ-UHFFFAOYSA-N 0 3 342.399 2.656 20 5 EFBDHN C[C@H](Cn1cc(Br)cn1)NCc1ccc([N+](=O)[O-])cc1 ZINC000089513322 472451986 /nfs/dbraw/zinc/45/19/86/472451986.db2.gz DFRJBIOQRLZBCP-SNVBAGLBSA-N 0 3 339.193 2.732 20 5 EFBDHN CNc1ccc(C(=O)NC[C@@H](C)N2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000032730643 472459174 /nfs/dbraw/zinc/45/91/74/472459174.db2.gz JCOWBRAXYZPMKJ-QWHCGFSZSA-N 0 3 334.420 2.629 20 5 EFBDHN O=[N+]([O-])c1ccc(NC2CCN([C@H]3CCOC3)CC2)c2ncccc12 ZINC000089602950 472468116 /nfs/dbraw/zinc/46/81/16/472468116.db2.gz SAQQIJNEHJVHRU-AWEZNQCLSA-N 0 3 342.399 2.808 20 5 EFBDHN CN(C)CCNc1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000032803828 472469028 /nfs/dbraw/zinc/46/90/28/472469028.db2.gz WOKMKGPMAOIPPX-UHFFFAOYSA-N 0 3 339.193 2.879 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC[C@H]1C[C@@H](O)CN1Cc1ccccc1 ZINC000089643955 472476524 /nfs/dbraw/zinc/47/65/24/472476524.db2.gz QOEUEVYLKMTLPS-QZTJIDSGSA-N 0 3 341.411 2.951 20 5 EFBDHN O=[N+]([O-])c1ccccc1NC[C@H]1C[C@@H](O)CN1Cc1ccccc1 ZINC000089644896 472478021 /nfs/dbraw/zinc/47/80/21/472478021.db2.gz PRHDQUYDMNGAPB-HZPDHXFCSA-N 0 3 327.384 2.642 20 5 EFBDHN CN(CCCNC(=O)c1cc(F)ccc1[N+](=O)[O-])Cc1ccccc1 ZINC000077221069 472479204 /nfs/dbraw/zinc/47/92/04/472479204.db2.gz HYITYRSYQCHUJE-UHFFFAOYSA-N 0 3 345.374 2.986 20 5 EFBDHN O=[N+]([O-])c1ccc(NC[C@H](O)CN2CCc3ccccc3C2)c(F)c1 ZINC000032923421 472481497 /nfs/dbraw/zinc/48/14/97/472481497.db2.gz RPFBSKKWMUOBNC-INIZCTEOSA-N 0 3 345.374 2.565 20 5 EFBDHN Cc1ccc([C@H](C)NCc2cccc(OCC(N)=O)c2)cc1[N+](=O)[O-] ZINC000128836616 472501534 /nfs/dbraw/zinc/50/15/34/472501534.db2.gz FRMBRUYYBXTKGD-ZDUSSCGKSA-N 0 3 343.383 2.618 20 5 EFBDHN CCN1CCCN(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000089892508 472535927 /nfs/dbraw/zinc/53/59/27/472535927.db2.gz UQOZFNDYQWXQNQ-UHFFFAOYSA-N 0 3 330.388 2.777 20 5 EFBDHN CCOc1ccc(C(=O)NC[C@@H](C)N2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000046593532 472573815 /nfs/dbraw/zinc/57/38/15/472573815.db2.gz FDICAPGZAGUNRV-UONOGXRCSA-N 0 3 349.431 2.986 20 5 EFBDHN CC(C)N(CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)C1CCC1 ZINC000119770540 472580987 /nfs/dbraw/zinc/58/09/87/472580987.db2.gz RKTIGRGONOKENB-UHFFFAOYSA-N 0 3 335.360 2.525 20 5 EFBDHN CN(C)CCOc1ccc(NC(=O)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000046723207 472589502 /nfs/dbraw/zinc/58/95/02/472589502.db2.gz IPWHHTCXEBYPFJ-UHFFFAOYSA-N 0 3 343.383 2.716 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC1CCN(C2CC2)CC1 ZINC000119924606 472604262 /nfs/dbraw/zinc/60/42/62/472604262.db2.gz LDAAYHFPQYWJLJ-UHFFFAOYSA-N 0 3 332.404 2.960 20 5 EFBDHN CCN1CCN([C@H](C)CNc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000059389294 472626210 /nfs/dbraw/zinc/62/62/10/472626210.db2.gz YQBGKNDZKCSRPI-GFCCVEGCSA-N 0 3 326.828 2.686 20 5 EFBDHN CN(CCCCc1ccccc1)CCn1cc([N+](=O)[O-])ccc1=O ZINC000090517888 472629057 /nfs/dbraw/zinc/62/90/57/472629057.db2.gz OOCJLZZGARYWON-UHFFFAOYSA-N 0 3 329.400 2.711 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCN1CCCC[C@@H]1Cc1ccccc1 ZINC000090525171 472630033 /nfs/dbraw/zinc/63/00/33/472630033.db2.gz RXVMVBPTYZTORH-QGZVFWFLSA-N 0 3 341.411 2.854 20 5 EFBDHN O=C(CN(C1CC1)C1CCCC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000103466239 472636020 /nfs/dbraw/zinc/63/60/20/472636020.db2.gz WTWJLGPSFOFGPE-UHFFFAOYSA-N 0 3 329.400 2.891 20 5 EFBDHN Cc1c(NC(=O)[C@@H](C)N(C)CC2CCOCC2)cccc1[N+](=O)[O-] ZINC000155910319 472638192 /nfs/dbraw/zinc/63/81/92/472638192.db2.gz QKMZZWNPZWSTKI-CYBMUJFWSA-N 0 3 335.404 2.589 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CN2CC[C@@H](c3ccccc3)C2)c1 ZINC000120191263 472646692 /nfs/dbraw/zinc/64/66/92/472646692.db2.gz CVUHSFRLZYGVBV-AEFFLSMTSA-N 0 3 342.395 2.824 20 5 EFBDHN C[C@H](NCC1(CO)COC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000090644566 472647593 /nfs/dbraw/zinc/64/75/93/472647593.db2.gz GAWWJUKBUYDHLZ-LBPRGKRZSA-N 0 3 348.424 2.983 20 5 EFBDHN C[C@@H]1C[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])c3cccnc23)CCN1C ZINC000156036836 472657945 /nfs/dbraw/zinc/65/79/45/472657945.db2.gz SBIOYGJSWGXHGL-OLZOCXBDSA-N 0 3 342.399 2.698 20 5 EFBDHN CCOC(=O)N1CCC(NCc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000060774008 472677400 /nfs/dbraw/zinc/67/74/00/472677400.db2.gz FKMSICQBTDWOFO-UHFFFAOYSA-N 0 3 341.795 2.959 20 5 EFBDHN CCN(Cc1cccs1)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000061170978 472693284 /nfs/dbraw/zinc/69/32/84/472693284.db2.gz BDDVHXFAAXOPEL-AWEZNQCLSA-N 0 3 336.413 2.918 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCCN2CCCN(CC(F)F)CC2)cc1 ZINC000091082803 472699493 /nfs/dbraw/zinc/69/94/93/472699493.db2.gz GPNUZRXWXGZCJK-UHFFFAOYSA-N 0 3 343.374 2.637 20 5 EFBDHN CN(C)Cc1cccc(NC(=O)COc2ccccc2[N+](=O)[O-])c1 ZINC000047452650 472715748 /nfs/dbraw/zinc/71/57/48/472715748.db2.gz MHTPXXMRNGMLLM-UHFFFAOYSA-N 0 3 329.356 2.674 20 5 EFBDHN CC1CCC(N(C)CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)CC1 ZINC000061799161 472721620 /nfs/dbraw/zinc/72/16/20/472721620.db2.gz STGPGYJDMPLLHU-UHFFFAOYSA-N 0 3 349.387 2.773 20 5 EFBDHN CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)C1CCN(C)CC1 ZINC000072835826 472724328 /nfs/dbraw/zinc/72/43/28/472724328.db2.gz MXHVNLCALDHDQO-UHFFFAOYSA-N 0 3 325.796 2.548 20 5 EFBDHN CO[C@@]1(C)C[C@H](NCc2cc3c(cc2[N+](=O)[O-])OCCO3)C1(C)C ZINC000072926541 472741573 /nfs/dbraw/zinc/74/15/73/472741573.db2.gz PPNIIEZAFCCXQP-RDJZCZTQSA-N 0 3 336.388 2.659 20 5 EFBDHN CN(C)Cc1ccccc1CNC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000078615904 472743871 /nfs/dbraw/zinc/74/38/71/472743871.db2.gz WZACPUDZLCRHQW-UHFFFAOYSA-N 0 3 328.372 2.978 20 5 EFBDHN CN1CCO[C@H](CNCc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000105471249 472753395 /nfs/dbraw/zinc/75/33/95/472753395.db2.gz BFYZAIDQJPQBFZ-CYBMUJFWSA-N 0 3 347.440 2.744 20 5 EFBDHN O=C1CC[C@H](NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)CN1 ZINC000105481600 472753799 /nfs/dbraw/zinc/75/37/99/472753799.db2.gz OUMVSRQZISRQHD-NSHDSACASA-N 0 3 331.397 2.692 20 5 EFBDHN CN1CCO[C@@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000105471022 472754235 /nfs/dbraw/zinc/75/42/35/472754235.db2.gz HLRSBGVTVFBRAN-HNNXBMFYSA-N 0 3 347.440 2.744 20 5 EFBDHN CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1NC[C@H]1CCCN(C)C1 ZINC000091483095 472772596 /nfs/dbraw/zinc/77/25/96/472772596.db2.gz KGRLZVUAJFBLIN-LLVKDONJSA-N 0 3 339.367 2.664 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(NC[C@H]2CCCN(C)C2)cc1Cl ZINC000091482758 472772617 /nfs/dbraw/zinc/77/26/17/472772617.db2.gz ZZFYKOPDJPJXPT-SNVBAGLBSA-N 0 3 341.795 2.789 20 5 EFBDHN CCOC1CCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000091676409 472792225 /nfs/dbraw/zinc/79/22/25/472792225.db2.gz MKFGHUYXHNIAPW-UHFFFAOYSA-N 0 3 344.415 2.996 20 5 EFBDHN COc1cc(CN[C@@H](C)CO)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000121176676 472812117 /nfs/dbraw/zinc/81/21/17/472812117.db2.gz UWAZZVXBOZRIIU-ZDUSSCGKSA-N 0 3 346.383 2.653 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CCC(OCc3ccc(F)cc3)CC2)c1 ZINC000091869235 472820507 /nfs/dbraw/zinc/82/05/07/472820507.db2.gz HXSTUVQDBZFIIX-UHFFFAOYSA-N 0 3 348.378 2.612 20 5 EFBDHN CC(C)[C@H](C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)N(C)C ZINC000133895070 472852448 /nfs/dbraw/zinc/85/24/48/472852448.db2.gz SXKIMOHOLLIZAY-QGZVFWFLSA-N 0 3 349.431 2.551 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000134196519 472884389 /nfs/dbraw/zinc/88/43/89/472884389.db2.gz DPNJJJFAIIYYMK-HNNXBMFYSA-N 0 3 344.415 2.609 20 5 EFBDHN C[C@H](CNC(=O)NCCc1ccccc1[N+](=O)[O-])N1CCC(C)CC1 ZINC000073897737 472897305 /nfs/dbraw/zinc/89/73/05/472897305.db2.gz KOBJRXMLRWFOPH-OAHLLOKOSA-N 0 3 348.447 2.557 20 5 EFBDHN CN(CCOc1ccc([N+](=O)[O-])cc1)Cc1ccc2c(c1)OCCO2 ZINC000065208778 472907703 /nfs/dbraw/zinc/90/77/03/472907703.db2.gz SJQOXKLHNRIRNG-UHFFFAOYSA-N 0 3 344.367 2.877 20 5 EFBDHN CCN1CCC(N(C)C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CC1 ZINC000134771525 472964164 /nfs/dbraw/zinc/96/41/64/472964164.db2.gz ASTZYSQFQLWPGW-UHFFFAOYSA-N 0 3 325.796 2.805 20 5 EFBDHN CNC(=O)CCNCc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000074371875 472996842 /nfs/dbraw/zinc/99/68/42/472996842.db2.gz BWXOCXQZLWFRFG-UHFFFAOYSA-N 0 3 342.399 2.588 20 5 EFBDHN CN(C)CCN(C(=O)c1csc([N+](=O)[O-])c1)C1CCCCC1 ZINC000065746463 473005397 /nfs/dbraw/zinc/00/53/97/473005397.db2.gz CCGLRTBWVSLEHH-UHFFFAOYSA-N 0 3 325.434 2.993 20 5 EFBDHN CSc1ccc(C(=O)N[C@@H]2CCN(CC3CC3)C2)cc1[N+](=O)[O-] ZINC000108306911 473012715 /nfs/dbraw/zinc/01/27/15/473012715.db2.gz DODAYNCTTMJSHP-CYBMUJFWSA-N 0 3 335.429 2.531 20 5 EFBDHN CN(CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C(C1CC1)C1CC1 ZINC000050989087 473016237 /nfs/dbraw/zinc/01/62/37/473016237.db2.gz MFQZKVSYXUIFBP-UHFFFAOYSA-N 0 3 329.400 2.604 20 5 EFBDHN O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1CCN(CC2CC2)C1 ZINC000108432022 473026449 /nfs/dbraw/zinc/02/64/49/473026449.db2.gz LGDZFEOBMQJNFV-NSHDSACASA-N 0 3 338.795 2.854 20 5 EFBDHN CN(C)[C@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000122610825 473036237 /nfs/dbraw/zinc/03/62/37/473036237.db2.gz TVCJPDHDOWJFDI-QGZVFWFLSA-N 0 3 345.374 2.696 20 5 EFBDHN C[C@@H]1C[C@@H](N(C)C(=O)/C=C/c2ccc(F)cc2[N+](=O)[O-])CCN1C ZINC000123232865 473114174 /nfs/dbraw/zinc/11/41/74/473114174.db2.gz CSDZZNNSSDMMRR-VQOXYXNASA-N 0 3 335.379 2.688 20 5 EFBDHN CC(C)c1ccc(CN2CC[C@@H](CN3CCOCC3)C2)cc1[N+](=O)[O-] ZINC000093664729 473133205 /nfs/dbraw/zinc/13/32/05/473133205.db2.gz RALPDXPAVBRIRJ-KRWDZBQOSA-N 0 3 347.459 2.872 20 5 EFBDHN CC1CCN(CCNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)CC1 ZINC000123426818 473141526 /nfs/dbraw/zinc/14/15/26/473141526.db2.gz ZRJNOSVQBVHFTN-UHFFFAOYSA-N 0 3 342.399 2.605 20 5 EFBDHN CN(Cc1ccccc1)[C@H]1CCN(C(=O)c2ccccc2[N+](=O)[O-])C1 ZINC000081124987 473152094 /nfs/dbraw/zinc/15/20/94/473152094.db2.gz QOVLQMKGSXRRGP-INIZCTEOSA-N 0 3 339.395 2.941 20 5 EFBDHN CN(C)CCNC(=O)c1cccc(CNc2ccc([N+](=O)[O-])s2)c1 ZINC000066816367 473157513 /nfs/dbraw/zinc/15/75/13/473157513.db2.gz UDTHLTZOIGLSCL-UHFFFAOYSA-N 0 3 348.428 2.560 20 5 EFBDHN C[C@H]1C[C@H](Nc2ncc([N+](=O)[O-])cc2Br)CCN1C ZINC000094007924 473167291 /nfs/dbraw/zinc/16/72/91/473167291.db2.gz RQYRVQVSIAMTQP-DTWKUNHWSA-N 0 3 329.198 2.647 20 5 EFBDHN Cc1c(NC(=O)N2CCC(N3CC=CC3)CC2)cccc1[N+](=O)[O-] ZINC000136722046 473174290 /nfs/dbraw/zinc/17/42/90/473174290.db2.gz QHFDPDAFOVDISB-UHFFFAOYSA-N 0 3 330.388 2.771 20 5 EFBDHN CCc1nn(C)c(NC[C@@H](C)N(C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000094157766 473181845 /nfs/dbraw/zinc/18/18/45/473181845.db2.gz PRMRBIHGAAUZJQ-CYBMUJFWSA-N 0 3 331.420 2.823 20 5 EFBDHN CN(C)C[C@@H]1CCCCN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000066946672 473182733 /nfs/dbraw/zinc/18/27/33/473182733.db2.gz QJHNPYKBJZFNBH-ZDUSSCGKSA-N 0 3 330.388 2.632 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)c1ccc(SC)c([N+](=O)[O-])c1 ZINC000110997548 473189394 /nfs/dbraw/zinc/18/93/94/473189394.db2.gz XRYUVLZHKITPAC-CYBMUJFWSA-N 0 3 337.445 2.921 20 5 EFBDHN Cc1c(CC(=O)N2CCN(C3CCCC3)CC2)cccc1[N+](=O)[O-] ZINC000160983149 473196822 /nfs/dbraw/zinc/19/68/22/473196822.db2.gz HSBHZOLWVAQXLA-UHFFFAOYSA-N 0 3 331.416 2.533 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H](C(C)C)N1CCCCC1 ZINC000171455552 473392547 /nfs/dbraw/zinc/39/25/47/473392547.db2.gz JNDHYEVVFZGJIK-KRWDZBQOSA-N 0 3 349.431 2.730 20 5 EFBDHN CSc1ccc(C(=O)N2CCCC[C@H]2CN(C)C)cc1[N+](=O)[O-] ZINC000171510903 473400611 /nfs/dbraw/zinc/40/06/11/473400611.db2.gz QHKPTSOBPOZKRP-ZDUSSCGKSA-N 0 3 337.445 2.873 20 5 EFBDHN Cc1c(CC(=O)NC[C@@H](C)N2CCC(C)CC2)cccc1[N+](=O)[O-] ZINC000163379181 473440166 /nfs/dbraw/zinc/44/01/66/473440166.db2.gz MFHTZVYYXHGOKB-CQSZACIVSA-N 0 3 333.432 2.682 20 5 EFBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H](C)N(C)C1CC1 ZINC000171695748 473441383 /nfs/dbraw/zinc/44/13/83/473441383.db2.gz YZCVHKBRBAVTEV-CQSZACIVSA-N 0 3 348.447 2.998 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(CCN(C)C)C(C)C ZINC000185532117 473450033 /nfs/dbraw/zinc/45/00/33/473450033.db2.gz WOCSIBQYWIVPRM-MRXNPFEDSA-N 0 3 335.448 2.962 20 5 EFBDHN CCS(=O)(=O)CCCCCN[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000191046057 473464918 /nfs/dbraw/zinc/46/49/18/473464918.db2.gz ZSEOAOKYTZZXOY-ZDUSSCGKSA-N 0 3 328.434 2.850 20 5 EFBDHN COC(=O)COc1ccc([C@H](C)NCc2cccc([N+](=O)[O-])c2)cc1 ZINC000185650489 473478671 /nfs/dbraw/zinc/47/86/71/473478671.db2.gz XLECTSQNPUIZSB-ZDUSSCGKSA-N 0 3 344.367 2.997 20 5 EFBDHN O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCC[C@@H](N2CCCC2)C1 ZINC000126148030 473492459 /nfs/dbraw/zinc/49/24/59/473492459.db2.gz GISNDVJIKLWWTH-CYBMUJFWSA-N 0 3 337.807 2.949 20 5 EFBDHN COCC[C@](C)(O)CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000172072217 473516467 /nfs/dbraw/zinc/51/64/67/473516467.db2.gz OLTDOHFCUQTJTB-KRWDZBQOSA-N 0 3 334.372 2.732 20 5 EFBDHN CCC1(CC)[C@H](NCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@@H]1OC ZINC000191367923 473531490 /nfs/dbraw/zinc/53/14/90/473531490.db2.gz FQGPIRACYQOHAT-CVEARBPZSA-N 0 3 349.431 2.741 20 5 EFBDHN COCC1=CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000185884969 473538516 /nfs/dbraw/zinc/53/85/16/473538516.db2.gz VRGLPQZRCKAZEY-UHFFFAOYSA-N 0 3 333.388 2.510 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CNC1CCN(CC(F)(F)F)CC1 ZINC000178728495 473549029 /nfs/dbraw/zinc/54/90/29/473549029.db2.gz VWTIKYZIDZXSQH-UHFFFAOYSA-N 0 3 347.337 2.720 20 5 EFBDHN CN(C[C@H]1CCCN(C)C1)C(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000115442285 473570186 /nfs/dbraw/zinc/57/01/86/473570186.db2.gz UAYFWHQAJMOHPT-NSHDSACASA-N 0 3 325.796 2.662 20 5 EFBDHN CC(=O)N1CC[C@@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000152890928 473598087 /nfs/dbraw/zinc/59/80/87/473598087.db2.gz DXXNFUFCNFUMOY-CQSZACIVSA-N 0 3 329.356 2.565 20 5 EFBDHN Cc1cc(C(=O)N2CCCN(C3CCCC3)CC2)c(N)c([N+](=O)[O-])c1 ZINC000172413017 473604273 /nfs/dbraw/zinc/60/42/73/473604273.db2.gz IJFYUQSFOGVHNA-UHFFFAOYSA-N 0 3 346.431 2.576 20 5 EFBDHN C[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N(C)C1CC1 ZINC000170794119 473616273 /nfs/dbraw/zinc/61/62/73/473616273.db2.gz PZZGJNCYVGMAJS-VIFPVBQESA-N 0 3 326.784 2.852 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[C@H](N2CC=CC2)C1 ZINC000127691046 473640351 /nfs/dbraw/zinc/64/03/51/473640351.db2.gz AYKUGRPDBDDKPY-AWEZNQCLSA-N 0 3 330.388 2.690 20 5 EFBDHN COc1ccc(OCCN2CCS[C@@H](C)CC2)c([N+](=O)[O-])c1 ZINC000192187877 473644697 /nfs/dbraw/zinc/64/46/97/473644697.db2.gz RBELPBCMIVIPFT-LBPRGKRZSA-N 0 3 326.418 2.810 20 5 EFBDHN C[C@H]1c2ccccc2CCN1C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000170956273 473654342 /nfs/dbraw/zinc/65/43/42/473654342.db2.gz BLEWYGBFFYMVTR-YOEHRIQHSA-N 0 3 342.395 2.954 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1OC[C@@H](O)CN(C)Cc1ccccc1 ZINC000154074547 473666589 /nfs/dbraw/zinc/66/65/89/473666589.db2.gz RYWMHCXZFVCSAT-KRWDZBQOSA-N 0 3 330.384 2.775 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCCN(C)C1 ZINC000154110550 473668320 /nfs/dbraw/zinc/66/83/20/473668320.db2.gz HEUGNWWTBWMLEB-LBPRGKRZSA-N 0 3 337.445 2.778 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCN(C)C1 ZINC000154110652 473668575 /nfs/dbraw/zinc/66/85/75/473668575.db2.gz HEUGNWWTBWMLEB-GFCCVEGCSA-N 0 3 337.445 2.778 20 5 EFBDHN C[C@@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)[C@@H](c1ccccc1)N(C)C ZINC000186496834 473681780 /nfs/dbraw/zinc/68/17/80/473681780.db2.gz QCFCJODTXAVOMO-PXAZEXFGSA-N 0 3 342.399 2.598 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@@H](C)CN2CCCC2=O)cc1[N+](=O)[O-] ZINC000179405562 473684689 /nfs/dbraw/zinc/68/46/89/473684689.db2.gz KTWXVBLNKYTNDL-STQMWFEESA-N 0 3 335.404 2.655 20 5 EFBDHN O=C(C1CCN(C2CC2)CC1)N1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192530035 473688933 /nfs/dbraw/zinc/68/89/33/473688933.db2.gz QHUUSDNYSPRDKW-UHFFFAOYSA-N 0 3 329.400 2.748 20 5 EFBDHN CCn1nc(C)c([N+](=O)[O-])c1NC[C@@H](c1cccc(OC)c1)N(C)C ZINC000172823488 473689129 /nfs/dbraw/zinc/68/91/29/473689129.db2.gz NHWSHHSHJQNNDW-HNNXBMFYSA-N 0 3 347.419 2.843 20 5 EFBDHN CN(C)CCOc1ccc(NC(=O)Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000172832671 473690243 /nfs/dbraw/zinc/69/02/43/473690243.db2.gz JQCXQOGMQOITPL-UHFFFAOYSA-N 0 3 343.383 2.716 20 5 EFBDHN C[C@H]1CCCC[C@@H]1N(C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000192629738 473698084 /nfs/dbraw/zinc/69/80/84/473698084.db2.gz JLGBTXJUOUJHEK-BBRMVZONSA-N 0 3 331.416 2.994 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)C2CCN(C3CC3)CC2)cc1[N+](=O)[O-] ZINC000192681076 473705187 /nfs/dbraw/zinc/70/51/87/473705187.db2.gz HUQFQEQGGPACOH-CYBMUJFWSA-N 0 3 331.416 2.955 20 5 EFBDHN O=C(CCN[C@@H]1CCCc2ccc([N+](=O)[O-])cc21)N1CCCCC1 ZINC000192693200 473706500 /nfs/dbraw/zinc/70/65/00/473706500.db2.gz UIEUVODQDKZQQT-QGZVFWFLSA-N 0 3 331.416 2.964 20 5 EFBDHN CN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC000269204580 473730654 /nfs/dbraw/zinc/73/06/54/473730654.db2.gz PPFFFNIDKKGEJG-UKRRQHHQSA-N 0 3 342.399 2.632 20 5 EFBDHN CN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC000269204582 473731102 /nfs/dbraw/zinc/73/11/02/473731102.db2.gz PPFFFNIDKKGEJG-ZFWWWQNUSA-N 0 3 342.399 2.632 20 5 EFBDHN CN(C)c1ccc(COC(=O)C2CCN(C3CC3)CC2)cc1[N+](=O)[O-] ZINC000192824615 473733608 /nfs/dbraw/zinc/73/36/08/473733608.db2.gz BVVSFMYRQDRSCK-UHFFFAOYSA-N 0 3 347.415 2.578 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)CCN(C)C1CC1 ZINC000186758527 473750337 /nfs/dbraw/zinc/75/03/37/473750337.db2.gz GEQIERODNCWDPB-HNNXBMFYSA-N 0 3 333.432 2.716 20 5 EFBDHN CC(C)N(CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)CC1CCC1 ZINC000193213494 473776124 /nfs/dbraw/zinc/77/61/24/473776124.db2.gz RWHVCPNPUGVTTP-UHFFFAOYSA-N 0 3 331.416 2.994 20 5 EFBDHN COc1cc(CN2CCCN(C(C)C)CC2)c([N+](=O)[O-])cc1F ZINC000274341232 473788009 /nfs/dbraw/zinc/78/80/09/473788009.db2.gz UNTXOTBMVLFVDM-UHFFFAOYSA-N 0 3 325.384 2.659 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCN(CC3CCCC3)C2)c1 ZINC000173275603 473790293 /nfs/dbraw/zinc/79/02/93/473790293.db2.gz SSJRIXYXTRIJSR-CQSZACIVSA-N 0 3 347.415 2.598 20 5 EFBDHN C[C@H]([NH2+]CCCNC(=O)c1cccc([O-])c1)c1cccc([N+](=O)[O-])c1 ZINC000173371986 473818783 /nfs/dbraw/zinc/81/87/83/473818783.db2.gz DSHMNJQEZODNKL-ZDUSSCGKSA-N 0 3 343.383 2.771 20 5 EFBDHN O=C1CC[C@H]2CN(Cc3ccc([N+](=O)[O-])cc3)CC[C@H]2N1C1CC1 ZINC000246299349 473821311 /nfs/dbraw/zinc/82/13/11/473821311.db2.gz PORRKLROZJUCOY-WMLDXEAASA-N 0 3 329.400 2.570 20 5 EFBDHN O=C(NCC1CCN(c2ccncc2)CC1)c1ccc([N+](=O)[O-])s1 ZINC000180214882 473830544 /nfs/dbraw/zinc/83/05/44/473830544.db2.gz NKCRUNNRIRHJAD-UHFFFAOYSA-N 0 3 346.412 2.698 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000194062008 473835334 /nfs/dbraw/zinc/83/53/34/473835334.db2.gz OISWQQANQCUELA-HIFRSBDPSA-N 0 3 334.376 2.562 20 5 EFBDHN COc1cc(OC)cc([C@H](O)CN[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173426441 473835514 /nfs/dbraw/zinc/83/55/14/473835514.db2.gz UKYMBBWIBAZPFL-KZULUSFZSA-N 0 3 346.383 2.996 20 5 EFBDHN COC(=O)C1CCN(CCCNc2c(C)cccc2[N+](=O)[O-])CC1 ZINC000263768600 473841271 /nfs/dbraw/zinc/84/12/71/473841271.db2.gz SCVIBSXMQZLRNI-UHFFFAOYSA-N 0 3 335.404 2.590 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@H]2CCN(C)C[C@@H]21 ZINC000281880963 473868988 /nfs/dbraw/zinc/86/89/88/473868988.db2.gz GFTWLGNJWDVLDS-WFASDCNBSA-N 0 3 348.403 2.551 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CCC[C@H]2C[C@@H](O)c2ccc(F)cc2)c1 ZINC000269704752 473869377 /nfs/dbraw/zinc/86/93/77/473869377.db2.gz ZGLQEJNRDHJYRI-DOTOQJQBSA-N 0 3 348.378 2.519 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H]2CCN(C)C[C@H]21 ZINC000281880955 473869365 /nfs/dbraw/zinc/86/93/65/473869365.db2.gz GFTWLGNJWDVLDS-IUODEOHRSA-N 0 3 348.403 2.551 20 5 EFBDHN C[C@@H](NCCC(=O)Nc1cc(N)ccc1F)c1cccc([N+](=O)[O-])c1 ZINC000180411202 473871168 /nfs/dbraw/zinc/87/11/68/473871168.db2.gz UGOQNHNKRKVVLN-LLVKDONJSA-N 0 3 346.362 2.996 20 5 EFBDHN CCN(Cc1ccc(CN(C)C)cc1)C(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000263846238 473875019 /nfs/dbraw/zinc/87/50/19/473875019.db2.gz DIBOGTWEVISLTQ-UHFFFAOYSA-N 0 3 330.388 2.647 20 5 EFBDHN Cc1nn(C)c(N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)c1[N+](=O)[O-] ZINC000288208580 473875261 /nfs/dbraw/zinc/87/52/61/473875261.db2.gz LKLYFIUVSHQXPC-HIFRSBDPSA-N 0 3 329.404 2.712 20 5 EFBDHN C[C@@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)c1cccc([N+](=O)[O-])c1 ZINC000180426025 473875403 /nfs/dbraw/zinc/87/54/03/473875403.db2.gz KJUQWLHOMLAVRD-BZNIZROVSA-N 0 3 331.328 2.887 20 5 EFBDHN C[C@H]1C[C@H](N2CCCC2)CN1C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000288218999 473878598 /nfs/dbraw/zinc/87/85/98/473878598.db2.gz DPNXOGWEDFTWIW-YOEHRIQHSA-N 0 3 345.443 2.958 20 5 EFBDHN CCN(Cc1ccccc1)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000194361551 473885900 /nfs/dbraw/zinc/88/59/00/473885900.db2.gz SSYVHOMQUJYCHH-INIZCTEOSA-N 0 3 330.384 2.857 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)C1=CCN(C)CC1 ZINC000281936840 473891328 /nfs/dbraw/zinc/89/13/28/473891328.db2.gz LAFUGHRRJIVCGW-LBPRGKRZSA-N 0 3 348.403 2.765 20 5 EFBDHN CS[C@@H]1CN(c2ccc(F)cc2[N+](=O)[O-])C[C@H]1N1CCCC1 ZINC000274677929 473917640 /nfs/dbraw/zinc/91/76/40/473917640.db2.gz MZZDNNIABVWOKX-HUUCEWRRSA-N 0 3 325.409 2.750 20 5 EFBDHN C[C@@H]1CN(CCCCNc2ccc([N+](=O)[O-])c(N)c2F)C[C@@H](C)O1 ZINC000274700017 473926035 /nfs/dbraw/zinc/92/60/35/473926035.db2.gz UDPKCKGTIJBKNI-VXGBXAGGSA-N 0 3 340.399 2.617 20 5 EFBDHN C[C@@H]1Cc2ccccc2CN1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000246738483 473946912 /nfs/dbraw/zinc/94/69/12/473946912.db2.gz MNWLVIFHRQXYIN-RDTXWAMCSA-N 0 3 342.395 2.781 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)N1C[C@@H](N2CCCC2)C[C@H]1C ZINC000288489758 473957383 /nfs/dbraw/zinc/95/73/83/473957383.db2.gz RLWVWKWAXUDZGZ-KGLIPLIRSA-N 0 3 347.415 2.692 20 5 EFBDHN COc1ccc(CNC[C@@H](CO)Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000264377566 473968278 /nfs/dbraw/zinc/96/82/78/473968278.db2.gz WNOOQYSBWTUFNK-HNNXBMFYSA-N 0 3 348.374 2.683 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])NCC(=O)N(C)CC ZINC000274815996 473970941 /nfs/dbraw/zinc/97/09/41/473970941.db2.gz WMSJPSIEEMMIIR-GFCCVEGCSA-N 0 3 325.434 2.533 20 5 EFBDHN C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000288560607 473981785 /nfs/dbraw/zinc/98/17/85/473981785.db2.gz WFCIUTILTCCGQD-YPMHNXCESA-N 0 3 337.807 2.947 20 5 EFBDHN C[C@@H](NC(=O)N1CC[C@@H](N2CCCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000264584574 474049231 /nfs/dbraw/zinc/04/92/31/474049231.db2.gz KIKZMCOPFHDRSD-RHSMWYFYSA-N 0 3 346.431 2.926 20 5 EFBDHN CS[C@H]1CN(Cc2ccc([N+](=O)[O-])cc2F)C[C@@H]1N1CCCC1 ZINC000275055056 474056515 /nfs/dbraw/zinc/05/65/15/474056515.db2.gz IWWMLFOTLUMNAT-HOTGVXAUSA-N 0 3 339.436 2.746 20 5 EFBDHN O=[N+]([O-])c1cc(CN2CC[C@@H](N3CCCCC3)C2)c2c(c1)COCO2 ZINC000264617276 474062213 /nfs/dbraw/zinc/06/22/13/474062213.db2.gz QWTSLVRHWFELRY-MRXNPFEDSA-N 0 3 347.415 2.522 20 5 EFBDHN O=[N+]([O-])c1cc(CN2CC[C@H](N3CCCCC3)C2)c2c(c1)COCO2 ZINC000264617275 474062229 /nfs/dbraw/zinc/06/22/29/474062229.db2.gz QWTSLVRHWFELRY-INIZCTEOSA-N 0 3 347.415 2.522 20 5 EFBDHN C[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000182069276 474092325 /nfs/dbraw/zinc/09/23/25/474092325.db2.gz GXRKHUAZFSAPSF-CYBMUJFWSA-N 0 3 345.374 2.984 20 5 EFBDHN C[C@@H](NCCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)c1cn[nH]c1 ZINC000275182519 474096099 /nfs/dbraw/zinc/09/60/99/474096099.db2.gz NLBOXQKUHOFDJN-LLVKDONJSA-N 0 3 327.344 2.866 20 5 EFBDHN CN(CCCOc1ccc(Cl)cc1)CCn1cc([N+](=O)[O-])cn1 ZINC000174830460 474103626 /nfs/dbraw/zinc/10/36/26/474103626.db2.gz PEBUITIBNAWUAD-UHFFFAOYSA-N 0 3 338.795 2.846 20 5 EFBDHN O=[N+]([O-])c1ccc(CN2CCN(C3CCOCC3)CC2)c(Cl)c1 ZINC000182209624 474123250 /nfs/dbraw/zinc/12/32/50/474123250.db2.gz KOJPROPUOHKHDL-UHFFFAOYSA-N 0 3 339.823 2.545 20 5 EFBDHN C[C@@H](CN1CCCCC1)NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000282675115 474151385 /nfs/dbraw/zinc/15/13/85/474151385.db2.gz HIFLIEBNIOQQDL-HNNXBMFYSA-N 0 3 348.447 2.653 20 5 EFBDHN Cc1ccc([C@H](C)NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1 ZINC000182394315 474165652 /nfs/dbraw/zinc/16/56/52/474165652.db2.gz HBHXYUBKTGALCP-GOEBONIOSA-N 0 3 330.384 2.994 20 5 EFBDHN Cc1ccnc(N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)c1[N+](=O)[O-] ZINC000265245249 474170468 /nfs/dbraw/zinc/17/04/68/474170468.db2.gz PRUUEAQSMSHYPX-HUUCEWRRSA-N 0 3 348.447 2.624 20 5 EFBDHN CC(C)N(CCn1cc([N+](=O)[O-])ccc1=O)Cc1cccc(F)c1 ZINC000270567778 474171693 /nfs/dbraw/zinc/17/16/93/474171693.db2.gz MQOKNFWKWIAUKG-UHFFFAOYSA-N 0 3 333.363 2.806 20 5 EFBDHN COc1cc(C(=O)NC[C@@H](C)N2CCC[C@H](C)C2)cc([N+](=O)[O-])c1C ZINC000188717225 474176369 /nfs/dbraw/zinc/17/63/69/474176369.db2.gz ZLCYDHMTHXIKDR-QWHCGFSZSA-N 0 3 349.431 2.762 20 5 EFBDHN C[C@@H]1CCN(CCOc2cccc([N+](=O)[O-])c2)C[C@H]1n1ccnc1 ZINC000247591506 474187532 /nfs/dbraw/zinc/18/75/32/474187532.db2.gz MNUJDIUFHUCQNK-RHSMWYFYSA-N 0 3 330.388 2.753 20 5 EFBDHN C[C@H]1CN(CC(C)(C)O)CCN1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000275480938 474202288 /nfs/dbraw/zinc/20/22/88/474202288.db2.gz DXDYOZILBAQXCY-LBPRGKRZSA-N 0 3 341.839 2.525 20 5 EFBDHN C[C@H]1CCN(CCOc2ccccc2[N+](=O)[O-])C[C@H]1n1ccnc1 ZINC000247731643 474204268 /nfs/dbraw/zinc/20/42/68/474204268.db2.gz VFXVHHKCGPYSEX-GOEBONIOSA-N 0 3 330.388 2.753 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)C[C@@H]2CCCN2CC)c1 ZINC000282832099 474210293 /nfs/dbraw/zinc/21/02/93/474210293.db2.gz LQJDEIJGCJKDMZ-ZDUSSCGKSA-N 0 3 335.404 2.550 20 5 EFBDHN CCO[C@@H]1C[C@H](NCc2ccc(C(N)=O)cc2[N+](=O)[O-])C12CCCC2 ZINC000289290104 474211860 /nfs/dbraw/zinc/21/18/60/474211860.db2.gz HAXQTZQSECBZLH-JKSUJKDBSA-N 0 3 347.415 2.521 20 5 EFBDHN C[C@@H](NCCn1cc([N+](=O)[O-])ccc1=O)c1cc2ccccc2o1 ZINC000182647622 474225654 /nfs/dbraw/zinc/22/56/54/474225654.db2.gz DPOYPBWDNIHWSD-GFCCVEGCSA-N 0 3 327.340 2.854 20 5 EFBDHN C[C@H](NCCn1cc([N+](=O)[O-])ccc1=O)c1cc2ccccc2o1 ZINC000182647602 474225694 /nfs/dbraw/zinc/22/56/94/474225694.db2.gz DPOYPBWDNIHWSD-LBPRGKRZSA-N 0 3 327.340 2.854 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1CN[C@H]1CCCO[C@@H]1c1cnn(C)c1 ZINC000275602374 474248387 /nfs/dbraw/zinc/24/83/87/474248387.db2.gz QKZLKKIPMANEPF-DLBZAZTESA-N 0 3 330.388 2.647 20 5 EFBDHN CN(C)CCN(Cc1ccccc1)C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000248053483 474251116 /nfs/dbraw/zinc/25/11/16/474251116.db2.gz XWLOEZPWWJOFHJ-UHFFFAOYSA-N 0 3 327.384 2.799 20 5 EFBDHN O=[N+]([O-])c1cncc(Br)c1NC[C@H]1CCN(C2CC2)C1 ZINC000231628927 474264330 /nfs/dbraw/zinc/26/43/30/474264330.db2.gz GONNKBHGXIRCHU-SECBINFHSA-N 0 3 341.209 2.649 20 5 EFBDHN CCCc1[nH]nc(C(=O)Nc2ccc(CN(C)C)cc2)c1[N+](=O)[O-] ZINC000265629356 474273842 /nfs/dbraw/zinc/27/38/42/474273842.db2.gz JADBFSHFARNPPF-UHFFFAOYSA-N 0 3 331.376 2.584 20 5 EFBDHN CC[C@H](c1cccc(OC)c1)N(C)CCn1cc([N+](=O)[O-])ccc1=O ZINC000289510194 474302620 /nfs/dbraw/zinc/30/26/20/474302620.db2.gz VAVCPXSVDPUPOA-QGZVFWFLSA-N 0 3 345.399 2.848 20 5 EFBDHN CCc1ccc(C(=O)N(C)[C@H](C)C2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000270965054 474342423 /nfs/dbraw/zinc/34/24/23/474342423.db2.gz SEZHIQBYHXTSJX-CYBMUJFWSA-N 0 3 333.432 2.960 20 5 EFBDHN C[C@H](C(=O)N(C)[C@@H]1CCN(C)C[C@@H]1C)c1ccc([N+](=O)[O-])cc1F ZINC000248545020 474352053 /nfs/dbraw/zinc/35/20/53/474352053.db2.gz DGUUDFIJOFYVJY-MQIPJXDCSA-N 0 3 337.395 2.636 20 5 EFBDHN C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000289695504 474380453 /nfs/dbraw/zinc/38/04/53/474380453.db2.gz NNKVYICOZUMZIS-GHMZBOCLSA-N 0 3 339.342 2.572 20 5 EFBDHN C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000289695530 474380597 /nfs/dbraw/zinc/38/05/97/474380597.db2.gz NNKVYICOZUMZIS-MNOVXSKESA-N 0 3 339.342 2.572 20 5 EFBDHN C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000265933194 474391789 /nfs/dbraw/zinc/39/17/89/474391789.db2.gz DZGFRIUWEMWEBG-GWCFXTLKSA-N 0 3 325.796 2.660 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)NC[C@H]2CCCN(C)C2)cc1[N+](=O)[O-] ZINC000176173937 474400587 /nfs/dbraw/zinc/40/05/87/474400587.db2.gz AUSWJYMWTNBFSZ-ZIAGYGMSSA-N 0 3 334.420 2.605 20 5 EFBDHN CCCN(Cc1cc(OC)c(OC)cc1[N+](=O)[O-])CC(C)(C)O ZINC000271147376 474404338 /nfs/dbraw/zinc/40/43/38/474404338.db2.gz AWUUZBMXCUBYRL-UHFFFAOYSA-N 0 3 326.393 2.595 20 5 EFBDHN CN(CCn1ccc([N+](=O)[O-])n1)Cc1ccc(Br)cc1 ZINC000176192972 474405250 /nfs/dbraw/zinc/40/52/50/474405250.db2.gz BTLLRWDMBGDJPL-UHFFFAOYSA-N 0 3 339.193 2.686 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CCC[C@H](c3nc4ccccc4o3)C2)n1 ZINC000176207222 474408865 /nfs/dbraw/zinc/40/88/65/474408865.db2.gz DLALLZJILXWRIY-ZDUSSCGKSA-N 0 3 341.371 2.812 20 5 EFBDHN CCCNC(=O)CN[C@H](CC)CSc1ccccc1[N+](=O)[O-] ZINC000271159311 474410614 /nfs/dbraw/zinc/41/06/14/474410614.db2.gz RUUWQBMHWAMHOC-GFCCVEGCSA-N 0 3 325.434 2.581 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1C[C@@H](C)N(C2CC2)C1 ZINC000248714576 474412541 /nfs/dbraw/zinc/41/25/41/474412541.db2.gz BSTKBIWUBHPLFN-BMFZPTHFSA-N 0 3 345.443 2.905 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CCC(COc3ccccc3)CC2)n1 ZINC000176242579 474418619 /nfs/dbraw/zinc/41/86/19/474418619.db2.gz NCABKZYPDVHZMQ-UHFFFAOYSA-N 0 3 330.388 2.582 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)CN2CCCCC2)c1 ZINC000283551510 474434240 /nfs/dbraw/zinc/43/42/40/474434240.db2.gz TZLPQEHOPHBSBO-ZDUSSCGKSA-N 0 3 335.404 2.598 20 5 EFBDHN CC(C)c1ccc(C(=O)N2CC[C@H]3CCN(C)C[C@@H]32)cc1[N+](=O)[O-] ZINC000276166801 474438867 /nfs/dbraw/zinc/43/88/67/474438867.db2.gz RNPZPQKPPVXHOT-DYVFJYSZSA-N 0 3 331.416 2.884 20 5 EFBDHN COCCOCCOCCN(C)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000276216148 474456730 /nfs/dbraw/zinc/45/67/30/474456730.db2.gz IFWKJLIEMGUAJK-HNNXBMFYSA-N 0 3 340.420 2.576 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000176426549 474470877 /nfs/dbraw/zinc/47/08/77/474470877.db2.gz HJTHQMNDJRBMPO-LXZKKBNFSA-N 0 3 346.431 2.924 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000176445829 474477878 /nfs/dbraw/zinc/47/78/78/474477878.db2.gz LDKWMCZVQLEVDV-NSHDSACASA-N 0 3 325.796 2.852 20 5 EFBDHN Cc1cccc(OC[C@@H](O)CN[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000266779075 474479471 /nfs/dbraw/zinc/47/94/71/474479471.db2.gz CEZUNCKNFIRGHJ-YOEHRIQHSA-N 0 3 330.384 2.994 20 5 EFBDHN Cc1cccc(OC[C@H](O)CN[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000266779071 474479717 /nfs/dbraw/zinc/47/97/17/474479717.db2.gz CEZUNCKNFIRGHJ-WMLDXEAASA-N 0 3 330.384 2.994 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN[C@@H]3CCO[C@H](C(F)(F)F)C3)nc2c1 ZINC000289908795 474481946 /nfs/dbraw/zinc/48/19/46/474481946.db2.gz XUUOEEYLUXFZKE-PELKAZGASA-N 0 3 344.293 2.671 20 5 EFBDHN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@H]2CCN(C)C[C@H]21 ZINC000289949661 474498867 /nfs/dbraw/zinc/49/88/67/474498867.db2.gz XPDQMGZWEJTXRW-XJKSGUPXSA-N 0 3 332.404 2.715 20 5 EFBDHN CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H]2CCN(C)C[C@@H]21 ZINC000289949653 474499073 /nfs/dbraw/zinc/49/90/73/474499073.db2.gz XPDQMGZWEJTXRW-CJNGLKHVSA-N 0 3 332.404 2.715 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NC2C[C@H]3CCC[C@@H](C2)N3C)c1 ZINC000283847371 474511784 /nfs/dbraw/zinc/51/17/84/474511784.db2.gz GYYAXCJAXFKTCE-AGUYFDCRSA-N 0 3 347.415 2.739 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N2CCC[C@H](N(C)C)C2)cc1[N+](=O)[O-] ZINC000176747135 474525653 /nfs/dbraw/zinc/52/56/53/474525653.db2.gz QMWWKMDNSQPQRU-ZFWWWQNUSA-N 0 3 334.420 2.700 20 5 EFBDHN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000276401304 474527862 /nfs/dbraw/zinc/52/78/62/474527862.db2.gz KQERZQKJDAVUEY-CYBMUJFWSA-N 0 3 332.404 2.984 20 5 EFBDHN CSc1cccc(C(=O)N(C)[C@@H]2CCN(C)C[C@@H]2C)c1[N+](=O)[O-] ZINC000249131816 474534926 /nfs/dbraw/zinc/53/49/26/474534926.db2.gz LYJNBCCRVUJYOO-WCQYABFASA-N 0 3 337.445 2.729 20 5 EFBDHN CCOc1ccc([C@@H](C)NCCCc2nc(C)no2)cc1[N+](=O)[O-] ZINC000271419936 474538319 /nfs/dbraw/zinc/53/83/19/474538319.db2.gz BOCBHIQDKVWWTP-LLVKDONJSA-N 0 3 334.376 2.968 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCN(CC(C)(C)O)[C@@H](C)C1 ZINC000249361741 474561279 /nfs/dbraw/zinc/56/12/79/474561279.db2.gz LRVSCAJQRGLQRT-GJZGRUSLSA-N 0 3 335.448 2.741 20 5 EFBDHN C[C@@](O)(CN[C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)C(F)(F)F ZINC000271474836 474563444 /nfs/dbraw/zinc/56/34/44/474563444.db2.gz ITPPIWNPEWXCRG-TZMCWYRMSA-N 0 3 332.322 2.819 20 5 EFBDHN CN(C)[C@]1(CNc2ccc3ncccc3c2[N+](=O)[O-])CCSC1 ZINC000267026773 474568334 /nfs/dbraw/zinc/56/83/34/474568334.db2.gz AGNLTAFUCZUECW-INIZCTEOSA-N 0 3 332.429 2.992 20 5 EFBDHN C[C@@H](NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC000184649968 474574711 /nfs/dbraw/zinc/57/47/11/474574711.db2.gz NPEZXFXUBMUPCU-GFCCVEGCSA-N 0 3 326.418 2.537 20 5 EFBDHN Cc1cc(F)c(NC(=O)N(C)C[C@@H]2CCCN(C)C2)cc1[N+](=O)[O-] ZINC000284114931 474575855 /nfs/dbraw/zinc/57/58/55/474575855.db2.gz TYHAHLVUGYHLPJ-GFCCVEGCSA-N 0 3 338.383 2.848 20 5 EFBDHN CN(C)[C@]1(CNc2ccc([N+](=O)[O-])c3cnccc23)CCSC1 ZINC000267072738 474582431 /nfs/dbraw/zinc/58/24/31/474582431.db2.gz IYQRMXDCLTXJMV-INIZCTEOSA-N 0 3 332.429 2.992 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H](N2CCCC2)C1 ZINC000184726529 474595606 /nfs/dbraw/zinc/59/56/06/474595606.db2.gz YNUFVKBYAWQNNL-AEFFLSMTSA-N 0 3 345.443 2.860 20 5 EFBDHN C[C@](CO)(NCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C1CCCCC1 ZINC000284208499 474596380 /nfs/dbraw/zinc/59/63/80/474596380.db2.gz SVZCNKDBBQTUOK-MRXNPFEDSA-N 0 3 337.376 2.924 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1 ZINC000184846147 474618838 /nfs/dbraw/zinc/61/88/38/474618838.db2.gz BSTKBIWUBHPLFN-CWRNSKLLSA-N 0 3 345.443 2.905 20 5 EFBDHN O=[N+]([O-])c1c(F)cccc1NC[C@@H](O)CN1CCc2ccccc2C1 ZINC000267248794 474628056 /nfs/dbraw/zinc/62/80/56/474628056.db2.gz UETMNWPYDGDGAM-OAHLLOKOSA-N 0 3 345.374 2.565 20 5 EFBDHN Cc1cc(NC[C@@H](O)C2CCOCC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000272890517 474635514 /nfs/dbraw/zinc/63/55/14/474635514.db2.gz XPIUOBZKYJOONH-QGZVFWFLSA-N 0 3 331.372 2.651 20 5 EFBDHN CC(C)CC[C@H](C)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000272904530 474638319 /nfs/dbraw/zinc/63/83/19/474638319.db2.gz FAYYONMTUCHHPS-ZDUSSCGKSA-N 0 3 328.434 2.783 20 5 EFBDHN Cc1cc([N+](=O)[O-])cc(C(=O)N(CCN(C)C)Cc2ccco2)c1F ZINC000278492433 474659767 /nfs/dbraw/zinc/65/97/67/474659767.db2.gz YYRYUYNSGCOXCN-UHFFFAOYSA-N 0 3 349.362 2.839 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@H](CO)Cc2c[nH]c3ccccc23)cc1 ZINC000344340128 474663131 /nfs/dbraw/zinc/66/31/31/474663131.db2.gz KSWNHQLXMQYRKQ-HNNXBMFYSA-N 0 3 325.368 2.769 20 5 EFBDHN COc1ccc(OCCN2CCC[C@@H](c3ncc[nH]3)C2)c([N+](=O)[O-])c1 ZINC000267377009 474666104 /nfs/dbraw/zinc/66/61/04/474666104.db2.gz AHLBCWJOCWRIRJ-CYBMUJFWSA-N 0 3 346.387 2.585 20 5 EFBDHN CN(C[C@@H]1CCCN(C)C1)c1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000278506395 474667314 /nfs/dbraw/zinc/66/73/14/474667314.db2.gz XSKCLVHPNNBURL-SNVBAGLBSA-N 0 3 332.326 2.787 20 5 EFBDHN Cc1ccc([C@@H](C)N[C@H]2CCCN(c3ccnn3C)C2)cc1[N+](=O)[O-] ZINC000278549522 474694767 /nfs/dbraw/zinc/69/47/67/474694767.db2.gz VSIKJNSYIPTZLN-ZBFHGGJFSA-N 0 3 343.431 2.956 20 5 EFBDHN COc1cc(CNC[C@@H]2CCCCS2)c([N+](=O)[O-])cc1OC ZINC000344370845 474696021 /nfs/dbraw/zinc/69/60/21/474696021.db2.gz YWIOZTKUYHLQBR-LBPRGKRZSA-N 0 3 326.418 2.987 20 5 EFBDHN CO[C@]1(C)C[C@@H](N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1(C)C ZINC000340847917 474713315 /nfs/dbraw/zinc/71/33/15/474713315.db2.gz HWKPBJIOFDFAIX-FABXCBLPSA-N 0 3 335.404 2.715 20 5 EFBDHN CO[C@]1(C)C[C@@H](N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1(C)C ZINC000340847919 474713941 /nfs/dbraw/zinc/71/39/41/474713941.db2.gz HWKPBJIOFDFAIX-JDSLSITLSA-N 0 3 335.404 2.715 20 5 EFBDHN CO[C@]1(C)C[C@H](N[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1(C)C ZINC000340854699 474718493 /nfs/dbraw/zinc/71/84/93/474718493.db2.gz WHAXNXMMJCGWDO-PZSREKOKSA-N 0 3 335.404 2.715 20 5 EFBDHN Cc1cccc([C@H]2CCN(CCn3cc([N+](=O)[O-])ccc3=O)C2)c1 ZINC000273150238 474743217 /nfs/dbraw/zinc/74/32/17/474743217.db2.gz XIYDBLWTSRSBFA-INIZCTEOSA-N 0 3 327.384 2.554 20 5 EFBDHN C[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F)N(C)C1CC1 ZINC000293013991 474766310 /nfs/dbraw/zinc/76/63/10/474766310.db2.gz KQTTUPJKXFKGEL-VIFPVBQESA-N 0 3 345.321 2.826 20 5 EFBDHN CN(CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C[C@@H]1CCCCO1 ZINC000273201233 474773628 /nfs/dbraw/zinc/77/36/28/474773628.db2.gz RMNHRZFYMHLIDI-ZDUSSCGKSA-N 0 3 339.367 2.563 20 5 EFBDHN C[C@H](CNC(=O)NCc1cc([N+](=O)[O-])ccc1Cl)N(C)C1CC1 ZINC000268083610 474787935 /nfs/dbraw/zinc/78/79/35/474787935.db2.gz JCYGVEPWNVRLAJ-SNVBAGLBSA-N 0 3 340.811 2.530 20 5 EFBDHN Cc1c(CNC[C@H](O)COCc2ccccc2)cccc1[N+](=O)[O-] ZINC000310072161 474823025 /nfs/dbraw/zinc/82/30/25/474823025.db2.gz NKDDOBHUGDIQIE-KRWDZBQOSA-N 0 3 330.384 2.571 20 5 EFBDHN CCOC(=O)c1cc(NC2CCN(C3CC3)CC2)ccc1[N+](=O)[O-] ZINC000268149295 474827429 /nfs/dbraw/zinc/82/74/29/474827429.db2.gz KDNJIMQDJCMOIF-UHFFFAOYSA-N 0 3 333.388 2.810 20 5 EFBDHN C[C@H]1CN(C)CC[C@@H]1N(C)c1ncc([N+](=O)[O-])cc1Br ZINC000268162492 474836277 /nfs/dbraw/zinc/83/62/77/474836277.db2.gz OUWKYCCWVAKXPE-CABZTGNLSA-N 0 3 343.225 2.529 20 5 EFBDHN COCC[C@H](NCCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccco1 ZINC000273331548 474846135 /nfs/dbraw/zinc/84/61/35/474846135.db2.gz ZLBGUFTYUWDUPH-AWEZNQCLSA-N 0 3 347.371 2.884 20 5 EFBDHN C[C@@H]1CCC[C@@]1(O)CNCc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000293174971 474854544 /nfs/dbraw/zinc/85/45/44/474854544.db2.gz WKDHZHBZHVYVFI-MEBBXXQBSA-N 0 3 330.331 2.837 20 5 EFBDHN CCn1nccc1C1CCN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000278824714 474854910 /nfs/dbraw/zinc/85/49/10/474854910.db2.gz HUIWFKJALOFKIS-GOSISDBHSA-N 0 3 344.415 2.724 20 5 EFBDHN CS[C@@H]1CN(C(=O)c2c(C)cccc2[N+](=O)[O-])C[C@H]1N1CCCC1 ZINC000278829806 474859666 /nfs/dbraw/zinc/85/96/66/474859666.db2.gz VDIFWQDNEZOYOD-HUUCEWRRSA-N 0 3 349.456 2.555 20 5 EFBDHN CCCN(CCN1CCN(CC)CC1)c1ccc(F)cc1[N+](=O)[O-] ZINC000341021996 474888256 /nfs/dbraw/zinc/88/82/56/474888256.db2.gz AAEZOAWOXAADAN-UHFFFAOYSA-N 0 3 338.427 2.588 20 5 EFBDHN CS[C@@H]1CN(C(=O)c2cccc(C)c2[N+](=O)[O-])C[C@@H]1N1CCCC1 ZINC000273438409 474896482 /nfs/dbraw/zinc/89/64/82/474896482.db2.gz AQWMRMSHENZOON-LSDHHAIUSA-N 0 3 349.456 2.555 20 5 EFBDHN C[C@@H]1CN(C(=O)c2ccc(F)cc2[N+](=O)[O-])CCN(C2CCC2)C1 ZINC000292237533 474918919 /nfs/dbraw/zinc/91/89/19/474918919.db2.gz CUXCUQXGBQNDSU-LBPRGKRZSA-N 0 3 335.379 2.680 20 5 EFBDHN Cc1cc(C(=O)N[C@H](C)CN2C[C@@H](C)C[C@H](C)C2)cc([N+](=O)[O-])c1 ZINC000255958649 474923648 /nfs/dbraw/zinc/92/36/48/474923648.db2.gz JHBFITYYKBRIAO-SOUVJXGZSA-N 0 3 333.432 2.999 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CNCCCNC(=O)OC(C)(C)C ZINC000278941366 474930810 /nfs/dbraw/zinc/93/08/10/474930810.db2.gz XSOXLFIPNNIYAF-UHFFFAOYSA-N 0 3 339.392 2.608 20 5 EFBDHN NC(=O)[C@@H](Cc1ccccc1)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000273504246 474934429 /nfs/dbraw/zinc/93/44/29/474934429.db2.gz PRGXNKNMUSPGCD-GOSISDBHSA-N 0 3 341.411 2.604 20 5 EFBDHN CC[C@H](NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)c1ccc(Cl)s1 ZINC000273513355 474938801 /nfs/dbraw/zinc/93/88/01/474938801.db2.gz PAVFPWOJPKXJRQ-QWRGUYRKSA-N 0 3 344.824 2.608 20 5 EFBDHN CCc1cccc(OC[C@@H](O)CNCc2cccc([N+](=O)[O-])c2)c1 ZINC000324572770 474970761 /nfs/dbraw/zinc/97/07/61/474970761.db2.gz XCLYQLWVEZGWSL-KRWDZBQOSA-N 0 3 330.384 2.687 20 5 EFBDHN CCC[C@H](NC[C@H]1CN2CCC[C@@H]2CO1)c1cccc([N+](=O)[O-])c1 ZINC000325810945 474995056 /nfs/dbraw/zinc/99/50/56/474995056.db2.gz KDIYOUJVTFONGM-SQNIBIBYSA-N 0 3 333.432 2.889 20 5 EFBDHN O=C(N[C@@H]1CCN(C2CCCC2)C1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000609310257 480142032 /nfs/dbraw/zinc/14/20/32/480142032.db2.gz YKRGSUJICHPUDJ-CYBMUJFWSA-N 0 3 342.399 2.823 20 5 EFBDHN C[C@H]1CN(Cc2ccccc2)CC[C@@H]1Nc1ncc([N+](=O)[O-])cn1 ZINC000273665820 475004637 /nfs/dbraw/zinc/00/46/37/475004637.db2.gz WXFNJBZKTBVMRX-BBRMVZONSA-N 0 3 327.388 2.707 20 5 EFBDHN COc1ccccc1[C@H](CNc1ncc([N+](=O)[O-])cn1)N1CCCC1 ZINC000273685528 475011480 /nfs/dbraw/zinc/01/14/80/475011480.db2.gz ZUQXRUGSLXONGX-HNNXBMFYSA-N 0 3 343.387 2.642 20 5 EFBDHN COc1ccccc1[C@@H](CNc1ncc([N+](=O)[O-])cn1)N1CCCC1 ZINC000273685529 475011496 /nfs/dbraw/zinc/01/14/96/475011496.db2.gz ZUQXRUGSLXONGX-OAHLLOKOSA-N 0 3 343.387 2.642 20 5 EFBDHN Cc1ccc2c(c1)[C@H]1CN(C)CC[C@@H]1N2C(=O)c1ccc([N+](=O)[O-])o1 ZINC000292423234 475018355 /nfs/dbraw/zinc/01/83/55/475018355.db2.gz UBVQICXGPGYAGP-HIFRSBDPSA-N 0 3 341.367 2.944 20 5 EFBDHN C[C@@H]1CN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H](C)N1C ZINC000293527475 475022930 /nfs/dbraw/zinc/02/29/30/475022930.db2.gz WRMGIMZFBGPJLB-OKILXGFUSA-N 0 3 344.415 2.817 20 5 EFBDHN C[C@@H]1CN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@H](C)N1C ZINC000293541897 475030426 /nfs/dbraw/zinc/03/04/26/475030426.db2.gz CWRWABAWJRRVLJ-OKILXGFUSA-N 0 3 343.431 2.520 20 5 EFBDHN C[C@H]1CN(C2CC2)C[C@H]1NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000273886007 475100508 /nfs/dbraw/zinc/10/05/08/475100508.db2.gz UHWBXPLRBOIFFN-MEDUHNTESA-N 0 3 349.406 2.610 20 5 EFBDHN CCc1ccc(C(=O)N2CC[C@H](N3CCCC3)[C@H]2C)cc1[N+](=O)[O-] ZINC000287356078 475112012 /nfs/dbraw/zinc/11/20/12/475112012.db2.gz WMYDJAPBPNABIR-CJNGLKHVSA-N 0 3 331.416 2.856 20 5 EFBDHN CCCCN1CCCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000337559856 475127714 /nfs/dbraw/zinc/12/77/14/475127714.db2.gz ZRTQFYAXXCNGJD-HNNXBMFYSA-N 0 3 349.431 2.988 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)N1C[C@@H](N2CCCC2)C[C@@H]1C ZINC000287415615 475137044 /nfs/dbraw/zinc/13/70/44/475137044.db2.gz DIDBMCMUECBHGY-JSGCOSHPSA-N 0 3 348.403 2.694 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)N1C[C@H](N2CCCC2)C[C@@H]1C ZINC000287415613 475138407 /nfs/dbraw/zinc/13/84/07/475138407.db2.gz DIDBMCMUECBHGY-GXTWGEPZSA-N 0 3 348.403 2.694 20 5 EFBDHN COc1cc(NCCCCN2C[C@@H](C)O[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000269044133 475145576 /nfs/dbraw/zinc/14/55/76/475145576.db2.gz NMIXOQCGERLEJF-ZIAGYGMSSA-N 0 3 337.420 2.905 20 5 EFBDHN CC[C@H]1CN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CCCO1 ZINC000281271277 475145728 /nfs/dbraw/zinc/14/57/28/475145728.db2.gz NVJNSJBDQSDGPE-KRWDZBQOSA-N 0 3 344.415 2.996 20 5 EFBDHN CC[C@H](C)N(CCO)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000287452906 475153047 /nfs/dbraw/zinc/15/30/47/475153047.db2.gz QSXPZRWDIZDEGL-JTQLQIEISA-N 0 3 331.210 2.950 20 5 EFBDHN COc1cc(CN2CCN(C3CC3)C[C@@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000296007969 475163155 /nfs/dbraw/zinc/16/31/55/475163155.db2.gz LJZLUOBBTBBUSA-ZDUSSCGKSA-N 0 3 349.431 2.528 20 5 EFBDHN COc1cc(CN2CCN(C3CC3)C[C@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000296007966 475163289 /nfs/dbraw/zinc/16/32/89/475163289.db2.gz LJZLUOBBTBBUSA-CYBMUJFWSA-N 0 3 349.431 2.528 20 5 EFBDHN CCc1nnc(CN[C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])[nH]1 ZINC000296035791 475172832 /nfs/dbraw/zinc/17/28/32/475172832.db2.gz NPWRQTBZKIYGRZ-OCCSQVGLSA-N 0 3 329.404 2.776 20 5 EFBDHN CCc1nnc(C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])[n-]1 ZINC000296035791 475172839 /nfs/dbraw/zinc/17/28/39/475172839.db2.gz NPWRQTBZKIYGRZ-OCCSQVGLSA-N 0 3 329.404 2.776 20 5 EFBDHN CCN1CC[C@H]2OCCN(Cc3c(Cl)cccc3[N+](=O)[O-])[C@@H]2C1 ZINC000339378167 475174667 /nfs/dbraw/zinc/17/46/67/475174667.db2.gz CNTJRMGJNONXRP-HZPDHXFCSA-N 0 3 339.823 2.543 20 5 EFBDHN CCOC(=O)c1ccnc(NC2CCN(C3CCC3)CC2)c1[N+](=O)[O-] ZINC000296093106 475193092 /nfs/dbraw/zinc/19/30/92/475193092.db2.gz UDWARRHDFDYASB-UHFFFAOYSA-N 0 3 348.403 2.595 20 5 EFBDHN CCOC(=O)c1cc(N2CC[C@]3(C2)CCCN(C)C3)ccc1[N+](=O)[O-] ZINC000292816865 475207024 /nfs/dbraw/zinc/20/70/24/475207024.db2.gz OOGWCXWEONNSEE-GOSISDBHSA-N 0 3 347.415 2.694 20 5 EFBDHN CC[C@H](C)N1CCN([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000296162270 475212073 /nfs/dbraw/zinc/21/20/73/475212073.db2.gz SXGZWHJKKIEXNX-DZGCQCFKSA-N 0 3 348.447 2.646 20 5 EFBDHN CC[C@@H](C)N1CCN([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000296163994 475213230 /nfs/dbraw/zinc/21/32/30/475213230.db2.gz SXGZWHJKKIEXNX-UKRRQHHQSA-N 0 3 348.447 2.646 20 5 EFBDHN CCCCN(C)C[C@@H](C)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000296186697 475218242 /nfs/dbraw/zinc/21/82/42/475218242.db2.gz UPZLJYJLVGKVGC-CQSZACIVSA-N 0 3 349.431 2.794 20 5 EFBDHN O=[N+]([O-])c1ccc(CCN2CCNC[C@@H]2c2cccc(F)c2)cc1 ZINC000262313981 475218933 /nfs/dbraw/zinc/21/89/33/475218933.db2.gz ZIHJVGXLRDJOGS-GOSISDBHSA-N 0 3 329.375 2.923 20 5 EFBDHN O=[N+]([O-])c1ccc(CCN2CCNC[C@H]2c2cccc(F)c2)cc1 ZINC000262313983 475218978 /nfs/dbraw/zinc/21/89/78/475218978.db2.gz ZIHJVGXLRDJOGS-SFHVURJKSA-N 0 3 329.375 2.923 20 5 EFBDHN CCn1cc([C@@H](C)NCCC(=O)Nc2ccc([N+](=O)[O-])cc2C)cn1 ZINC000296209570 475224446 /nfs/dbraw/zinc/22/44/46/475224446.db2.gz VOARXDXQGIZWPP-CYBMUJFWSA-N 0 3 345.403 2.799 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCN(CC2CC2)C1 ZINC000609382425 480154497 /nfs/dbraw/zinc/15/44/97/480154497.db2.gz AWSBIALNBKPBQA-TZMCWYRMSA-N 0 3 349.456 2.676 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCN(C2CC2)C1 ZINC000361159169 475231710 /nfs/dbraw/zinc/23/17/10/475231710.db2.gz ISGMEYZDVBPDNU-LSDHHAIUSA-N 0 3 331.416 2.516 20 5 EFBDHN COc1ccc2c(c1)CCN(C[C@H](O)c1cccc([N+](=O)[O-])c1)CC2 ZINC000361176614 475246492 /nfs/dbraw/zinc/24/64/92/475246492.db2.gz FLTSHPZOVYIXNT-IBGZPJMESA-N 0 3 342.395 2.738 20 5 EFBDHN COCCOC[C@H]1CCN(C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000347354037 475259380 /nfs/dbraw/zinc/25/93/80/475259380.db2.gz HZKWQGPTNQFGFK-OBHPCNEJSA-N 0 3 334.416 2.983 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCN(C2CCOCC2)CC1 ZINC000347363498 475266718 /nfs/dbraw/zinc/26/67/18/475266718.db2.gz QYEKXKCGTOTNQP-DTQAZKPQSA-N 0 3 345.443 2.795 20 5 EFBDHN CCN1CCN(CCNc2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000341744755 475267910 /nfs/dbraw/zinc/26/79/10/475267910.db2.gz OZGOULGVLLGKFZ-UHFFFAOYSA-N 0 3 347.246 2.951 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCN(C)[C@@H](C)C1 ZINC000361213225 475273874 /nfs/dbraw/zinc/27/38/74/475273874.db2.gz QEPJPUGYMNXEEY-NUEKZKHPSA-N 0 3 333.432 2.762 20 5 EFBDHN CN1CCC(C(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)CC1 ZINC000345693900 475370687 /nfs/dbraw/zinc/37/06/87/475370687.db2.gz YJPJMJUKQYZHSD-MRXNPFEDSA-N 0 3 335.429 2.511 20 5 EFBDHN COCC[C@H](N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000337845443 475372385 /nfs/dbraw/zinc/37/23/85/475372385.db2.gz HBWNPHWQCCSBJJ-DOMZBBRYSA-N 0 3 337.420 2.963 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN[C@@H]1CC(=O)N2CCCC[C@H]12 ZINC000337848348 475374430 /nfs/dbraw/zinc/37/44/30/475374430.db2.gz ILCVTXSAYJSAAK-WZFZXHKMSA-N 0 3 329.400 2.741 20 5 EFBDHN COCC[C@H](N[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])C(C)(C)C ZINC000337862915 475387280 /nfs/dbraw/zinc/38/72/80/475387280.db2.gz OEFWZXOXVUZCQY-WFASDCNBSA-N 0 3 337.420 2.963 20 5 EFBDHN CC(C)(C)[C@H]1CCCN1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000331723144 475391266 /nfs/dbraw/zinc/39/12/66/475391266.db2.gz LNAUFVMPXMROKY-MRXNPFEDSA-N 0 3 331.416 2.994 20 5 EFBDHN CN(C)CCO[C@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000339677569 475402462 /nfs/dbraw/zinc/40/24/62/475402462.db2.gz OGOGTQHWYZGTGC-LBPRGKRZSA-N 0 3 347.337 2.771 20 5 EFBDHN CN(C)CCO[C@H]1CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000339680205 475404209 /nfs/dbraw/zinc/40/42/09/475404209.db2.gz BJUAUUKFVXFZCW-LBPRGKRZSA-N 0 3 347.337 2.771 20 5 EFBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCCN(C)[C@@H]1C ZINC000345778189 475442397 /nfs/dbraw/zinc/44/23/97/475442397.db2.gz LEOMHAFAWVTKMK-RHSMWYFYSA-N 0 3 348.447 2.998 20 5 EFBDHN Cc1cc(Cl)c(C(=O)N2CC[C@H]3CCN(C)C[C@@H]32)cc1[N+](=O)[O-] ZINC000296791776 475479493 /nfs/dbraw/zinc/47/94/93/475479493.db2.gz OFKHLBYHGIZMLG-ABAIWWIYSA-N 0 3 337.807 2.723 20 5 EFBDHN CNC(=O)[C@H]1CCC[C@H]1NCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000345828288 475487669 /nfs/dbraw/zinc/48/76/69/475487669.db2.gz IYIWRSIVVMEIRC-DZGCQCFKSA-N 0 3 343.383 2.859 20 5 EFBDHN C[C@@H]1CN(Cc2c(F)cc([N+](=O)[O-])cc2F)CCN(C2CC2)C1 ZINC000296823658 475491737 /nfs/dbraw/zinc/49/17/37/475491737.db2.gz VVJAUFFSOAJSPF-LLVKDONJSA-N 0 3 325.359 2.789 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[C@@H](N2CCCC2)[C@H]1C ZINC000332081277 475503978 /nfs/dbraw/zinc/50/39/78/475503978.db2.gz LPTHBNFYLYQKHD-GDBMZVCRSA-N 0 3 331.416 2.910 20 5 EFBDHN CC[C@@H]1[C@H](C)CCN1Cc1ccc(OCC(=O)OC)c([N+](=O)[O-])c1 ZINC000354914545 475515336 /nfs/dbraw/zinc/51/53/36/475515336.db2.gz DPCQUNFLUKXTJP-TZMCWYRMSA-N 0 3 336.388 2.767 20 5 EFBDHN CN1CC[C@@]2(CCN(C(=O)Nc3cccc([N+](=O)[O-])c3Cl)C2)C1 ZINC000296894259 475524010 /nfs/dbraw/zinc/52/40/10/475524010.db2.gz XKAOHFCRTXPMBD-OAHLLOKOSA-N 0 3 338.795 2.808 20 5 EFBDHN Cn1nccc1[C@H]1CCCN(CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000338031595 475525828 /nfs/dbraw/zinc/52/58/28/475525828.db2.gz VLECBTNHQSXVHC-AWEZNQCLSA-N 0 3 330.388 2.587 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@@]2(C1)CCCN(C)C2 ZINC000296915004 475533973 /nfs/dbraw/zinc/53/39/73/475533973.db2.gz PFKGURMSAWUWPX-KRWDZBQOSA-N 0 3 332.404 2.853 20 5 EFBDHN Cc1nc(NC[C@@H]2CCCN2Cc2ccccc2)ncc1[N+](=O)[O-] ZINC000296963282 475554604 /nfs/dbraw/zinc/55/46/04/475554604.db2.gz CRNDHACQDSDRCU-HNNXBMFYSA-N 0 3 327.388 2.770 20 5 EFBDHN COC(=O)[C@@]12CN(Cc3cc([N+](=O)[O-])ccc3OC)C[C@H]1CCCC2 ZINC000342158894 475565351 /nfs/dbraw/zinc/56/53/51/475565351.db2.gz RXMJTFYLODAGPJ-KDOFPFPSSA-N 0 3 348.399 2.769 20 5 EFBDHN COc1ccc(-c2ccc(CN3C[C@H](C)[C@H](CO)C3)o2)c([N+](=O)[O-])c1 ZINC000361659687 475638725 /nfs/dbraw/zinc/63/87/25/475638725.db2.gz IQAVMGBAYMGFEF-STQMWFEESA-N 0 3 346.383 2.924 20 5 EFBDHN CC[C@@H]1CN2CCC[C@H]2CN1C(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000332592756 475679214 /nfs/dbraw/zinc/67/92/14/475679214.db2.gz NWOSJGTVEYSTCA-CABCVRRESA-N 0 3 331.416 2.910 20 5 EFBDHN CC[C@@H]1CN2CCC[C@@H]2CN1C(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000332592760 475680473 /nfs/dbraw/zinc/68/04/73/475680473.db2.gz NWOSJGTVEYSTCA-HUUCEWRRSA-N 0 3 331.416 2.910 20 5 EFBDHN COC(=O)COc1ccc(CNCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000361730817 475703851 /nfs/dbraw/zinc/70/38/51/475703851.db2.gz CKZPZRNIKRQYFV-UHFFFAOYSA-N 0 3 344.367 2.745 20 5 EFBDHN Cc1nc([C@H]2CCCN(CC=Cc3ccccc3[N+](=O)[O-])C2)n[nH]1 ZINC000355172495 475716441 /nfs/dbraw/zinc/71/64/41/475716441.db2.gz OLGRDYSRTOUTBY-QZDDGCDVSA-N 0 3 327.388 2.914 20 5 EFBDHN Cc1n[nH]c([C@H]2CCCN(CC=Cc3ccccc3[N+](=O)[O-])C2)n1 ZINC000355172495 475716446 /nfs/dbraw/zinc/71/64/46/475716446.db2.gz OLGRDYSRTOUTBY-QZDDGCDVSA-N 0 3 327.388 2.914 20 5 EFBDHN Cc1nnc([C@H]2CCCN(CC=Cc3ccccc3[N+](=O)[O-])C2)[nH]1 ZINC000355172495 475716453 /nfs/dbraw/zinc/71/64/53/475716453.db2.gz OLGRDYSRTOUTBY-QZDDGCDVSA-N 0 3 327.388 2.914 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN[C@H]1CCC[C@@H]1OC(F)F ZINC000348519497 475719372 /nfs/dbraw/zinc/71/93/72/475719372.db2.gz DBGNPFAOJNQFMB-JQWIXIFHSA-N 0 3 343.330 2.592 20 5 EFBDHN CN(CC1CCN(c2ccncc2)CC1)c1ccc([N+](=O)[O-])nc1 ZINC000346657569 475739575 /nfs/dbraw/zinc/73/95/75/475739575.db2.gz OGYHSVMHPVANIP-UHFFFAOYSA-N 0 3 327.388 2.738 20 5 EFBDHN O=[N+]([O-])c1ccc(CNC[C@]2(CO)C[C@H]2c2ccccc2)c(F)c1 ZINC000353191905 475759480 /nfs/dbraw/zinc/75/94/80/475759480.db2.gz LAFOVIZMUDXOIF-WMZOPIPTSA-N 0 3 330.359 2.990 20 5 EFBDHN Cn1cc(CNCCOC(F)(F)F)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000353193990 475761283 /nfs/dbraw/zinc/76/12/83/475761283.db2.gz PYSCAWKYIOIFSE-UHFFFAOYSA-N 0 3 344.293 2.621 20 5 EFBDHN O=C(CCN(Cc1cccc([N+](=O)[O-])c1)C1CC1)Nc1cccnc1 ZINC000361828659 475789914 /nfs/dbraw/zinc/78/99/14/475789914.db2.gz GHRMURKCRSDSPO-UHFFFAOYSA-N 0 3 340.383 2.983 20 5 EFBDHN CCCCN1CCCC[C@H]1CNC(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000355281251 475796498 /nfs/dbraw/zinc/79/64/98/475796498.db2.gz GRXXYUYYZOTEFB-HNNXBMFYSA-N 0 3 349.431 2.988 20 5 EFBDHN C[C@H](NC(=O)NC1CCN(C2CC2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000297567454 475809709 /nfs/dbraw/zinc/80/97/09/475809709.db2.gz WNHNSAIJGBZNEF-LBPRGKRZSA-N 0 3 332.404 2.582 20 5 EFBDHN Cc1ccc([C@H](C)NCCC(=O)Nc2cccnc2)cc1[N+](=O)[O-] ZINC000361860507 475817373 /nfs/dbraw/zinc/81/73/73/475817373.db2.gz MVARVWIOIDTFSL-ZDUSSCGKSA-N 0 3 328.372 2.978 20 5 EFBDHN C[C@@H](CN(C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000340181447 475833569 /nfs/dbraw/zinc/83/35/69/475833569.db2.gz RDRCTTIQXDTRNQ-ZDUSSCGKSA-N 0 3 327.384 2.929 20 5 EFBDHN Cc1c(NC(=O)[C@H](C)N[C@H](C)[C@H]2CCCOC2)cccc1[N+](=O)[O-] ZINC000355341440 475844200 /nfs/dbraw/zinc/84/42/00/475844200.db2.gz JRPJECJLTAESSV-RDBSUJKOSA-N 0 3 335.404 2.635 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCN(C)CC[C@@H]1C ZINC000346770694 475844849 /nfs/dbraw/zinc/84/48/49/475844849.db2.gz OZHWYNJKUZWGLQ-LBPRGKRZSA-N 0 3 336.392 2.551 20 5 EFBDHN C[C@H](CNC(=O)CCOc1ccccc1[N+](=O)[O-])N1CCCC[C@H]1C ZINC000340266590 475900465 /nfs/dbraw/zinc/90/04/65/475900465.db2.gz FEJSPPHWCZIMLV-HUUCEWRRSA-N 0 3 349.431 2.743 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2N(C)CCCC2(C)C)c1 ZINC000338461198 475928422 /nfs/dbraw/zinc/92/84/22/475928422.db2.gz HHQPWYOBUUPGOR-MRXNPFEDSA-N 0 3 349.431 2.844 20 5 EFBDHN O=[N+]([O-])c1cccc(CCN[C@@H](c2cccs2)c2nnc[nH]2)c1 ZINC000340317248 475941475 /nfs/dbraw/zinc/94/14/75/475941475.db2.gz VQOTWEBIQKMDNR-AWEZNQCLSA-N 0 3 329.385 2.696 20 5 EFBDHN CC(C)c1ccc(CN(C)CCCN2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000349316759 475945340 /nfs/dbraw/zinc/94/53/40/475945340.db2.gz OLNATBQUDMKWNN-UHFFFAOYSA-N 0 3 348.491 2.788 20 5 EFBDHN CCCN(CCN1CCCCC1)c1ccc(C(=O)NC)cc1[N+](=O)[O-] ZINC000343371604 475996458 /nfs/dbraw/zinc/99/64/58/475996458.db2.gz VTDHTJRVJPAFMI-UHFFFAOYSA-N 0 3 348.447 2.657 20 5 EFBDHN CN(C[C@@H]1CCCN(C)C1)C(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000340384637 476000539 /nfs/dbraw/zinc/00/05/39/476000539.db2.gz AYTKMWVGKNCMJW-CQSZACIVSA-N 0 3 333.432 2.673 20 5 EFBDHN CC(C)n1nccc1[C@@H]1OCC[C@@H]1NCc1ccc([N+](=O)[O-])cc1 ZINC000343406319 476035790 /nfs/dbraw/zinc/03/57/90/476035790.db2.gz UVIZLXMZRXUXPZ-DOTOQJQBSA-N 0 3 330.388 2.992 20 5 EFBDHN CCCCN(C)CCN[C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000353515295 476037286 /nfs/dbraw/zinc/03/72/86/476037286.db2.gz DNEMYIZAVJKSLA-QGZVFWFLSA-N 0 3 345.447 2.739 20 5 EFBDHN CCc1ccc([C@H](CNC(=O)c2ccc([N+](=O)[O-])[nH]2)N(C)C)cc1 ZINC000340467510 476052242 /nfs/dbraw/zinc/05/22/42/476052242.db2.gz PUKLJLCJBCMIQG-HNNXBMFYSA-N 0 3 330.388 2.518 20 5 EFBDHN O=C(NCCN1CCCCCC1)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000298339705 476061009 /nfs/dbraw/zinc/06/10/09/476061009.db2.gz IDDJHUUZLJKKLW-UHFFFAOYSA-N 0 3 325.796 2.854 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(NCCCCN2C[C@H](C)O[C@@H](C)C2)c1 ZINC000338679070 476106542 /nfs/dbraw/zinc/10/65/42/476106542.db2.gz VKOOHHCMQAUCKY-KBPBESRZSA-N 0 3 337.420 2.905 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(NCCCCN2C[C@@H](C)O[C@H](C)C2)c1 ZINC000338679072 476107388 /nfs/dbraw/zinc/10/73/88/476107388.db2.gz VKOOHHCMQAUCKY-ZIAGYGMSSA-N 0 3 337.420 2.905 20 5 EFBDHN O=C1NCCc2ccc(CNC/C=C/c3ccccc3[N+](=O)[O-])cc21 ZINC000350269808 476115089 /nfs/dbraw/zinc/11/50/89/476115089.db2.gz SAOWQXWWIMWEJU-HWKANZROSA-N 0 3 337.379 2.684 20 5 EFBDHN O=[N+]([O-])c1ccc(CNC[C@H](CO)Cc2ccc(F)cc2)c(F)c1 ZINC000350287975 476122066 /nfs/dbraw/zinc/12/20/66/476122066.db2.gz NCXLMRLMZYDNQU-CYBMUJFWSA-N 0 3 336.338 2.814 20 5 EFBDHN O=C(CSc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCN(C2CCCC2)C1 ZINC000359058348 476152681 /nfs/dbraw/zinc/15/26/81/476152681.db2.gz CXGGINVHHNBKNQ-CYBMUJFWSA-N 0 3 349.456 2.820 20 5 EFBDHN Cc1ccc(CCCN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1 ZINC000353646083 476153630 /nfs/dbraw/zinc/15/36/30/476153630.db2.gz BSAFVMARJYASPQ-INIZCTEOSA-N 0 3 341.415 2.812 20 5 EFBDHN CN(C)CCN(Cc1ccc(F)cc1F)c1ncccc1[N+](=O)[O-] ZINC000347181774 476153967 /nfs/dbraw/zinc/15/39/67/476153967.db2.gz BWMXGSGIYAOEMT-UHFFFAOYSA-N 0 3 336.342 2.836 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CNCCn3cncn3)s2)cc1 ZINC000336888150 476179466 /nfs/dbraw/zinc/17/94/66/476179466.db2.gz HLWXIBCVMNSYAF-UHFFFAOYSA-N 0 3 329.385 2.705 20 5 EFBDHN CN1CCC2(CCCN2C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)CC1 ZINC000347288316 476232472 /nfs/dbraw/zinc/23/24/72/476232472.db2.gz QSTALGXTINAARE-UHFFFAOYSA-N 0 3 336.367 2.826 20 5 EFBDHN C[C@H](CN1CCC[C@H](C)C1)NC(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000347295676 476238588 /nfs/dbraw/zinc/23/85/88/476238588.db2.gz YSYFCZQBIYQJHE-NWDGAFQWSA-N 0 3 338.383 2.976 20 5 EFBDHN CC(C)CN(CCN(C)C)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000347296233 476239419 /nfs/dbraw/zinc/23/94/19/476239419.db2.gz YWMUSNRCVLSULS-UHFFFAOYSA-N 0 3 326.372 2.785 20 5 EFBDHN CS[C@@H]1CN(c2ccc3cc([N+](=O)[O-])ccc3n2)C[C@@H]1N(C)C ZINC000340733978 476240555 /nfs/dbraw/zinc/24/05/55/476240555.db2.gz BUGCZPRRWBVHBC-LSDHHAIUSA-N 0 3 332.429 2.625 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCN1CCC[C@@H](Cc2ccccc2)C1 ZINC000362467418 476269944 /nfs/dbraw/zinc/26/99/44/476269944.db2.gz GHMXXPQERAPYDW-KRWDZBQOSA-N 0 3 341.411 2.711 20 5 EFBDHN CN1CCC2(CCCN2C(=O)c2cc(F)c([N+](=O)[O-])cc2F)CC1 ZINC000359885466 476270696 /nfs/dbraw/zinc/27/06/96/476270696.db2.gz ZVKVRXXCGQQQLZ-UHFFFAOYSA-N 0 3 339.342 2.573 20 5 EFBDHN Cc1cc(N2CCO[C@@H](CN(C)C)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000360047760 476286662 /nfs/dbraw/zinc/28/66/62/476286662.db2.gz NMDWHWYLZSSRIE-NSHDSACASA-N 0 3 347.337 2.689 20 5 EFBDHN CN(C)CCN(C)c1ccc([N+](=O)[O-])c(OCc2ccccc2)n1 ZINC000360666983 476334758 /nfs/dbraw/zinc/33/47/58/476334758.db2.gz STNLOWWZUHQQJG-UHFFFAOYSA-N 0 3 330.388 2.567 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCCN(C)[C@@H]1C ZINC000360800572 476396169 /nfs/dbraw/zinc/39/61/69/476396169.db2.gz OFJKIOZRJCQXGS-FRFSOERESA-N 0 3 333.432 2.762 20 5 EFBDHN Cc1nn(C)c(NC[C@H]2CCCN(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000377455452 476404105 /nfs/dbraw/zinc/40/41/05/476404105.db2.gz LOZFJPDYJHUWQD-MRXNPFEDSA-N 0 3 343.431 2.961 20 5 EFBDHN CCn1c(C)nc([N+](=O)[O-])c1NCCCN1CCc2ccccc2C1 ZINC000360891093 476458591 /nfs/dbraw/zinc/45/85/91/476458591.db2.gz FYGCFXKIIAPQLK-UHFFFAOYSA-N 0 3 343.431 2.980 20 5 EFBDHN CSc1cccc(C(=O)N[C@@H]2CN(C3CC3)C[C@H]2C)c1[N+](=O)[O-] ZINC000362927181 476485564 /nfs/dbraw/zinc/48/55/64/476485564.db2.gz GVNHLQYPLBSSDC-ZWNOBZJWSA-N 0 3 335.429 2.529 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CN(C2CC2)C[C@@H]1C ZINC000360944812 476491813 /nfs/dbraw/zinc/49/18/13/476491813.db2.gz PCMNZAKZDNOYCW-JCKWVBRZSA-N 0 3 345.443 2.762 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H]2CCN(C)C[C@@H]21 ZINC000360944822 476494118 /nfs/dbraw/zinc/49/41/18/476494118.db2.gz PENLEPBXHMMYCX-NUJGCVRESA-N 0 3 345.443 2.716 20 5 EFBDHN Cc1cc(N[C@@H]2CCN(C)[C@H](C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000361066823 476579000 /nfs/dbraw/zinc/57/90/00/476579000.db2.gz PVAHRXKBRAIUJV-UKRRQHHQSA-N 0 3 341.415 2.677 20 5 EFBDHN CC(C)NC(=O)c1ccc(N[C@H]2CCN(C)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000361100198 476601278 /nfs/dbraw/zinc/60/12/78/476601278.db2.gz XYMQOHYMXHPLJV-JSGCOSHPSA-N 0 3 334.420 2.628 20 5 EFBDHN CC[C@@H]1CCCCN1CCNC(=O)c1cc([N+](=O)[O-])ccc1OC ZINC000354372106 476618593 /nfs/dbraw/zinc/61/85/93/476618593.db2.gz LJTYBDCUOSGXHF-CYBMUJFWSA-N 0 3 335.404 2.598 20 5 EFBDHN COc1cc(C[NH2+]C[C@@]2(C)CCO[C@H]2C2CC2)c([N+](=O)[O-])cc1[O-] ZINC000375121553 476681814 /nfs/dbraw/zinc/68/18/14/476681814.db2.gz RWLQCRPPBBTDEH-DLBZAZTESA-N 0 3 336.388 2.604 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1CN1CCCC1 ZINC000421754213 476693808 /nfs/dbraw/zinc/69/38/08/476693808.db2.gz AXXSUSHFNFNBJP-HNNXBMFYSA-N 0 3 331.416 2.912 20 5 EFBDHN CC(C)N1CCC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000413707260 476699937 /nfs/dbraw/zinc/69/99/37/476699937.db2.gz BGXZJAQYKCHJKS-BHYGNILZSA-N 0 3 331.416 2.687 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCCCNCc1cccnc1 ZINC000422735198 476752580 /nfs/dbraw/zinc/75/25/80/476752580.db2.gz VTESOQOLYMBKOX-UHFFFAOYSA-N 0 3 342.399 2.516 20 5 EFBDHN CCO[C@@H]1CCC[C@H]1NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000452018330 476777526 /nfs/dbraw/zinc/77/75/26/476777526.db2.gz QNSFRAUVCYLJQU-ZIAGYGMSSA-N 0 3 341.795 2.734 20 5 EFBDHN COC(=O)[C@H]1CCCC[C@]1(C)NCc1ccc([N+](=O)[O-])cc1OC ZINC000430199035 476779222 /nfs/dbraw/zinc/77/92/22/476779222.db2.gz AVTYLFINGRKMKL-PBHICJAKSA-N 0 3 336.388 2.815 20 5 EFBDHN Cc1nn(C)cc1[C@@H]1CCCN1CCOc1ccc([N+](=O)[O-])cc1 ZINC000370406875 476794643 /nfs/dbraw/zinc/79/46/43/476794643.db2.gz QILOUMKBRQQNBH-KRWDZBQOSA-N 0 3 330.388 2.853 20 5 EFBDHN CC(C)N1CC[C@@H](N(C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000452118655 476837893 /nfs/dbraw/zinc/83/78/93/476837893.db2.gz PCQZUWNUISTADC-OAHLLOKOSA-N 0 3 345.403 2.559 20 5 EFBDHN Cc1cc(NC(=O)c2ccccc2[N+](=O)[O-])n(C2CCN(C)CC2)n1 ZINC000430477454 476839488 /nfs/dbraw/zinc/83/94/88/476839488.db2.gz RESAQYFTLARGKD-UHFFFAOYSA-N 0 3 343.387 2.619 20 5 EFBDHN COc1cc(C(=O)NCCN2CCCC2(C)C)cc([N+](=O)[O-])c1C ZINC000457060454 476851549 /nfs/dbraw/zinc/85/15/49/476851549.db2.gz SOPRCWQPMXZXBJ-UHFFFAOYSA-N 0 3 335.404 2.516 20 5 EFBDHN COc1ccc(CN[C@@H](C)c2ccc(CN)nc2C)cc1[N+](=O)[O-] ZINC000422949325 476860759 /nfs/dbraw/zinc/86/07/59/476860759.db2.gz VABSCDAPZKRCMJ-NSHDSACASA-N 0 3 330.388 2.616 20 5 EFBDHN C[C@@H]1CN(C(=O)C(C)(C)c2ccccc2[N+](=O)[O-])CCN(C2CC2)C1 ZINC000452169201 476864934 /nfs/dbraw/zinc/86/49/34/476864934.db2.gz FIRCZXYYXGSKLI-AWEZNQCLSA-N 0 3 345.443 2.815 20 5 EFBDHN CSc1cccc(C(=O)N(C)[C@@H]2CCN(C(C)C)C2)c1[N+](=O)[O-] ZINC000457083669 476865833 /nfs/dbraw/zinc/86/58/33/476865833.db2.gz GBOBPRQXFGCDJE-GFCCVEGCSA-N 0 3 337.445 2.871 20 5 EFBDHN C[C@@H]1CN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)CCN(C2CC2)C1 ZINC000452171698 476867351 /nfs/dbraw/zinc/86/73/51/476867351.db2.gz LFRPRRCJNSIIDO-AWEZNQCLSA-N 0 3 345.443 2.815 20 5 EFBDHN COc1ccc(CNC[C@@H]2NCCc3ccccc32)cc1[N+](=O)[O-] ZINC000414958653 476901431 /nfs/dbraw/zinc/90/14/31/476901431.db2.gz RKCCUMKUGKRCBM-INIZCTEOSA-N 0 3 327.384 2.580 20 5 EFBDHN COc1ccc(CNC[C@H]2NCCc3ccccc32)cc1[N+](=O)[O-] ZINC000414958654 476902036 /nfs/dbraw/zinc/90/20/36/476902036.db2.gz RKCCUMKUGKRCBM-MRXNPFEDSA-N 0 3 327.384 2.580 20 5 EFBDHN CC(C)C[C@@H](CN1CCCC1)NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000452342383 476922874 /nfs/dbraw/zinc/92/28/74/476922874.db2.gz OTRMBQUMJCSQHV-HNNXBMFYSA-N 0 3 349.431 2.600 20 5 EFBDHN CC(C)C[C@@H](CN1CCCC1)NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000452342638 476924627 /nfs/dbraw/zinc/92/46/27/476924627.db2.gz IVEZCXIDMNUYLJ-HNNXBMFYSA-N 0 3 349.431 2.600 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN[C@@H]3[C@@H]4CCO[C@@H]4C34CCC4)nc2c1 ZINC000446854535 476928952 /nfs/dbraw/zinc/92/89/52/476928952.db2.gz ZTIFIHPZTSTCSV-XZJROXQQSA-N 0 3 328.372 2.518 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN[C@@H]3[C@@H]4CCO[C@H]4C34CCC4)nc2c1 ZINC000446854533 476929918 /nfs/dbraw/zinc/92/99/18/476929918.db2.gz ZTIFIHPZTSTCSV-IUIKQTSFSA-N 0 3 328.372 2.518 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@H]1NCCc2ccccc21 ZINC000415508728 476933008 /nfs/dbraw/zinc/93/30/08/476933008.db2.gz VOISKZBRHLYUOQ-KRWDZBQOSA-N 0 3 340.383 2.912 20 5 EFBDHN CN(CCc1ccccc1[N+](=O)[O-])Cc1ccc(-n2ccnc2)nc1 ZINC000375665307 476941915 /nfs/dbraw/zinc/94/19/15/476941915.db2.gz LRXKSLMAPLVKGH-UHFFFAOYSA-N 0 3 337.383 2.850 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(NC[C@@]2(O)CCN(Cc3ccccc3)C2)c1 ZINC000447079134 476952141 /nfs/dbraw/zinc/95/21/41/476952141.db2.gz SZVWOBRWWUOIFI-IBGZPJMESA-N 0 3 341.411 2.952 20 5 EFBDHN O=C(NCCc1cccc([N+](=O)[O-])c1)Nc1ccc2c(c1)CNCC2 ZINC000415904950 476965956 /nfs/dbraw/zinc/96/59/56/476965956.db2.gz YXTXRWINULRMDT-UHFFFAOYSA-N 0 3 340.383 2.605 20 5 EFBDHN CN(C)c1cccc(CN[C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)n1 ZINC000447589645 477018223 /nfs/dbraw/zinc/01/82/23/477018223.db2.gz YTHOYUSLKGSGBH-LSDHHAIUSA-N 0 3 344.419 2.526 20 5 EFBDHN C[C@@H](NC[C@H]1CNCCO1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423514487 477056398 /nfs/dbraw/zinc/05/63/98/477056398.db2.gz DDBCEFXGOSMHMQ-CHWSQXEVSA-N 0 3 347.440 2.962 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N[C@@H]1CCN(C)[C@H](C)C1 ZINC000447810569 477064024 /nfs/dbraw/zinc/06/40/24/477064024.db2.gz JQYUQKQAFWEBDD-NXEZZACHSA-N 0 3 341.795 2.929 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N[C@H]1CCN(C)[C@@H](C)C1 ZINC000447810570 477064059 /nfs/dbraw/zinc/06/40/59/477064059.db2.gz JQYUQKQAFWEBDD-UWVGGRQHSA-N 0 3 341.795 2.929 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCc1ccc2c(c1)CNC2 ZINC000423587494 477077105 /nfs/dbraw/zinc/07/71/05/477077105.db2.gz FTRUAUJPACSLBC-UHFFFAOYSA-N 0 3 325.368 2.745 20 5 EFBDHN Cc1cc(OCC(=O)N[C@@H](C)CN2CCC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000431834367 477103507 /nfs/dbraw/zinc/10/35/07/477103507.db2.gz RFCJERZFUANXLS-ZFWWWQNUSA-N 0 3 349.431 2.519 20 5 EFBDHN CC(C)[C@@H](C(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)N(C)C ZINC000452850648 477106266 /nfs/dbraw/zinc/10/62/66/477106266.db2.gz MQZPVKZNTFSXBM-WBVHZDCISA-N 0 3 333.432 2.887 20 5 EFBDHN CCNc1ccc(C(=O)N(C)[C@H]2CCN(C(C)C)C2)cc1[N+](=O)[O-] ZINC000411086728 477109807 /nfs/dbraw/zinc/10/98/07/477109807.db2.gz PGPUBBZQPZICSG-AWEZNQCLSA-N 0 3 334.420 2.581 20 5 EFBDHN COc1ccc(C[C@H]2CCCN(CCn3ccc([N+](=O)[O-])n3)C2)cc1 ZINC000371084199 477115648 /nfs/dbraw/zinc/11/56/48/477115648.db2.gz GEHWPJYIPZHVLN-MRXNPFEDSA-N 0 3 344.415 2.755 20 5 EFBDHN Cc1c(CNC(=O)NC[C@@H]2N(C)CCCC2(C)C)cccc1[N+](=O)[O-] ZINC000448010588 477115709 /nfs/dbraw/zinc/11/57/09/477115709.db2.gz NKVUEOZFRUBCHD-INIZCTEOSA-N 0 3 348.447 2.823 20 5 EFBDHN CCN1CCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000411218926 477155811 /nfs/dbraw/zinc/15/58/11/477155811.db2.gz ANQNAWZOAYVUQV-CQSZACIVSA-N 0 3 335.404 2.596 20 5 EFBDHN CN(CCC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@H](CO)c1ccccc1 ZINC000411220579 477156273 /nfs/dbraw/zinc/15/62/73/477156273.db2.gz GDFSSZTVADOGJU-QGZVFWFLSA-N 0 3 343.383 2.589 20 5 EFBDHN C[C@@H](CCCc1cccnc1)NCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000453123332 477173698 /nfs/dbraw/zinc/17/36/98/477173698.db2.gz QICSUODFRUSLNR-AWEZNQCLSA-N 0 3 342.399 2.929 20 5 EFBDHN C[C@@H]1CCCN(CCNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000411414423 477225640 /nfs/dbraw/zinc/22/56/40/477225640.db2.gz MANJFIJCKGTTNI-XOKHGSTOSA-N 0 3 331.416 2.546 20 5 EFBDHN CC(C)N1CC[C@@H](N(C)C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000457843630 477227286 /nfs/dbraw/zinc/22/72/86/477227286.db2.gz BKJRACINQLKBJE-XJKSGUPXSA-N 0 3 334.420 2.780 20 5 EFBDHN CCc1ccccc1[C@@H](N)CNC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000423971687 477239072 /nfs/dbraw/zinc/23/90/72/477239072.db2.gz HFODIOIGGOBHEI-KRWDZBQOSA-N 0 3 327.384 2.516 20 5 EFBDHN CCOc1cc(NCCCN2CCCO[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000432871745 477283127 /nfs/dbraw/zinc/28/31/27/477283127.db2.gz JLXLZDSLAQQEKC-AWEZNQCLSA-N 0 3 337.420 2.906 20 5 EFBDHN CC(C)C[C@@H](CN1CCCC1)NC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000454284871 477284432 /nfs/dbraw/zinc/28/44/32/477284432.db2.gz YVWXLADKMVLNLQ-INIZCTEOSA-N 0 3 348.447 2.905 20 5 EFBDHN C[C@]1(CNC(=O)c2ccc([N+](=O)[O-])o2)CCN(Cc2ccccc2)C1 ZINC000366987187 477287158 /nfs/dbraw/zinc/28/71/58/477287158.db2.gz DJFXEZOXWSZTNZ-GOSISDBHSA-N 0 3 343.383 2.830 20 5 EFBDHN CCn1cccc(CNC/C(C)=C\c2cccc([N+](=O)[O-])c2)c1=O ZINC000433175130 477316384 /nfs/dbraw/zinc/31/63/84/477316384.db2.gz NEOMTFFZTRYGNR-UVTDQMKNSA-N 0 3 327.384 2.970 20 5 EFBDHN O=C(CCN1CCSC[C@H]1C1CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411796287 477371895 /nfs/dbraw/zinc/37/18/95/477371895.db2.gz VUGRWVNQXFVPNT-HNNXBMFYSA-N 0 3 335.429 2.751 20 5 EFBDHN CC(C)Oc1cc(C(=O)NC[C@H](C)N(C)C2CC2)ccc1[N+](=O)[O-] ZINC000411968321 477400238 /nfs/dbraw/zinc/40/02/38/477400238.db2.gz FVRMAHOPNMPLHN-LBPRGKRZSA-N 0 3 335.404 2.595 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@](C(N)=O)(c2ccccc2)C1 ZINC000411971581 477401987 /nfs/dbraw/zinc/40/19/87/477401987.db2.gz UERVPZCZIXDMGY-AUUYWEPGSA-N 0 3 339.395 2.785 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1C[C@H](C(N)=O)[C@@H](c2ccccc2)C1 ZINC000411991124 477402473 /nfs/dbraw/zinc/40/24/73/477402473.db2.gz YLSZCMZBHDJCKW-XYPHTWIQSA-N 0 3 339.395 2.857 20 5 EFBDHN CN(C)[C@H](CNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)C1CC1 ZINC000436060440 477414336 /nfs/dbraw/zinc/41/43/36/477414336.db2.gz NNWBGGQFGGAOQX-LJQANCHMSA-N 0 3 349.434 2.751 20 5 EFBDHN O=C(N[C@H]1CCN(C2CCCC2)C1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000376620865 477432238 /nfs/dbraw/zinc/43/22/38/477432238.db2.gz UCQVIORINUSERZ-LBPRGKRZSA-N 0 3 337.807 2.995 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N[C@H]1CCN(c2ccccc2)C1=O ZINC000449121864 477447999 /nfs/dbraw/zinc/44/79/99/477447999.db2.gz IXHWNFSYPZSJPK-YOEHRIQHSA-N 0 3 339.395 2.921 20 5 EFBDHN Cc1ccc(NC(=O)N2CCCC23CCN(C)CC3)cc1[N+](=O)[O-] ZINC000367357984 477471338 /nfs/dbraw/zinc/47/13/38/477471338.db2.gz GJDIHUSECSXUPD-UHFFFAOYSA-N 0 3 332.404 2.995 20 5 EFBDHN C[C@H](NC(=O)N1CC[C@H](N2CCCCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000455094723 477496237 /nfs/dbraw/zinc/49/62/37/477496237.db2.gz PJUOFBPCEHLAKT-YOEHRIQHSA-N 0 3 346.431 2.926 20 5 EFBDHN O=[N+]([O-])c1ccc(S(=O)(=O)CCN[C@H]2CCCC23CCC3)cc1 ZINC000449236820 477499303 /nfs/dbraw/zinc/49/93/03/477499303.db2.gz LWXJAJLNRIXYQE-HNNXBMFYSA-N 0 3 338.429 2.681 20 5 EFBDHN CC[C@@H]1CN(c2ccc([N+](=O)[O-])c3ncccc23)CCN1CCOC ZINC000413124354 477532386 /nfs/dbraw/zinc/53/23/86/477532386.db2.gz COKSBDPCEVQOFO-CQSZACIVSA-N 0 3 344.415 2.690 20 5 EFBDHN Cc1c(CNC(=O)N2CC[C@]3(C2)CCCN(C)C3)cccc1[N+](=O)[O-] ZINC000458688394 477548319 /nfs/dbraw/zinc/54/83/19/477548319.db2.gz JEMVAQPAVSEAHC-GOSISDBHSA-N 0 3 346.431 2.531 20 5 EFBDHN CN(CC1CCN(c2ccncc2)CC1)c1ncc([N+](=O)[O-])cc1F ZINC000413215053 477573860 /nfs/dbraw/zinc/57/38/60/477573860.db2.gz NPVILRCHVJJXGP-UHFFFAOYSA-N 0 3 345.378 2.877 20 5 EFBDHN CN1C[C@@H]2CCCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[C@@H]2C1 ZINC000425051666 477619034 /nfs/dbraw/zinc/61/90/34/477619034.db2.gz UHJLFXPPBTXFJL-SMDDNHRTSA-N 0 3 345.424 2.976 20 5 EFBDHN C[C@@H]1CN(c2ncc([N+](=O)[O-])cc2C(F)(F)F)CCN(C2CC2)C1 ZINC000413322858 477627856 /nfs/dbraw/zinc/62/78/56/477627856.db2.gz HOPAOSAMSXVYCP-JTQLQIEISA-N 0 3 344.337 2.929 20 5 EFBDHN CC(C)c1ccc(C(=O)N2CCC[C@H]3CN(C)C[C@H]32)cc1[N+](=O)[O-] ZINC000425070628 477629037 /nfs/dbraw/zinc/62/90/37/477629037.db2.gz WWQHLZPFULZVRX-WMLDXEAASA-N 0 3 331.416 2.884 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1CCN(C2CC2)C[C@H](C)C1 ZINC000450549848 477629747 /nfs/dbraw/zinc/62/97/47/477629747.db2.gz WHHJQCUTMVKLGR-LBPRGKRZSA-N 0 3 347.415 2.610 20 5 EFBDHN CCCCN1CCCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1OC ZINC000426961510 477762725 /nfs/dbraw/zinc/76/27/25/477762725.db2.gz ALYINBIKKQYVPS-HNNXBMFYSA-N 0 3 349.431 2.988 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCN1CCC(c2cccc(F)c2)CC1 ZINC000372349885 477766948 /nfs/dbraw/zinc/76/69/48/477766948.db2.gz LEGNXNVMBDJDAW-UHFFFAOYSA-N 0 3 345.374 2.775 20 5 EFBDHN Cc1ccc(CN[C@H]([C@@H]2CCCO2)C2(CO)CCC2)cc1[N+](=O)[O-] ZINC000367956277 477770046 /nfs/dbraw/zinc/77/00/46/477770046.db2.gz MGRUYSNVZRHEHT-DLBZAZTESA-N 0 3 334.416 2.703 20 5 EFBDHN Cc1ccc(CN[C@@H]([C@H]2CCCO2)C2(CO)CCC2)cc1[N+](=O)[O-] ZINC000367956280 477770543 /nfs/dbraw/zinc/77/05/43/477770543.db2.gz MGRUYSNVZRHEHT-SJORKVTESA-N 0 3 334.416 2.703 20 5 EFBDHN Cc1ccc(CN[C@@H]([C@@H]2CCCO2)C2(CO)CCC2)cc1[N+](=O)[O-] ZINC000367956279 477770563 /nfs/dbraw/zinc/77/05/63/477770563.db2.gz MGRUYSNVZRHEHT-IRXDYDNUSA-N 0 3 334.416 2.703 20 5 EFBDHN CC1(C)CCCN1CCNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000450947451 477771099 /nfs/dbraw/zinc/77/10/99/477771099.db2.gz BUZVHENBJLAZID-UHFFFAOYSA-N 0 3 332.404 2.766 20 5 EFBDHN CC(C)c1ccc(CN2CCN(CC(C)(C)O)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000438253483 477813529 /nfs/dbraw/zinc/81/35/29/477813529.db2.gz DWZZZGKSRDIFBG-HNNXBMFYSA-N 0 3 349.475 2.995 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN(CCO)C2CCOCC2)o1 ZINC000438334331 477826526 /nfs/dbraw/zinc/82/65/26/477826526.db2.gz ZFIDXSGSGLQNCJ-UHFFFAOYSA-N 0 3 346.383 2.828 20 5 EFBDHN CC(C)[C@H](CN[C@@H]1CCc2c1cccc2[N+](=O)[O-])N1CCOCC1 ZINC000515501033 477833127 /nfs/dbraw/zinc/83/31/27/477833127.db2.gz YSZQNDGAZXCICN-AEFFLSMTSA-N 0 3 333.432 2.529 20 5 EFBDHN CC[C@@H]1CN(Cc2c(Cl)cccc2[N+](=O)[O-])CCN1C[C@H](C)O ZINC000493819331 477841222 /nfs/dbraw/zinc/84/12/22/477841222.db2.gz MQESFAODTAYTGG-QWHCGFSZSA-N 0 3 341.839 2.525 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1C[C@H](N2CCOCC2)C[C@@H]1C ZINC000558411625 477863851 /nfs/dbraw/zinc/86/38/51/477863851.db2.gz JWQHBSUVKJUHAU-SCAUPEPPSA-N 0 3 345.443 2.793 20 5 EFBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1C[C@H]2C[C@H](Cn3c(=O)cccc32)C1 ZINC000451226165 477888322 /nfs/dbraw/zinc/88/83/22/477888322.db2.gz HGBOYKOAYPUDDK-SOUVJXGZSA-N 0 3 339.395 2.937 20 5 EFBDHN CN(Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C[C@H]1CCCN1C ZINC000421011096 477898913 /nfs/dbraw/zinc/89/89/13/477898913.db2.gz RUWGFMBLPTXOBV-MRXNPFEDSA-N 0 3 330.388 2.776 20 5 EFBDHN Cc1c(CC(=O)NC[C@H](C)N2CCCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000438903069 477903161 /nfs/dbraw/zinc/90/31/61/477903161.db2.gz PQWZGTJPVIHERJ-KBPBESRZSA-N 0 3 333.432 2.825 20 5 EFBDHN CN(C[C@H]1CCCN1C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000421033182 477922703 /nfs/dbraw/zinc/92/27/03/477922703.db2.gz AGIJWMKTPZXCCQ-LLVKDONJSA-N 0 3 326.784 2.806 20 5 EFBDHN Cc1c([C@H](C)NC[C@H](O)COc2ccccc2)cccc1[N+](=O)[O-] ZINC000532453083 477930534 /nfs/dbraw/zinc/93/05/34/477930534.db2.gz URAMVSZFTFFMCN-GJZGRUSLSA-N 0 3 330.384 2.994 20 5 EFBDHN Cn1ccnc1[C@H]1OCCC[C@@H]1N[C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000516491920 477941328 /nfs/dbraw/zinc/94/13/28/477941328.db2.gz MQJSGVNMGKDBQR-ZOBUZTSGSA-N 0 3 342.399 2.826 20 5 EFBDHN Cc1c(CC(=O)N2CCCN(C(C)(C)C)CC2)cccc1[N+](=O)[O-] ZINC000532676810 477969581 /nfs/dbraw/zinc/96/95/81/477969581.db2.gz VFGHJAHKOLGLIF-UHFFFAOYSA-N 0 3 333.432 2.779 20 5 EFBDHN CC1(C)Cc2ccsc2CN1CCn1cc([N+](=O)[O-])ccc1=O ZINC000459583967 477990117 /nfs/dbraw/zinc/99/01/17/477990117.db2.gz QDRHYFFEEUNLJZ-UHFFFAOYSA-N 0 3 333.413 2.655 20 5 EFBDHN CN(Cc1ccccc1)CC(C)(C)NC(=O)c1cc([N+](=O)[O-])cn1C ZINC000532821493 477995084 /nfs/dbraw/zinc/99/50/84/477995084.db2.gz PTNGYAINFGQBIA-UHFFFAOYSA-N 0 3 344.415 2.574 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CNC[C@H](O)[C@H](C)c1ccccc1 ZINC000516921934 478012517 /nfs/dbraw/zinc/01/25/17/478012517.db2.gz XTTWTWPLTGORTC-DYVFJYSZSA-N 0 3 330.384 2.858 20 5 EFBDHN COc1ccc(NC(=O)CN[C@@H]2CCC23CCCC3)c([N+](=O)[O-])c1 ZINC000451454244 478025975 /nfs/dbraw/zinc/02/59/75/478025975.db2.gz HVFHBVVQHZKGJL-OAHLLOKOSA-N 0 3 333.388 2.854 20 5 EFBDHN Cc1nc(NC[C@H]2CCCN(C)[C@@H]2c2ccccc2)ncc1[N+](=O)[O-] ZINC000560213396 478032926 /nfs/dbraw/zinc/03/29/26/478032926.db2.gz LJWYAZMBFQIZKN-NVXWUHKLSA-N 0 3 341.415 2.610 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@@H]1[C@H]2CCCO[C@H]2C1(C)C ZINC000451477142 478037290 /nfs/dbraw/zinc/03/72/90/478037290.db2.gz HGIFYXQJBLEBJI-KBRIMQKVSA-N 0 3 347.415 2.635 20 5 EFBDHN Cc1ccc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1F ZINC000517042958 478043136 /nfs/dbraw/zinc/04/31/36/478043136.db2.gz DXOQIIJKKGNWIM-HNNXBMFYSA-N 0 3 334.347 2.572 20 5 EFBDHN CCCCN(C)CCNC(=O)Nc1cc([N+](=O)[O-])ccc1OCC ZINC000439909500 478048117 /nfs/dbraw/zinc/04/81/17/478048117.db2.gz PIDQHHNWCUQGDH-UHFFFAOYSA-N 0 3 338.408 2.847 20 5 EFBDHN COc1ccc([C@H](CO)CNCc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000459769018 478083781 /nfs/dbraw/zinc/08/37/81/478083781.db2.gz YVKTUYFRTKXXEP-AWEZNQCLSA-N 0 3 334.347 2.608 20 5 EFBDHN CNc1ccc(C(=O)NC[C@H]2CCCCN2CC(C)C)cc1[N+](=O)[O-] ZINC000533506526 478090520 /nfs/dbraw/zinc/09/05/20/478090520.db2.gz OYVIKKFEELCJLS-OAHLLOKOSA-N 0 3 348.447 2.877 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N[C@H]1CCC[C@@H]2C[C@@H]21 ZINC000459796380 478097378 /nfs/dbraw/zinc/09/73/78/478097378.db2.gz YMOSVCLUTPCVQJ-RFHZTLPTSA-N 0 3 333.388 2.709 20 5 EFBDHN COCCN(CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[C@H]1C ZINC000488001427 478105226 /nfs/dbraw/zinc/10/52/26/478105226.db2.gz JRNMJACNHQHPHS-RHSMWYFYSA-N 0 3 349.431 2.695 20 5 EFBDHN O=[N+]([O-])c1cc(F)c(CN[C@H]([C@@H](CO)C2CC2)C2CC2)c(F)c1 ZINC000451593582 478114316 /nfs/dbraw/zinc/11/43/16/478114316.db2.gz CWKQBEOPNOWMRA-BBRMVZONSA-N 0 3 326.343 2.760 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCN[C@]2(CO)CCCc3ccccc32)cc1 ZINC000440481134 478122969 /nfs/dbraw/zinc/12/29/69/478122969.db2.gz MHEHZDJTBSWIPQ-IBGZPJMESA-N 0 3 342.395 2.787 20 5 EFBDHN COC(=O)[C@H]1CCN(Cc2ccc(OC)c([N+](=O)[O-])c2)[C@H]1C(C)C ZINC000429388098 478127154 /nfs/dbraw/zinc/12/71/54/478127154.db2.gz ULMFONMGHUXMPX-BBRMVZONSA-N 0 3 336.388 2.623 20 5 EFBDHN C[C@@H]1CN(C2CC2)C[C@@H]1Nc1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000534144703 478128168 /nfs/dbraw/zinc/12/81/68/478128168.db2.gz RIZROCYUNDSVHC-CJNGLKHVSA-N 0 3 338.411 2.973 20 5 EFBDHN Cc1cccc2c1CN(C[C@@H](O)COc1cccc([N+](=O)[O-])c1)CC2 ZINC000429583574 478159921 /nfs/dbraw/zinc/15/99/21/478159921.db2.gz BLKXWISXUQAOKO-QGZVFWFLSA-N 0 3 342.395 2.701 20 5 EFBDHN CC(=O)c1cc(N2CCN([C@@H]3C[C@H]3C)C[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000488750671 478178754 /nfs/dbraw/zinc/17/87/54/478178754.db2.gz OGPRWAMBIYHINH-VEVIJQCQSA-N 0 3 331.416 2.964 20 5 EFBDHN COC(=O)c1ccc([N+](=O)[O-])c(N2CCN([C@@H]3C[C@H]3C)C[C@@H](C)C2)c1 ZINC000488763657 478180264 /nfs/dbraw/zinc/18/02/64/478180264.db2.gz JSXKSTKVZSRSFZ-XJKCOSOUSA-N 0 3 347.415 2.548 20 5 EFBDHN CC(C)Oc1nc(N2CCN(C3CC3)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000518999973 478204219 /nfs/dbraw/zinc/20/42/19/478204219.db2.gz NYQHQSOVQRCMPP-ZDUSSCGKSA-N 0 3 334.420 2.698 20 5 EFBDHN CCCCN(C)CCNC(=O)NC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000488966355 478206475 /nfs/dbraw/zinc/20/64/75/478206475.db2.gz AKAVLNTUQMYHTP-UHFFFAOYSA-N 0 3 336.436 2.861 20 5 EFBDHN O=[N+]([O-])c1ccn(C2CCN(CCc3ccc4c(c3)CCO4)CC2)n1 ZINC000489030649 478212699 /nfs/dbraw/zinc/21/26/99/478212699.db2.gz YSILLQSSHWOGRZ-UHFFFAOYSA-N 0 3 342.399 2.606 20 5 EFBDHN O=[N+]([O-])c1cccc(OCCN2CCC(Nc3ccccn3)CC2)c1 ZINC000535577064 478216905 /nfs/dbraw/zinc/21/69/05/478216905.db2.gz ZPQMPOXYRLFRER-UHFFFAOYSA-N 0 3 342.399 2.945 20 5 EFBDHN COC(=O)N1CCC(CNCc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000495619777 478247485 /nfs/dbraw/zinc/24/74/85/478247485.db2.gz YPBZJJWZXCYZJU-UHFFFAOYSA-N 0 3 341.795 2.816 20 5 EFBDHN O=[N+]([O-])c1cc(CN2CCC[C@@H]2[C@@H]2CCCOC2)c2c(c1)COCO2 ZINC000579350057 478277335 /nfs/dbraw/zinc/27/73/35/478277335.db2.gz YQKFKZOIJWOCTI-CXAGYDPISA-N 0 3 348.399 2.852 20 5 EFBDHN O=[N+]([O-])c1cccc2c1ccnc2NC1CCN([C@@H]2CCOC2)CC1 ZINC000590694412 478295053 /nfs/dbraw/zinc/29/50/53/478295053.db2.gz JMBBSFWHMKNZEM-CQSZACIVSA-N 0 3 342.399 2.808 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1CCCN2CCCC[C@H]12 ZINC000594281053 478318049 /nfs/dbraw/zinc/31/80/49/478318049.db2.gz BDLRWTFUCSAYCO-NVXWUHKLSA-N 0 3 346.431 2.753 20 5 EFBDHN COC(=O)[C@@H]1CCC[C@@H]1NCc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000590752417 478319312 /nfs/dbraw/zinc/31/93/12/478319312.db2.gz TWYZUHZWMWYDJJ-CABCVRRESA-N 0 3 336.388 2.813 20 5 EFBDHN Cc1ccc(CN(C)CCC(=O)Nc2ccccc2[N+](=O)[O-])nc1 ZINC000590755000 478320580 /nfs/dbraw/zinc/32/05/80/478320580.db2.gz ZIDWTGXFAIOCHK-UHFFFAOYSA-N 0 3 328.372 2.759 20 5 EFBDHN O=C(N[C@@H]1CCCN2CCCC[C@@H]12)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000594418473 478374638 /nfs/dbraw/zinc/37/46/38/478374638.db2.gz JFLMTVQWBUWCEU-HIFRSBDPSA-N 0 3 342.399 2.823 20 5 EFBDHN O=C(N[C@H]1CCCN2CCCC[C@@H]12)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000594419135 478375962 /nfs/dbraw/zinc/37/59/62/478375962.db2.gz NOIQGYXGYBBVQX-ZFWWWQNUSA-N 0 3 342.399 2.823 20 5 EFBDHN CC[C@H]1CN(C)CCN1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000563022648 478420002 /nfs/dbraw/zinc/42/00/02/478420002.db2.gz CAYXIOOTHIQASZ-HNNXBMFYSA-N 0 3 344.415 2.818 20 5 EFBDHN CC[C@@H]1CN(C)CCCN1C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000597603439 478427886 /nfs/dbraw/zinc/42/78/86/478427886.db2.gz BYXDEXGJEZXOFI-CYBMUJFWSA-N 0 3 337.445 2.630 20 5 EFBDHN Cc1ccc([C@H](C)NCCC(=O)Nc2ccccn2)cc1[N+](=O)[O-] ZINC000539715419 478428582 /nfs/dbraw/zinc/42/85/82/478428582.db2.gz ANYYRLXPNGFCHU-ZDUSSCGKSA-N 0 3 328.372 2.978 20 5 EFBDHN CC[C@H]1CN(C)CCCN1C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000597604151 478428646 /nfs/dbraw/zinc/42/86/46/478428646.db2.gz GTHAJXVPZAQKDA-LBPRGKRZSA-N 0 3 330.388 2.632 20 5 EFBDHN CC[C@@H]1CN(C)CCCN1C(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000597605705 478430392 /nfs/dbraw/zinc/43/03/92/478430392.db2.gz SBIHMZOIBDLODA-QWHCGFSZSA-N 0 3 337.395 2.780 20 5 EFBDHN Cn1ncc2c1CCCN(CCCOc1ccc([N+](=O)[O-])cc1)C2 ZINC000591041801 478442122 /nfs/dbraw/zinc/44/21/22/478442122.db2.gz MTJZRNDMPKLJIL-UHFFFAOYSA-N 0 3 330.388 2.546 20 5 EFBDHN COc1cccc(C(=O)N2CCCN(C(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000570783797 478444213 /nfs/dbraw/zinc/44/42/13/478444213.db2.gz MVBHYAZRZUAZDN-UHFFFAOYSA-N 0 3 335.404 2.550 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@@H]2CCN(Cc3ccc4[nH]cnc4c3)C2)nc1 ZINC000539838784 478445206 /nfs/dbraw/zinc/44/52/06/478445206.db2.gz YHUCISLQVNKEEE-CYBMUJFWSA-N 0 3 338.371 2.553 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@@H]2CCN(Cc3ccc4nc[nH]c4c3)C2)nc1 ZINC000539838784 478445211 /nfs/dbraw/zinc/44/52/11/478445211.db2.gz YHUCISLQVNKEEE-CYBMUJFWSA-N 0 3 338.371 2.553 20 5 EFBDHN CCC(C)(C)N1CCN(c2ncnc3cccc([N+](=O)[O-])c32)CC1 ZINC000594593889 478453726 /nfs/dbraw/zinc/45/37/26/478453726.db2.gz GEINVFCFNWBSQH-UHFFFAOYSA-N 0 3 329.404 2.849 20 5 EFBDHN O=[N+]([O-])c1ccc2ncnc(N[C@@H]3CCCN4CCCC[C@H]34)c2c1 ZINC000594596604 478455472 /nfs/dbraw/zinc/45/54/72/478455472.db2.gz AUHVPCMWJXPXMX-HZPDHXFCSA-N 0 3 327.388 2.967 20 5 EFBDHN CN1CC[C@@]2(C1)CCCN(C(=O)c1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000597714144 478476350 /nfs/dbraw/zinc/47/63/50/478476350.db2.gz GTJIGMCIKWIRFC-MRXNPFEDSA-N 0 3 337.807 2.806 20 5 EFBDHN CN1CC[C@@]2(C1)CCCN(C(=O)c1c[nH]c3cc([N+](=O)[O-])ccc13)C2 ZINC000597716946 478478022 /nfs/dbraw/zinc/47/80/22/478478022.db2.gz UFNYIQPURNXPFB-GOSISDBHSA-N 0 3 342.399 2.634 20 5 EFBDHN CN(C)C[C@@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000563253911 478495892 /nfs/dbraw/zinc/49/58/92/478495892.db2.gz FYUHVJKJQFEMPG-YESZJQIVSA-N 0 3 331.416 2.641 20 5 EFBDHN C[C@H](NC(=O)Nc1cnc2c(c1)CNCC2)c1cccc([N+](=O)[O-])c1 ZINC000591310680 478518058 /nfs/dbraw/zinc/51/80/58/478518058.db2.gz BDEYSDBMDFDCFH-NSHDSACASA-N 0 3 341.371 2.518 20 5 EFBDHN Cc1ncsc1CNC1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000600849140 478540280 /nfs/dbraw/zinc/54/02/80/478540280.db2.gz KUHQMOIKSPJTME-UHFFFAOYSA-N 0 3 333.417 2.513 20 5 EFBDHN COc1ccc(OCCN(C)CCc2ccccc2O)c([N+](=O)[O-])c1 ZINC000541392019 478555600 /nfs/dbraw/zinc/55/56/00/478555600.db2.gz DNEZVTOXSCDRGI-UHFFFAOYSA-N 0 3 346.383 2.862 20 5 EFBDHN COC[C@H](N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)C ZINC000541597042 478572400 /nfs/dbraw/zinc/57/24/00/478572400.db2.gz KQXFGEIHHPVPFJ-HZMBPMFUSA-N 0 3 343.811 2.836 20 5 EFBDHN C[C@H](C(=O)N[C@H]1CCN(C(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1F ZINC000597920377 478574916 /nfs/dbraw/zinc/57/49/16/478574916.db2.gz ASNIATBAQPTNDI-RYUDHWBXSA-N 0 3 337.395 2.826 20 5 EFBDHN CN(C)C[C@H]1CCCCN1C(=O)/C=C\c1ccc(F)cc1[N+](=O)[O-] ZINC000491531660 478578391 /nfs/dbraw/zinc/57/83/91/478578391.db2.gz HOVOWWZOTQQWFK-SOIVGHGOSA-N 0 3 335.379 2.690 20 5 EFBDHN CC(C)(C)N1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000597925837 478579218 /nfs/dbraw/zinc/57/92/18/478579218.db2.gz SGOPWHDONWGVJZ-JTQLQIEISA-N 0 3 325.796 2.851 20 5 EFBDHN COc1cc(CN[C@H](C)CN2CCCCC2)c([N+](=O)[O-])cc1OC ZINC000594914175 478582908 /nfs/dbraw/zinc/58/29/08/478582908.db2.gz DZINEJQWGHYRSX-CYBMUJFWSA-N 0 3 337.420 2.576 20 5 EFBDHN CCC[C@H](NC[C@H](O)COc1ccccc1[N+](=O)[O-])c1ccccn1 ZINC000591734563 478615434 /nfs/dbraw/zinc/61/54/34/478615434.db2.gz PDNHRSFMZGVAKU-GJZGRUSLSA-N 0 3 345.399 2.861 20 5 EFBDHN CCCN1CC[C@H](NCc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000594992421 478619995 /nfs/dbraw/zinc/61/99/95/478619995.db2.gz RCQCTWWAKKECAC-LBPRGKRZSA-N 0 3 329.347 2.770 20 5 EFBDHN CC1(C)CCC[C@@H]1CNCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000591767788 478625592 /nfs/dbraw/zinc/62/55/92/478625592.db2.gz KWUXCZBJKQYGIV-CYBMUJFWSA-N 0 3 340.445 2.784 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCCCOC[C@@H]1CCOC1 ZINC000595007938 478626844 /nfs/dbraw/zinc/62/68/44/478626844.db2.gz LIDRRRSBUWXTCO-KGLIPLIRSA-N 0 3 338.404 2.697 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)N[C@@H](CO)Cc1ccccc1 ZINC000595008662 478627978 /nfs/dbraw/zinc/62/79/78/478627978.db2.gz POUKSMWUCTXGEV-UKRRQHHQSA-N 0 3 330.384 2.858 20 5 EFBDHN CNC(=O)C1CCC(N[C@@H](C)c2ccc([N+](=O)[O-])cc2OC)CC1 ZINC000595017381 478629517 /nfs/dbraw/zinc/62/95/17/478629517.db2.gz UOLBHDMXUQPJGT-HIFPTAJRSA-N 0 3 335.404 2.559 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCCN(C)CC(F)(F)F ZINC000595020981 478631370 /nfs/dbraw/zinc/63/13/70/478631370.db2.gz WETNGUJPKACFJJ-SNVBAGLBSA-N 0 3 335.326 2.748 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@@H](CO)Cc1ccco1 ZINC000595020753 478631629 /nfs/dbraw/zinc/63/16/29/478631629.db2.gz NNWWCUHZJNDOOA-STQMWFEESA-N 0 3 334.372 2.698 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@H](CO)Cc1ccco1 ZINC000595018403 478631765 /nfs/dbraw/zinc/63/17/65/478631765.db2.gz NNWWCUHZJNDOOA-CHWSQXEVSA-N 0 3 334.372 2.698 20 5 EFBDHN C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000582580518 478632856 /nfs/dbraw/zinc/63/28/56/478632856.db2.gz LCGBUWULTMWGNJ-ILXRZTDVSA-N 0 3 333.432 2.935 20 5 EFBDHN CCCN1C[C@@H](CN[C@H](C)c2ccc([N+](=O)[O-])cc2OC)CC1=O ZINC000595044434 478638416 /nfs/dbraw/zinc/63/84/16/478638416.db2.gz MSMUGMPMAHQNMO-CHWSQXEVSA-N 0 3 335.404 2.513 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCC1([S@@](C)=O)CCC1 ZINC000595040324 478639338 /nfs/dbraw/zinc/63/93/38/478639338.db2.gz UAVOQQYZYJJIIZ-RKFFSXRUSA-N 0 3 326.418 2.555 20 5 EFBDHN Cc1cccc(OC[C@]2(O)CCN(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000601069079 478639503 /nfs/dbraw/zinc/63/95/03/478639503.db2.gz KJHPZENQJJVVRI-IBGZPJMESA-N 0 3 342.395 2.919 20 5 EFBDHN O=[N+]([O-])c1cc(F)ccc1OC[C@@]1(O)CCN(Cc2ccccc2)C1 ZINC000601068609 478639715 /nfs/dbraw/zinc/63/97/15/478639715.db2.gz IDPBSZNKHMUHHZ-GOSISDBHSA-N 0 3 346.358 2.750 20 5 EFBDHN O=[N+]([O-])c1cccc(F)c1OC[C@]1(O)CCN(Cc2ccccc2)C1 ZINC000601071238 478641764 /nfs/dbraw/zinc/64/17/64/478641764.db2.gz YLCSTHPMRFAIJU-SFHVURJKSA-N 0 3 346.358 2.750 20 5 EFBDHN COC[C@H](NCc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])C(C)C ZINC000542526751 478660656 /nfs/dbraw/zinc/66/06/56/478660656.db2.gz PRKDPAVDRKTPTQ-NSHDSACASA-N 0 3 348.346 2.965 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC1CCN([C@@H]2CCOC2)CC1 ZINC000595100807 478660645 /nfs/dbraw/zinc/66/06/45/478660645.db2.gz JAOFEKWVYUNTRG-XJKSGUPXSA-N 0 3 349.431 2.507 20 5 EFBDHN CCOC(=O)Cc1ccc(NC[C@@H]2CCCN2CC)c([N+](=O)[O-])c1 ZINC000591888757 478675439 /nfs/dbraw/zinc/67/54/39/478675439.db2.gz AUMLUIKKMQAQCC-AWEZNQCLSA-N 0 3 335.404 2.597 20 5 EFBDHN CCOC(=O)Cc1ccc(NCCN2CCCCC2)c([N+](=O)[O-])c1 ZINC000591896680 478681819 /nfs/dbraw/zinc/68/18/19/478681819.db2.gz CKIOPQOCPOLHME-UHFFFAOYSA-N 0 3 335.404 2.598 20 5 EFBDHN COc1c(C(=O)N[C@H]2CCN(C3CCCCC3)C2)cccc1[N+](=O)[O-] ZINC000598218508 478709731 /nfs/dbraw/zinc/70/97/31/478709731.db2.gz GSGAJSFTMVBMPU-ZDUSSCGKSA-N 0 3 347.415 2.740 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2NCCc1nnc2n1CCCCC2 ZINC000564226333 478710701 /nfs/dbraw/zinc/71/07/01/478710701.db2.gz VCMBEFSARZUEMP-HNNXBMFYSA-N 0 3 341.415 2.732 20 5 EFBDHN O=C(N[C@H]1CCN(C2CCCCC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000598220964 478711661 /nfs/dbraw/zinc/71/16/61/478711661.db2.gz SGOFGXZOBHVZBM-LBPRGKRZSA-N 0 3 335.379 2.871 20 5 EFBDHN O=C(N[C@@H]1CCN(C2CCCCC2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000598220962 478712109 /nfs/dbraw/zinc/71/21/09/478712109.db2.gz SGOFGXZOBHVZBM-GFCCVEGCSA-N 0 3 335.379 2.871 20 5 EFBDHN CN1CC[C@@H]2CN(c3c(Br)cccc3[N+](=O)[O-])C[C@@H]2C1 ZINC000601184137 478712241 /nfs/dbraw/zinc/71/22/41/478712241.db2.gz HZVGAKLQXUXOCV-MNOVXSKESA-N 0 3 340.221 2.745 20 5 EFBDHN C[C@H](CN1CCC(C)CC1)NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000598262482 478730664 /nfs/dbraw/zinc/73/06/64/478730664.db2.gz KUMAPDODDXOFIB-CYBMUJFWSA-N 0 3 344.415 2.926 20 5 EFBDHN CCOc1ccc(C(=O)N[C@H](C)CN2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000598266428 478733300 /nfs/dbraw/zinc/73/33/00/478733300.db2.gz XVQWLMHFYWHIOI-CQSZACIVSA-N 0 3 349.431 2.844 20 5 EFBDHN Cc1noc(CN2CCCN(Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000595329767 478734761 /nfs/dbraw/zinc/73/47/61/478734761.db2.gz IKLHSPJXYFEGFN-CQSZACIVSA-N 0 3 344.415 2.988 20 5 EFBDHN CN1CCC[C@@H](CNc2nc(-c3ccc([N+](=O)[O-])cc3)cs2)C1 ZINC000583124504 478767651 /nfs/dbraw/zinc/76/76/51/478767651.db2.gz BZFNVRRQCCZVLB-LBPRGKRZSA-N 0 3 332.429 2.894 20 5 EFBDHN Cc1ccc([C@H](C)NCCc2nnn(C(C)(C)C)n2)cc1[N+](=O)[O-] ZINC000595419262 478770088 /nfs/dbraw/zinc/77/00/88/478770088.db2.gz JKZGMXOBELULBA-LBPRGKRZSA-N 0 3 332.408 2.538 20 5 EFBDHN CCCN1CC[C@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000598341381 478775835 /nfs/dbraw/zinc/77/58/35/478775835.db2.gz AEBUPTGCISGPJO-LBPRGKRZSA-N 0 3 345.321 2.828 20 5 EFBDHN CS[C@@H]1CN(Cc2ccc(F)cc2[N+](=O)[O-])C[C@@H]1N1CCCC1 ZINC000595433927 478779174 /nfs/dbraw/zinc/77/91/74/478779174.db2.gz WWYIIPNUAFYZHK-JKSUJKDBSA-N 0 3 339.436 2.746 20 5 EFBDHN C[C@@H]1CCN(CCNC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C1 ZINC000564765604 478805241 /nfs/dbraw/zinc/80/52/41/478805241.db2.gz DTYQSAFGMGPVRT-CYBMUJFWSA-N 0 3 333.432 2.964 20 5 EFBDHN CC(=O)c1nc(CCN(C)CCc2ccccc2[N+](=O)[O-])[nH]c1C ZINC000595485928 478815352 /nfs/dbraw/zinc/81/53/52/478815352.db2.gz ZJHTWSXMQARGLY-UHFFFAOYSA-N 0 3 330.388 2.546 20 5 EFBDHN CC(=O)c1[nH]c(CCN(C)CCc2ccccc2[N+](=O)[O-])nc1C ZINC000595485928 478815359 /nfs/dbraw/zinc/81/53/59/478815359.db2.gz ZJHTWSXMQARGLY-UHFFFAOYSA-N 0 3 330.388 2.546 20 5 EFBDHN COCC1(NCc2cc([N+](=O)[O-])ccc2C(F)(F)F)CCOCC1 ZINC000595498066 478820682 /nfs/dbraw/zinc/82/06/82/478820682.db2.gz AQCNCSOKVOURMI-UHFFFAOYSA-N 0 3 348.321 2.899 20 5 EFBDHN Cc1noc(CN2CCN(Cc3ccccc3)C[C@@H](C)C2)c1[N+](=O)[O-] ZINC000595519212 478831176 /nfs/dbraw/zinc/83/11/76/478831176.db2.gz DQTVWQYQEWCYFN-CQSZACIVSA-N 0 3 344.415 2.845 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2N[C@H]1CCN(c2ncccc2F)C1 ZINC000572422615 478832749 /nfs/dbraw/zinc/83/27/49/478832749.db2.gz DIGJCANCWDADDD-LRDDRELGSA-N 0 3 342.374 2.985 20 5 EFBDHN C[C@H](CN1CCC(C)CC1)NC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000595523244 478833594 /nfs/dbraw/zinc/83/35/94/478833594.db2.gz QCBSXKXZNMDACF-OAHLLOKOSA-N 0 3 348.447 2.557 20 5 EFBDHN C[C@@H]1CN(CCN2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C[C@@H](C)O1 ZINC000595527551 478836077 /nfs/dbraw/zinc/83/60/77/478836077.db2.gz VBIPZXHXEGCOCD-NUJGCVRESA-N 0 3 347.459 2.883 20 5 EFBDHN CN(CCOc1ccccc1[N+](=O)[O-])[C@H](CO)Cc1ccccc1 ZINC000595595300 478875135 /nfs/dbraw/zinc/87/51/35/478875135.db2.gz JOHOUEXDCPDQJK-INIZCTEOSA-N 0 3 330.384 2.509 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN[C@H](C(C)C)C1 ZINC000598569220 478900654 /nfs/dbraw/zinc/90/06/54/478900654.db2.gz BTFLRUJTTPZQNU-RDJZCZTQSA-N 0 3 333.432 2.620 20 5 EFBDHN CC(C)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCN1 ZINC000598576584 478905877 /nfs/dbraw/zinc/90/58/77/478905877.db2.gz XGJCGJLSEGGTSJ-CYBMUJFWSA-N 0 3 345.321 2.684 20 5 EFBDHN COc1cc(CN(C)C)ccc1NC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000601621627 478911706 /nfs/dbraw/zinc/91/17/06/478911706.db2.gz PCRXIFQOIQCJNE-UHFFFAOYSA-N 0 3 343.383 2.846 20 5 EFBDHN CN1CCN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC12CCCCC2 ZINC000565170713 478934845 /nfs/dbraw/zinc/93/48/45/478934845.db2.gz JXWJUZCFMGFTQB-UHFFFAOYSA-N 0 3 343.431 2.921 20 5 EFBDHN COC[C@@H](NCCOc1ccc([N+](=O)[O-])cc1)c1cccc(OC)c1 ZINC000595685682 478935636 /nfs/dbraw/zinc/93/56/36/478935636.db2.gz YUFJFPGYHGYRLA-GOSISDBHSA-N 0 3 346.383 2.960 20 5 EFBDHN C[C@H](C(=O)N1CCC[C@H]1CN1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000583787026 478940108 /nfs/dbraw/zinc/94/01/08/478940108.db2.gz SVKOSNPRKZCXBE-YOEHRIQHSA-N 0 3 331.416 2.785 20 5 EFBDHN O=C(N[C@@H]1CCN(C2CCCCC2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000601670397 478941917 /nfs/dbraw/zinc/94/19/17/478941917.db2.gz DIBPIIGSJKAHAR-GFCCVEGCSA-N 0 3 335.379 2.871 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[C@@H](OC(C)C)C1 ZINC000572957444 478960262 /nfs/dbraw/zinc/96/02/62/478960262.db2.gz BUMNPAALYNTWBG-OAHLLOKOSA-N 0 3 335.404 2.731 20 5 EFBDHN COc1cc(CN[C@@H](CO)C2CCCCC2)c([N+](=O)[O-])cc1F ZINC000546629013 479043756 /nfs/dbraw/zinc/04/37/56/479043756.db2.gz ZCTRDNKAKLFNEO-AWEZNQCLSA-N 0 3 326.368 2.773 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN(C)CC1=CCSC1 ZINC000595887596 479053324 /nfs/dbraw/zinc/05/33/24/479053324.db2.gz GZQGWTXETCIEHR-UHFFFAOYSA-N 0 3 335.429 2.837 20 5 EFBDHN CC[C@@H]1CCC[C@@H]1CNCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000565654568 479054195 /nfs/dbraw/zinc/05/41/95/479054195.db2.gz MHXDOSYPTGAOEB-ZIAGYGMSSA-N 0 3 340.445 2.784 20 5 EFBDHN CCCN(C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)[C@H]1CCN(C)C1 ZINC000592829788 479062543 /nfs/dbraw/zinc/06/25/43/479062543.db2.gz YZUIWHUTOKLVKR-YESZJQIVSA-N 0 3 331.416 2.641 20 5 EFBDHN CN1CCC[C@@H](CNC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C1 ZINC000547710549 479118883 /nfs/dbraw/zinc/11/88/83/479118883.db2.gz ABDQMNOTOKPPSU-AWEZNQCLSA-N 0 3 349.434 2.753 20 5 EFBDHN CCN1CCN(C[C@@H](C)CNc2cc(C)sc2[N+](=O)[O-])CC1 ZINC000596082161 479128235 /nfs/dbraw/zinc/12/82/35/479128235.db2.gz MQJWHWGMRDCGNL-LBPRGKRZSA-N 0 3 326.466 2.650 20 5 EFBDHN O=[N+]([O-])c1ccc(NCCCN2CCC(O)CC2)c(C(F)(F)F)c1 ZINC000596084582 479129600 /nfs/dbraw/zinc/12/96/00/479129600.db2.gz CFGZSYYYUJHCDI-UHFFFAOYSA-N 0 3 347.337 2.872 20 5 EFBDHN O=[N+]([O-])c1ccc(CNCC[C@@H](O)COCc2ccccc2)cc1 ZINC000599021894 479130119 /nfs/dbraw/zinc/13/01/19/479130119.db2.gz FNWKALROWLDNBZ-GOSISDBHSA-N 0 3 330.384 2.652 20 5 EFBDHN CCN(CC)[C@H](CNc1ccc([N+](=O)[O-])c(C(N)=O)c1)c1ccco1 ZINC000596093132 479134044 /nfs/dbraw/zinc/13/40/44/479134044.db2.gz SBFQXCOXHCMXGO-OAHLLOKOSA-N 0 3 346.387 2.782 20 5 EFBDHN Cc1ncccc1CN[C@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000599073204 479149170 /nfs/dbraw/zinc/14/91/70/479149170.db2.gz MQSUKPRGCPSQPW-GFCCVEGCSA-N 0 3 328.372 2.805 20 5 EFBDHN CC[C@H]1CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](CC)CO1 ZINC000593056935 479149171 /nfs/dbraw/zinc/14/91/71/479149171.db2.gz BMGWDODWSQFXEK-HOCLYGCPSA-N 0 3 335.404 2.813 20 5 EFBDHN Cc1ncccc1CN[C@@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000599074492 479150665 /nfs/dbraw/zinc/15/06/65/479150665.db2.gz SSMYNDOJMWZAPQ-LBPRGKRZSA-N 0 3 328.372 2.805 20 5 EFBDHN CCOc1ccc([C@@H](C)NCCN(C)CC(F)F)cc1[N+](=O)[O-] ZINC000599095106 479158966 /nfs/dbraw/zinc/15/89/66/479158966.db2.gz RLKXDMATNSDJAB-LLVKDONJSA-N 0 3 331.363 2.841 20 5 EFBDHN Cc1nc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000593088013 479166237 /nfs/dbraw/zinc/16/62/37/479166237.db2.gz ZZAIKHLIUNVFPC-UWVGGRQHSA-N 0 3 347.293 2.984 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCCSc1ccccc1 ZINC000569762249 479168536 /nfs/dbraw/zinc/16/85/36/479168536.db2.gz KMPINTSEVIMVCZ-AWEZNQCLSA-N 0 3 348.424 2.716 20 5 EFBDHN O=[N+]([O-])c1ccc(CCN2CC[C@H](OCc3ccccn3)C2)cc1 ZINC000610765521 479181433 /nfs/dbraw/zinc/18/14/33/479181433.db2.gz DDIRFERRBHSCDJ-SFHVURJKSA-N 0 3 327.384 2.823 20 5 EFBDHN C[C@@H](Nc1ccc([N+](=O)[O-])c(C(N)=O)c1)[C@@H](c1ccccc1)N(C)C ZINC000596216733 479206024 /nfs/dbraw/zinc/20/60/24/479206024.db2.gz LKKNWEYFCFSWER-PXAZEXFGSA-N 0 3 342.399 2.797 20 5 EFBDHN CN1CC[C@@]2(CCN(c3c(Br)cccc3[N+](=O)[O-])C2)C1 ZINC000596242145 479220002 /nfs/dbraw/zinc/22/00/02/479220002.db2.gz NHEPYOJCTULKJU-CQSZACIVSA-N 0 3 340.221 2.889 20 5 EFBDHN CN(C)CC1CN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C1 ZINC000596246823 479222945 /nfs/dbraw/zinc/22/29/45/479222945.db2.gz HWQTVLARFHKERK-UHFFFAOYSA-N 0 3 339.395 2.824 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)F)ccc1NC[C@@H]1CCCN1CCCO ZINC000596256646 479226689 /nfs/dbraw/zinc/22/66/89/479226689.db2.gz FEBPRKNBYGSNDY-LBPRGKRZSA-N 0 3 329.347 2.791 20 5 EFBDHN C[C@@H]1CC[C@H](C)N1CC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000610965068 479245102 /nfs/dbraw/zinc/24/51/02/479245102.db2.gz SKJXTDODTGXYSG-OKILXGFUSA-N 0 3 331.416 2.959 20 5 EFBDHN COC(=O)CCCCN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000599303358 479245873 /nfs/dbraw/zinc/24/58/73/479245873.db2.gz OGQIMMPCJWSGFK-UHFFFAOYSA-N 0 3 336.388 2.781 20 5 EFBDHN CC(C)(C)N1CC[C@@H](Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1 ZINC000596337400 479258695 /nfs/dbraw/zinc/25/86/95/479258695.db2.gz WNJMGRFHUCRPRW-GFCCVEGCSA-N 0 3 332.404 2.764 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCc1ccc(Cl)cc1 ZINC000574429776 479285960 /nfs/dbraw/zinc/28/59/60/479285960.db2.gz RDTGOANOQYLMON-AWEZNQCLSA-N 0 3 336.775 2.778 20 5 EFBDHN O=[N+]([O-])c1ncccc1NCC1CCN(Cc2ccncc2)CC1 ZINC000596442983 479297273 /nfs/dbraw/zinc/29/72/73/479297273.db2.gz WBNYVSNAVFDWOU-UHFFFAOYSA-N 0 3 327.388 2.709 20 5 EFBDHN C[C@@H](c1ccccc1[N+](=O)[O-])n1cc(CCN2CCCCC2)nn1 ZINC000603220368 479308774 /nfs/dbraw/zinc/30/87/74/479308774.db2.gz UERGNNLHTVUSQG-AWEZNQCLSA-N 0 3 329.404 2.824 20 5 EFBDHN O=[N+]([O-])c1cc(F)ccc1Cn1cc(CNC2CCCCC2)nn1 ZINC000603224576 479310449 /nfs/dbraw/zinc/31/04/49/479310449.db2.gz QXNXNCNBVHKRMD-UHFFFAOYSA-N 0 3 333.367 2.796 20 5 EFBDHN C[C@@H]1CN(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C[C@@H](C)C1(F)F ZINC000599511850 479317518 /nfs/dbraw/zinc/31/75/18/479317518.db2.gz BYXNIOVYEBYQFN-YRGRVCCFSA-N 0 3 344.358 2.558 20 5 EFBDHN CCOc1ccc([C@@H](C)NCCOC[C@@H]2CCOC2)cc1[N+](=O)[O-] ZINC000611248453 479322627 /nfs/dbraw/zinc/32/26/27/479322627.db2.gz GDCPUWUUPLBTQM-ZIAGYGMSSA-N 0 3 338.404 2.697 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C/CN1CCCN(C[C@H]2CCCO2)CC1 ZINC000611254051 479324693 /nfs/dbraw/zinc/32/46/93/479324693.db2.gz KFXRYXCSIAKSTJ-NTSMAEHXSA-N 0 3 345.443 2.795 20 5 EFBDHN O=[N+]([O-])c1cccc2ncnc(NC[C@H]3CCN3Cc3ccccc3)c21 ZINC000596559474 479339196 /nfs/dbraw/zinc/33/91/96/479339196.db2.gz ZHLKETYVBZZOFL-OAHLLOKOSA-N 0 3 349.394 2.646 20 5 EFBDHN CC(C)[C@@H]1C[C@H](NCc2cc3c(cc2[N+](=O)[O-])OCCO3)CCO1 ZINC000611314636 479346547 /nfs/dbraw/zinc/34/65/47/479346547.db2.gz WRNNQMVGFVLYHD-HIFRSBDPSA-N 0 3 336.388 2.659 20 5 EFBDHN Cc1cccc(C(=O)NCCN[C@@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000574770988 479346535 /nfs/dbraw/zinc/34/65/35/479346535.db2.gz NMWMJAKZPYRDQX-QGZVFWFLSA-N 0 3 339.395 2.910 20 5 EFBDHN COc1cccc(C)c1CN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000602471384 479353037 /nfs/dbraw/zinc/35/30/37/479353037.db2.gz CMPJDHRRPOWAMC-AWEZNQCLSA-N 0 3 342.399 2.993 20 5 EFBDHN CN1CCN(Cc2ccccc2-c2cc(CO)cc([N+](=O)[O-])c2)CC1 ZINC000596638800 479367358 /nfs/dbraw/zinc/36/73/58/479367358.db2.gz CZUBDBLYMWJZOJ-UHFFFAOYSA-N 0 3 341.411 2.502 20 5 EFBDHN CC(=O)c1cc(N2CCN(c3ccncc3)CC2)ccc1[N+](=O)[O-] ZINC000587029601 479370047 /nfs/dbraw/zinc/37/00/47/479370047.db2.gz DUWYIUIFSFJPOF-UHFFFAOYSA-N 0 3 326.356 2.519 20 5 EFBDHN O=[N+]([O-])c1ccsc1NC1CCN([C@@H]2CCCC[C@@H]2O)CC1 ZINC000611413619 479372008 /nfs/dbraw/zinc/37/20/08/479372008.db2.gz IILGMQMRIXFYOS-OCCSQVGLSA-N 0 3 325.434 2.836 20 5 EFBDHN Cc1nccn1C[C@@H](C)CNCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602508201 479373099 /nfs/dbraw/zinc/37/30/99/479373099.db2.gz ADYPNYMRXHXUDV-NSHDSACASA-N 0 3 329.360 2.667 20 5 EFBDHN O=C(NC1CC1)c1cccc(CNCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000602528165 479383108 /nfs/dbraw/zinc/38/31/08/479383108.db2.gz NMUYBOKGRSENLP-UHFFFAOYSA-N 0 3 339.395 2.819 20 5 EFBDHN COC[C@H](C)N(CCn1ccc([N+](=O)[O-])n1)[C@H]1CCc2ccccc21 ZINC000599683263 479388802 /nfs/dbraw/zinc/38/88/02/479388802.db2.gz PTEIKXWCQRFFEO-YOEHRIQHSA-N 0 3 344.415 2.816 20 5 EFBDHN CC(C)c1cc(CNC2CCN(c3ccc([N+](=O)[O-])nc3)CC2)on1 ZINC000602546441 479391502 /nfs/dbraw/zinc/39/15/02/479391502.db2.gz SMLATTXWQCNYBM-UHFFFAOYSA-N 0 3 345.403 2.860 20 5 EFBDHN C[C@]1(CNCc2cc(Br)c([N+](=O)[O-])s2)CCOC1 ZINC000602550540 479392410 /nfs/dbraw/zinc/39/24/10/479392410.db2.gz KHIDMWVHHLOSLB-LLVKDONJSA-N 0 3 335.223 2.935 20 5 EFBDHN Cc1cnc(CNC2CCN(c3ccc([N+](=O)[O-])nc3)CC2)s1 ZINC000602547734 479393038 /nfs/dbraw/zinc/39/30/38/479393038.db2.gz NLZICXLVQJNYTI-UHFFFAOYSA-N 0 3 333.417 2.513 20 5 EFBDHN C[C@H](NCc1cc(Br)c([N+](=O)[O-])s1)[C@@H]1CCOC1 ZINC000602558990 479397416 /nfs/dbraw/zinc/39/74/16/479397416.db2.gz RQZDBAZRVGUVSI-JGVFFNPUSA-N 0 3 335.223 2.933 20 5 EFBDHN O=[N+]([O-])c1ccc2oc(CN[C@H]3CCO[C@@]4(CCSC4)C3)nc2c1 ZINC000602566670 479400275 /nfs/dbraw/zinc/40/02/75/479400275.db2.gz AKWRLOGXOWLHOP-ZBEGNZNMSA-N 0 3 349.412 2.880 20 5 EFBDHN COc1cc(CNCCSC)c([N+](=O)[O-])cc1OCC(F)F ZINC000611519118 479403519 /nfs/dbraw/zinc/40/35/19/479403519.db2.gz WVPMXVAIJLTGTD-UHFFFAOYSA-N 0 3 336.360 2.700 20 5 EFBDHN CC[C@H](CCO)CNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602574641 479405155 /nfs/dbraw/zinc/40/51/55/479405155.db2.gz XOPQWFHZSYXGMI-MRVPVSSYSA-N 0 3 337.239 2.917 20 5 EFBDHN COc1ccc(CN(C)C)cc1NC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000603589844 479410467 /nfs/dbraw/zinc/41/04/67/479410467.db2.gz IVNLEWFXFVSAHJ-UHFFFAOYSA-N 0 3 329.356 2.917 20 5 EFBDHN NC(=O)C1(CNCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCCC1 ZINC000602594256 479414624 /nfs/dbraw/zinc/41/46/24/479414624.db2.gz PULOPRUMVLOIOY-UHFFFAOYSA-N 0 3 345.321 2.749 20 5 EFBDHN C[C@@H]1CN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])CCN(C2CCC2)C1 ZINC000593722119 479434244 /nfs/dbraw/zinc/43/42/44/479434244.db2.gz UFSVIXQUNQRRRZ-ZDUSSCGKSA-N 0 3 349.406 2.609 20 5 EFBDHN CCOc1ccc([C@@H](C)NCC[C@@]2(O)CCCOC2)cc1[N+](=O)[O-] ZINC000593720958 479434420 /nfs/dbraw/zinc/43/44/20/479434420.db2.gz NMXWLSFFWNCOEM-DYVFJYSZSA-N 0 3 338.404 2.576 20 5 EFBDHN Cc1nccc([C@@H]2CCCN(CCOc3cccc([N+](=O)[O-])c3)C2)n1 ZINC000603834186 479434687 /nfs/dbraw/zinc/43/46/87/479434687.db2.gz KLZHDFIEEGASPI-OAHLLOKOSA-N 0 3 342.399 2.952 20 5 EFBDHN COc1ccc([C@H](CNc2cccnc2[N+](=O)[O-])N(C)C)cc1OC ZINC000603837190 479435168 /nfs/dbraw/zinc/43/51/68/479435168.db2.gz CZCUFLYKWXNPGT-AWEZNQCLSA-N 0 3 346.387 2.722 20 5 EFBDHN CCn1c(C)nc([N+](=O)[O-])c1N1CC[C@H](N(C)Cc2ccccc2)C1 ZINC000588821877 479444208 /nfs/dbraw/zinc/44/42/08/479444208.db2.gz OMIRVPUDKAAAEG-INIZCTEOSA-N 0 3 343.431 2.830 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1CNC[C@H]1COc3ccccc31)OCCO2 ZINC000588934468 479460189 /nfs/dbraw/zinc/46/01/89/479460189.db2.gz ZQCKKRVQHPKAOO-ZDUSSCGKSA-N 0 3 342.351 2.632 20 5 EFBDHN CCCN1CC[C@@H](NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000596881139 479469730 /nfs/dbraw/zinc/46/97/30/479469730.db2.gz IORZRJYQAZRSLC-CQSZACIVSA-N 0 3 334.420 2.613 20 5 EFBDHN Cc1ccccc1CN1CCCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 ZINC000604102692 479473295 /nfs/dbraw/zinc/47/32/95/479473295.db2.gz MYSUJSLZJWYUKC-UHFFFAOYSA-N 0 3 342.399 2.579 20 5 EFBDHN CCN(C(=O)c1ccc(Cl)cc1[N+](=O)[O-])C1CCN(C)CC1 ZINC000599985795 479486622 /nfs/dbraw/zinc/48/66/22/479486622.db2.gz ITQNASUYMRMGFG-UHFFFAOYSA-N 0 3 325.796 2.805 20 5 EFBDHN CCN(C(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F)C1CCN(C)CC1 ZINC000599986192 479488105 /nfs/dbraw/zinc/48/81/05/479488105.db2.gz QEUGFLGXLSZYBG-GFCCVEGCSA-N 0 3 337.395 2.780 20 5 EFBDHN C[C@H](CN1CCC(C)CC1)NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602717627 479500710 /nfs/dbraw/zinc/50/07/10/479500710.db2.gz LXFNYURGKAREPX-CYBMUJFWSA-N 0 3 332.404 2.946 20 5 EFBDHN Cc1ccncc1[C@H](C)NCCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000611940353 479528584 /nfs/dbraw/zinc/52/85/84/479528584.db2.gz YQVSBDLZURKRLI-ZDUSSCGKSA-N 0 3 328.372 2.978 20 5 EFBDHN O=[N+]([O-])c1sccc1NCCCN1CCN(c2ccncc2)CC1 ZINC000604524809 479533568 /nfs/dbraw/zinc/53/35/68/479533568.db2.gz FSPVSJXJOHQWCY-UHFFFAOYSA-N 0 3 347.444 2.676 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN(C)CCOc1cccc(Cl)c1 ZINC000602760601 479534011 /nfs/dbraw/zinc/53/40/11/479534011.db2.gz YDLDUNQUXDVDTR-UHFFFAOYSA-N 0 3 338.795 2.764 20 5 EFBDHN COc1ccc(C2CCN(CCn3c(C)ncc3[N+](=O)[O-])CC2)cc1 ZINC000602785845 479551608 /nfs/dbraw/zinc/55/16/08/479551608.db2.gz WDQURNDCXYDYQV-UHFFFAOYSA-N 0 3 344.415 2.988 20 5 EFBDHN Cc1cc(N2CCCN(C[C@H]3CCCO3)CC2)c(F)cc1[N+](=O)[O-] ZINC000589685032 479558622 /nfs/dbraw/zinc/55/86/22/479558622.db2.gz XKOLLYVTGYMKGQ-CQSZACIVSA-N 0 3 337.395 2.733 20 5 EFBDHN COc1ccc([C@@H](NCCn2c(C)ncc2[N+](=O)[O-])C2CC2)cc1 ZINC000602805053 479565469 /nfs/dbraw/zinc/56/54/69/479565469.db2.gz LCEBFLYJKKTXJK-KRWDZBQOSA-N 0 3 330.388 2.849 20 5 EFBDHN CN(Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@@]1(CO)CCOC1 ZINC000600178648 479566275 /nfs/dbraw/zinc/56/62/75/479566275.db2.gz NYXHRKUWPGCBIQ-QGZVFWFLSA-N 0 3 348.424 2.907 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN1CC[C@H](COc2ccccc2)C1 ZINC000602807942 479567009 /nfs/dbraw/zinc/56/70/09/479567009.db2.gz VNDGFUZMPKJXHX-HNNXBMFYSA-N 0 3 330.388 2.501 20 5 EFBDHN CC[C@@](C)(O)CN(CCn1c(C)ncc1[N+](=O)[O-])Cc1ccccc1 ZINC000602819016 479573103 /nfs/dbraw/zinc/57/31/03/479573103.db2.gz YEBVMAYCRAUUFA-GOSISDBHSA-N 0 3 346.431 2.763 20 5 EFBDHN COc1ccc([C@@H](C)NCCn2c(C)ncc2[N+](=O)[O-])c(C)c1OC ZINC000602828214 479579203 /nfs/dbraw/zinc/57/92/03/479579203.db2.gz CWXZSEXTIYRTEW-GFCCVEGCSA-N 0 3 348.403 2.776 20 5 EFBDHN COc1ccc(NC(=O)N[C@@H]2CCCN3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000594077864 479581474 /nfs/dbraw/zinc/58/14/74/479581474.db2.gz BAOFLUBHMMFOER-KGLIPLIRSA-N 0 3 348.403 2.742 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@@H]1CC[C@](O)(C(F)(F)F)C1 ZINC000589938044 479583635 /nfs/dbraw/zinc/58/36/35/479583635.db2.gz BLWVIPYSCVQWDY-BXUZGUMPSA-N 0 3 348.321 2.929 20 5 EFBDHN O=[N+]([O-])c1cccc2c(NC3CCN([C@H]4CCOC4)CC3)ccnc21 ZINC000590083683 479602147 /nfs/dbraw/zinc/60/21/47/479602147.db2.gz HRGSQOXSIAIRON-AWEZNQCLSA-N 0 3 342.399 2.808 20 5 EFBDHN CC1(C)CN(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)[C@@H]2CCC[C@H]21 ZINC000590204430 479616996 /nfs/dbraw/zinc/61/69/96/479616996.db2.gz LBRBZAOLDQYNAU-HZPDHXFCSA-N 0 3 343.427 2.994 20 5 EFBDHN CC1(C)CN(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)[C@H]2CCC[C@H]21 ZINC000590203733 479617781 /nfs/dbraw/zinc/61/77/81/479617781.db2.gz QPFJBCSMGLAYFW-WBVHZDCISA-N 0 3 343.427 2.994 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@H]1CCCN2CCCC[C@H]12 ZINC000594195710 479627458 /nfs/dbraw/zinc/62/74/58/479627458.db2.gz HQOQGOGFPNPOMM-JKSUJKDBSA-N 0 3 331.416 2.958 20 5 EFBDHN CCc1ccc(C(=O)N[C@@H]2CCCN3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000594197842 479628159 /nfs/dbraw/zinc/62/81/59/479628159.db2.gz QPTWHWJLZMPWJC-CVEARBPZSA-N 0 3 331.416 2.904 20 5 EFBDHN O=C(CSc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCCN2CCCC[C@@H]12 ZINC000594197186 479628595 /nfs/dbraw/zinc/62/85/95/479628595.db2.gz AVOBTWQILAGKSR-CVEARBPZSA-N 0 3 349.456 2.820 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C\CN(CCN1CCOCC1)CC1CC1 ZINC000597223450 479628879 /nfs/dbraw/zinc/62/88/79/479628879.db2.gz OYXUUXSCWQNURG-HYXAFXHYSA-N 0 3 345.443 2.652 20 5 EFBDHN CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CCCN2CCCC[C@@H]12 ZINC000594199396 479629323 /nfs/dbraw/zinc/62/93/23/479629323.db2.gz YIOPHDNJWYONBB-KBPBESRZSA-N 0 3 347.415 2.740 20 5 EFBDHN CCOC(=O)[C@@]1(C)CCC[C@@H]1NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000597240071 479638505 /nfs/dbraw/zinc/63/85/05/479638505.db2.gz NRBZUOLZBZGXJO-RDJZCZTQSA-N 0 3 336.388 2.815 20 5 EFBDHN CCOC(=O)[C@@]1(C)CCC[C@H]1NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000597240072 479638608 /nfs/dbraw/zinc/63/86/08/479638608.db2.gz NRBZUOLZBZGXJO-WBVHZDCISA-N 0 3 336.388 2.815 20 5 EFBDHN CN1CCC[C@@]2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4o3)C2)C1 ZINC000590505887 479654699 /nfs/dbraw/zinc/65/46/99/479654699.db2.gz CNRBVUUZJKCQEV-GOSISDBHSA-N 0 3 343.383 2.899 20 5 EFBDHN CC(C)(CO)[C@H](NCCOc1cccc([N+](=O)[O-])c1)c1cccnc1 ZINC000590600329 479666933 /nfs/dbraw/zinc/66/69/33/479666933.db2.gz JQZQOVGBQPUBIK-QGZVFWFLSA-N 0 3 345.399 2.718 20 5 EFBDHN O=[N+]([O-])c1cccc2ncnc(N3CC[C@@H](N4CCCCC4)C3)c21 ZINC000612444418 479673795 /nfs/dbraw/zinc/67/37/95/479673795.db2.gz RQHUOOJVFOJNOU-CYBMUJFWSA-N 0 3 327.388 2.603 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCN([C@@H]2CCC[C@H]2O)CC1 ZINC000615835395 479765517 /nfs/dbraw/zinc/76/55/17/479765517.db2.gz RRLQGHDRIDFZAR-BDZHWRPJSA-N 0 3 345.443 2.529 20 5 EFBDHN Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000619525364 479818487 /nfs/dbraw/zinc/81/84/87/479818487.db2.gz DJIKLUZGAQAUQN-QGZVFWFLSA-N 0 3 342.399 2.500 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@@H]2CCc3ccccc32)c1 ZINC000619558367 479827294 /nfs/dbraw/zinc/82/72/94/479827294.db2.gz LCDZWZKSKJYEEH-CRAIPNDOSA-N 0 3 328.368 2.612 20 5 EFBDHN CC[C@@H]1CN(C)CCCN1C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000619578963 479834253 /nfs/dbraw/zinc/83/42/53/479834253.db2.gz WZNSBRFBMKNYCN-CQSZACIVSA-N 0 3 344.415 2.561 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCN(CC2CC2)C1 ZINC000619639155 479845878 /nfs/dbraw/zinc/84/58/78/479845878.db2.gz QPEMIGCTVXMXFT-CYBMUJFWSA-N 0 3 348.403 2.599 20 5 EFBDHN CNc1ccc(C(=O)N(CCN(C)C)C2CCCC2)cc1[N+](=O)[O-] ZINC000609583057 480181488 /nfs/dbraw/zinc/18/14/88/480181488.db2.gz QPRVVPGNMGUMKV-UHFFFAOYSA-N 0 3 334.420 2.583 20 5 EFBDHN COC1(CNCc2cc3c(cc2[N+](=O)[O-])OCCO3)CCCCC1 ZINC000614101144 480191490 /nfs/dbraw/zinc/19/14/90/480191490.db2.gz UOGUQQKIJYVVBD-UHFFFAOYSA-N 0 3 336.388 2.805 20 5 EFBDHN CC[C@H](CN1CCCC1)NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000609833346 480210807 /nfs/dbraw/zinc/21/08/07/480210807.db2.gz HPTKJJFOZDLSIC-GFCCVEGCSA-N 0 3 325.796 2.852 20 5 EFBDHN CN(C)[C@@H](CNc1ncnc2ccc([N+](=O)[O-])cc21)c1cccs1 ZINC000609849295 480213426 /nfs/dbraw/zinc/21/34/26/480213426.db2.gz ILPTXMVWXHDVKI-AWEZNQCLSA-N 0 3 343.412 2.736 20 5 EFBDHN CC[C@H](CN1CCCC1)NC(=O)c1ccc(SC)c([N+](=O)[O-])c1 ZINC000609877120 480215453 /nfs/dbraw/zinc/21/54/53/480215453.db2.gz JUNKOFWXTIIXOE-CYBMUJFWSA-N 0 3 337.445 2.921 20 5 EFBDHN Cn1c(C(=O)N(CCN2CCCC2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000610051500 480231348 /nfs/dbraw/zinc/23/13/48/480231348.db2.gz SZWSOURGAUHQSM-UHFFFAOYSA-N 0 3 342.399 2.676 20 5 EFBDHN Cc1cc(N2CC[C@@H](C)[S@](=O)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000617483678 480237013 /nfs/dbraw/zinc/23/70/13/480237013.db2.gz JEWCWPXMJPJEEV-SFDCACGMSA-N 0 3 333.413 2.799 20 5 EFBDHN Cn1cnc([N+](=O)[O-])c1N[C@@H](CN1CCCCC1)c1ccccc1 ZINC000610279217 480269282 /nfs/dbraw/zinc/26/92/82/480269282.db2.gz AMKXOVWHXXLIMJ-HNNXBMFYSA-N 0 3 329.404 2.967 20 5 EFBDHN COCCN(CCn1cc([N+](=O)[O-])cn1)Cc1ccc(C)cc1C ZINC000610447548 480308604 /nfs/dbraw/zinc/30/86/04/480308604.db2.gz QHEMACJBMOKQPB-UHFFFAOYSA-N 0 3 332.404 2.557 20 5 EFBDHN COCCN(CCn1ccc([N+](=O)[O-])n1)Cc1ccc(C)cc1C ZINC000610485017 480317807 /nfs/dbraw/zinc/31/78/07/480317807.db2.gz RLPFNVYGWMQNNL-UHFFFAOYSA-N 0 3 332.404 2.557 20 5 EFBDHN CC[C@H](CN1CCCC1)Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000610715919 480372850 /nfs/dbraw/zinc/37/28/50/480372850.db2.gz COWAFKJXFBRMED-CQSZACIVSA-N 0 3 346.431 2.773 20 5 EFBDHN CC[C@H](CN1CCCC1)NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000610719286 480374064 /nfs/dbraw/zinc/37/40/64/480374064.db2.gz PKTOBLVMZZUZFV-UKRRQHHQSA-N 0 3 334.420 2.829 20 5 EFBDHN C[C@H](NCCc1ccc([N+](=O)[O-])cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000129713744 533872872 /nfs/dbraw/zinc/87/28/72/533872872.db2.gz HPAPHCGLWBYPAF-ZDUSSCGKSA-N 0 3 348.424 2.892 20 5 EFBDHN O=c1ccc([N+](=O)[O-])cn1CCN(Cc1ccc(F)cc1)CC1CC1 ZINC000159830039 534320509 /nfs/dbraw/zinc/32/05/09/534320509.db2.gz ZOMNLLUMDVWYKW-UHFFFAOYSA-N 0 3 345.374 2.808 20 5 EFBDHN CC(C)(C)CCN1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000055936351 518646449 /nfs/dbraw/zinc/64/64/49/518646449.db2.gz PEHZZNRQIHNUQE-UHFFFAOYSA-N 0 3 348.447 2.587 20 5 EFBDHN NC(=O)[C@H]1CCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000155029487 534450190 /nfs/dbraw/zinc/45/01/90/534450190.db2.gz MMRRDUZEFQDAGO-LBPRGKRZSA-N 0 3 329.356 2.552 20 5 EFBDHN CN(C)CCN(Cc1ccccc1F)C(=O)c1ccc([N+](=O)[O-])o1 ZINC000072013263 521750498 /nfs/dbraw/zinc/75/04/98/521750498.db2.gz JHNMPHBYARBMNI-UHFFFAOYSA-N 0 3 335.335 2.531 20 5 EFBDHN CN(C)Cc1ccc(CNC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000018174840 521906815 /nfs/dbraw/zinc/90/68/15/521906815.db2.gz WOKVGRNMPOCTLD-UHFFFAOYSA-N 0 3 328.372 2.978 20 5 EFBDHN CCc1nn(C)c(NC[C@H]2CCN(Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000192957996 522670498 /nfs/dbraw/zinc/67/04/98/522670498.db2.gz XAXKMGCZFJORQD-OAHLLOKOSA-N 0 3 343.431 2.825 20 5 EFBDHN CN(CCOc1cccc([N+](=O)[O-])c1)[C@@H]1CCCc2c1cnn2C ZINC000135569902 522913497 /nfs/dbraw/zinc/91/34/97/522913497.db2.gz VPZZMCHYQDQPEA-MRXNPFEDSA-N 0 3 330.388 2.717 20 5 EFBDHN CN(C)CCN(C(=O)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000063829517 524058599 /nfs/dbraw/zinc/05/85/99/524058599.db2.gz XUQGXHCAEPLWIQ-UHFFFAOYSA-N 0 3 327.384 2.732 20 5 EFBDHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000119774067 525010555 /nfs/dbraw/zinc/01/05/55/525010555.db2.gz WMKJOHFFBRWNDZ-KDOFPFPSSA-N 0 3 339.395 2.845 20 5 EFBDHN C[C@@H]1C[C@@H](NC(=O)c2ccccc2[N+](=O)[O-])CN1Cc1ccccc1 ZINC000137457233 525262796 /nfs/dbraw/zinc/26/27/96/525262796.db2.gz NQYBJGQNILBBBE-GDBMZVCRSA-N 0 3 339.395 2.988 20 5 EFBDHN C[C@H](NCCc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)NC(=O)CO2 ZINC000194415207 525369222 /nfs/dbraw/zinc/36/92/22/525369222.db2.gz AFSMNWHHMKTZDH-LBPRGKRZSA-N 0 3 341.367 2.819 20 5 EFBDHN Cc1c(C(=O)NCc2cccc(CN(C)C)c2)cccc1[N+](=O)[O-] ZINC000043966577 525627594 /nfs/dbraw/zinc/62/75/94/525627594.db2.gz NTFVQJCSVWOLEO-UHFFFAOYSA-N 0 3 327.384 2.895 20 5 EFBDHN O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)c1csc([N+](=O)[O-])c1 ZINC000193787183 526537717 /nfs/dbraw/zinc/53/77/17/526537717.db2.gz CLXZAAZUHYRSST-AWEZNQCLSA-N 0 3 345.424 2.908 20 5 EFBDHN O=C(c1ccc([N+](=O)[O-])o1)N1CCCN(CC2CCCCC2)CC1 ZINC000072013505 526716432 /nfs/dbraw/zinc/71/64/32/526716432.db2.gz LBZVPBMERGUEHJ-UHFFFAOYSA-N 0 3 335.404 2.916 20 5 EFBDHN Cc1sc(C(=O)N[C@H]2CCN(CC3CCCC3)C2)cc1[N+](=O)[O-] ZINC000081293074 526873894 /nfs/dbraw/zinc/87/38/94/526873894.db2.gz GTJBOVVVRZVSHH-ZDUSSCGKSA-N 0 3 337.445 2.959 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@@H]2CCN(CCOc3ccccc3)C2)nc1 ZINC000118866413 527368437 /nfs/dbraw/zinc/36/84/37/527368437.db2.gz JEWLCRGACKLXAI-CQSZACIVSA-N 0 3 328.372 2.555 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CCC[C@@H](c3nc4ccccc4o3)C2)c1 ZINC000157639481 527414857 /nfs/dbraw/zinc/41/48/57/527414857.db2.gz DWAYQLMBFMNEJA-CYBMUJFWSA-N 0 3 341.371 2.812 20 5 EFBDHN CCO[C@@H]1C[C@](N)(C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1(C)C ZINC000188003078 527980825 /nfs/dbraw/zinc/98/08/25/527980825.db2.gz YAASYDUJKLRPMA-PNPHSEOMSA-N 0 3 349.431 2.613 20 5 EFBDHN CCCCN(CCO)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000159082958 528429407 /nfs/dbraw/zinc/42/94/07/528429407.db2.gz PFFPKLLSFWJYLQ-UHFFFAOYSA-N 0 3 332.404 2.590 20 5 EFBDHN CC[C@H](c1ccncc1)N(C)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000130157787 529186528 /nfs/dbraw/zinc/18/65/28/529186528.db2.gz LKCUHNIOPXXCAN-FUHWJXTLSA-N 0 3 345.399 2.813 20 5 EFBDHN CC(C)Oc1cc(C(=O)N(C)[C@H]2CCN(C)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000412120651 534942617 /nfs/dbraw/zinc/94/26/17/534942617.db2.gz DUGVLCUYDZYSNC-HIFRSBDPSA-N 0 3 349.431 2.794 20 5 EFBDHN CC(C)Oc1cc(C(=O)N2CC[C@@H]3CCN(C)C[C@@H]32)ccc1[N+](=O)[O-] ZINC000412248097 534945165 /nfs/dbraw/zinc/94/51/65/534945165.db2.gz KUASJZUTFBWFEH-BBRMVZONSA-N 0 3 347.415 2.548 20 5 EFBDHN CC(C)Oc1cc(C(=O)N[C@@H]2CCCN(C)[C@H]2C)ccc1[N+](=O)[O-] ZINC000412252827 534950248 /nfs/dbraw/zinc/95/02/48/534950248.db2.gz XDLHPOLAYQSPOP-GXTWGEPZSA-N 0 3 335.404 2.595 20 5 EFBDHN CC(C)Oc1ccc([C@@H](CNc2ncc([N+](=O)[O-])cn2)N(C)C)cc1 ZINC000340923670 535020362 /nfs/dbraw/zinc/02/03/62/535020362.db2.gz WGWMSQWRFBBHIS-MRXNPFEDSA-N 0 3 345.403 2.887 20 5 EFBDHN CC1(C)[C@H](NCc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H]2CCCO[C@@H]21 ZINC000344680563 535073516 /nfs/dbraw/zinc/07/35/16/535073516.db2.gz NZSPRINOBIOIDN-UAGQMJEPSA-N 0 3 348.399 2.755 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000412103413 535487660 /nfs/dbraw/zinc/48/76/60/535487660.db2.gz ZYENZQAEISJRHN-OAHLLOKOSA-N 0 3 349.431 2.986 20 5 EFBDHN CCOC(=O)CCCCCN1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000344608733 535625428 /nfs/dbraw/zinc/62/54/28/535625428.db2.gz WGZDHGKUYYRFIZ-UHFFFAOYSA-N 0 3 349.431 2.840 20 5 EFBDHN CCOC[C@@H](O)CNCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000344529521 535676287 /nfs/dbraw/zinc/67/62/87/535676287.db2.gz IZZNFLJJUPTXTQ-LBPRGKRZSA-N 0 3 336.413 2.810 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)C[C@H]1CCCN1C ZINC000421710677 535771779 /nfs/dbraw/zinc/77/17/79/535771779.db2.gz LVBALALEBUWPBN-DOTOQJQBSA-N 0 3 333.432 2.716 20 5 EFBDHN CC[C@@H](NCCC(C)(C)S(C)(=O)=O)c1cccc([N+](=O)[O-])c1 ZINC000414251001 535803335 /nfs/dbraw/zinc/80/33/35/535803335.db2.gz ICYHEISTNHOUPF-CQSZACIVSA-N 0 3 328.434 2.849 20 5 EFBDHN CN(C)CCN(C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C1CC1 ZINC000356289262 535846716 /nfs/dbraw/zinc/84/67/16/535846716.db2.gz AJNPDNRJCHSEIH-UHFFFAOYSA-N 0 3 345.321 2.780 20 5 EFBDHN CN(C)CCN(C/C=C\c1ccccc1[N+](=O)[O-])C[C@@H]1CCCO1 ZINC000349065144 535854443 /nfs/dbraw/zinc/85/44/43/535854443.db2.gz XVJHGGVMTFNXOE-AFCDSYGPSA-N 0 3 333.432 2.651 20 5 EFBDHN CN(C)CCN(Cc1ccc([N+](=O)[O-])cc1Cl)C[C@@H]1CCCO1 ZINC000349070340 535861933 /nfs/dbraw/zinc/86/19/33/535861933.db2.gz BWQLHOGVDOKFPG-HNNXBMFYSA-N 0 3 341.839 2.791 20 5 EFBDHN CN(C)CCN(Cc1ccccn1)c1ncc([N+](=O)[O-])cc1Cl ZINC000433434756 535866909 /nfs/dbraw/zinc/86/69/09/535866909.db2.gz QAJOZAOBKJNSRX-UHFFFAOYSA-N 0 3 335.795 2.606 20 5 EFBDHN CC[C@H](NCC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)[C@H]1CC1(C)C ZINC000419316899 535895886 /nfs/dbraw/zinc/89/58/86/535895886.db2.gz MEVZYCHSGUISJU-MNOVXSKESA-N 0 3 349.387 2.676 20 5 EFBDHN CC[C@H](NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1CC1(C)C ZINC000414124017 535904572 /nfs/dbraw/zinc/90/45/72/535904572.db2.gz BQTJADXJILWWST-CABCVRRESA-N 0 3 340.445 2.783 20 5 EFBDHN CCc1cc(NCC2(N(C)C)CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000419003116 536088935 /nfs/dbraw/zinc/08/89/35/536088935.db2.gz CFXBGUSZPOPFFU-UHFFFAOYSA-N 0 3 341.415 2.542 20 5 EFBDHN CN(CCCN(C)c1nc2sccn2c1[N+](=O)[O-])Cc1ccco1 ZINC000343814955 536342800 /nfs/dbraw/zinc/34/28/00/536342800.db2.gz RFQBALVBOHMJKC-UHFFFAOYSA-N 0 3 349.416 2.855 20 5 EFBDHN CN(C[C@H]1CCCN(C)C1)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000360090474 536446070 /nfs/dbraw/zinc/44/60/70/536446070.db2.gz WRKGKMDJNWMPTR-LBPRGKRZSA-N 0 3 331.372 2.755 20 5 EFBDHN CN1CC[C@@H]2[C@@H](CCCN2C(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000246365686 536470273 /nfs/dbraw/zinc/47/02/73/536470273.db2.gz ADOYLCFBNZVWFD-XJKSGUPXSA-N 0 3 349.456 2.630 20 5 EFBDHN COC(=O)[C@@]12CN(Cc3ccc([N+](=O)[O-])cc3OC)C[C@H]1CCCC2 ZINC000342185157 536586777 /nfs/dbraw/zinc/58/67/77/536586777.db2.gz ZTKLRPOTGKSBEK-KDOFPFPSSA-N 0 3 348.399 2.769 20 5 EFBDHN COC(=O)[C@@]12CN(Cc3ccc(OC)c([N+](=O)[O-])c3)C[C@H]1CCCC2 ZINC000342128078 536587759 /nfs/dbraw/zinc/58/77/59/536587759.db2.gz RLLDRNGXKOABBL-KDOFPFPSSA-N 0 3 348.399 2.769 20 5 EFBDHN COC(=O)[C@@]12CN(Cc3ccc([N+](=O)[O-])c(OC)c3)C[C@H]1CCCC2 ZINC000342149772 536588377 /nfs/dbraw/zinc/58/83/77/536588377.db2.gz GRXMWCLMYMVUGB-KDOFPFPSSA-N 0 3 348.399 2.769 20 5 EFBDHN CO[C@H](CNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C(C)C ZINC000266599501 536639830 /nfs/dbraw/zinc/63/98/30/536639830.db2.gz CSYYSUZWZFKOSJ-MRXNPFEDSA-N 0 3 332.404 2.756 20 5 EFBDHN COc1cc(CNC[C@H]2CCC[C@@H](CO)C2)c([N+](=O)[O-])cc1OC ZINC000342243291 536799864 /nfs/dbraw/zinc/79/98/64/536799864.db2.gz ITKWAUNCTDJRJS-QWHCGFSZSA-N 0 3 338.404 2.500 20 5 EFBDHN COc1ccc(CNC[C@@H](CO)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000414534642 536893123 /nfs/dbraw/zinc/89/31/23/536893123.db2.gz VJNPPJOEZQCCGY-AWEZNQCLSA-N 0 3 334.347 2.608 20 5 EFBDHN CCc1ccc(C(=O)N2C[C@@H](N3CCCC3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000285895883 545682919 /nfs/dbraw/zinc/68/29/19/545682919.db2.gz RPIQLBUXHUVVOQ-CJNGLKHVSA-N 0 3 331.416 2.856 20 5 EFBDHN C[C@H]1CN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@H](C)S1 ZINC000753917423 575359113 /nfs/dbraw/zinc/35/91/13/575359113.db2.gz PNHFGFQORDQNFY-QWRGUYRKSA-N 0 3 341.408 2.888 20 5 EFBDHN Cc1cc(C)cc(OCCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000754250706 575410687 /nfs/dbraw/zinc/41/06/87/575410687.db2.gz MPKGXXSGQKTQIW-SFHVURJKSA-N 0 3 330.384 2.914 20 5 EFBDHN O=[N+]([O-])c1ccc([C@@H](O)CNCc2ccc(-n3ccnc3)cc2)cc1 ZINC000754250553 575410766 /nfs/dbraw/zinc/41/07/66/575410766.db2.gz JJFIGRAPDONKSU-SFHVURJKSA-N 0 3 338.367 2.604 20 5 EFBDHN O=[N+]([O-])c1ccc([C@@H](O)CNCCOc2ccc(Cl)cc2)cc1 ZINC000754251877 575411116 /nfs/dbraw/zinc/41/11/16/575411116.db2.gz XULUPLJODPHDCT-INIZCTEOSA-N 0 3 336.775 2.950 20 5 EFBDHN O=C(CCN[C@@H](CCO)c1cccs1)Nc1ccc([N+](=O)[O-])cc1 ZINC000754382079 575427919 /nfs/dbraw/zinc/42/79/19/575427919.db2.gz FGHWLCMHNQTJJC-AWEZNQCLSA-N 0 3 349.412 2.698 20 5 EFBDHN COC[C@@H](N[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)C(C)C ZINC000754383830 575428317 /nfs/dbraw/zinc/42/83/17/575428317.db2.gz JUAMNGLIIYIFCX-IINYFYTJSA-N 0 3 343.811 2.836 20 5 EFBDHN C[C@@H]1CC[C@H](C)N1CC(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000756998574 575809402 /nfs/dbraw/zinc/80/94/02/575809402.db2.gz MTUXJXABNBBKHH-PHIMTYICSA-N 0 3 325.796 2.737 20 5 EFBDHN C[C@H]1CN(C2CC2)C[C@H]1NC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000757795341 575853115 /nfs/dbraw/zinc/85/31/15/575853115.db2.gz KXZMNGFCWGPOSJ-TVQRCGJNSA-N 0 3 338.795 2.852 20 5 EFBDHN Cc1cc(CN(C)C)cc(NC(=O)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000759751319 575929975 /nfs/dbraw/zinc/92/99/75/575929975.db2.gz XJIULDICIGIYBW-UHFFFAOYSA-N 0 3 328.372 2.799 20 5 EFBDHN CS(=O)(=O)[C@H]1CCC[C@@H](NCc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000761525430 576174382 /nfs/dbraw/zinc/17/43/82/576174382.db2.gz JZZPKGXIFCFKDW-NEPJUHHUSA-N 0 3 346.836 2.694 20 5 EFBDHN C[C@H](CNC(=O)c1cc(F)c([N+](=O)[O-])cc1F)N1CCCC[C@@H]1C ZINC000763407607 576376130 /nfs/dbraw/zinc/37/61/30/576376130.db2.gz NOHVOWQUNQKBFB-WDEREUQCSA-N 0 3 341.358 2.866 20 5 EFBDHN C[C@@H](C[C@H](O)c1ccco1)NCc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000763523891 576380079 /nfs/dbraw/zinc/38/00/79/576380079.db2.gz KANIVDYSCZVFHO-FZMZJTMJSA-N 0 3 348.355 2.561 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCN1CCC[C@H]1C ZINC000765747610 577072251 /nfs/dbraw/zinc/07/22/51/577072251.db2.gz ZCMJZKSLUCTNHV-ZBFHGGJFSA-N 0 3 333.432 2.764 20 5 EFBDHN Cc1cc(F)cc(C(=O)NC[C@H]2CCCCN2C2CC2)c1[N+](=O)[O-] ZINC000765795187 577077841 /nfs/dbraw/zinc/07/78/41/577077841.db2.gz GGTWDCNRNQMAOY-CQSZACIVSA-N 0 3 335.379 2.789 20 5 EFBDHN O=C(NC[C@@H]1CCCCN1C1CC1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000765798722 577078148 /nfs/dbraw/zinc/07/81/48/577078148.db2.gz BWSKBGLAIRSHSM-ZDUSSCGKSA-N 0 3 337.807 2.995 20 5 EFBDHN O=[N+]([O-])c1ccc([C@@H](O)CN[C@H]2CCOc3ccc(F)cc32)cc1 ZINC000765847994 577082519 /nfs/dbraw/zinc/08/25/19/577082519.db2.gz DIHUZMUYDFTVMP-HOTGVXAUSA-N 0 3 332.331 2.881 20 5 EFBDHN Cc1ccc([C@@H](O)CN[C@H](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2)o1 ZINC000766141531 577113855 /nfs/dbraw/zinc/11/38/55/577113855.db2.gz MYBJZZHSKQKRRU-ABAIWWIYSA-N 0 3 347.371 2.537 20 5 EFBDHN CC[C@@H](CO)N(Cc1ccccc1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000767820008 577236360 /nfs/dbraw/zinc/23/63/60/577236360.db2.gz OLXHJFCFMITTMW-HKUYNNGSSA-N 0 3 344.411 2.901 20 5 EFBDHN CN1CCC2(CCCN2C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000769139525 577338377 /nfs/dbraw/zinc/33/83/77/577338377.db2.gz IIHSLBAWLTXUJB-UHFFFAOYSA-N 0 3 337.807 2.949 20 5 EFBDHN CN1CCC[C@H](CNC(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000770011018 577397791 /nfs/dbraw/zinc/39/77/91/577397791.db2.gz YKACBMLXKZSELC-SNVBAGLBSA-N 0 3 326.784 2.712 20 5 EFBDHN O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)OCCN1CCCCC1 ZINC000770410903 577416283 /nfs/dbraw/zinc/41/62/83/577416283.db2.gz KNOAXPBBHZAOMT-UHFFFAOYSA-N 0 3 331.372 2.648 20 5 EFBDHN O=[N+]([O-])c1ccc([C@H](O)CN2CC[C@@]3(C2)OCc2ccccc23)cc1 ZINC000770689218 581126064 /nfs/dbraw/zinc/12/60/64/581126064.db2.gz PMVDYDYDYOAZIX-MOPGFXCFSA-N 0 3 340.379 2.760 20 5 EFBDHN Cn1cc([N+](=O)[O-])cc1C(=O)OCC1CCN(Cc2ccco2)CC1 ZINC000772688172 581355939 /nfs/dbraw/zinc/35/59/39/581355939.db2.gz CKNPJXYONJWEGV-UHFFFAOYSA-N 0 3 347.371 2.595 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCC(NCc3cccc(F)n3)CC2)cc1 ZINC000773090419 581395854 /nfs/dbraw/zinc/39/58/54/581395854.db2.gz TWEAYUCJDOMGBO-UHFFFAOYSA-N 0 3 330.363 2.888 20 5 EFBDHN CC(C)(CNCc1cc(Cl)ccc1[N+](=O)[O-])[C@@]1(O)CCCOC1 ZINC000850400288 1250467436 /nfs/dbraw/zinc/46/74/36/1250467436.db2.gz FATZYTXGCRSHNL-MRXNPFEDSA-N 0 3 342.823 2.906 20 5 EFBDHN CC(COC(=O)C(C)(C)Oc1ccc(Br)cc1)[N+](=O)[O-] ZINC000851036679 1250765121 /nfs/dbraw/zinc/76/51/21/1250765121.db2.gz LZRKYWNEOKXYTC-SECBINFHSA-N 0 3 346.177 2.815 20 5 EFBDHN CC([C@@H](OC(=O)Cn1cc(C2CC2)cn1)c1ccccc1F)[N+](=O)[O-] ZINC000851107932 1250800534 /nfs/dbraw/zinc/80/05/34/1250800534.db2.gz FRUSORKQRGHYOR-APPDUMDISA-N 0 3 347.346 2.849 20 5 EFBDHN CCN(C)C(C)(C)C(=O)NC/C=C/CNc1cc(C)ccc1[N+](=O)[O-] ZINC001107390833 1255705828 /nfs/dbraw/zinc/70/58/28/1255705828.db2.gz ABEARNHVUWAASB-BQYQJAHWSA-N 0 3 348.447 2.718 20 5 EFBDHN CCN(C)C(C)(C)C(=O)NC/C=C\CNc1ccc(C)cc1[N+](=O)[O-] ZINC001107391472 1255724928 /nfs/dbraw/zinc/72/49/28/1255724928.db2.gz ILSDCMORDQUFSJ-FPLPWBNLSA-N 0 3 348.447 2.718 20 5 EFBDHN O=C(N1CCC(NCc2csc([N+](=O)[O-])c2)CC1)C1(C2CC2)CC1 ZINC000996701170 1255772154 /nfs/dbraw/zinc/77/21/54/1255772154.db2.gz AKJOXEXSJBCJNC-UHFFFAOYSA-N 0 3 349.456 2.927 20 5 EFBDHN O=C([C@H]1C[C@H]2C[C@H]2C1)N1CCC(NCc2csc([N+](=O)[O-])c2)CC1 ZINC000996917876 1256466395 /nfs/dbraw/zinc/46/63/95/1256466395.db2.gz QDLYTZWXYLAXJF-WDNDVIMCSA-N 0 3 349.456 2.783 20 5 EFBDHN O=C(NCCNCc1ccc([N+](=O)[O-])cc1)c1sccc1Cl ZINC001127851164 1256633401 /nfs/dbraw/zinc/63/34/01/1256633401.db2.gz VJMRCHBMNAUUDF-UHFFFAOYSA-N 0 3 339.804 2.829 20 5 EFBDHN O=C(C1CC=CC1)N1CCC(CNCc2csc([N+](=O)[O-])c2)CC1 ZINC000997638651 1258142820 /nfs/dbraw/zinc/14/28/20/1258142820.db2.gz UEJWTIHXPIYBIM-UHFFFAOYSA-N 0 3 349.456 2.951 20 5 EFBDHN CCN(CC)CC(=O)NCCC1(CNc2ccc([N+](=O)[O-])cc2)CC1 ZINC001089944636 1261011108 /nfs/dbraw/zinc/01/11/08/1261011108.db2.gz YVARVDGWGIJASD-UHFFFAOYSA-N 0 3 348.447 2.635 20 5 EFBDHN Cc1cccc(C)c1CC(=O)NCCNCc1cccc([N+](=O)[O-])c1 ZINC001128396267 1264590098 /nfs/dbraw/zinc/59/00/98/1264590098.db2.gz XJYJHJTYGZDCMA-UHFFFAOYSA-N 0 3 341.411 2.660 20 5 EFBDHN Cc1cc[nH]c1C(=O)NC[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001086075035 1269799592 /nfs/dbraw/zinc/79/95/92/1269799592.db2.gz RZIFREHNVPGVQK-OTVXOJSOSA-N 0 3 342.399 2.530 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCN1CCC[C@H]1C ZINC000742239976 1269950602 /nfs/dbraw/zinc/95/06/02/1269950602.db2.gz PFLXGFJZZVBFOE-CHWSQXEVSA-N 0 3 337.445 2.676 20 5 EFBDHN Cc1cc(Cl)c(C(=O)NC[C@@H](C)N2CCCC2)cc1[N+](=O)[O-] ZINC000825441865 1278550460 /nfs/dbraw/zinc/55/04/60/1278550460.db2.gz ZFQKRNYPUNHWAQ-LLVKDONJSA-N 0 3 325.796 2.771 20 5 EFBDHN O=C(NC[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1)c1cccs1 ZINC001086297457 1270868950 /nfs/dbraw/zinc/86/89/50/1270868950.db2.gz GMOPJPZJAAARRD-MQMHXKEQSA-N 0 3 345.424 2.955 20 5 EFBDHN O=C(N[C@H]1CC[C@H](NCc2csc([N+](=O)[O-])c2)CC1)C1CCC1 ZINC001034577523 1272322484 /nfs/dbraw/zinc/32/24/84/1272322484.db2.gz LUPFDAIJTBVLKQ-HDJSIYSDSA-N 0 3 337.445 2.973 20 5 EFBDHN CN(CC(F)F)C1CCN(CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000746483236 1272408233 /nfs/dbraw/zinc/40/82/33/1272408233.db2.gz UEVPMUBOYILVAZ-UHFFFAOYSA-N 0 3 343.374 2.635 20 5 EFBDHN O=C(CN[C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(C(F)(F)F)cc1 ZINC001168976267 1272546637 /nfs/dbraw/zinc/54/66/37/1272546637.db2.gz CDYPMNVSXKOWPX-ZWNOBZJWSA-N 0 3 330.306 2.923 20 5 EFBDHN O=[N+]([O-])C[C@H]1CC[C@@H](N2CCN(c3nsc4ccccc43)CC2)C1 ZINC001169010654 1272582644 /nfs/dbraw/zinc/58/26/44/1272582644.db2.gz FGMOSTOCFCORQV-UONOGXRCSA-N 0 3 346.456 2.864 20 5 EFBDHN O=c1[nH]c2ccccc2n1C1CCN([C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169012427 1272585544 /nfs/dbraw/zinc/58/55/44/1272585544.db2.gz QAKHLYNOILAQRJ-ZFWWWQNUSA-N 0 3 344.415 2.824 20 5 EFBDHN O=[N+]([O-])C[C@@H]1CC[C@@H](N2CCN(Cc3cccc(Cl)c3)CC2)C1 ZINC001169028491 1272592558 /nfs/dbraw/zinc/59/25/58/1272592558.db2.gz SRBAWJBYCFCDDE-NVXWUHKLSA-N 0 3 337.851 2.903 20 5 EFBDHN O=[N+]([O-])C[C@H]1CC[C@@H](N2CCN(Cc3cccc(Cl)c3)CC2)C1 ZINC001169028489 1272592749 /nfs/dbraw/zinc/59/27/49/1272592749.db2.gz SRBAWJBYCFCDDE-DOTOQJQBSA-N 0 3 337.851 2.903 20 5 EFBDHN CC[C@@H]1CN(C(=O)OC(C)(C)C)CCN1[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169033230 1272596621 /nfs/dbraw/zinc/59/66/21/1272596621.db2.gz BLVFFQGSEAYJDF-RBSFLKMASA-N 0 3 341.452 2.763 20 5 EFBDHN C[C@@H]1CN([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C[C@H](C)N1C(=O)OC(C)(C)C ZINC001169037541 1272603603 /nfs/dbraw/zinc/60/36/03/1272603603.db2.gz SEDOFOLAONWQEW-LJISPDSOSA-N 0 3 341.452 2.762 20 5 EFBDHN CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H]1CN2[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169041603 1272612952 /nfs/dbraw/zinc/61/29/52/1272612952.db2.gz BLEHFJISZGPSGN-QPSCCSFWSA-N 0 3 339.436 2.516 20 5 EFBDHN C[C@@H](N)c1ccn(-c2c(Br)cc(F)cc2[N+](=O)[O-])n1 ZINC001169231643 1272748320 /nfs/dbraw/zinc/74/83/20/1272748320.db2.gz OPIMIGONKPXFTG-ZCFIWIBFSA-N 0 3 329.129 2.702 20 5 EFBDHN C[C@@H](N)c1ccn(-c2ccc(C(=O)OC(C)(C)C)c([N+](=O)[O-])c2)n1 ZINC001169234268 1272748904 /nfs/dbraw/zinc/74/89/04/1272748904.db2.gz WMUOVVXLBVIDSX-SNVBAGLBSA-N 0 3 332.360 2.756 20 5 EFBDHN O=[N+]([O-])c1ccc(Cl)cc1N1CCCN(C[C@@H]2CCCO2)CC1 ZINC000804344504 1273328571 /nfs/dbraw/zinc/32/85/71/1273328571.db2.gz UKHKDKMHETUGAW-AWEZNQCLSA-N 0 3 339.823 2.939 20 5 EFBDHN Cc1cc(NCCCN(C)C(=O)CN(C)C(C)C)ccc1[N+](=O)[O-] ZINC001109463376 1274307722 /nfs/dbraw/zinc/30/77/22/1274307722.db2.gz DVUHDFMLPGLFLN-UHFFFAOYSA-N 0 3 336.436 2.504 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(NCCCN(C)C(=O)CN(C)C2CCC2)c1 ZINC001109652870 1274522431 /nfs/dbraw/zinc/52/24/31/1274522431.db2.gz FWMMOZYJMODLGK-UHFFFAOYSA-N 0 3 348.447 2.648 20 5 EFBDHN Cc1cc(NC[C@@H]2CN3CCC[C@H]3CO2)c(Cl)cc1[N+](=O)[O-] ZINC000785808010 1275193931 /nfs/dbraw/zinc/19/39/31/1275193931.db2.gz WMKCNYUQFCYMQH-NWDGAFQWSA-N 0 3 325.796 2.832 20 5 EFBDHN CN1CCC[C@@H]2CN(c3nc(Cl)c(Cl)cc3[N+](=O)[O-])C[C@@H]21 ZINC001157265269 1275859634 /nfs/dbraw/zinc/85/96/34/1275859634.db2.gz IKOVYZXZWQTZJE-KCJUWKMLSA-N 0 3 331.203 2.827 20 5 EFBDHN COc1ccc(C[C@H](C)NCC(=O)Nc2ccccc2)c([N+](=O)[O-])c1 ZINC001170305374 1278991888 /nfs/dbraw/zinc/99/18/88/1278991888.db2.gz JVDUHBUJYFLPAF-ZDUSSCGKSA-N 0 3 343.383 2.763 20 5 EFBDHN COc1ccc(C[C@@H](C)NCc2cccc(OC)n2)c([N+](=O)[O-])c1 ZINC001170312231 1279008024 /nfs/dbraw/zinc/00/80/24/1279008024.db2.gz FJDVUJZSSVPNHL-GFCCVEGCSA-N 0 3 331.372 2.728 20 5 EFBDHN C[C@@H](N[C@@H](C)CNC(=O)OC(C)(C)C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788780084 1276322635 /nfs/dbraw/zinc/32/26/35/1276322635.db2.gz AZYBUJSVVPJPHD-WDEREUQCSA-N 0 3 338.408 2.741 20 5 EFBDHN COc1ccc(C[C@@H](C)N2CCC[C@]3(CCC(=O)O3)C2)c([N+](=O)[O-])c1 ZINC001170355233 1279034502 /nfs/dbraw/zinc/03/45/02/1279034502.db2.gz YAPCUNZFQYOTAL-ACJLOTCBSA-N 0 3 348.399 2.706 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CNCc2ccc(OCC3CC3)nc2)c1 ZINC000818991148 1276564944 /nfs/dbraw/zinc/56/49/44/1276564944.db2.gz XPAFINCMMAGTNU-KRWDZBQOSA-N 0 3 343.383 2.602 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCOc3ccc(F)cc32)c1 ZINC000819048654 1276581546 /nfs/dbraw/zinc/58/15/46/1276581546.db2.gz OEPNFPFMYHBXNH-HZPDHXFCSA-N 0 3 332.331 2.881 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CCOc3c(F)cccc32)c1 ZINC000819251066 1276685206 /nfs/dbraw/zinc/68/52/06/1276685206.db2.gz AIWFSUQVPLZNIW-HOTGVXAUSA-N 0 3 332.331 2.881 20 5 EFBDHN CC[C@H](C)Oc1cc(CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)ccn1 ZINC000819215825 1276692842 /nfs/dbraw/zinc/69/28/42/1276692842.db2.gz OCPONJUGXAYENA-SUMWQHHRSA-N 0 3 345.399 2.990 20 5 EFBDHN O=[N+]([O-])c1ccc([C@H](O)CNCc2ccc3c(n2)CCCC3)cc1 ZINC000819267217 1276719657 /nfs/dbraw/zinc/71/96/57/1276719657.db2.gz SBTYQCDHNZQPIE-GOSISDBHSA-N 0 3 327.384 2.692 20 5 EFBDHN CC[C@H](C)N[C@H](CNC[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000819386564 1276766775 /nfs/dbraw/zinc/76/67/75/1276766775.db2.gz AXEQHCOXNIMTKN-XKQJLSEDSA-N 0 3 347.415 2.940 20 5 EFBDHN CCC(CC)Nc1ccncc1NC(=O)c1cc([N+](=O)[O-])ccc1N ZINC000820139561 1277042976 /nfs/dbraw/zinc/04/29/76/1277042976.db2.gz GXWFCECRVGQKHK-UHFFFAOYSA-N 0 3 343.387 2.847 20 5 EFBDHN C[C@H](C(=O)N1[C@@H]2CC[C@H]1CN(C)CC2)c1ccc([N+](=O)[O-])cc1F ZINC000923271093 1277437208 /nfs/dbraw/zinc/43/72/08/1277437208.db2.gz KQANYOWVDOUROO-SCRDCRAPSA-N 0 3 335.379 2.533 20 5 EFBDHN CN1CC[C@@H]2CC[C@H](C1)N2C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000923284168 1277460195 /nfs/dbraw/zinc/46/01/95/1277460195.db2.gz IPXDSCFQOYUODJ-GOEBONIOSA-N 0 3 331.416 2.568 20 5 EFBDHN CCN(C(=O)c1cc([N+](=O)[O-])ccc1SC)C1CCN(C)CC1 ZINC000821401495 1277536307 /nfs/dbraw/zinc/53/63/07/1277536307.db2.gz UXTGCUHVVVTDEN-UHFFFAOYSA-N 0 3 337.445 2.873 20 5 EFBDHN O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])OCCN1CCCCC1 ZINC000790747225 1277757566 /nfs/dbraw/zinc/75/75/66/1277757566.db2.gz WLMGNWAYGGLJIF-UHFFFAOYSA-N 0 3 344.770 2.959 20 5 EFBDHN CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1N(C)CCCC1(C)C ZINC000791118180 1277952934 /nfs/dbraw/zinc/95/29/34/1277952934.db2.gz WJBVRLDBWBJNNR-MRXNPFEDSA-N 0 3 348.447 2.511 20 5 EFBDHN COc1ccc(C[C@H](C)N2CCN3CCCC[C@H]3C2)c([N+](=O)[O-])c1 ZINC001170345048 1279050024 /nfs/dbraw/zinc/05/00/24/1279050024.db2.gz GXHHKOBIRCLOGH-HOCLYGCPSA-N 0 3 333.432 2.705 20 5 EFBDHN COc1ccc(C[C@H](C)N2CCC3(CCOC3=O)CC2)c([N+](=O)[O-])c1 ZINC001170351435 1279056945 /nfs/dbraw/zinc/05/69/45/1279056945.db2.gz CFGWMSRXTFZSNA-ZDUSSCGKSA-N 0 3 348.399 2.564 20 5 EFBDHN COc1ccc(C[C@@H](C)n2c(C)nc3c2CNCC3)c([N+](=O)[O-])c1 ZINC001170351022 1279057849 /nfs/dbraw/zinc/05/78/49/1279057849.db2.gz DHPZSUDOHGMMMM-LLVKDONJSA-N 0 3 330.388 2.558 20 5 EFBDHN CCN1CCN([C@H](C)CNc2cc(Cl)c(F)cc2[N+](=O)[O-])CC1 ZINC000845466973 1279660663 /nfs/dbraw/zinc/66/06/63/1279660663.db2.gz DLLTUOLZRHNSJG-LLVKDONJSA-N 0 3 344.818 2.825 20 5 EFBDHN CN1CCN(CCNc2cc(Cl)c(F)cc2[N+](=O)[O-])CC1(C)C ZINC000845537787 1279708042 /nfs/dbraw/zinc/70/80/42/1279708042.db2.gz ZNLADARYMZENNN-UHFFFAOYSA-N 0 3 344.818 2.825 20 5 EFBDHN COc1ccc(CC(=O)OC[C@H]2CCN2C(C)(C)C)cc1[N+](=O)[O-] ZINC000845734143 1279806028 /nfs/dbraw/zinc/80/60/28/1279806028.db2.gz FTMFAEKWPUUDJX-CYBMUJFWSA-N 0 3 336.388 2.562 20 5 EFBDHN CC([C@@H](OC(=O)c1n[nH]c2c1CCCC2)c1ccccc1F)[N+](=O)[O-] ZINC000845872132 1279900984 /nfs/dbraw/zinc/90/09/84/1279900984.db2.gz CISUBHODFZDDGX-QLJPJBMISA-N 0 3 347.346 2.991 20 5 EFBDHN Cc1cc(C)n(CCC(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])n1 ZINC000845872237 1279901273 /nfs/dbraw/zinc/90/12/73/1279901273.db2.gz FEJUIXXQDPPYML-SUMWQHHRSA-N 0 3 349.362 2.979 20 5 EFBDHN COc1cccc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])n1 ZINC000845877477 1279902979 /nfs/dbraw/zinc/90/29/79/1279902979.db2.gz PWQBPGXIKZUYSK-ZUZCIYMTSA-N 0 3 334.303 2.793 20 5 EFBDHN CC([C@H](OC(=O)c1ccn(C(F)F)n1)c1ccccc1F)[N+](=O)[O-] ZINC000845876743 1279903350 /nfs/dbraw/zinc/90/33/50/1279903350.db2.gz OFSSJBBMLFKAAA-PELKAZGASA-N 0 3 343.261 2.981 20 5 EFBDHN COCC1(CC(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])CC1 ZINC000845881661 1279904422 /nfs/dbraw/zinc/90/44/22/1279904422.db2.gz MZFSFBAVOLEKOS-XHDPSFHLSA-N 0 3 325.336 2.892 20 5 EFBDHN CC([C@H](OC(=O)Cn1cc(Cl)cn1)c1ccccc1F)[N+](=O)[O-] ZINC000845880064 1279904624 /nfs/dbraw/zinc/90/46/24/1279904624.db2.gz KKQSISGURLJIPO-XPTSAGLGSA-N 0 3 341.726 2.625 20 5 EFBDHN CC([C@H](OC(=O)C[C@H]1CCCOC1)c1ccccc1F)[N+](=O)[O-] ZINC000845883828 1279905792 /nfs/dbraw/zinc/90/57/92/1279905792.db2.gz WHMDVUMJVMQFMJ-HSMVNMDESA-N 0 3 325.336 2.892 20 5 EFBDHN CC([C@@H](OC(=O)c1cc(Cl)n(C)n1)c1ccccc1F)[N+](=O)[O-] ZINC000845882068 1279905961 /nfs/dbraw/zinc/90/59/61/1279905961.db2.gz NVAYYAXDBYGZAJ-ISVAXAHUSA-N 0 3 341.726 2.776 20 5 EFBDHN CC([C@@H](OC(=O)C[C@H]1CCCOC1)c1ccccc1F)[N+](=O)[O-] ZINC000845883831 1279906303 /nfs/dbraw/zinc/90/63/03/1279906303.db2.gz WHMDVUMJVMQFMJ-XHBSWPGZSA-N 0 3 325.336 2.892 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1NCCC1CCC3(CC1)OCCO3)CNC2 ZINC001171223948 1280148376 /nfs/dbraw/zinc/14/83/76/1280148376.db2.gz ZXKAMKQFZWNAKN-UHFFFAOYSA-N 0 3 347.415 2.933 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H]1CCc2nc(C)nn2C1 ZINC000872031987 1287407034 /nfs/dbraw/zinc/40/70/34/1287407034.db2.gz OSCRHGCAHIGKFY-JQWIXIFHSA-N 0 3 347.444 2.882 20 5 EFBDHN O=C(NCCNCc1cccc([N+](=O)[O-])c1)c1ccc(C(F)F)o1 ZINC001149390460 1280233097 /nfs/dbraw/zinc/23/30/97/1280233097.db2.gz RQIVOPMPTFBGKC-UHFFFAOYSA-N 0 3 339.298 2.645 20 5 EFBDHN O=[N+]([O-])c1ccc(Cl)cc1CN[C@H](C1CC1)[C@]1(CO)CCCO1 ZINC000815289268 1287413166 /nfs/dbraw/zinc/41/31/66/1287413166.db2.gz XKMMSCMSTUSFGY-HZPDHXFCSA-N 0 3 340.807 2.658 20 5 EFBDHN CN(CCN1CCCCC1)C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000846614698 1280323039 /nfs/dbraw/zinc/32/30/39/1280323039.db2.gz RPDGXDRHJFVGBY-UHFFFAOYSA-N 0 3 325.796 2.806 20 5 EFBDHN CCOC1CC(O)(CN[C@H](C)c2cc([N+](=O)[O-])ccc2SC)C1 ZINC000872066714 1287418842 /nfs/dbraw/zinc/41/88/42/1287418842.db2.gz KRGNWHUJHSSRPW-FFKNIBCLSA-N 0 3 340.445 2.897 20 5 EFBDHN CN1CCN(Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC12CCCCC2 ZINC000846942290 1280646599 /nfs/dbraw/zinc/64/65/99/1280646599.db2.gz QJBXVFVGOKEPOE-UHFFFAOYSA-N 0 3 348.403 2.953 20 5 EFBDHN CN1CCN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC12CCCCC2 ZINC000846945378 1280647076 /nfs/dbraw/zinc/64/70/76/1280647076.db2.gz ZQDZAICMSKGRFA-QGZVFWFLSA-N 0 3 333.432 2.579 20 5 EFBDHN Cc1ccc(N[C@H]2C[C@H](CNC(=O)CN(C)C(C)C)C2)c([N+](=O)[O-])c1 ZINC001091462233 1280742811 /nfs/dbraw/zinc/74/28/11/1280742811.db2.gz HSMRAWOQEGATDV-SHTZXODSSA-N 0 3 348.447 2.550 20 5 EFBDHN CCc1ccc(F)cc1C(=O)NCCNCc1cccc([N+](=O)[O-])c1 ZINC001130814614 1281201114 /nfs/dbraw/zinc/20/11/14/1281201114.db2.gz WOLQIRHWASIQQQ-UHFFFAOYSA-N 0 3 345.374 2.816 20 5 EFBDHN CCc1ccc(C(=O)NCCNCc2ccc([N+](=O)[O-])cc2)s1 ZINC001130965797 1281341062 /nfs/dbraw/zinc/34/10/62/1281341062.db2.gz NAURWIMFQAIIES-UHFFFAOYSA-N 0 3 333.413 2.738 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C\CN[C@@H]1COc2ccccc2[C@@H]1O ZINC000808454435 1281717770 /nfs/dbraw/zinc/71/77/70/1281717770.db2.gz QABOMJWJLMQYLU-CBCNTLDJSA-N 0 3 326.352 2.692 20 5 EFBDHN Cc1ccc(C)c(C(=O)NCCNCc2cccc([N+](=O)[O-])c2)c1 ZINC001148959977 1281821268 /nfs/dbraw/zinc/82/12/68/1281821268.db2.gz ATCFSOOJONXUNH-UHFFFAOYSA-N 0 3 327.384 2.731 20 5 EFBDHN O=C(NCCNCc1cccc([N+](=O)[O-])c1)C1CCC2(CC2)CC1 ZINC001131422012 1281866124 /nfs/dbraw/zinc/86/61/24/1281866124.db2.gz GLONUWMGHALDHT-UHFFFAOYSA-N 0 3 331.416 2.771 20 5 EFBDHN Cc1ccc(F)cc1C(=O)NCCNCc1cccc([N+](=O)[O-])c1 ZINC001132019987 1282768938 /nfs/dbraw/zinc/76/89/38/1282768938.db2.gz HMCMOLJGEMHKFH-UHFFFAOYSA-N 0 3 331.347 2.562 20 5 EFBDHN C[C@H](N[C@@H]1CC(=O)N(c2ccccc2)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815567291 1287601837 /nfs/dbraw/zinc/60/18/37/1287601837.db2.gz SYAYOHJRJITUIK-GXTWGEPZSA-N 0 3 340.383 2.633 20 5 EFBDHN O=C(NCCNCc1cccc([N+](=O)[O-])c1)c1cc2ccsc2[nH]1 ZINC001132092906 1282909040 /nfs/dbraw/zinc/90/90/40/1282909040.db2.gz ILHDJUJXAYIPIB-UHFFFAOYSA-N 0 3 344.396 2.657 20 5 EFBDHN C[C@H](NCc1ccc(C[S@](C)=O)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815625934 1287645672 /nfs/dbraw/zinc/64/56/72/1287645672.db2.gz QIDGXRIEKQGPJS-MCFWBGNESA-N 0 3 347.440 2.906 20 5 EFBDHN Cc1c(C(=O)NCCNCc2ccc([N+](=O)[O-])cc2)ccn1C(C)C ZINC001132722479 1284180664 /nfs/dbraw/zinc/18/06/64/1284180664.db2.gz JHCQEFYSCZWHKL-UHFFFAOYSA-N 0 3 344.415 2.805 20 5 EFBDHN O=C(NCCNCc1cccc([N+](=O)[O-])c1)C1(C(F)F)CCCC1 ZINC001132812874 1284317546 /nfs/dbraw/zinc/31/75/46/1284317546.db2.gz SSPOLUPZOXZFAY-UHFFFAOYSA-N 0 3 341.358 2.626 20 5 EFBDHN Cn1nccc1CCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811491017 1284347515 /nfs/dbraw/zinc/34/75/15/1284347515.db2.gz XWRAADSHQVCIGW-UHFFFAOYSA-N 0 3 329.187 2.967 20 5 EFBDHN C[C@H](N)c1ncc(-c2ccccc2)n1-c1ncnc(Cl)c1[N+](=O)[O-] ZINC001170678872 1285185974 /nfs/dbraw/zinc/18/59/74/1285185974.db2.gz HHWCQUMMNCGXNR-VIFPVBQESA-N 0 3 344.762 2.911 20 5 EFBDHN CC(C)C(=O)Nc1ccc(Cl)c(C(=O)OCC(C)[N+](=O)[O-])c1 ZINC000813100636 1285652323 /nfs/dbraw/zinc/65/23/23/1285652323.db2.gz UTSGIIWFKCOURS-SECBINFHSA-N 0 3 328.752 2.757 20 5 EFBDHN CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)OCC(C)[N+](=O)[O-] ZINC000813103303 1285653460 /nfs/dbraw/zinc/65/34/60/1285653460.db2.gz BUGKNZHTTJBJBJ-JTQLQIEISA-N 0 3 332.360 2.712 20 5 EFBDHN CC(C)CC(=O)Nc1ccc(C(=O)OCC(C)[N+](=O)[O-])cc1F ZINC000813104152 1285653854 /nfs/dbraw/zinc/65/38/54/1285653854.db2.gz XAFHCNSASVSHHC-SNVBAGLBSA-N 0 3 326.324 2.632 20 5 EFBDHN COc1cc(-n2cccc2)c(Cl)cc1C(=O)OCC(C)[N+](=O)[O-] ZINC000813102417 1285654317 /nfs/dbraw/zinc/65/43/17/1285654317.db2.gz RFPPNGZUJLWXPD-JTQLQIEISA-N 0 3 338.747 2.961 20 5 EFBDHN CC(COC(=O)c1ccc(-n2cnc3ccccc32)cc1)[N+](=O)[O-] ZINC000813103246 1285654914 /nfs/dbraw/zinc/65/49/14/1285654914.db2.gz ZHGAELZFIWFVKW-LBPRGKRZSA-N 0 3 325.324 2.848 20 5 EFBDHN CC(COC(=O)c1ccccc1C(=O)c1ccc(F)cc1)[N+](=O)[O-] ZINC000813105746 1285665965 /nfs/dbraw/zinc/66/59/65/1285665965.db2.gz UABFKCKEOWUFRD-NSHDSACASA-N 0 3 331.299 2.879 20 5 EFBDHN Cc1nc(COc2ccccc2C(=O)OCC(C)[N+](=O)[O-])cs1 ZINC000813106623 1285679368 /nfs/dbraw/zinc/67/93/68/1285679368.db2.gz FIMQTLPWXNHRDD-SNVBAGLBSA-N 0 3 336.369 2.853 20 5 EFBDHN Cc1ccc(C(=O)OCC(C)[N+](=O)[O-])cc1NC(=O)NC(C)(C)C ZINC000813108312 1285681095 /nfs/dbraw/zinc/68/10/95/1285681095.db2.gz DCWMFQFQDXHQNQ-NSHDSACASA-N 0 3 337.376 2.737 20 5 EFBDHN COc1ccccc1OCc1ccc(C(=O)OCC(C)[N+](=O)[O-])o1 ZINC000813109178 1285682328 /nfs/dbraw/zinc/68/23/28/1285682328.db2.gz GPVCHIIBEMBQKS-LLVKDONJSA-N 0 3 335.312 2.689 20 5 EFBDHN CC(COC(=O)C1CCN(c2nc3ccccc3s2)CC1)[N+](=O)[O-] ZINC000813112559 1285684566 /nfs/dbraw/zinc/68/45/66/1285684566.db2.gz IFQANALAFJCCTR-LLVKDONJSA-N 0 3 349.412 2.721 20 5 EFBDHN CCc1c(C(=O)OCC(C)[N+](=O)[O-])cnn1-c1cccc(Cl)c1 ZINC000813115333 1285687014 /nfs/dbraw/zinc/68/70/14/1285687014.db2.gz PEFLRPBEWINEFF-SNVBAGLBSA-N 0 3 337.763 2.910 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CC[C@@H](C)[C@@H](O)CC2)c1F ZINC001173178933 1286453974 /nfs/dbraw/zinc/45/39/74/1286453974.db2.gz CFGTUPZVDRVQRF-XUJVJEKNSA-N 0 3 340.395 2.766 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)NCc2cnc(C)nc2)c1F ZINC001173189404 1286458257 /nfs/dbraw/zinc/45/82/57/1286458257.db2.gz PBAFYJSIMAAGLP-JTQLQIEISA-N 0 3 334.351 2.562 20 5 EFBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N(C)CCNC(=O)OC(C)(C)C ZINC001173224465 1286478361 /nfs/dbraw/zinc/47/83/61/1286478361.db2.gz GFQFWCMYIBNYMB-CYBMUJFWSA-N 0 3 337.420 2.982 20 5 EFBDHN CCNC(=O)OC1CCN([C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173231103 1286483558 /nfs/dbraw/zinc/48/35/58/1286483558.db2.gz JQLGDJACHXYGBS-CYBMUJFWSA-N 0 3 335.404 2.736 20 5 EFBDHN CC(C)NC(=O)N[C@H]1CCCN([C@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173238141 1286495796 /nfs/dbraw/zinc/49/57/96/1286495796.db2.gz NWWNPASNVUAAMR-ZBFHGGJFSA-N 0 3 348.447 2.698 20 5 EFBDHN Cc1ccc(C(=O)NCCNCc2cccc([N+](=O)[O-])c2)c(F)c1 ZINC001134301915 1286544013 /nfs/dbraw/zinc/54/40/13/1286544013.db2.gz JFOBJGPCUMFYMQ-UHFFFAOYSA-N 0 3 331.347 2.562 20 5 EFBDHN O=C(NCCNCc1ccc([N+](=O)[O-])cc1)C1CCC(F)(F)CC1 ZINC001134334680 1286581820 /nfs/dbraw/zinc/58/18/20/1286581820.db2.gz UPIGDVUDFOEUJU-UHFFFAOYSA-N 0 3 341.358 2.626 20 5 EFBDHN CCN(CC)CC(=O)N1CCC(Nc2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC001095228746 1286712354 /nfs/dbraw/zinc/71/23/54/1286712354.db2.gz VCRMNAYFRNAIHL-UHFFFAOYSA-N 0 3 348.447 2.648 20 5 EFBDHN CCc1ccc(CC(=O)NCCNCc2cccc([N+](=O)[O-])c2)cc1 ZINC001134491600 1286809787 /nfs/dbraw/zinc/80/97/87/1286809787.db2.gz XPNNGQFJLCRNRE-UHFFFAOYSA-N 0 3 341.411 2.606 20 5 EFBDHN Cc1nsc(C)c1C(=O)NCCCNCc1ccccc1[N+](=O)[O-] ZINC001177111080 1288276160 /nfs/dbraw/zinc/27/61/60/1288276160.db2.gz FFCDWFIBPZLDKK-UHFFFAOYSA-N 0 3 348.428 2.578 20 5 EFBDHN CNC(=O)c1ccc(CNCc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC000873009832 1289516490 /nfs/dbraw/zinc/51/64/90/1289516490.db2.gz BRWBBBPAUROQHX-UHFFFAOYSA-N 0 3 327.384 2.861 20 5 EFBDHN COc1ccc(OC)c([C@H](O)[C@H](C)NCc2ccc([N+](=O)[O-])cc2)c1 ZINC000873195545 1289634019 /nfs/dbraw/zinc/63/40/19/1289634019.db2.gz NSKYTZOTCUHSCA-KPZWWZAWSA-N 0 3 346.383 2.824 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000825797053 1290555450 /nfs/dbraw/zinc/55/54/50/1290555450.db2.gz PDZPXWYTQXFCLD-GFCCVEGCSA-N 0 3 325.796 2.852 20 5 EFBDHN CC[C@@H](NCCn1cc([N+](=O)[O-])ccc1=O)c1ccccc1OC ZINC000775065307 1291058414 /nfs/dbraw/zinc/05/84/14/1291058414.db2.gz MXCGKFNPTZYROY-OAHLLOKOSA-N 0 3 331.372 2.506 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1C[C@H](N2CCOCC2)C[C@@H]1C ZINC000877517031 1291254881 /nfs/dbraw/zinc/25/48/81/1291254881.db2.gz KVUDAVLBBZRPGB-GOEBONIOSA-N 0 3 333.432 2.507 20 5 EFBDHN CC(F)(F)C1(C(=O)NCCCNCc2csc([N+](=O)[O-])c2)CC1 ZINC001166838300 1312850795 /nfs/dbraw/zinc/85/07/95/1312850795.db2.gz BTKDKSXJFLPBFT-UHFFFAOYSA-N 0 3 347.387 2.688 20 5 EFBDHN Cc1c[n+]([O-])c(NC[C@@H](c2ccccc2)N2CCCC2)cc1[N+](=O)[O-] ZINC001166864695 1312855900 /nfs/dbraw/zinc/85/59/00/1312855900.db2.gz GQWGDUQIGVNUGQ-KRWDZBQOSA-N 0 3 342.399 2.786 20 5 EFBDHN O=C(NCCNCc1ccc([N+](=O)[O-])cc1)C12CCC(CC1)CC2 ZINC001151842058 1292038983 /nfs/dbraw/zinc/03/89/83/1292038983.db2.gz ALENGEZULDRGFS-UHFFFAOYSA-N 0 3 331.416 2.771 20 5 EFBDHN COc1ccc([C@H]2CN(Cc3cccc([N+](=O)[O-])c3)CCN2)cc1 ZINC000879519423 1292166917 /nfs/dbraw/zinc/16/69/17/1292166917.db2.gz SYEMWEBTUHTMPC-GOSISDBHSA-N 0 3 327.384 2.750 20 5 EFBDHN COc1ccc([C@@H]2CN(Cc3ccc([N+](=O)[O-])cc3F)CCN2)cc1 ZINC000879520309 1292168343 /nfs/dbraw/zinc/16/83/43/1292168343.db2.gz DNLGRWXUGXZXHI-SFHVURJKSA-N 0 3 345.374 2.889 20 5 EFBDHN O=[N+]([O-])c1c(F)nccc1N1CCCN(Cc2ccccc2)CC1 ZINC000881779112 1293003460 /nfs/dbraw/zinc/00/34/60/1293003460.db2.gz CZZVDVSIHWWPAW-UHFFFAOYSA-N 0 3 330.363 2.841 20 5 EFBDHN COc1cc(CN[C@@H](C)C[C@@H](O)c2ccco2)c([N+](=O)[O-])cc1O ZINC000130636500 1293411979 /nfs/dbraw/zinc/41/19/79/1293411979.db2.gz BGGSSKSJMYBLMG-GXFFZTMASA-N 0 3 336.344 2.504 20 5 EFBDHN CCN1CCC[C@H](Oc2c([N+](=O)[O-])cc([N+](=O)[O-])c3cccnc32)C1 ZINC001233903298 1313014967 /nfs/dbraw/zinc/01/49/67/1313014967.db2.gz CFYQIRNWSFUVSY-NSHDSACASA-N 0 3 346.343 2.914 20 5 EFBDHN CCN1CCC[C@@H](Oc2c([N+](=O)[O-])cc([N+](=O)[O-])c3cccnc32)C1 ZINC001233903297 1313015139 /nfs/dbraw/zinc/01/51/39/1313015139.db2.gz CFYQIRNWSFUVSY-LLVKDONJSA-N 0 3 346.343 2.914 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)Nc2cnc3c(c2)CNCC3)c1C ZINC000884243450 1294063456 /nfs/dbraw/zinc/06/34/56/1294063456.db2.gz HAHIGOTWRFDQPV-UHFFFAOYSA-N 0 3 326.356 2.505 20 5 EFBDHN O=[N+]([O-])c1ncccc1CN1CCC(c2ncc3n2CCCC3)CC1 ZINC000886178767 1294753340 /nfs/dbraw/zinc/75/33/40/1294753340.db2.gz FJXHUXULYXYBRO-UHFFFAOYSA-N 0 3 341.415 2.902 20 5 EFBDHN CCOC(=O)Cc1ccc([N+](=O)[O-])c(O[C@H]2CCN(C(C)C)C2)c1 ZINC001234409778 1313121814 /nfs/dbraw/zinc/12/18/14/1313121814.db2.gz GYUJXDCHRMQOOX-AWEZNQCLSA-N 0 3 336.388 2.562 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1C(=O)NCCN1CCCCCC1 ZINC000930106571 1297233772 /nfs/dbraw/zinc/23/37/72/1297233772.db2.gz RQEVNXWOAPKILL-UHFFFAOYSA-N 0 3 337.445 2.923 20 5 EFBDHN CN(CCOc1ccccc1F)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776273397 1297334599 /nfs/dbraw/zinc/33/45/99/1297334599.db2.gz AZPKWNFMYMGOPG-INIZCTEOSA-N 0 3 334.347 2.778 20 5 EFBDHN O=[N+]([O-])c1ccc([C@@H](O)CNCc2cnccc2C(F)(F)F)cc1 ZINC000853134382 1300019577 /nfs/dbraw/zinc/01/95/77/1300019577.db2.gz RGEQUCKOVMVHPZ-AWEZNQCLSA-N 0 3 341.289 2.832 20 5 EFBDHN Cc1noc(COC(=O)c2cccc(CN3CCCC3)c2)c1[N+](=O)[O-] ZINC000853913936 1300338229 /nfs/dbraw/zinc/33/82/29/1300338229.db2.gz HZTWLTKZGNCMBK-UHFFFAOYSA-N 0 3 345.355 2.844 20 5 EFBDHN CC(C)(C)N1CC[C@@H](NC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C1 ZINC000855289809 1300893774 /nfs/dbraw/zinc/89/37/74/1300893774.db2.gz VGZVMWURUDNFCS-GFCCVEGCSA-N 0 3 341.358 2.676 20 5 EFBDHN O=C(CC1CC1)NC1CC2(CC(NCc3csc([N+](=O)[O-])c3)C2)C1 ZINC000963485789 1300939157 /nfs/dbraw/zinc/93/91/57/1300939157.db2.gz VVQGLJNAUBFHPN-UHFFFAOYSA-N 0 3 349.456 2.973 20 5 EFBDHN CSc1cccc(C(=O)NC[C@@H](C)N2CCCCC2)c1[N+](=O)[O-] ZINC000777129393 1301624799 /nfs/dbraw/zinc/62/47/99/1301624799.db2.gz YMYWEEJIKCHEHB-GFCCVEGCSA-N 0 3 337.445 2.921 20 5 EFBDHN CCN(C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)C1CCN(C)CC1 ZINC000861892867 1302234300 /nfs/dbraw/zinc/23/43/00/1302234300.db2.gz VIHXGBNYMLNPMK-UHFFFAOYSA-N 0 3 341.358 2.629 20 5 EFBDHN CCOC[C@H](NCC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])C(C)C ZINC000794600238 1302836020 /nfs/dbraw/zinc/83/60/20/1302836020.db2.gz MBKOABQSHHEMJJ-ZDUSSCGKSA-N 0 3 343.811 2.837 20 5 EFBDHN CN(C)CCN(C(=O)Cc1cccc(F)c1[N+](=O)[O-])c1ccccc1 ZINC000865050573 1303138585 /nfs/dbraw/zinc/13/85/85/1303138585.db2.gz UKXPFLYUIXYBGO-UHFFFAOYSA-N 0 3 345.374 2.871 20 5 EFBDHN CCN1CCN(CCNc2ccc([N+](=O)[O-])cc2C(F)F)CC1 ZINC000865437690 1303256988 /nfs/dbraw/zinc/25/69/88/1303256988.db2.gz RSIPSJKNRGKLQM-UHFFFAOYSA-N 0 3 328.363 2.582 20 5 EFBDHN Cc1cccc(CN2CC[C@@H](NC(=O)CCC(C)(C)[N+](=O)[O-])C2)c1 ZINC000870909075 1305674559 /nfs/dbraw/zinc/67/45/59/1305674559.db2.gz JPWWCOVSWXNHGN-MRXNPFEDSA-N 0 3 333.432 2.521 20 5 EFBDHN O=C(c1cc(Cl)c(F)c([N+](=O)[O-])c1)N1CC[C@@H](N2CCCC2)C1 ZINC000900518202 1308248073 /nfs/dbraw/zinc/24/80/73/1308248073.db2.gz BODVYOALFZSXME-LLVKDONJSA-N 0 3 341.770 2.698 20 5 EFBDHN O=C(c1cc(Cl)c(F)c([N+](=O)[O-])c1)N1CC[C@H](N2CCCC2)C1 ZINC000900518206 1308248193 /nfs/dbraw/zinc/24/81/93/1308248193.db2.gz BODVYOALFZSXME-NSHDSACASA-N 0 3 341.770 2.698 20 5 EFBDHN CCNCc1ccn(Cc2cc(-c3ccccc3[N+](=O)[O-])no2)n1 ZINC000901396413 1310332283 /nfs/dbraw/zinc/33/22/83/1310332283.db2.gz RIDOXEMUYAGOIF-UHFFFAOYSA-N 0 3 327.344 2.604 20 5 EFBDHN Cc1nccc([C@H]2CCCN(C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)n1 ZINC000749687423 1311037553 /nfs/dbraw/zinc/03/75/53/1311037553.db2.gz JQSOTFGHYSYLIY-MAUKXSAKSA-N 0 3 342.399 2.606 20 5 EFBDHN Cc1nccc([C@H]2CCCN(C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)n1 ZINC000749688132 1311037688 /nfs/dbraw/zinc/03/76/88/1311037688.db2.gz JQSOTFGHYSYLIY-YJBOKZPZSA-N 0 3 342.399 2.606 20 5 EFBDHN COc1ccc(COC(=O)C2CCN(C3CC3)CC2)cc1[N+](=O)[O-] ZINC000801874220 1311041861 /nfs/dbraw/zinc/04/18/61/1311041861.db2.gz MYGLHMQCAZKVOX-UHFFFAOYSA-N 0 3 334.372 2.521 20 5 EFBDHN COc1cnc(-n2c(-c3ccccc3)cnc2[C@H](C)N)c([N+](=O)[O-])c1 ZINC001159592397 1311547633 /nfs/dbraw/zinc/54/76/33/1311547633.db2.gz SJTOCYHFRWOQBV-NSHDSACASA-N 0 3 339.355 2.871 20 5 EFBDHN COc1cc(-n2c(-c3ccccc3)cnc2[C@H](C)N)ncc1[N+](=O)[O-] ZINC001159592266 1311547691 /nfs/dbraw/zinc/54/76/91/1311547691.db2.gz PDBMWVHDBUOXFC-NSHDSACASA-N 0 3 339.355 2.871 20 5 EFBDHN COc1nc(-n2c(-c3ccccc3)cnc2[C@H](C)N)ccc1[N+](=O)[O-] ZINC001159592597 1311547722 /nfs/dbraw/zinc/54/77/22/1311547722.db2.gz ZCEWZKAHATXEPB-NSHDSACASA-N 0 3 339.355 2.871 20 5 EFBDHN O=[N+]([O-])c1c([O-])ccnc1OC1CC[NH+](Cc2ccccc2)CC1 ZINC001225660001 1311561365 /nfs/dbraw/zinc/56/13/65/1311561365.db2.gz BINHJZYZJRMGJP-UHFFFAOYSA-N 0 3 329.356 2.739 20 5 EFBDHN CCN1CCC(Oc2ncc(Br)cc2[N+](=O)[O-])CC1 ZINC001225748573 1311572404 /nfs/dbraw/zinc/57/24/04/1311572404.db2.gz VAKSZXBJRYGCIO-UHFFFAOYSA-N 0 3 330.182 2.615 20 5 EFBDHN CO[C@@H]1CCN(CCOc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC001225916811 1311590479 /nfs/dbraw/zinc/59/04/79/1311590479.db2.gz ARKHKOXCSGMHFT-LLVKDONJSA-N 0 3 334.294 2.713 20 5 EFBDHN COCCN1CCC(Oc2cc(Cl)c(F)cc2[N+](=O)[O-])CC1 ZINC001226908739 1311739317 /nfs/dbraw/zinc/73/93/17/1311739317.db2.gz NKAREQZNXHLHQU-UHFFFAOYSA-N 0 3 332.759 2.877 20 5 EFBDHN Cc1ccc(CC(=O)NCCCNCc2ccccc2[N+](=O)[O-])cc1 ZINC001161995378 1312024945 /nfs/dbraw/zinc/02/49/45/1312024945.db2.gz MXDGLVSCXJWRIW-UHFFFAOYSA-N 0 3 341.411 2.742 20 5 EFBDHN COC(=O)c1cc(Cl)cc([N+](=O)[O-])c1OC1CCN(C)CC1 ZINC001228962140 1312027744 /nfs/dbraw/zinc/02/77/44/1312027744.db2.gz FPVPKONEVDZPEE-UHFFFAOYSA-N 0 3 328.752 2.508 20 5 EFBDHN CC(C)OCC(=N)NOCc1c(Br)cccc1[N+](=O)[O-] ZINC000902701546 1312034442 /nfs/dbraw/zinc/03/44/42/1312034442.db2.gz JMDCGIOZLOIICU-UHFFFAOYSA-N 0 3 346.181 2.781 20 5 EFBDHN CCC(CC)C(=O)N1C[C@H]2CN(Cc3ccccc3[N+](=O)[O-])C[C@H]2C1 ZINC001048690620 1312048806 /nfs/dbraw/zinc/04/88/06/1312048806.db2.gz BFBKOEIQAXTNDC-CALCHBBNSA-N 0 3 345.443 2.921 20 5 EFBDHN COCCCN1CCC(Oc2cccc(C(C)=O)c2[N+](=O)[O-])CC1 ZINC001229138258 1312052363 /nfs/dbraw/zinc/05/23/63/1312052363.db2.gz VBULXVYNVRQFEH-UHFFFAOYSA-N 0 3 336.388 2.677 20 5 EFBDHN CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3ccc([N+](=O)[O-])c(C)c3C)C[C@H]1N2C ZINC001229880803 1312153566 /nfs/dbraw/zinc/15/35/66/1312153566.db2.gz IZQCKNLJCGKWDG-KMCQBPLKSA-N 0 3 348.399 2.757 20 5 EFBDHN Cc1c(Br)cnc(OC2CCN(C)CC2)c1[N+](=O)[O-] ZINC001230035302 1312175186 /nfs/dbraw/zinc/17/51/86/1312175186.db2.gz QTRHHKITVKUVRS-UHFFFAOYSA-N 0 3 330.182 2.534 20 5 EFBDHN Cc1c(Br)cnc(O[C@H]2CCN(C(C)C)C2)c1[N+](=O)[O-] ZINC001230038223 1312175598 /nfs/dbraw/zinc/17/55/98/1312175598.db2.gz RYAVXZKHISAUMQ-JTQLQIEISA-N 0 3 344.209 2.922 20 5 EFBDHN O=C(NCCC1(CNCc2csc([N+](=O)[O-])c2)CC1)c1ccco1 ZINC001163180716 1312259017 /nfs/dbraw/zinc/25/90/17/1312259017.db2.gz ISXKSIBPMGXTAY-UHFFFAOYSA-N 0 3 349.412 2.939 20 5 EFBDHN COC(=O)c1ccc([N+](=O)[O-])cc1N[C@@H]1CNCc2ccsc21 ZINC001163228975 1312269845 /nfs/dbraw/zinc/26/98/45/1312269845.db2.gz NGUUOTGIHHARFS-CYBMUJFWSA-N 0 3 333.369 2.699 20 5 EFBDHN O=C(NCCC1(CNCc2ccccc2[N+](=O)[O-])CC1)c1ccoc1 ZINC001163411014 1312307768 /nfs/dbraw/zinc/30/77/68/1312307768.db2.gz FRVQBXRLXVUASG-UHFFFAOYSA-N 0 3 343.383 2.878 20 5 EFBDHN CN(CCCNC(=O)c1ccccc1F)Cc1cccc([N+](=O)[O-])c1 ZINC001231309163 1312475526 /nfs/dbraw/zinc/47/55/26/1312475526.db2.gz FKTQSGPXLDACCL-UHFFFAOYSA-N 0 3 345.374 2.986 20 5 EFBDHN CC(C)(C)C(=O)N1C[C@H]2CN(Cc3ccc([N+](=O)[O-])cc3)C[C@H]2C1 ZINC001049183788 1312551155 /nfs/dbraw/zinc/55/11/55/1312551155.db2.gz JAUWIMFEKWQSHB-GASCZTMLSA-N 0 3 331.416 2.531 20 5 EFBDHN CC(C)(C)N1CCN(c2ccc(-c3ccccc3[N+](=O)[O-])nn2)CC1 ZINC001165091080 1312566136 /nfs/dbraw/zinc/56/61/36/1312566136.db2.gz LUKIHFMRIUCXEH-UHFFFAOYSA-N 0 3 341.415 2.972 20 5 EFBDHN CC(C)N1CCN(c2ccc(-c3ccc([N+](=O)[O-])cc3)nn2)C[C@H]1C ZINC001165199620 1312583710 /nfs/dbraw/zinc/58/37/10/1312583710.db2.gz DZVZLSKFNAXXLQ-CQSZACIVSA-N 0 3 341.415 2.971 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)cnc1N1C[C@H]2c3ccccc3CN[C@@H]2C1 ZINC001165349946 1312613340 /nfs/dbraw/zinc/61/33/40/1312613340.db2.gz LJNVVQAYVXDHQL-UONOGXRCSA-N 0 3 330.775 2.719 20 5 EFBDHN Cc1ccccc1C(=O)N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001019949046 1314547454 /nfs/dbraw/zinc/54/74/54/1314547454.db2.gz DHLDYOYRYOSCHZ-WKILWMFISA-N 0 3 339.395 2.954 20 5 EFBDHN O=C(N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1)c1cc(Cl)c[nH]1 ZINC001019986216 1314557922 /nfs/dbraw/zinc/55/79/22/1314557922.db2.gz BCSXTOKEMKCUGW-JOCQHMNTSA-N 0 3 348.790 2.627 20 5 EFBDHN COc1ccc(C[C@@H](C)N2CCNC3=CCCC[C@H]32)c([N+](=O)[O-])c1 ZINC001246996781 1314727359 /nfs/dbraw/zinc/72/73/59/1314727359.db2.gz PMZVXTVYIDAUCE-CXAGYDPISA-N 0 3 331.416 2.876 20 5 EFBDHN O=[N+]([O-])c1ccc(/C=C/c2nc(-c3ccc4c(n3)CCNC4)no2)cc1 ZINC001247597644 1314805962 /nfs/dbraw/zinc/80/59/62/1314805962.db2.gz ABQNTAXOHACXQS-FPYGCLRLSA-N 0 3 349.350 2.856 20 5 EFBDHN O=[N+]([O-])c1cccc(/C=C/c2nc(-c3ccc4c(n3)CCNC4)no2)c1 ZINC001247598429 1314806142 /nfs/dbraw/zinc/80/61/42/1314806142.db2.gz UBJYDWIXDMNZCN-QPJJXVBHSA-N 0 3 349.350 2.856 20 5 EFBDHN CC1(C)N[C@H](CO[C@@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)CO1 ZINC001217917370 1315120965 /nfs/dbraw/zinc/12/09/65/1315120965.db2.gz WKPJFUFOJVYMJI-PWSUYJOCSA-N 0 3 334.294 2.939 20 5 EFBDHN CCC(C)(C)c1cc([N+](=O)[O-])c(O[C@@H]2CNC[C@@H]2F)c([N+](=O)[O-])c1 ZINC001218001492 1315131942 /nfs/dbraw/zinc/13/19/42/1315131942.db2.gz WTFGAXICFCUELM-GXFFZTMASA-N 0 3 341.339 2.879 20 5 EFBDHN O=[N+]([O-])c1ccc(O[C@H]2CNCCC2(F)F)c(C(F)(F)F)c1 ZINC001218447634 1315197138 /nfs/dbraw/zinc/19/71/38/1315197138.db2.gz IKEHGBVYZVOHJM-JTQLQIEISA-N 0 3 326.221 2.990 20 5 EFBDHN O=[N+]([O-])c1cc(Br)cc(O[C@H]2CNCCC2(F)F)c1 ZINC001218448668 1315197246 /nfs/dbraw/zinc/19/72/46/1315197246.db2.gz OMYBISMXNHJRMU-JTQLQIEISA-N 0 3 337.120 2.733 20 5 EFBDHN O=[N+]([O-])c1ccc(O[C@@H]2CNCCC2(F)F)cc1C(F)(F)F ZINC001218450256 1315197926 /nfs/dbraw/zinc/19/79/26/1315197926.db2.gz XYYIQPIHTJHJDC-SNVBAGLBSA-N 0 3 326.221 2.990 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCCCC2)cc1O[C@H]1CNCCC1(F)F ZINC001218451381 1315198366 /nfs/dbraw/zinc/19/83/66/1315198366.db2.gz FRSYUHHVEBVHBI-HNNXBMFYSA-N 0 3 341.358 2.961 20 5 EFBDHN COC(=O)c1ccc([N+](=O)[O-])cc1O[C@@H]1CNCc2ccccc21 ZINC001218484176 1315203983 /nfs/dbraw/zinc/20/39/83/1315203983.db2.gz JCUDEAYQKAPUOG-MRXNPFEDSA-N 0 3 328.324 2.605 20 5 EFBDHN Nc1ccc2n(C(=O)[C@@H](N)CC3CCC3)c3ccccc3cc-2c1=O ZINC001219255662 1315294793 /nfs/dbraw/zinc/29/47/93/1315294793.db2.gz JMVHRIRDSNPUAI-INIZCTEOSA-N 0 3 335.407 2.846 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])NCC(=O)N1CCc2ccccc21 ZINC001254537295 1315721400 /nfs/dbraw/zinc/72/14/00/1315721400.db2.gz ZFVOUMBMTVPKOI-AWEZNQCLSA-N 0 3 339.395 2.705 20 5 EFBDHN CC(C)Oc1nccc(CN[C@@H](C)Cc2ccccc2[N+](=O)[O-])n1 ZINC001254543195 1315721684 /nfs/dbraw/zinc/72/16/84/1315721684.db2.gz CLRUFAFEWRDENW-ZDUSSCGKSA-N 0 3 330.388 2.893 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])NCC(=O)NCc1ccc(F)cc1 ZINC001254547153 1315722158 /nfs/dbraw/zinc/72/21/58/1315722158.db2.gz VTTBIRZVTCCKDU-CYBMUJFWSA-N 0 3 345.374 2.571 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N(C)CCNC(=O)OC(C)(C)C ZINC001254550433 1315722574 /nfs/dbraw/zinc/72/25/74/1315722574.db2.gz JQPOZHPIZLJASR-ZDUSSCGKSA-N 0 3 337.420 2.982 20 5 EFBDHN CC(C)C(=O)NC1CCN([C@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC001254563108 1315724185 /nfs/dbraw/zinc/72/41/85/1315724185.db2.gz UANMSSCCHCKZTI-CQSZACIVSA-N 0 3 333.432 2.762 20 5 EFBDHN Cc1cncnc1O[C@H]1CCN([C@H](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC001254571294 1315725154 /nfs/dbraw/zinc/72/51/54/1315725154.db2.gz RUGFDMLFAMEMQP-ZBFHGGJFSA-N 0 3 342.399 2.778 20 5 EFBDHN O=C(CN[C@H]1Cc2ccc([N+](=O)[O-])cc2C1)Cc1ccc(F)cc1 ZINC001254581068 1315726910 /nfs/dbraw/zinc/72/69/10/1315726910.db2.gz JSMHUQIQRXMERW-INIZCTEOSA-N 0 3 328.343 2.603 20 5 EFBDHN CC(C)COc1cc(CN[C@H]2Cc3ccc([N+](=O)[O-])cc3C2)ncn1 ZINC001254584199 1315727608 /nfs/dbraw/zinc/72/76/08/1315727608.db2.gz FYBBNJYWHNGOTN-HNNXBMFYSA-N 0 3 342.399 2.677 20 5 EFBDHN N[C@H]([C@@H]1CCCN([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1)C(F)(F)F ZINC001254587782 1315727889 /nfs/dbraw/zinc/72/78/89/1315727889.db2.gz BAQIGYIIKPTHNE-BYCMXARLSA-N 0 3 343.349 2.664 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@H](N1CCCC[C@](O)(C(F)(F)F)C1)C2 ZINC001254593397 1315728488 /nfs/dbraw/zinc/72/84/88/1315728488.db2.gz LZUMTBBPOQAAGJ-HUUCEWRRSA-N 0 3 344.333 2.841 20 5 EFBDHN CCOC(=O)C[C@@H]1CCCN([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254592691 1315728544 /nfs/dbraw/zinc/72/85/44/1315728544.db2.gz FUKJGDWGQNNWIA-SUMWQHHRSA-N 0 3 332.400 2.727 20 5 EFBDHN Cc1nc(C2CCN([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)CC2)no1 ZINC001254597370 1315729079 /nfs/dbraw/zinc/72/90/79/1315729079.db2.gz CTVSTQWPOISCDX-INIZCTEOSA-N 0 3 328.372 2.633 20 5 EFBDHN CC(C)(C)OC(=O)[C@@H]1CCN([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254597439 1315729141 /nfs/dbraw/zinc/72/91/41/1315729141.db2.gz DQIYUOYMJZDVRB-CZUORRHYSA-N 0 3 332.400 2.726 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@H](N1CCC[C@](O)(C(F)(F)F)CC1)C2 ZINC001254599319 1315729208 /nfs/dbraw/zinc/72/92/08/1315729208.db2.gz NUDBYLPIJJKAKH-HUUCEWRRSA-N 0 3 344.333 2.841 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@H](N1CC[C@H](Oc3cccnc3)C1)C2 ZINC001254599938 1315729755 /nfs/dbraw/zinc/72/97/55/1315729755.db2.gz MZPRCEVRLDNYML-AEFFLSMTSA-N 0 3 325.368 2.610 20 5 EFBDHN Cc1cnccc1O[C@H]1CCN([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254606317 1315730256 /nfs/dbraw/zinc/73/02/56/1315730256.db2.gz GJHMHVARPKWLHX-MSOLQXFVSA-N 0 3 339.395 2.919 20 5 EFBDHN CCOC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1[C@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254609394 1315731155 /nfs/dbraw/zinc/73/11/55/1315731155.db2.gz WAEINJDZCFLXTQ-MGHWNKPDSA-N 0 3 344.411 2.726 20 5 EFBDHN CCc1nnc(C2CCN([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)CC2)o1 ZINC001254608273 1315731274 /nfs/dbraw/zinc/73/12/74/1315731274.db2.gz QDJASDKYPCXPEN-MRXNPFEDSA-N 0 3 342.399 2.887 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)c2ncnc(N[C@H]3CCN(C4CC4)C3)c2c1 ZINC001261647979 1316422555 /nfs/dbraw/zinc/42/25/55/1316422555.db2.gz NREKGIISVQTPKX-VIFPVBQESA-N 0 3 333.779 2.840 20 5 EFBDHN CC([C@H](OC(=O)COC(F)(F)F)c1ccccc1F)[N+](=O)[O-] ZINC001263534898 1316548721 /nfs/dbraw/zinc/54/87/21/1316548721.db2.gz LUPGDCJULQKGDW-HQJQHLMTSA-N 0 3 325.214 2.612 20 5 EFBDHN Cc1nccn1-c1cc[nH+]cc1[N-]C(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC001318604980 1328650862 /nfs/dbraw/zinc/65/08/62/1328650862.db2.gz QWXRUMJORSLMCR-UHFFFAOYSA-N 0 3 341.302 2.875 20 5 EFBDHN Cc1nccn1-c1ccncc1NC(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC001318604980 1328650868 /nfs/dbraw/zinc/65/08/68/1328650868.db2.gz QWXRUMJORSLMCR-UHFFFAOYSA-N 0 3 341.302 2.875 20 5 EFBDHN Cc1nccn1-c1cc[nH+]cc1[N-]C(=O)c1csc([N+](=O)[O-])c1 ZINC001318814259 1328708856 /nfs/dbraw/zinc/70/88/56/1328708856.db2.gz DWOPNCQEKLXWAT-UHFFFAOYSA-N 0 3 329.341 2.798 20 5 EFBDHN CS[C@H]1CC[C@@H](N(C)Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C1 ZINC001319404375 1328874547 /nfs/dbraw/zinc/87/45/47/1328874547.db2.gz NGSRCEXEUGVIKP-YPMHNXCESA-N 0 3 335.433 2.821 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CCC[C@H](c3nc4ccccc4[nH]3)C2)n1 ZINC001319604909 1328927029 /nfs/dbraw/zinc/92/70/29/1328927029.db2.gz YMYONXBJFDMKPR-ZDUSSCGKSA-N 0 3 340.387 2.547 20 5 EFBDHN CN1CCN(Cc2cccc(CNc3ccc([N+](=O)[O-])cc3)c2)CC1 ZINC001319799592 1328993677 /nfs/dbraw/zinc/99/36/77/1328993677.db2.gz WWHAWSXHGIVYIE-UHFFFAOYSA-N 0 3 340.427 2.954 20 5 EFBDHN CN(C)[C@H]1CCCC[C@H]1Nc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC001323107007 1329512375 /nfs/dbraw/zinc/51/23/75/1329512375.db2.gz GWDBZYGHCJNARM-KGLIPLIRSA-N 0 3 331.376 2.528 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CN2CCC[C@@](O)(c3ccccc3)C2)c1 ZINC001328882624 1330643281 /nfs/dbraw/zinc/64/32/81/1330643281.db2.gz AYAFGSYUPKUNJN-OALUTQOASA-N 0 3 342.395 2.612 20 5 EFBDHN COCCN1CCC[C@H](Nc2ncc([N+](=O)[O-])c3ccccc32)C1 ZINC001331555601 1330852604 /nfs/dbraw/zinc/85/26/04/1330852604.db2.gz BTGFDYGANLCIBJ-ZDUSSCGKSA-N 0 3 330.388 2.666 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)ccc1CNC[C@H](CO)CC1CCOCC1 ZINC001333808590 1331218177 /nfs/dbraw/zinc/21/81/77/1331218177.db2.gz NFTPWKCENQNAIS-CYBMUJFWSA-N 0 3 342.823 2.763 20 5 EFBDHN COc1ccc([C@@H](C)NC[C@H](O)c2cccc([N+](=O)[O-])c2)c(OC)c1 ZINC001336762513 1331500497 /nfs/dbraw/zinc/50/04/97/1331500497.db2.gz FVYLPQDOOHZJEP-PXAZEXFGSA-N 0 3 346.383 2.996 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCCN1C ZINC001337477905 1331579345 /nfs/dbraw/zinc/57/93/45/1331579345.db2.gz AFMSJMHSRMIWOA-CYBMUJFWSA-N 0 3 337.445 2.921 20 5 EFBDHN CC(C)NC(=O)c1ccc(NC[C@H]2CCCCN2C)c([N+](=O)[O-])c1 ZINC001338020120 1331636584 /nfs/dbraw/zinc/63/65/84/1331636584.db2.gz BGGBNFFWWOODGS-CQSZACIVSA-N 0 3 334.420 2.629 20 5 EFBDHN CC([C@@H](OC(=O)/C=C\c1cn(C)cn1)c1ccccc1F)[N+](=O)[O-] ZINC001345207375 1332521776 /nfs/dbraw/zinc/52/17/76/1332521776.db2.gz KPGMBIPPUUQTEQ-ZXTJNULESA-N 0 3 333.319 2.522 20 5 EFBDHN Cc1cncc([N+](=O)[O-])c1N[C@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC001346094319 1332598268 /nfs/dbraw/zinc/59/82/68/1332598268.db2.gz IFNULRMEDFLYJL-HOCLYGCPSA-N 0 3 326.400 2.653 20 5 EFBDHN CCCN1CC[C@@H](NC(=O)c2cc(Cl)c(C)cc2[N+](=O)[O-])C1 ZINC001347869421 1332779523 /nfs/dbraw/zinc/77/95/23/1332779523.db2.gz UZQCZYZHIFUOJQ-LLVKDONJSA-N 0 3 325.796 2.771 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)c2ncnc(N3CC[C@H](N4CC=CC4)C3)c2c1 ZINC001350465240 1333085643 /nfs/dbraw/zinc/08/56/43/1333085643.db2.gz IHFPQPWVGFQIGW-NSHDSACASA-N 0 3 345.790 2.642 20 5 EFBDHN O=C(N[C@@H]1CCCN2CCCC[C@@H]12)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000847254008 1333447293 /nfs/dbraw/zinc/44/72/93/1333447293.db2.gz CHTWNNCEYVIEMF-KGLIPLIRSA-N 0 3 339.342 2.620 20 5 EFBDHN O=C(N[C@H]1CCCN2CCCC[C@@H]12)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000847253610 1333448112 /nfs/dbraw/zinc/44/81/12/1333448112.db2.gz JLBHWGGGLKMGAL-KBPBESRZSA-N 0 3 337.807 2.995 20 5 EFBDHN CN1CCN(C(C)(C)CNc2ncc([N+](=O)[O-])c3ccccc32)CC1 ZINC001353227946 1334032077 /nfs/dbraw/zinc/03/20/77/1334032077.db2.gz KVMAUABDQWMMQG-UHFFFAOYSA-N 0 3 343.431 2.581 20 5 EFBDHN CCN1CCN([C@@H](C)CNc2ncc([N+](=O)[O-])c3ccccc32)CC1 ZINC001353229991 1334033271 /nfs/dbraw/zinc/03/32/71/1334033271.db2.gz ZUVCUQACDMHUOL-AWEZNQCLSA-N 0 3 343.431 2.581 20 5 EFBDHN CN(CCOC(=O)Cc1ccccc1)CCc1cccc([N+](=O)[O-])c1 ZINC001473415770 1397301166 /nfs/dbraw/zinc/30/11/66/1397301166.db2.gz BNXYGUPHJWZDMB-UHFFFAOYSA-N 0 3 342.395 2.855 20 5 EFBDHN CC1(C(=O)N[C@H]2C[C@H](NCc3ccccc3[N+](=O)[O-])C2)CCCC1 ZINC001020445704 713016011 /nfs/dbraw/zinc/01/60/11/713016011.db2.gz RKJNKFRCXDEPQE-SHTZXODSSA-N 0 3 331.416 2.912 20 5 EFBDHN O=C(N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1)c1ccc(F)cc1 ZINC001021779059 714465562 /nfs/dbraw/zinc/46/55/62/714465562.db2.gz RZISKXBVRKMVRC-IYBDPMFKSA-N 0 3 343.358 2.785 20 5 EFBDHN Cc1noc(C[C@H]2CCCN(CCOc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000933575408 714901149 /nfs/dbraw/zinc/90/11/49/714901149.db2.gz ADIYEFBPESLPMR-CQSZACIVSA-N 0 3 346.387 2.620 20 5 EFBDHN Cc1cocc1C(=O)N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001022550706 715206382 /nfs/dbraw/zinc/20/63/82/715206382.db2.gz GDAVICUKRUYAPS-OKILXGFUSA-N 0 3 329.356 2.547 20 5 EFBDHN C[C@@H](Cc1cccnc1)NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000934232732 715271363 /nfs/dbraw/zinc/27/13/63/715271363.db2.gz FZFIFJVEWOMIJK-NSHDSACASA-N 0 3 348.790 2.803 20 5 EFBDHN Cc1ccc([C@@H](C)NC(=O)N(C)[C@H]2CCCN(C)C2)cc1[N+](=O)[O-] ZINC000893453537 715570933 /nfs/dbraw/zinc/57/09/33/715570933.db2.gz PPKDYJAZTZNNIR-HIFRSBDPSA-N 0 3 334.420 2.700 20 5 EFBDHN Cc1ccc(C(=O)N[C@H]2C[C@@H](NCc3ccccc3[N+](=O)[O-])C2)cc1 ZINC001023014872 716084330 /nfs/dbraw/zinc/08/43/30/716084330.db2.gz BWLCXCOSBCPOCF-CALCHBBNSA-N 0 3 339.395 2.954 20 5 EFBDHN COc1ccccc1CC[NH2+]Cc1ccc([O-])c(OC)c1[N+](=O)[O-] ZINC000892437526 717457664 /nfs/dbraw/zinc/45/76/64/717457664.db2.gz OCXHCUGPGUOMAJ-UHFFFAOYSA-N 0 3 332.356 2.650 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]CCCN(C)c2ccccc2)c1[N+](=O)[O-] ZINC000892439219 717461902 /nfs/dbraw/zinc/46/19/02/717461902.db2.gz UVOZTHUEGJUZFA-UHFFFAOYSA-N 0 3 345.399 2.925 20 5 EFBDHN COc1c(O)ccc(CNCCCN(C)c2ccccc2)c1[N+](=O)[O-] ZINC000892439219 717461903 /nfs/dbraw/zinc/46/19/03/717461903.db2.gz UVOZTHUEGJUZFA-UHFFFAOYSA-N 0 3 345.399 2.925 20 5 EFBDHN COc1c(O)ccc(CNC[C@H](C)N(C)c2ccccc2)c1[N+](=O)[O-] ZINC000892570250 718293539 /nfs/dbraw/zinc/29/35/39/718293539.db2.gz IFMAWMRFCLTXHH-ZDUSSCGKSA-N 0 3 345.399 2.924 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]C[C@H](C)N(C)c2ccccc2)c1[N+](=O)[O-] ZINC000892570250 718293541 /nfs/dbraw/zinc/29/35/41/718293541.db2.gz IFMAWMRFCLTXHH-ZDUSSCGKSA-N 0 3 345.399 2.924 20 5 EFBDHN C[C@H](CN1CCOCC1)NCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000892581963 718306878 /nfs/dbraw/zinc/30/68/78/718306878.db2.gz YYDNYUUNJJOSES-SNVBAGLBSA-N 0 3 348.230 2.712 20 5 EFBDHN COc1c(O)ccc(CNCCSC(F)(F)F)c1[N+](=O)[O-] ZINC000892599799 718326116 /nfs/dbraw/zinc/32/61/16/718326116.db2.gz ASPKHJCCVTZFIS-UHFFFAOYSA-N 0 3 326.296 2.652 20 5 EFBDHN Cc1cc(N2C[C@@H](C)N(C)C[C@@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000351507533 719242924 /nfs/dbraw/zinc/24/29/24/719242924.db2.gz BTZOGOHKKMPBJY-KGLIPLIRSA-N 0 3 341.415 2.889 20 5 EFBDHN CC(COC(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1)[N+](=O)[O-] ZINC000893044755 719527108 /nfs/dbraw/zinc/52/71/08/719527108.db2.gz MMUCLLOALJVMFN-LLVKDONJSA-N 0 3 338.360 2.880 20 5 EFBDHN O=C(NCCCNCc1ccc(Cl)cc1[N+](=O)[O-])C1CCC1 ZINC000893102426 719653108 /nfs/dbraw/zinc/65/31/08/719653108.db2.gz VBPZPVMRGWAPOW-UHFFFAOYSA-N 0 3 325.796 2.644 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]CCc2nc(C)c(C)s2)c1[N+](=O)[O-] ZINC000893157688 719762998 /nfs/dbraw/zinc/76/29/98/719762998.db2.gz XKLIAKIRHRYGDY-UHFFFAOYSA-N 0 3 337.401 2.715 20 5 EFBDHN COc1ccc(CN2CCC(n3ccc([N+](=O)[O-])n3)CC2)c(C)c1 ZINC000894079707 720272019 /nfs/dbraw/zinc/27/20/19/720272019.db2.gz QXHDTRHAVMUFPY-UHFFFAOYSA-N 0 3 330.388 2.945 20 5 EFBDHN O=[N+]([O-])c1ccn(C2CCN(Cc3ccc4c(c3)CCCO4)CC2)n1 ZINC000894079623 720272140 /nfs/dbraw/zinc/27/21/40/720272140.db2.gz PKSZGVJLHMIIND-UHFFFAOYSA-N 0 3 342.399 2.953 20 5 EFBDHN COc1c(O)ccc(CNCC2(OC)CCC(C)CC2)c1[N+](=O)[O-] ZINC000894158601 720971642 /nfs/dbraw/zinc/97/16/42/720971642.db2.gz HSBNIHNMYVGJKO-UHFFFAOYSA-N 0 3 338.404 2.994 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]CC2(OC)CCC(C)CC2)c1[N+](=O)[O-] ZINC000894158601 720971647 /nfs/dbraw/zinc/97/16/47/720971647.db2.gz HSBNIHNMYVGJKO-UHFFFAOYSA-N 0 3 338.404 2.994 20 5 EFBDHN CC(C)(C)CCN1CCN(c2nc3ccccn3c2[N+](=O)[O-])CC1 ZINC000917524586 728750976 /nfs/dbraw/zinc/75/09/76/728750976.db2.gz AXMPNURCFAVLLS-UHFFFAOYSA-N 0 3 331.420 2.801 20 5 EFBDHN O=[N+]([O-])c1ccc2ncnc(N3CCN(C4CCCC4)CC3)c2c1 ZINC000609849726 721855208 /nfs/dbraw/zinc/85/52/08/721855208.db2.gz JTZIEYQBCMJIGD-UHFFFAOYSA-N 0 3 327.388 2.603 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]CC[C@@H]2C[C@@H](C)O[C@@H](C)C2)c1[N+](=O)[O-] ZINC000894275201 721882605 /nfs/dbraw/zinc/88/26/05/721882605.db2.gz QIDHKHDOCAUHTQ-CLLJXQQHSA-N 0 3 338.404 2.992 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C1CCN(C(=O)c2ccoc2)CC1 ZINC000985270317 724047999 /nfs/dbraw/zinc/04/79/99/724047999.db2.gz PLDGQMQBLOQXQD-UHFFFAOYSA-N 0 3 343.383 2.924 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1CCC2(CC1)C[C@@H](O)CCO2 ZINC000897258015 724137896 /nfs/dbraw/zinc/13/78/96/724137896.db2.gz OVQVLPAHNWEBMR-HNNXBMFYSA-N 0 3 334.416 2.718 20 5 EFBDHN C/C=C(/C)C(=O)N1CCC(N(C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000985367422 724175415 /nfs/dbraw/zinc/17/54/15/724175415.db2.gz GSZNMXRNXGDTGE-CPSFFCFKSA-N 0 3 331.416 2.984 20 5 EFBDHN Cc1nccn1CCCCN1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000163458524 726402409 /nfs/dbraw/zinc/40/24/09/726402409.db2.gz JRSAVQSLTOHYHQ-UHFFFAOYSA-N 0 3 343.431 2.702 20 5 EFBDHN CCN1CCCN(C(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)[C@H](C)C1 ZINC000910269065 727425386 /nfs/dbraw/zinc/42/53/86/727425386.db2.gz DEQJVSYQDMHPFN-CQSZACIVSA-N 0 3 349.431 2.938 20 5 EFBDHN C[C@@H]1CCN(Cc2ccccc2)C[C@H]1NC(=O)CCC(C)(C)[N+](=O)[O-] ZINC000913098180 727781067 /nfs/dbraw/zinc/78/10/67/727781067.db2.gz ZVAKLUROEKYTGW-NVXWUHKLSA-N 0 3 347.459 2.849 20 5 EFBDHN CN(C)[C@H](CNc1nc2ccccn2c1[N+](=O)[O-])c1ccccc1 ZINC000070790025 728407444 /nfs/dbraw/zinc/40/74/44/728407444.db2.gz LIESUTDRFWGHAT-CQSZACIVSA-N 0 3 325.372 2.957 20 5 EFBDHN N[C@@H](CC(=O)N1CCc2c1ccc([N+](=O)[O-])c2F)c1ccccc1 ZINC001580117907 1090778594 /nfs/dbraw/zinc/77/85/94/1090778594.db2.gz FEBWMTBPXOGIHY-ZDUSSCGKSA-N 0 3 329.331 2.713 20 5 EFBDHN O=C(CSc1ccccc1[N+](=O)[O-])N1CCNCC12CCCCC2 ZINC001580564857 1090951320 /nfs/dbraw/zinc/95/13/20/1090951320.db2.gz IIDHSSYOHQUVAU-UHFFFAOYSA-N 0 3 349.456 2.822 20 5 EFBDHN O=C(Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)C1(NC2CC2)CCC1 ZINC001580757917 1090998667 /nfs/dbraw/zinc/99/86/67/1090998667.db2.gz QCGYNZJEFWGQGW-UHFFFAOYSA-N 0 3 341.371 2.598 20 5 EFBDHN O=C(Nc1ccnc([C@H]2CCCN2)n1)c1ccc([N+](=O)[O-])cc1Cl ZINC001580785518 1091008169 /nfs/dbraw/zinc/00/81/69/1091008169.db2.gz RGWLEUIHIVTHHD-GFCCVEGCSA-N 0 3 347.762 2.715 20 5 EFBDHN O=C(Nc1ccnc([C@@H]2CCCN2)n1)c1cc([N+](=O)[O-])ccc1Cl ZINC001580785467 1091008538 /nfs/dbraw/zinc/00/85/38/1091008538.db2.gz PKRKLGMTRRLRTO-LBPRGKRZSA-N 0 3 347.762 2.715 20 5 EFBDHN O=C(Nc1ccnc([C@H]2CCCN2)n1)c1cc([N+](=O)[O-])ccc1Cl ZINC001580785466 1091008552 /nfs/dbraw/zinc/00/85/52/1091008552.db2.gz PKRKLGMTRRLRTO-GFCCVEGCSA-N 0 3 347.762 2.715 20 5 EFBDHN O=[N+]([O-])c1cc(Br)ccc1N[C@H]1CNCCC1(F)F ZINC001580874859 1091031386 /nfs/dbraw/zinc/03/13/86/1091031386.db2.gz MHSRCDGZUNUYHI-JTQLQIEISA-N 0 3 336.136 2.766 20 5 EFBDHN CC(C)N(C)CC(=O)NCC1(Nc2ccccc2[N+](=O)[O-])CCCC1 ZINC001104397087 1092434738 /nfs/dbraw/zinc/43/47/38/1092434738.db2.gz WTQHVCUPMXTPKE-UHFFFAOYSA-N 0 3 348.447 2.776 20 5 EFBDHN C[C@H](C[N@H+](C)Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])C(C)(C)C ZINC001589844120 1093158233 /nfs/dbraw/zinc/15/82/33/1093158233.db2.gz JICNLFIXWVNVOS-LLVKDONJSA-N 0 3 332.408 2.889 20 5 EFBDHN C[C@H](C[N@@H+](C)Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])C(C)(C)C ZINC001589844120 1093158238 /nfs/dbraw/zinc/15/82/38/1093158238.db2.gz JICNLFIXWVNVOS-LLVKDONJSA-N 0 3 332.408 2.889 20 5 EFBDHN C[C@@H](C[N@H+](C)Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])C(C)(C)C ZINC001589844121 1093158618 /nfs/dbraw/zinc/15/86/18/1093158618.db2.gz JICNLFIXWVNVOS-NSHDSACASA-N 0 3 332.408 2.889 20 5 EFBDHN C[C@@H](C[N@@H+](C)Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])C(C)(C)C ZINC001589844121 1093158625 /nfs/dbraw/zinc/15/86/25/1093158625.db2.gz JICNLFIXWVNVOS-NSHDSACASA-N 0 3 332.408 2.889 20 5 EFBDHN CC1(C)CCC[N@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])CC1 ZINC001590096927 1093267019 /nfs/dbraw/zinc/26/70/19/1093267019.db2.gz OBHWKNYRSPINRQ-UHFFFAOYSA-N 0 3 330.392 2.787 20 5 EFBDHN CC1(C)CCC[N@@H+](Cc2c(-c3nnn[n-]3)cccc2[N+](=O)[O-])CC1 ZINC001590096927 1093267025 /nfs/dbraw/zinc/26/70/25/1093267025.db2.gz OBHWKNYRSPINRQ-UHFFFAOYSA-N 0 3 330.392 2.787 20 5 EFBDHN CC1(C)CCC[N@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])CC1 ZINC001590096927 1093267032 /nfs/dbraw/zinc/26/70/32/1093267032.db2.gz OBHWKNYRSPINRQ-UHFFFAOYSA-N 0 3 330.392 2.787 20 5 EFBDHN CC1(C)CCC[N@@H+](Cc2c(-c3nn[n-]n3)cccc2[N+](=O)[O-])CC1 ZINC001590096927 1093267039 /nfs/dbraw/zinc/26/70/39/1093267039.db2.gz OBHWKNYRSPINRQ-UHFFFAOYSA-N 0 3 330.392 2.787 20 5 EFBDHN CCC(CC)[C@@H](CNc1ccc(-c2nnn[n-]2)c([N+](=O)[O-])c1)[NH+](C)C ZINC001590432968 1093420050 /nfs/dbraw/zinc/42/00/50/1093420050.db2.gz TXQVKNVJJYYBLG-OAHLLOKOSA-N 0 3 347.423 2.553 20 5 EFBDHN CC[C@@]1(C)CCC[N@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001590489201 1093450699 /nfs/dbraw/zinc/45/06/99/1093450699.db2.gz BHNUIGNOPGBOGQ-INIZCTEOSA-N 0 3 330.392 2.787 20 5 EFBDHN CC[C@@]1(C)CCC[N@@H+](Cc2ccc(-c3nnn[n-]3)cc2[N+](=O)[O-])C1 ZINC001590489201 1093450707 /nfs/dbraw/zinc/45/07/07/1093450707.db2.gz BHNUIGNOPGBOGQ-INIZCTEOSA-N 0 3 330.392 2.787 20 5 EFBDHN CCC[C@@H]1CCCC[N@@H+]1Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001590569036 1093494189 /nfs/dbraw/zinc/49/41/89/1093494189.db2.gz JNPHDSVFGUFDTB-GFCCVEGCSA-N 0 3 330.392 2.930 20 5 EFBDHN CCC[C@@H]1CCCC[N@H+]1Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001590569036 1093494193 /nfs/dbraw/zinc/49/41/93/1093494193.db2.gz JNPHDSVFGUFDTB-GFCCVEGCSA-N 0 3 330.392 2.930 20 5 EFBDHN CCC[C@@H]1CCCC[N@@H+]1Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001590569036 1093494197 /nfs/dbraw/zinc/49/41/97/1093494197.db2.gz JNPHDSVFGUFDTB-GFCCVEGCSA-N 0 3 330.392 2.930 20 5 EFBDHN CCC[C@@H]1CCCC[N@H+]1Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001590569036 1093494200 /nfs/dbraw/zinc/49/42/00/1093494200.db2.gz JNPHDSVFGUFDTB-GFCCVEGCSA-N 0 3 330.392 2.930 20 5 EFBDHN CC[NH+](CC)CCC[C@@H](C)Nc1cc(-c2nnn[n-]2)ccc1[N+](=O)[O-] ZINC001590688027 1093549832 /nfs/dbraw/zinc/54/98/32/1093549832.db2.gz TVLANPSBIWDTTA-GFCCVEGCSA-N 0 3 347.423 2.697 20 5 EFBDHN CC[NH+](CC)CCC[C@@H](C)Nc1cc(-c2nn[n-]n2)ccc1[N+](=O)[O-] ZINC001590688027 1093549835 /nfs/dbraw/zinc/54/98/35/1093549835.db2.gz TVLANPSBIWDTTA-GFCCVEGCSA-N 0 3 347.423 2.697 20 5 EFBDHN CCS[C@H]1CCC[C@@H]1[NH2+]Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001590849763 1093596471 /nfs/dbraw/zinc/59/64/71/1093596471.db2.gz BVGCHJVWIZVBNM-JSGCOSHPSA-N 0 3 348.432 2.539 20 5 EFBDHN CCS[C@H]1CCC[C@@H]1[NH2+]Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001590849763 1093596478 /nfs/dbraw/zinc/59/64/78/1093596478.db2.gz BVGCHJVWIZVBNM-JSGCOSHPSA-N 0 3 348.432 2.539 20 5 EFBDHN C[N@@H+](Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])C[C@H]1CC=CCC1 ZINC001591126416 1093664479 /nfs/dbraw/zinc/66/44/79/1093664479.db2.gz VCDVXGLYGZHOPO-LBPRGKRZSA-N 0 3 328.376 2.563 20 5 EFBDHN C[N@H+](Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-])C[C@H]1CC=CCC1 ZINC001591126416 1093664485 /nfs/dbraw/zinc/66/44/85/1093664485.db2.gz VCDVXGLYGZHOPO-LBPRGKRZSA-N 0 3 328.376 2.563 20 5 EFBDHN C[N@@H+](Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])C[C@H]1CC=CCC1 ZINC001591126416 1093664490 /nfs/dbraw/zinc/66/44/90/1093664490.db2.gz VCDVXGLYGZHOPO-LBPRGKRZSA-N 0 3 328.376 2.563 20 5 EFBDHN C[N@H+](Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-])C[C@H]1CC=CCC1 ZINC001591126416 1093664494 /nfs/dbraw/zinc/66/44/94/1093664494.db2.gz VCDVXGLYGZHOPO-LBPRGKRZSA-N 0 3 328.376 2.563 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[N@@H+]1CCCC2(CCCC2)C1 ZINC001593466713 1094308998 /nfs/dbraw/zinc/30/89/98/1094308998.db2.gz FKWRMROLNHFRGV-UHFFFAOYSA-N 0 3 342.403 2.931 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[N@H+]1CCCC2(CCCC2)C1 ZINC001593466713 1094309009 /nfs/dbraw/zinc/30/90/09/1094309009.db2.gz FKWRMROLNHFRGV-UHFFFAOYSA-N 0 3 342.403 2.931 20 5 EFBDHN O=[N+]([O-])c1cc(-c2nnn[n-]2)ccc1C[NH+]1CCC2(CCCC2)CC1 ZINC001593467889 1094310924 /nfs/dbraw/zinc/31/09/24/1094310924.db2.gz WUNVTZJWTNSEOB-UHFFFAOYSA-N 0 3 342.403 2.931 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[N@@H+]1CCC[C@H]2CCC[C@H]21 ZINC001593483129 1094327516 /nfs/dbraw/zinc/32/75/16/1094327516.db2.gz VRYFJFRJMKTTET-BXUZGUMPSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[N@H+]1CCC[C@H]2CCC[C@H]21 ZINC001593483129 1094327525 /nfs/dbraw/zinc/32/75/25/1094327525.db2.gz VRYFJFRJMKTTET-BXUZGUMPSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[N@@H+]1CCC[C@H]2CCC[C@H]21 ZINC001593483129 1094327535 /nfs/dbraw/zinc/32/75/35/1094327535.db2.gz VRYFJFRJMKTTET-BXUZGUMPSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[N@H+]1CCC[C@H]2CCC[C@H]21 ZINC001593483129 1094327544 /nfs/dbraw/zinc/32/75/44/1094327544.db2.gz VRYFJFRJMKTTET-BXUZGUMPSA-N 0 3 328.376 2.539 20 5 EFBDHN O=[N+]([O-])c1cc(Br)ccc1O[C@@H]1CNCCC1(F)F ZINC001218450302 1094800428 /nfs/dbraw/zinc/80/04/28/1094800428.db2.gz ZEYLHKNOVNUSPO-SNVBAGLBSA-N 0 3 337.120 2.733 20 5 EFBDHN CCOC(=O)c1cccc([N+](=O)[O-])c1-n1nc(CN)c2ccccc21 ZINC001167698430 1095994577 /nfs/dbraw/zinc/99/45/77/1095994577.db2.gz WXMBHCWFZBIDKN-UHFFFAOYSA-N 0 3 340.339 2.569 20 5 EFBDHN CC[C@@H]([NH2+]Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])[C@H]1CC1(C)C ZINC001604061197 1096714747 /nfs/dbraw/zinc/71/47/47/1096714747.db2.gz KRYORILXIVPNSW-CHWSQXEVSA-N 0 3 330.392 2.689 20 5 EFBDHN CC[C@@H]([NH2+]Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])[C@H]1CC1(C)C ZINC001604061197 1096714751 /nfs/dbraw/zinc/71/47/51/1096714751.db2.gz KRYORILXIVPNSW-CHWSQXEVSA-N 0 3 330.392 2.689 20 5 EFBDHN CC[C@H]1CCCCC[N@@H+]1Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001604103233 1096738844 /nfs/dbraw/zinc/73/88/44/1096738844.db2.gz SIJDTSOIJINWBD-LBPRGKRZSA-N 0 3 330.392 2.930 20 5 EFBDHN CC[C@H]1CCCCC[N@H+]1Cc1c(-c2nnn[n-]2)cccc1[N+](=O)[O-] ZINC001604103233 1096738849 /nfs/dbraw/zinc/73/88/49/1096738849.db2.gz SIJDTSOIJINWBD-LBPRGKRZSA-N 0 3 330.392 2.930 20 5 EFBDHN CC[C@H]1CCCCC[N@@H+]1Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001604103233 1096738850 /nfs/dbraw/zinc/73/88/50/1096738850.db2.gz SIJDTSOIJINWBD-LBPRGKRZSA-N 0 3 330.392 2.930 20 5 EFBDHN CC[C@H]1CCCCC[N@H+]1Cc1c(-c2nn[n-]n2)cccc1[N+](=O)[O-] ZINC001604103233 1096738853 /nfs/dbraw/zinc/73/88/53/1096738853.db2.gz SIJDTSOIJINWBD-LBPRGKRZSA-N 0 3 330.392 2.930 20 5 EFBDHN CCC[C@@H]([NH2+]Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-])C1CCC1 ZINC001604144849 1096751809 /nfs/dbraw/zinc/75/18/09/1096751809.db2.gz MWLIHDXPXKPIJS-CQSZACIVSA-N 0 3 330.392 2.833 20 5 EFBDHN CCC[C@@H]([NH2+]Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-])C1CCC1 ZINC001604144849 1096751814 /nfs/dbraw/zinc/75/18/14/1096751814.db2.gz MWLIHDXPXKPIJS-CQSZACIVSA-N 0 3 330.392 2.833 20 5 EFBDHN CC(C)(C)[C@H]1CCC[N@@H+]1Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001609074618 1098132977 /nfs/dbraw/zinc/13/29/77/1098132977.db2.gz VHBHGYYGHFYHJS-CQSZACIVSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)(C)[C@H]1CCC[N@H+]1Cc1ccc(-c2nnn[n-]2)cc1[N+](=O)[O-] ZINC001609074618 1098132981 /nfs/dbraw/zinc/13/29/81/1098132981.db2.gz VHBHGYYGHFYHJS-CQSZACIVSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)(C)[C@H]1CCC[N@@H+]1Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001609074618 1098132984 /nfs/dbraw/zinc/13/29/84/1098132984.db2.gz VHBHGYYGHFYHJS-CQSZACIVSA-N 0 3 330.392 2.785 20 5 EFBDHN CC(C)(C)[C@H]1CCC[N@H+]1Cc1ccc(-c2nn[n-]n2)cc1[N+](=O)[O-] ZINC001609074618 1098132988 /nfs/dbraw/zinc/13/29/88/1098132988.db2.gz VHBHGYYGHFYHJS-CQSZACIVSA-N 0 3 330.392 2.785 20 5 EFBDHN CN1C[C@H]2C[C@@H](C1)N(C(=O)c1cccc3nc4ccccc4nc31)C2 ZINC001269504622 1098197900 /nfs/dbraw/zinc/19/79/00/1098197900.db2.gz IGZJBKRQKGJOIS-KGLIPLIRSA-N 0 3 332.407 2.559 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nnn[n-]2)c1C[NH+](C1CCC1)C1CCC1 ZINC001609602498 1098395410 /nfs/dbraw/zinc/39/54/10/1098395410.db2.gz PVWPWOGALZXTMM-UHFFFAOYSA-N 0 3 328.376 2.682 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nn[n-]n2)c1C[NH+](C1CCC1)C1CCC1 ZINC001609602498 1098395417 /nfs/dbraw/zinc/39/54/17/1098395417.db2.gz PVWPWOGALZXTMM-UHFFFAOYSA-N 0 3 328.376 2.682 20 5 EFBDHN CC(C)[C@@H]1N(C[C@H](O)c2cccc([N+](=O)[O-])c2)CC12CCOCC2 ZINC000840776255 1101670906 /nfs/dbraw/zinc/67/09/06/1101670906.db2.gz HWMWMTPCUAWCHJ-IRXDYDNUSA-N 0 3 334.416 2.765 20 5 EFBDHN O=C(CCNCc1cccc2c1OCC2)Nc1ccccc1[N+](=O)[O-] ZINC000905616476 1103418985 /nfs/dbraw/zinc/41/89/85/1103418985.db2.gz JWDJYEABLIUGLU-UHFFFAOYSA-N 0 3 341.367 2.648 20 5 EFBDHN O=[N+]([O-])c1ccc([C@@H](O)CN[C@@H]2CCOc3c(F)cccc32)cc1 ZINC000905644648 1103462811 /nfs/dbraw/zinc/46/28/11/1103462811.db2.gz RKXAKNCRMGDUEV-CVEARBPZSA-N 0 3 332.331 2.881 20 5 EFBDHN O=[N+]([O-])c1ccc([C@H](O)CN[C@@H]2CCOc3c(F)cccc32)cc1 ZINC000905644650 1103463030 /nfs/dbraw/zinc/46/30/30/1103463030.db2.gz RKXAKNCRMGDUEV-HZPDHXFCSA-N 0 3 332.331 2.881 20 5 EFBDHN COc1ccc(-c2ccc(CN3C[C@@H](C)[C@H](O)C3)o2)c([N+](=O)[O-])c1 ZINC000897684000 1106047591 /nfs/dbraw/zinc/04/75/91/1106047591.db2.gz JBYUWTXQPPRQOW-BDJLRTHQSA-N 0 3 332.356 2.676 20 5 EFBDHN O=[N+]([O-])c1sc(CNCC[C@H](O)C2CC2)cc1Br ZINC000898198071 1106277421 /nfs/dbraw/zinc/27/74/21/1106277421.db2.gz AWHJUZMQAYRBAX-JTQLQIEISA-N 0 3 335.223 2.669 20 5 EFBDHN O=C(C1CC=CC1)N1CCC(NCc2csc([N+](=O)[O-])c2)CC1 ZINC000990504050 1108134011 /nfs/dbraw/zinc/13/40/11/1108134011.db2.gz MMAIFJKOQIBTLS-UHFFFAOYSA-N 0 3 335.429 2.703 20 5 EFBDHN CCN(CC)CC(=O)N1CCC(C)(Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC001112353174 1111219442 /nfs/dbraw/zinc/21/94/42/1111219442.db2.gz UFYYOVSXXNILBI-UHFFFAOYSA-N 0 3 348.447 2.730 20 5 EFBDHN CCN(CC)CC(=O)N(CC)CCNc1ccc([N+](=O)[O-])c(C)c1 ZINC001106776273 1111822550 /nfs/dbraw/zinc/82/25/50/1111822550.db2.gz ZUORYXIBTSVPIX-UHFFFAOYSA-N 0 3 336.436 2.505 20 5 EFBDHN CCN(CCNc1ccc(C)cc1[N+](=O)[O-])C(=O)CN(C)C(C)C ZINC001106779019 1111826416 /nfs/dbraw/zinc/82/64/16/1111826416.db2.gz RDIVYQWPJTVYQY-UHFFFAOYSA-N 0 3 336.436 2.504 20 5 EFBDHN CCN(CCNc1cc(C)ccc1[N+](=O)[O-])C(=O)C1(N(C)C)CCC1 ZINC001106874218 1111939308 /nfs/dbraw/zinc/93/93/08/1111939308.db2.gz WUQVRKVOYBJHMT-UHFFFAOYSA-N 0 3 348.447 2.648 20 5 EFBDHN Cc1c(NC(=O)[C@@H](C)N(C)C[C@@H]2CCCOC2)cccc1[N+](=O)[O-] ZINC000174149574 231132640 /nfs/dbraw/zinc/13/26/40/231132640.db2.gz VEVJFDITGJVZDK-KGLIPLIRSA-N 0 3 335.404 2.589 20 5 EFBDHN CN(C)[C@@H](CC(=O)NCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000431738082 282168783 /nfs/dbraw/zinc/16/87/83/282168783.db2.gz UZHGQTSTAWKGIY-KRWDZBQOSA-N 0 3 327.384 2.904 20 5 EFBDHN Cc1cccc(NC2CCN(CCn3cc([N+](=O)[O-])cn3)CC2)c1 ZINC000174873200 231331616 /nfs/dbraw/zinc/33/16/16/231331616.db2.gz PMFCTURCRVYDCR-UHFFFAOYSA-N 0 3 329.404 2.676 20 5 EFBDHN CN(C)[C@H](CC(=O)NCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000431738083 282235798 /nfs/dbraw/zinc/23/57/98/282235798.db2.gz UZHGQTSTAWKGIY-QGZVFWFLSA-N 0 3 327.384 2.904 20 5 EFBDHN CCc1nn(C)c(N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000160232922 529767664 /nfs/dbraw/zinc/76/76/64/529767664.db2.gz VTOJENHMZXZMCB-XJKSGUPXSA-N 0 3 343.431 2.823 20 5 EFBDHN CN(CCC(=O)Nc1ccccc1[N+](=O)[O-])CCc1nccs1 ZINC000157785673 529871969 /nfs/dbraw/zinc/87/19/69/529871969.db2.gz AJFVQONIVKJTBR-UHFFFAOYSA-N 0 3 334.401 2.554 20 5 EFBDHN CN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)c1ccc([N+](=O)[O-])o1 ZINC000174943293 529970364 /nfs/dbraw/zinc/97/03/64/529970364.db2.gz RAPSURVINJLAHG-OAHLLOKOSA-N 0 3 343.383 2.782 20 5 EFBDHN Cn1c(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000345299383 282569561 /nfs/dbraw/zinc/56/95/61/282569561.db2.gz INPLLBWGZIMZMG-HNNXBMFYSA-N 0 3 342.399 2.500 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N(C)C[C@@H]1CCCN(C)C1 ZINC000179576336 233183913 /nfs/dbraw/zinc/18/39/13/233183913.db2.gz SRKZPRNNQNZHJR-OAHLLOKOSA-N 0 3 333.432 2.934 20 5 EFBDHN C[C@H](NC(=O)Cc1cccc([N+](=O)[O-])c1)[C@H](c1ccccc1)N(C)C ZINC000187165309 236134770 /nfs/dbraw/zinc/13/47/70/236134770.db2.gz FZWCPSKPYLOVEG-IFXJQAMLSA-N 0 3 341.411 2.945 20 5 EFBDHN CN(C)C1(CN(C)C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CCC1 ZINC000187889551 236329125 /nfs/dbraw/zinc/32/91/25/236329125.db2.gz ZYPIYRQGNSYVPP-UHFFFAOYSA-N 0 3 325.796 2.805 20 5 EFBDHN Cc1ccc([C@@H](CNCc2cccc([N+](=O)[O-])c2)N2CCOCC2)o1 ZINC000073052209 216344734 /nfs/dbraw/zinc/34/47/34/216344734.db2.gz YAGHGKKLCADKJS-QGZVFWFLSA-N 0 3 345.399 2.659 20 5 EFBDHN CN(C)[C@@H](CNC(=O)c1ccc(F)cc1[N+](=O)[O-])c1ccccc1 ZINC000159148214 239021632 /nfs/dbraw/zinc/02/16/32/239021632.db2.gz WZTAMFVLPDBZKL-INIZCTEOSA-N 0 3 331.347 2.767 20 5 EFBDHN COc1ccc(C(=O)Nc2ccccc2CN(C)C)cc1[N+](=O)[O-] ZINC000024810198 212440799 /nfs/dbraw/zinc/44/07/99/212440799.db2.gz WBRDBBLKCSVUFM-UHFFFAOYSA-N 0 3 329.356 2.917 20 5 EFBDHN C[C@H](N[C@H]1CC(C)(C)OC1(C)C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000132407588 223328751 /nfs/dbraw/zinc/32/87/51/223328751.db2.gz CZQAMVXLNLSVBQ-FZMZJTMJSA-N 0 3 335.404 2.858 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1C(=O)NC1CCN(CCOC(C)C)CC1 ZINC000194795288 240180637 /nfs/dbraw/zinc/18/06/37/240180637.db2.gz QCUBHNUHOATCJO-UHFFFAOYSA-N 0 3 349.431 2.522 20 5 EFBDHN COc1cccc(C(=O)NCc2ccccc2CN(C)C)c1[N+](=O)[O-] ZINC000195325375 240221366 /nfs/dbraw/zinc/22/13/66/240221366.db2.gz CWCJUNVTBBIITK-UHFFFAOYSA-N 0 3 343.383 2.595 20 5 EFBDHN COc1cc(CNCC2(SC)CCC2)c([N+](=O)[O-])cc1OC ZINC000193649543 240250818 /nfs/dbraw/zinc/25/08/18/240250818.db2.gz UFUZKWVUQFDGIH-UHFFFAOYSA-N 0 3 326.418 2.987 20 5 EFBDHN CN(CCSCCn1cc([N+](=O)[O-])ccc1=O)Cc1ccccc1 ZINC000193636813 240243972 /nfs/dbraw/zinc/24/39/72/240243972.db2.gz RMJSBCFQAKCWOP-UHFFFAOYSA-N 0 3 347.440 2.622 20 5 EFBDHN C[C@@H]1CCNC(=O)[C@H]1NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000193679813 240264145 /nfs/dbraw/zinc/26/41/45/240264145.db2.gz BMXOWXKZCGHBOI-BZNIZROVSA-N 0 3 345.424 2.938 20 5 EFBDHN C[C@H]1CCNC(=O)[C@@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000193700815 240270486 /nfs/dbraw/zinc/27/04/86/240270486.db2.gz KVRMFXVSDWSICS-MEDUHNTESA-N 0 3 345.424 2.938 20 5 EFBDHN C[C@H]1CCNC(=O)[C@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000193700844 240271988 /nfs/dbraw/zinc/27/19/88/240271988.db2.gz KVRMFXVSDWSICS-ZBEGNZNMSA-N 0 3 345.424 2.938 20 5 EFBDHN COc1ccc(C(=O)N[C@@H](C)CN2C[C@H](C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000195625107 241032438 /nfs/dbraw/zinc/03/24/38/241032438.db2.gz SYJSCJPMOSPWHZ-MJBXVCDLSA-N 0 3 349.431 2.700 20 5 EFBDHN Cc1ccc([C@H]2CCCCCN2C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)o1 ZINC000229349871 242156853 /nfs/dbraw/zinc/15/68/53/242156853.db2.gz BFHCEGFFCRHDEJ-HZPDHXFCSA-N 0 3 348.403 2.671 20 5 EFBDHN CO[C@@](C)([C@@H](C)NCC(=O)Nc1c(C)cccc1[N+](=O)[O-])C1CC1 ZINC000411965450 243049117 /nfs/dbraw/zinc/04/91/17/243049117.db2.gz FKCJEIKDEOZQRH-PXAZEXFGSA-N 0 3 335.404 2.635 20 5 EFBDHN C[C@@H](CNC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12)N(C)C ZINC000412393337 243300342 /nfs/dbraw/zinc/30/03/42/243300342.db2.gz HLPHVQJSCRNJSU-NSHDSACASA-N 0 3 341.386 2.500 20 5 EFBDHN Cc1c([C@H](C)NCCC(C)(C)S(C)(=O)=O)cccc1[N+](=O)[O-] ZINC000414244103 244058585 /nfs/dbraw/zinc/05/85/85/244058585.db2.gz ALFRMIKCNGRDHV-LBPRGKRZSA-N 0 3 328.434 2.767 20 5 EFBDHN COC(=O)COc1ccc(CN2C[C@H](C)[C@@H](C)[C@H]2C)cc1[N+](=O)[O-] ZINC000418121924 245111832 /nfs/dbraw/zinc/11/18/32/245111832.db2.gz JFEXONKATDNOEC-YNEHKIRRSA-N 0 3 336.388 2.623 20 5 EFBDHN CC[C@@H](NCC(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@H]1CC1(C)C ZINC000419324264 245376999 /nfs/dbraw/zinc/37/69/99/245376999.db2.gz VKYFOXIXLNZGSP-CHWSQXEVSA-N 0 3 335.404 2.956 20 5 EFBDHN O=[N+]([O-])c1cc(CNCC2(N3CCCCC3)CCOCC2)cs1 ZINC000111403468 220151503 /nfs/dbraw/zinc/15/15/03/220151503.db2.gz UIHFZDFNGOMGRA-UHFFFAOYSA-N 0 3 339.461 2.781 20 5 EFBDHN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCC[C@H](N2CCCC2)C1 ZINC000363369204 296210189 /nfs/dbraw/zinc/21/01/89/296210189.db2.gz IATQZYNKZCUFMY-ZDUSSCGKSA-N 0 3 337.807 2.949 20 5 EFBDHN C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)C[C@@H]1CCCN1C ZINC000421704576 246068386 /nfs/dbraw/zinc/06/83/86/246068386.db2.gz PGZCSAPYUNENHU-JSGCOSHPSA-N 0 3 337.445 2.628 20 5 EFBDHN CN(C[C@H]1CCCN1C)C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000421709632 246073720 /nfs/dbraw/zinc/07/37/20/246073720.db2.gz GFLMJKFXUBEUKU-LLVKDONJSA-N 0 3 345.321 2.780 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@H]1CCCN1C ZINC000421709828 246074738 /nfs/dbraw/zinc/07/47/38/246074738.db2.gz HJBJIEFERKZFHO-CYBMUJFWSA-N 0 3 337.445 2.873 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@H](N2CCCCC2)C1 ZINC000264442437 246506658 /nfs/dbraw/zinc/50/66/58/246506658.db2.gz FCIXOVMRFBEZPA-CQSZACIVSA-N 0 3 348.403 2.696 20 5 EFBDHN CN(CCN(C)C1CC1)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425429814 247082506 /nfs/dbraw/zinc/08/25/06/247082506.db2.gz BDQBAJNRQYTXJD-UHFFFAOYSA-N 0 3 342.237 2.883 20 5 EFBDHN O=[N+]([O-])c1cc(Br)ccc1CN[C@@H]1CCC[C@@H]1CCO ZINC000425468846 247096342 /nfs/dbraw/zinc/09/63/42/247096342.db2.gz DAALANKSJKDZQR-ZWNOBZJWSA-N 0 3 343.221 2.998 20 5 EFBDHN O=[N+]([O-])c1cccc(CNC[C@@]2(CO)C[C@H]2c2ccc(F)cc2)c1 ZINC000428542748 247498555 /nfs/dbraw/zinc/49/85/55/247498555.db2.gz YFNKFXPMMMOIOL-ZWKOTPCHSA-N 0 3 330.359 2.990 20 5 EFBDHN Cc1c(CNC(=O)NC[C@H]2CCCCN2C2CC2)cccc1[N+](=O)[O-] ZINC000433905066 248101280 /nfs/dbraw/zinc/10/12/80/248101280.db2.gz BDCRMMJKLCZRJB-MRXNPFEDSA-N 0 3 346.431 2.719 20 5 EFBDHN O=[N+]([O-])c1cc2ccccc2nc1NC[C@@H]1CCCCN1C1CC1 ZINC000433811942 248091398 /nfs/dbraw/zinc/09/13/98/248091398.db2.gz MHWNUJAJKKUFRU-HNNXBMFYSA-N 0 3 326.400 2.994 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCN(CC3CC3)CC2)cc1OC(F)F ZINC000266163386 248141998 /nfs/dbraw/zinc/14/19/98/248141998.db2.gz XINDBYSKEKIWKQ-UHFFFAOYSA-N 0 3 327.331 2.728 20 5 EFBDHN CN(Cc1ccccc1[N+](=O)[O-])C(=O)NC[C@@H]1CCCCN1C1CC1 ZINC000433953725 248107512 /nfs/dbraw/zinc/10/75/12/248107512.db2.gz LWBHPKAPEDOUSC-INIZCTEOSA-N 0 3 346.431 2.753 20 5 EFBDHN CCO[C@H]1C[C@H](NCc2cc([N+](=O)[O-])cc3c2OCOC3)C12CCC2 ZINC000266121933 248111489 /nfs/dbraw/zinc/11/14/89/248111489.db2.gz AFXOHIBYAPQZJR-HOTGVXAUSA-N 0 3 348.399 2.899 20 5 EFBDHN C[C@@H](N[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[C@@H]1CCOC1 ZINC000266292588 248229237 /nfs/dbraw/zinc/22/92/37/248229237.db2.gz KGTRMOALSJVZIG-OUAUKWLOSA-N 0 3 341.795 2.590 20 5 EFBDHN CO[C@@H]1CCCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000091772230 218063304 /nfs/dbraw/zinc/06/33/04/218063304.db2.gz QEJVXORQTOUWJH-MRXNPFEDSA-N 0 3 330.388 2.606 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CC[C@@H]2CC[C@H](C1)N2C ZINC000091991193 218100584 /nfs/dbraw/zinc/10/05/84/218100584.db2.gz LBIJRZGYCXMAJF-LSDHHAIUSA-N 0 3 331.416 2.829 20 5 EFBDHN COc1ccc(C(=O)NC[C@@H](c2ccccc2)N(C)C)cc1[N+](=O)[O-] ZINC000010442636 211172569 /nfs/dbraw/zinc/17/25/69/211172569.db2.gz LABJGTIDQZMSRV-INIZCTEOSA-N 0 3 343.383 2.636 20 5 EFBDHN CCC(CC)(CNCc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(=O)OC ZINC000444656741 250324058 /nfs/dbraw/zinc/32/40/58/250324058.db2.gz HVNUDQUQKBXWPN-UHFFFAOYSA-N 0 3 334.376 2.540 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN[C@H]3CCCC[C@H]3n3cccn3)nc2c1 ZINC000444685647 250328693 /nfs/dbraw/zinc/32/86/93/250328693.db2.gz OWKJZKDMMMIMNU-GOEBONIOSA-N 0 3 340.387 2.941 20 5 EFBDHN COc1nccc(CN[C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])n1 ZINC000449373557 251001255 /nfs/dbraw/zinc/00/12/55/251001255.db2.gz RYORVFKZNFDYOU-BBRMVZONSA-N 0 3 342.399 2.894 20 5 EFBDHN O=[N+]([O-])c1cc(CN2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)c2c(c1)COCO2 ZINC000449477932 251041431 /nfs/dbraw/zinc/04/14/31/251041431.db2.gz XLWKEVFMOQSBCZ-BBWFWOEESA-N 0 3 348.399 2.587 20 5 EFBDHN NC(=O)[C@@H]1CC[C@H](NCc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000449743666 251137117 /nfs/dbraw/zinc/13/71/17/251137117.db2.gz AENIOOUBTOYTAR-NEPJUHHUSA-N 0 3 329.356 2.598 20 5 EFBDHN NC(=O)[C@@H]1CC[C@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000449746994 251137707 /nfs/dbraw/zinc/13/77/07/251137707.db2.gz VBFVXUNKUYAUMW-OLZOCXBDSA-N 0 3 329.356 2.598 20 5 EFBDHN C[C@H]1C[C@@H](NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CCN1C ZINC000449942139 251207153 /nfs/dbraw/zinc/20/71/53/251207153.db2.gz RVYXYIHVGROIBC-ONGXEEELSA-N 0 3 345.321 2.826 20 5 EFBDHN CN(C)CCOC1CCN(c2nccc3c2cccc3[N+](=O)[O-])CC1 ZINC000450330776 251348979 /nfs/dbraw/zinc/34/89/79/251348979.db2.gz PRFLBOQBUGZRIN-UHFFFAOYSA-N 0 3 344.415 2.690 20 5 EFBDHN Cc1nc(N(CCN2CCCCCC2)C2CCC2)ncc1[N+](=O)[O-] ZINC000450536778 251410003 /nfs/dbraw/zinc/41/00/03/251410003.db2.gz BKSANAJVPOMDRW-UHFFFAOYSA-N 0 3 333.436 2.928 20 5 EFBDHN CO[C@H]1C[C@H](NCC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC000451490469 251582702 /nfs/dbraw/zinc/58/27/02/251582702.db2.gz IBNDXISRDBHVHD-STQMWFEESA-N 0 3 341.795 2.590 20 5 EFBDHN COc1ccc(CN[C@H](CO)Cc2ccc(C)c(C)c2)cc1[N+](=O)[O-] ZINC000453627734 252056328 /nfs/dbraw/zinc/05/63/28/252056328.db2.gz MRNFECLQLDPAGB-KRWDZBQOSA-N 0 3 344.411 2.913 20 5 EFBDHN COc1cc(OC)cc([C@@H](O)CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000131057136 533085007 /nfs/dbraw/zinc/08/50/07/533085007.db2.gz VFSAHLYBZYYSCW-SGTLLEGYSA-N 0 3 346.383 2.996 20 5 EFBDHN COc1ccc([C@H](CO)N(C)CCOc2cccc([N+](=O)[O-])c2)cc1 ZINC000112622798 220357563 /nfs/dbraw/zinc/35/75/63/220357563.db2.gz UMVNVYUCHSBKMT-SFHVURJKSA-N 0 3 346.383 2.648 20 5 EFBDHN COc1ccc([C@@H](CO)N(C)CCOc2cccc([N+](=O)[O-])c2)cc1 ZINC000112622801 220357945 /nfs/dbraw/zinc/35/79/45/220357945.db2.gz UMVNVYUCHSBKMT-GOSISDBHSA-N 0 3 346.383 2.648 20 5 EFBDHN CC(C)(CN1CCCC1)NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000457024684 255672071 /nfs/dbraw/zinc/67/20/71/255672071.db2.gz HJNODLHMBZZOSO-UHFFFAOYSA-N 0 3 346.431 2.773 20 5 EFBDHN CN(C)CC(C)(C)NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000457209800 255682946 /nfs/dbraw/zinc/68/29/46/255682946.db2.gz PBOQKNQKBGPUSB-UHFFFAOYSA-N 0 3 333.310 2.684 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN[C@@H]1CC(=O)N(C(C)(C)C)C1 ZINC000468746279 256018302 /nfs/dbraw/zinc/01/83/02/256018302.db2.gz FZUTVWHCBRWHQD-XETPBLJFSA-N 0 3 331.416 2.987 20 5 EFBDHN CCN1CCCN([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000118826074 221190507 /nfs/dbraw/zinc/19/05/07/221190507.db2.gz PRXZZSARRRVWLW-ZDUSSCGKSA-N 0 3 345.403 2.733 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)CCN[C@@H](C)c1cccnc1 ZINC000181665590 533223910 /nfs/dbraw/zinc/22/39/10/533223910.db2.gz NGOVFWVPSPJYRM-LBPRGKRZSA-N 0 3 344.371 2.678 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CNCc1cccc(C(N)=O)c1 ZINC000344877049 533384865 /nfs/dbraw/zinc/38/48/65/533384865.db2.gz PAXWQHYXOJLHOD-JYRVWZFOSA-N 0 3 325.368 2.887 20 5 EFBDHN CN(CC[C@H]1CCCO1)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000343478475 142005532 /nfs/dbraw/zinc/00/55/32/142005532.db2.gz XPGJMLATTNMCQK-QGZVFWFLSA-N 0 3 344.415 2.996 20 5 EFBDHN CN(CC[C@@H]1CCCO1)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000343478473 142005618 /nfs/dbraw/zinc/00/56/18/142005618.db2.gz XPGJMLATTNMCQK-KRWDZBQOSA-N 0 3 344.415 2.996 20 5 EFBDHN C[C@@H](CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CCC[C@@H](C)C1 ZINC000344475839 142024073 /nfs/dbraw/zinc/02/40/73/142024073.db2.gz RAWBYLONCZZGGR-OLZOCXBDSA-N 0 3 344.415 2.926 20 5 EFBDHN CO[C@@H]1[C@H](C)[C@H](N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1(C)C ZINC000344487102 142025991 /nfs/dbraw/zinc/02/59/91/142025991.db2.gz UNGBAMPMAYFOCT-HKCMKHECSA-N 0 3 335.404 2.571 20 5 EFBDHN CN1CCCC(C)(C)[C@@H]1CNC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000344693318 142062029 /nfs/dbraw/zinc/06/20/29/142062029.db2.gz RXTXHPSZIYEXQY-INIZCTEOSA-N 0 3 348.447 2.633 20 5 EFBDHN CCCCN1CCCC[C@@H]1CNC(=O)c1cccc([N+](=O)[O-])c1N ZINC000344932981 142099617 /nfs/dbraw/zinc/09/96/17/142099617.db2.gz DGFCQSBYRZNNTN-CYBMUJFWSA-N 0 3 334.420 2.561 20 5 EFBDHN Cc1ccc(C(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000346135959 142152582 /nfs/dbraw/zinc/15/25/82/142152582.db2.gz LHRPWAKAVMLNLV-DUVNUKRYSA-N 0 3 331.416 2.706 20 5 EFBDHN Cc1c(C(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000346136834 142153023 /nfs/dbraw/zinc/15/30/23/142153023.db2.gz LRTYMUBYZNJCBH-GDZNZVCISA-N 0 3 331.416 2.706 20 5 EFBDHN C[C@H]1C[C@@H]1N1CCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000346151574 142155900 /nfs/dbraw/zinc/15/59/00/142155900.db2.gz ZEVFWSMVBNRACT-HUBLWGQQSA-N 0 3 335.379 2.536 20 5 EFBDHN Cc1c(CC(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000346221976 142170533 /nfs/dbraw/zinc/17/05/33/142170533.db2.gz LAHPAPOOLPLSSH-QWQRMKEZSA-N 0 3 345.443 2.634 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@]2(CCN(C)C2)C1 ZINC000346331706 142190586 /nfs/dbraw/zinc/19/05/86/142190586.db2.gz WSGQEHWFAIFOPK-VQIMIIECSA-N 0 3 345.443 2.718 20 5 EFBDHN CN(CCn1ccc([N+](=O)[O-])n1)[C@@H]1C[C@H](Oc2ccccc2)C1(C)C ZINC000347484588 142224329 /nfs/dbraw/zinc/22/43/29/142224329.db2.gz WNXXWZVGWLFOBA-CVEARBPZSA-N 0 3 344.415 2.969 20 5 EFBDHN CC(C)N1CCCN(C(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000347931978 142295448 /nfs/dbraw/zinc/29/54/48/142295448.db2.gz CVWJVFHOGIMRTB-ZDUSSCGKSA-N 0 3 337.395 2.780 20 5 EFBDHN CCN(CCOc1ccc(OC)cc1[N+](=O)[O-])Cc1ccncc1 ZINC000348070474 142316688 /nfs/dbraw/zinc/31/66/88/142316688.db2.gz IRGJFYITHWDJMV-UHFFFAOYSA-N 0 3 331.372 2.899 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC1(c2ccc(F)cc2)CC1 ZINC000342745320 145183754 /nfs/dbraw/zinc/18/37/54/145183754.db2.gz ZHQGNFZMQRKXBA-HNNXBMFYSA-N 0 3 346.358 2.753 20 5 EFBDHN Cc1cc(NCc2ccnc(OCCN(C)C)c2)ccc1[N+](=O)[O-] ZINC000342801298 145196696 /nfs/dbraw/zinc/19/66/96/145196696.db2.gz WUZKIAZHNUDSEI-UHFFFAOYSA-N 0 3 330.388 2.851 20 5 EFBDHN CC1(C)C[C@H](N[C@H]2CCC(=O)N[C@H]2C2CC2)c2cc([N+](=O)[O-])ccc21 ZINC000342808259 145198495 /nfs/dbraw/zinc/19/84/95/145198495.db2.gz AVGQXJCLJGYNJF-BQFCYCMXSA-N 0 3 343.427 2.964 20 5 EFBDHN CCN1CCC(N(C)C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)CC1 ZINC000342879799 145214109 /nfs/dbraw/zinc/21/41/09/145214109.db2.gz DLRLTTWVOXKBMO-UHFFFAOYSA-N 0 3 330.388 2.632 20 5 EFBDHN C[C@@H](CNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12)N1CCC(C)CC1 ZINC000342899447 145217927 /nfs/dbraw/zinc/21/79/27/145217927.db2.gz HDXCQPWQFFHGNH-ZDUSSCGKSA-N 0 3 344.415 2.926 20 5 EFBDHN C[C@H]1CCCN(CCNC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C1 ZINC000342918230 145221433 /nfs/dbraw/zinc/22/14/33/145221433.db2.gz YVWLAEZFYSJVTK-LBPRGKRZSA-N 0 3 330.388 2.538 20 5 EFBDHN CCCN1CCC[C@H]1CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000343587652 145246466 /nfs/dbraw/zinc/24/64/66/145246466.db2.gz FGFJTUDQVSLKGH-INIZCTEOSA-N 0 3 333.432 2.863 20 5 EFBDHN C[C@@H]1[C@@H](Nc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)CCCN1C ZINC000343610183 145251597 /nfs/dbraw/zinc/25/15/97/145251597.db2.gz STSKYMHKJUPXOF-CJNGLKHVSA-N 0 3 346.431 2.725 20 5 EFBDHN CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CN(C2CC2)C[C@@H]1C ZINC000343896055 145319240 /nfs/dbraw/zinc/31/92/40/145319240.db2.gz MBWIMRZQRTYHEV-NHYWBVRUSA-N 0 3 349.456 2.919 20 5 EFBDHN CCO[C@@H]1C[C@H](NCC(=O)Nc2ccccc2[N+](=O)[O-])C12CCCC2 ZINC000344097121 145367298 /nfs/dbraw/zinc/36/72/98/145367298.db2.gz IETRKMULAPPULE-JKSUJKDBSA-N 0 3 347.415 2.861 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC[C@H]1C1CCOCC1 ZINC000348915696 146023651 /nfs/dbraw/zinc/02/36/51/146023651.db2.gz CMZZLDRDUTZNAP-KRWDZBQOSA-N 0 3 347.415 2.733 20 5 EFBDHN COCCN(CCN(C)C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000349296297 146076691 /nfs/dbraw/zinc/07/66/91/146076691.db2.gz LOAKLOKCXUIGGU-UHFFFAOYSA-N 0 3 347.415 2.865 20 5 EFBDHN O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2NCc2ccc3c(c2)OCO3)n1 ZINC000351516436 146136763 /nfs/dbraw/zinc/13/67/63/146136763.db2.gz JRMJEGWOROYUCC-KGLIPLIRSA-N 0 3 344.371 2.794 20 5 EFBDHN O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2NCc2ccc3c(c2)OCO3)n1 ZINC000351516437 146136860 /nfs/dbraw/zinc/13/68/60/146136860.db2.gz JRMJEGWOROYUCC-UONOGXRCSA-N 0 3 344.371 2.794 20 5 EFBDHN O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CC[C@@H](N2CCCCC2)C1 ZINC000351750294 146194637 /nfs/dbraw/zinc/19/46/37/146194637.db2.gz VCLZSIJYYOOVSM-CYBMUJFWSA-N 0 3 336.367 2.826 20 5 EFBDHN C[C@@H]1CN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H](C)CN1C ZINC000351944907 146243183 /nfs/dbraw/zinc/24/31/83/146243183.db2.gz NOKQTOHTZNTSCZ-KGLIPLIRSA-N 0 3 344.415 2.817 20 5 EFBDHN CCCN(CCN1CCCC1)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000352890047 146341365 /nfs/dbraw/zinc/34/13/65/146341365.db2.gz WDGHTFGDXHCBHZ-UHFFFAOYSA-N 0 3 348.447 2.650 20 5 EFBDHN COC(=O)COc1ccc(CN([C@@H](C)C2CC2)C2CC2)cc1[N+](=O)[O-] ZINC000355583931 147004021 /nfs/dbraw/zinc/00/40/21/147004021.db2.gz NOSZFWNTMIVDGJ-LBPRGKRZSA-N 0 3 348.399 2.910 20 5 EFBDHN COC(=O)COc1ccc(CN([C@H](C)C2CC2)C2CC2)cc1[N+](=O)[O-] ZINC000355583925 147004151 /nfs/dbraw/zinc/00/41/51/147004151.db2.gz NOSZFWNTMIVDGJ-GFCCVEGCSA-N 0 3 348.399 2.910 20 5 EFBDHN CCNc1ccc(C(=O)N2C[C@H](N3CCCC3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000356285924 147200958 /nfs/dbraw/zinc/20/09/58/147200958.db2.gz VOBXRFQUMBEPOR-UKRRQHHQSA-N 0 3 346.431 2.725 20 5 EFBDHN CSc1ccc(C(=O)N2CC[C@]3(C2)CCCN(C)C3)cc1[N+](=O)[O-] ZINC000356289233 147202450 /nfs/dbraw/zinc/20/24/50/147202450.db2.gz VQOXBRPIKWBRSW-QGZVFWFLSA-N 0 3 349.456 2.875 20 5 EFBDHN CCn1nc(C)c([N+](=O)[O-])c1NC[C@H](Cc1ccccc1)N(C)C ZINC000359368206 148068563 /nfs/dbraw/zinc/06/85/63/148068563.db2.gz ZEXOIUDVRADHQR-HNNXBMFYSA-N 0 3 331.420 2.704 20 5 EFBDHN Cc1cccc(C(=O)NCCN[C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000360140277 148281913 /nfs/dbraw/zinc/28/19/13/148281913.db2.gz NUUDQTQCKKXAJM-CQSZACIVSA-N 0 3 327.384 2.984 20 5 EFBDHN CN(C)C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)c1ccc(F)cc1 ZINC000360211137 148300523 /nfs/dbraw/zinc/30/05/23/148300523.db2.gz BTBRPZJGRXNNSK-MRXNPFEDSA-N 0 3 349.337 2.906 20 5 EFBDHN CCc1nn(C)c(N2CC[C@H](N(C)Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000364901233 149270781 /nfs/dbraw/zinc/27/07/81/149270781.db2.gz RZCHTZMOSPBVPE-HNNXBMFYSA-N 0 3 343.431 2.601 20 5 EFBDHN Cc1cccc(N2CCC(C)(CN3CCN(C)CC3)CC2)c1[N+](=O)[O-] ZINC000368725453 150191130 /nfs/dbraw/zinc/19/11/30/150191130.db2.gz UZXFIJBVIUIYAX-UHFFFAOYSA-N 0 3 346.475 2.757 20 5 EFBDHN CN1CCC2(CCCN2C(=O)/C=C/c2cccc([N+](=O)[O-])c2)CC1 ZINC000372436378 151006305 /nfs/dbraw/zinc/00/63/05/151006305.db2.gz SEXURMZMNLAJLF-VOTSOKGWSA-N 0 3 329.400 2.695 20 5 EFBDHN Cc1nn(C)cc1[C@H]1CCCN1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000372729628 151052801 /nfs/dbraw/zinc/05/28/01/151052801.db2.gz VYOVMONDLHDHSQ-SJORKVTESA-N 0 3 330.388 2.507 20 5 EFBDHN O=[N+]([O-])c1cccc([C@@H](O)CN2CC[C@H](Oc3ccccc3)C2)c1 ZINC000372730744 151053242 /nfs/dbraw/zinc/05/32/42/151053242.db2.gz ZRKRWRHGLQTACV-ROUUACIJSA-N 0 3 328.368 2.782 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CC[C@H](Oc3ccccc3)C2)c1 ZINC000372730746 151053579 /nfs/dbraw/zinc/05/35/79/151053579.db2.gz ZRKRWRHGLQTACV-ZWKOTPCHSA-N 0 3 328.368 2.782 20 5 EFBDHN Cc1ccc([C@H](C)N[C@@H]2CCN(c3cnn(C)c3)C2)cc1[N+](=O)[O-] ZINC000372785893 151062241 /nfs/dbraw/zinc/06/22/41/151062241.db2.gz VYAQLYNHSYYISK-DZGCQCFKSA-N 0 3 329.404 2.566 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@@H]2CC(=O)N3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000374514824 151361223 /nfs/dbraw/zinc/36/12/23/151361223.db2.gz PYPHPFOGMWOFKY-CFVMTHIKSA-N 0 3 347.415 2.798 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@H]2CC(=O)N3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000374514828 151361296 /nfs/dbraw/zinc/36/12/96/151361296.db2.gz PYPHPFOGMWOFKY-QEJZJMRPSA-N 0 3 347.415 2.798 20 5 EFBDHN CN(CCc1cccc([N+](=O)[O-])c1)Cc1ccc(-n2ccnc2)nc1 ZINC000374629579 151384536 /nfs/dbraw/zinc/38/45/36/151384536.db2.gz WKOVTWRVAIYFID-UHFFFAOYSA-N 0 3 337.383 2.850 20 5 EFBDHN COc1ccc(-c2ccc(CN(C)CCN(C)C)o2)c([N+](=O)[O-])c1 ZINC000348902374 286263526 /nfs/dbraw/zinc/26/35/26/286263526.db2.gz BREMFRLFSDWXAE-UHFFFAOYSA-N 0 3 333.388 2.857 20 5 EFBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])N[C@H](C)C(=O)NC(C)C ZINC000414332881 286857991 /nfs/dbraw/zinc/85/79/91/286857991.db2.gz FFJFYGYALSZVFK-OLZOCXBDSA-N 0 3 339.461 2.968 20 5 EFBDHN CC[C@@H]1CN([C@H](C)c2cc([N+](=O)[O-])ccc2C)CCN1C[C@@H](C)O ZINC000245516340 287210619 /nfs/dbraw/zinc/21/06/19/287210619.db2.gz FUVLGVOVVQUHBN-BZUAXINKSA-N 0 3 335.448 2.741 20 5 EFBDHN NC(=O)C1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000158595930 225050880 /nfs/dbraw/zinc/05/08/80/225050880.db2.gz IVWSWCCWEKAEBL-UHFFFAOYSA-N 0 3 329.356 2.552 20 5 EFBDHN C[C@H]1C[C@H](N(C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CCN1C ZINC000124001082 222363238 /nfs/dbraw/zinc/36/32/38/222363238.db2.gz XEXWIJKZNXFSDE-SWLSCSKDSA-N 0 3 345.403 2.559 20 5 EFBDHN CN(C)[C@H]1CCCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 ZINC000171634881 227187178 /nfs/dbraw/zinc/18/71/78/227187178.db2.gz GNZSZMVOWKKACB-ZDUSSCGKSA-N 0 3 333.413 2.976 20 5 EFBDHN CN1CCC[C@@H]1CNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113328513 544569982 /nfs/dbraw/zinc/56/99/82/544569982.db2.gz URCVKZSPPNVHDN-OAHLLOKOSA-N 0 3 332.429 2.902 20 5 EFBDHN COc1ccc(CN[C@@H](CO)Cc2ccccc2C)cc1[N+](=O)[O-] ZINC000188941291 265165132 /nfs/dbraw/zinc/16/51/32/265165132.db2.gz WGORAFJRKSJTQD-MRXNPFEDSA-N 0 3 330.384 2.605 20 5 EFBDHN COC(=O)[C@](C)(CNCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000191586429 265269340 /nfs/dbraw/zinc/26/93/40/265269340.db2.gz VHTZZYBTGDVSCP-GOSISDBHSA-N 0 3 328.368 2.815 20 5 EFBDHN COCCOc1ccccc1CNCCc1ccc([N+](=O)[O-])cc1 ZINC000083455338 272991292 /nfs/dbraw/zinc/99/12/92/272991292.db2.gz GXMNNBOAGUQYOI-UHFFFAOYSA-N 0 3 330.384 2.952 20 5 EFBDHN COC(=O)[C@@H]1CC12CCN(C/C=C/c1ccccc1[N+](=O)[O-])CC2 ZINC000271179868 265908678 /nfs/dbraw/zinc/90/86/78/265908678.db2.gz KRTPQYKWOCBYRA-DRDHIDPGSA-N 0 3 330.384 2.883 20 5 EFBDHN CC[C@@H](NC[C@H](O)Cn1cc([N+](=O)[O-])cn1)c1cccc(Cl)c1 ZINC000271761460 266055518 /nfs/dbraw/zinc/05/55/18/266055518.db2.gz MLQYWGKYUIZIEE-LSDHHAIUSA-N 0 3 338.795 2.547 20 5 EFBDHN CO[C@@H]1[C@H](C)[C@@H](N[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1(C)C ZINC000271854637 266079787 /nfs/dbraw/zinc/07/97/87/266079787.db2.gz UQDVQAWFJNVTJZ-BAESOJJISA-N 0 3 335.404 2.571 20 5 EFBDHN CN1CC=C(CNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000271918864 266096432 /nfs/dbraw/zinc/09/64/32/266096432.db2.gz KAOPNSJECPJVRO-UHFFFAOYSA-N 0 3 343.305 2.605 20 5 EFBDHN CN1CC=C(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 ZINC000271975129 266112228 /nfs/dbraw/zinc/11/22/28/266112228.db2.gz NNJUHPVQSYCZCR-UHFFFAOYSA-N 0 3 331.397 2.801 20 5 EFBDHN COC(=O)[C@H]1CCCC[C@@]1(C)NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000271992868 266117688 /nfs/dbraw/zinc/11/76/88/266117688.db2.gz GNNJFJLWTQUODC-CXAGYDPISA-N 0 3 336.388 2.815 20 5 EFBDHN COC(=O)[C@@H]1CCCC[C@@]1(C)NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000271992872 266117741 /nfs/dbraw/zinc/11/77/41/266117741.db2.gz GNNJFJLWTQUODC-SUMWQHHRSA-N 0 3 336.388 2.815 20 5 EFBDHN COc1cc(C[NH2+][C@H]2CCO[C@@H](CC(C)C)C2)c([N+](=O)[O-])cc1[O-] ZINC000272045918 266135561 /nfs/dbraw/zinc/13/55/61/266135561.db2.gz WXJWPWBQXDUEPX-KBPBESRZSA-N 0 3 338.404 2.992 20 5 EFBDHN C[C@@H](C1CCN(C)CC1)N(C)C(=O)c1cc(F)c([N+](=O)[O-])cc1F ZINC000272125918 266161813 /nfs/dbraw/zinc/16/18/13/266161813.db2.gz ALDUORLJNZUSND-JTQLQIEISA-N 0 3 341.358 2.675 20 5 EFBDHN CN1CC[C@@H]2CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)[C@@H]2C1 ZINC000272372097 266244297 /nfs/dbraw/zinc/24/42/97/266244297.db2.gz GQYPJPQBYQHFRY-QMTHXVAHSA-N 0 3 338.795 2.806 20 5 EFBDHN C[C@H](NC(=O)N1CCC[C@H]2CN(C)CC[C@H]21)c1ccccc1[N+](=O)[O-] ZINC000272593852 266319303 /nfs/dbraw/zinc/31/93/03/266319303.db2.gz OGFPNEWHDJAZFV-OFQRWUPVSA-N 0 3 346.431 2.782 20 5 EFBDHN COC(=O)C1=C(C)O[C@H](CN[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000272609273 266326456 /nfs/dbraw/zinc/32/64/56/266326456.db2.gz WMHCZTDUADXZCN-RISCZKNCSA-N 0 3 334.372 2.790 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)C2=CCN(C)CC2)c1 ZINC000272813487 266388292 /nfs/dbraw/zinc/38/82/92/266388292.db2.gz WIRDZLJDLDXYAA-LLVKDONJSA-N 0 3 335.429 2.697 20 5 EFBDHN Cc1cc(NCC2(CS(C)(=O)=O)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000272827192 266393632 /nfs/dbraw/zinc/39/36/32/266393632.db2.gz KGQPEYVIPZFNMS-UHFFFAOYSA-N 0 3 349.412 2.688 20 5 EFBDHN CN(CC1CCN(C)CC1)C(=O)/C=C/c1ccc(F)cc1[N+](=O)[O-] ZINC000103451191 273001461 /nfs/dbraw/zinc/00/14/61/273001461.db2.gz BCQUFQZNZAFYST-GQCTYLIASA-N 0 3 335.379 2.547 20 5 EFBDHN CS[C@@H]1CN(c2cccc(F)c2[N+](=O)[O-])C[C@H]1N1CCCC1 ZINC000275431901 266805599 /nfs/dbraw/zinc/80/55/99/266805599.db2.gz ISGFOKDNZFAGPA-ZIAGYGMSSA-N 0 3 325.409 2.750 20 5 EFBDHN CCc1ccc([C@H](O)CNCc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000276555150 267012887 /nfs/dbraw/zinc/01/28/87/267012887.db2.gz FVISXRZOKWATIU-QGZVFWFLSA-N 0 3 330.384 2.989 20 5 EFBDHN CCOc1cc(CN[C@@H](CC(N)=O)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000276982717 267091743 /nfs/dbraw/zinc/09/17/43/267091743.db2.gz YMZYSKGZONKRTA-HNNXBMFYSA-N 0 3 349.431 2.907 20 5 EFBDHN CCOc1cc(CN[C@H](CC(N)=O)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000276982719 267092288 /nfs/dbraw/zinc/09/22/88/267092288.db2.gz YMZYSKGZONKRTA-OAHLLOKOSA-N 0 3 349.431 2.907 20 5 EFBDHN CCNC(=O)C1(CNCc2cc(Cl)ccc2[N+](=O)[O-])CCC1 ZINC000277399179 267172770 /nfs/dbraw/zinc/17/27/70/267172770.db2.gz KJTQVKQBGNZJQE-UHFFFAOYSA-N 0 3 325.796 2.644 20 5 EFBDHN CCOC1CC(O)(CNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000277455742 267182240 /nfs/dbraw/zinc/18/22/40/267182240.db2.gz AOYQIDYATJLHOI-UHFFFAOYSA-N 0 3 346.383 2.874 20 5 EFBDHN C[C@@H]1CC(C)(C)C[C@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000277543183 267193418 /nfs/dbraw/zinc/19/34/18/267193418.db2.gz XIYHSUCUTAZEIU-IUODEOHRSA-N 0 3 340.445 2.783 20 5 EFBDHN O=C(NC[C@@H]1CCCCN1C1CC1)c1cc([N+](=O)[O-])ccc1Cl ZINC000277582984 267204226 /nfs/dbraw/zinc/20/42/26/267204226.db2.gz UVGRQHVIJYOCCL-ZDUSSCGKSA-N 0 3 337.807 2.995 20 5 EFBDHN O=C(NC[C@@H]1CCCCN1C1CC1)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000277630060 267216425 /nfs/dbraw/zinc/21/64/25/267216425.db2.gz XAOGSMOCEBHBOT-ZDUSSCGKSA-N 0 3 337.807 2.995 20 5 EFBDHN O=C(NC[C@H]1CCCCN1C1CC1)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000277630057 267216838 /nfs/dbraw/zinc/21/68/38/267216838.db2.gz XAOGSMOCEBHBOT-CYBMUJFWSA-N 0 3 337.807 2.995 20 5 EFBDHN CCOC1CC(O)(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000277706337 267239823 /nfs/dbraw/zinc/23/98/23/267239823.db2.gz MBCCCWHRCJEQMV-UHFFFAOYSA-N 0 3 346.383 2.874 20 5 EFBDHN CO[C@@H]1CCCC[C@H]1N[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000278708021 267530027 /nfs/dbraw/zinc/53/00/27/267530027.db2.gz QRWWSEWGNJIFPX-XNRPHZJLSA-N 0 3 335.404 2.777 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CCC[C@@H]2C[C@@H](O)c2ccco2)c1 ZINC000269642209 273086964 /nfs/dbraw/zinc/08/69/64/273086964.db2.gz JSRNQHOTULLMKC-DJIMGWMZSA-N 0 3 346.383 2.809 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])N[C@H]1CCCCNC1=O ZINC000271116597 273098863 /nfs/dbraw/zinc/09/88/63/273098863.db2.gz INWNOZIUFGRVEJ-OLZOCXBDSA-N 0 3 337.445 2.724 20 5 EFBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])N[C@@H]1CCCCNC1=O ZINC000271116600 273098917 /nfs/dbraw/zinc/09/89/17/273098917.db2.gz INWNOZIUFGRVEJ-QWHCGFSZSA-N 0 3 337.445 2.724 20 5 EFBDHN CN1CC=C(CNC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)CC1 ZINC000271876859 273110914 /nfs/dbraw/zinc/11/09/14/273110914.db2.gz MJYWXFUBUVWSKO-UHFFFAOYSA-N 0 3 331.416 2.884 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[C@H]2CCN(C)C[C@@H]21 ZINC000274268707 273128686 /nfs/dbraw/zinc/12/86/86/273128686.db2.gz MEGDPUDSHFDLIF-CJNGLKHVSA-N 0 3 332.404 2.770 20 5 EFBDHN CC(C)O[C@@H]1C[C@H](NCC(=O)Nc2ccccc2[N+](=O)[O-])C1(C)C ZINC000274308308 273131563 /nfs/dbraw/zinc/13/15/63/273131563.db2.gz SSBZUCNVKAIXIV-LSDHHAIUSA-N 0 3 335.404 2.715 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(N2C[C@@H](SC)[C@H](N3CCCC3)C2)c1 ZINC000275517856 273137336 /nfs/dbraw/zinc/13/73/36/273137336.db2.gz VUIHYPOVNWYZFA-HZPDHXFCSA-N 0 3 337.445 2.619 20 5 EFBDHN COc1ccc(CNCCOCC(F)(F)C(F)F)cc1[N+](=O)[O-] ZINC000277504408 273158709 /nfs/dbraw/zinc/15/87/09/273158709.db2.gz PZXWFMDGOOAFOG-UHFFFAOYSA-N 0 3 340.273 2.610 20 5 EFBDHN Cn1cc(CN2CCC[C@@](C)(O)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000279690637 273242594 /nfs/dbraw/zinc/24/25/94/273242594.db2.gz PSMLHQLVFNFCKM-GOSISDBHSA-N 0 3 344.415 2.732 20 5 EFBDHN CCN1CCC(NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])CC1 ZINC000279951511 273273626 /nfs/dbraw/zinc/27/36/26/273273626.db2.gz JTMYQLFQWLFSBC-UHFFFAOYSA-N 0 3 343.786 2.530 20 5 EFBDHN CCn1nc(C)c([N+](=O)[O-])c1N[C@H]1CCN(Cc2ccccc2)C1 ZINC000280054641 273285607 /nfs/dbraw/zinc/28/56/07/273285607.db2.gz NTCMENHNDAKTKS-HNNXBMFYSA-N 0 3 329.404 2.806 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CNC[C@@H](CO)[C@@H]3CCOC3)o2)cc1 ZINC000280290969 273312037 /nfs/dbraw/zinc/31/20/37/273312037.db2.gz MQVBGOUOSKAQAV-CABCVRRESA-N 0 3 346.383 2.589 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CNC[C@H](CO)[C@@H]3CCOC3)o2)cc1 ZINC000280290973 273312049 /nfs/dbraw/zinc/31/20/49/273312049.db2.gz MQVBGOUOSKAQAV-HUUCEWRRSA-N 0 3 346.383 2.589 20 5 EFBDHN CO[C@]1(C)CCCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000280519971 273336453 /nfs/dbraw/zinc/33/64/53/273336453.db2.gz HPZXLCFBOWAEPG-GOSISDBHSA-N 0 3 344.415 2.996 20 5 EFBDHN CN(CCOc1ccc([N+](=O)[O-])cc1)[C@@H](CC(N)=O)c1ccccc1 ZINC000280626947 273348210 /nfs/dbraw/zinc/34/82/10/273348210.db2.gz XBXHHXITHPZAQT-KRWDZBQOSA-N 0 3 343.383 2.522 20 5 EFBDHN Cc1cc(OCC(=O)Nc2cccc(CN(C)C)c2)ccc1[N+](=O)[O-] ZINC000282097108 273513765 /nfs/dbraw/zinc/51/37/65/273513765.db2.gz XQZNVXBBUZCUEW-UHFFFAOYSA-N 0 3 343.383 2.982 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H](CC(C)C)CN(C)C)c1 ZINC000283421844 273713750 /nfs/dbraw/zinc/71/37/50/273713750.db2.gz XRBIQLKOMNMMPJ-CYBMUJFWSA-N 0 3 337.420 2.700 20 5 EFBDHN COCCCN1CCC(Nc2ccc([N+](=O)[O-])c(C(C)=O)c2)CC1 ZINC000283919098 273774905 /nfs/dbraw/zinc/77/49/05/273774905.db2.gz WZJGEXLPGDVWMP-UHFFFAOYSA-N 0 3 335.404 2.710 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@H](CCO)C2CCCCC2)c([N+](=O)[O-])c1 ZINC000284067662 273792737 /nfs/dbraw/zinc/79/27/37/273792737.db2.gz KMHDTGXXRZHOCZ-OAHLLOKOSA-N 0 3 337.376 2.924 20 5 EFBDHN CC[C@@H](NCCn1ccc([N+](=O)[O-])n1)c1ccc(OC)c(OC)c1 ZINC000285441083 274000234 /nfs/dbraw/zinc/00/02/34/274000234.db2.gz LITNIOWINOJXPT-CYBMUJFWSA-N 0 3 334.376 2.549 20 5 EFBDHN COC1CCC(N(C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])CC1 ZINC000360305143 274016248 /nfs/dbraw/zinc/01/62/48/274016248.db2.gz RXGTXZXDMDLCKQ-UHFFFAOYSA-N 0 3 335.404 2.731 20 5 EFBDHN COCC(C)(C)N1CCN(c2nccc3cc([N+](=O)[O-])ccc32)CC1 ZINC000425281657 274017143 /nfs/dbraw/zinc/01/71/43/274017143.db2.gz QCLBBUUWGXGNID-UHFFFAOYSA-N 0 3 344.415 2.690 20 5 EFBDHN C[C@H]1C[C@H](N2CCCC2)CN1C(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000285624585 274040255 /nfs/dbraw/zinc/04/02/55/274040255.db2.gz KNIOSLJWPCZQFH-AAEUAGOBSA-N 0 3 336.367 2.824 20 5 EFBDHN C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000285624593 274040286 /nfs/dbraw/zinc/04/02/86/274040286.db2.gz KNIOSLJWPCZQFH-YPMHNXCESA-N 0 3 336.367 2.824 20 5 EFBDHN CCc1ccc(C(=O)N2C[C@@H](N3CCCC3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000285893886 274095565 /nfs/dbraw/zinc/09/55/65/274095565.db2.gz RPIQLBUXHUVVOQ-BBRMVZONSA-N 0 3 331.416 2.856 20 5 EFBDHN COc1ccc2c(c1)ncc([N+](=O)[O-])c2N1CCN(CC2CC2)CC1 ZINC000450266240 274140459 /nfs/dbraw/zinc/14/04/59/274140459.db2.gz OXLTUMHDEMETMD-UHFFFAOYSA-N 0 3 342.399 2.684 20 5 EFBDHN Nc1ccc(NCC2(N3CCSCC3)CCCC2)c([N+](=O)[O-])c1 ZINC000286253875 274162988 /nfs/dbraw/zinc/16/29/88/274162988.db2.gz VKZNCXMMAYVPMD-UHFFFAOYSA-N 0 3 336.461 2.951 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000286671876 274247822 /nfs/dbraw/zinc/24/78/22/274247822.db2.gz KRNWKACZWYOZOU-MRXNPFEDSA-N 0 3 348.447 2.653 20 5 EFBDHN C[C@@H]1CCC[C@H](C)CN1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000357737933 274295163 /nfs/dbraw/zinc/29/51/63/274295163.db2.gz GCJZBWIWWSUBIM-UONOGXRCSA-N 0 3 331.416 2.994 20 5 EFBDHN CS[C@@H]1CN(c2ccc([N+](=O)[O-])cc2C(C)=O)C[C@H]1N1CCCC1 ZINC000286904893 274297462 /nfs/dbraw/zinc/29/74/62/274297462.db2.gz PGSZNLGYXMXQEO-IAGOWNOFSA-N 0 3 349.456 2.813 20 5 EFBDHN Cc1cc(NC(=O)N2C[C@@H](N3CCCC3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000286985203 274315312 /nfs/dbraw/zinc/31/53/12/274315312.db2.gz DMUZUKAUJUQPAI-HIFRSBDPSA-N 0 3 332.404 2.994 20 5 EFBDHN C[C@H](NC(=O)Nc1ccncc1[N+](=O)[O-])[C@@H](c1ccccc1)N(C)C ZINC000287019564 274323370 /nfs/dbraw/zinc/32/33/70/274323370.db2.gz IERZLYSKMPBSBO-LRDDRELGSA-N 0 3 343.387 2.803 20 5 EFBDHN CN(CCCN(C)C(=O)Nc1ccncc1[N+](=O)[O-])Cc1ccco1 ZINC000287224302 274371895 /nfs/dbraw/zinc/37/18/95/274371895.db2.gz VNKJXCFYSRUQDT-UHFFFAOYSA-N 0 3 347.375 2.569 20 5 EFBDHN C[C@@H]1[C@H](N2CCCC2)CCN1C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000287244603 274376852 /nfs/dbraw/zinc/37/68/52/274376852.db2.gz RFGQAMFZOKDMPZ-CZUORRHYSA-N 0 3 349.456 2.772 20 5 EFBDHN CN(C)C[C@@H](NC(=O)Nc1ccncc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000287293529 274387319 /nfs/dbraw/zinc/38/73/19/274387319.db2.gz ZQFBTSPUUONFKJ-CQSZACIVSA-N 0 3 347.350 2.553 20 5 EFBDHN CN(C)CCOc1ccc(CCNc2ccc(N)cc2[N+](=O)[O-])cc1 ZINC000287831346 274492363 /nfs/dbraw/zinc/49/23/63/274492363.db2.gz KSTZIRAAWUYOKL-UHFFFAOYSA-N 0 3 344.415 2.772 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N[C@@H]1CCN(c2ccccc2)C1=O ZINC000449121862 274498852 /nfs/dbraw/zinc/49/88/52/274498852.db2.gz IXHWNFSYPZSJPK-RHSMWYFYSA-N 0 3 339.395 2.921 20 5 EFBDHN C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000288218976 274550500 /nfs/dbraw/zinc/55/05/00/274550500.db2.gz DPNXOGWEDFTWIW-PBHICJAKSA-N 0 3 345.443 2.958 20 5 EFBDHN C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000288485880 274602825 /nfs/dbraw/zinc/60/28/25/274602825.db2.gz RFVLSGUNIYLELI-TZMCWYRMSA-N 0 3 342.399 2.775 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCCC12CCN(C)CC2 ZINC000362616455 274763591 /nfs/dbraw/zinc/76/35/91/274763591.db2.gz MJLYIEWWXJWCOC-UHFFFAOYSA-N 0 3 332.404 2.995 20 5 EFBDHN Cn1cc(N2CC[C@@H](N[C@H]3CCCc4ccc([N+](=O)[O-])cc43)C2)cn1 ZINC000375717199 274893153 /nfs/dbraw/zinc/89/31/53/274893153.db2.gz DEVRJAZTOLMQAR-KDOFPFPSSA-N 0 3 341.415 2.574 20 5 EFBDHN O=[N+]([O-])c1cccc(Cl)c1NC1CCN([C@H]2CCOC2)CC1 ZINC000367774490 275039318 /nfs/dbraw/zinc/03/93/18/275039318.db2.gz ZZODHRUEMPZZMB-LBPRGKRZSA-N 0 3 325.796 2.913 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000110995846 276160043 /nfs/dbraw/zinc/16/00/43/276160043.db2.gz UYTQUWBNIWBURP-AWEZNQCLSA-N 0 3 337.445 2.678 20 5 EFBDHN CCN1CCN([C@H]2CCN([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)CC1 ZINC000245535415 276201597 /nfs/dbraw/zinc/20/15/97/276201597.db2.gz WPUMLRQKTOHLLY-AEFFLSMTSA-N 0 3 346.475 2.676 20 5 EFBDHN CCOc1cccc(N2CCN(CC3CCOCC3)CC2)c1[N+](=O)[O-] ZINC000184119807 276381155 /nfs/dbraw/zinc/38/11/55/276381155.db2.gz RHQZXCCFHNQFQB-UHFFFAOYSA-N 0 3 349.431 2.542 20 5 EFBDHN CCc1ccc(C(=O)N2CCCC23CCN(C)CC3)cc1[N+](=O)[O-] ZINC000367351645 276666015 /nfs/dbraw/zinc/66/60/15/276666015.db2.gz MWCAYWQTQCLWSD-UHFFFAOYSA-N 0 3 331.416 2.858 20 5 EFBDHN CN1CCC2(CCCN2C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CC1 ZINC000351992869 277037827 /nfs/dbraw/zinc/03/78/27/277037827.db2.gz FPVIXQJZFVGYLP-UHFFFAOYSA-N 0 3 342.399 2.777 20 5 EFBDHN CN1CCC[C@]2(CCN(c3nc(-c4ccc([N+](=O)[O-])cc4)no3)C2)C1 ZINC000338740027 277087395 /nfs/dbraw/zinc/08/73/95/277087395.db2.gz ACAONQFCFRDEBI-KRWDZBQOSA-N 0 3 343.387 2.567 20 5 EFBDHN CN1CC[C@H]2[C@H](CCCN2c2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000428177775 277183327 /nfs/dbraw/zinc/18/33/27/277183327.db2.gz RJMIOQYFTHAKNK-HIFRSBDPSA-N 0 3 343.387 2.565 20 5 EFBDHN CNC(=O)[C@@H]1CCC[C@H]1N[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433281429 277244226 /nfs/dbraw/zinc/24/42/26/277244226.db2.gz JECWGOYSLXSMST-DAXOMENPSA-N 0 3 331.416 2.822 20 5 EFBDHN CC(C)Oc1cccc([C@H](C)NCCn2cc([N+](=O)[O-])ccc2=O)c1 ZINC000179664591 277703113 /nfs/dbraw/zinc/70/31/13/277703113.db2.gz CKUZECZAVCFBSF-AWEZNQCLSA-N 0 3 345.399 2.895 20 5 EFBDHN CC1(C)CCCN1CCNC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000457052503 278219534 /nfs/dbraw/zinc/21/95/34/278219534.db2.gz AFLVDULZJBDBMP-UHFFFAOYSA-N 0 3 337.445 2.678 20 5 EFBDHN C[C@@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000182073383 278241765 /nfs/dbraw/zinc/24/17/65/278241765.db2.gz IEEZIVSMBVWBGM-ZDUSSCGKSA-N 0 3 345.374 2.984 20 5 EFBDHN C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000370636278 278476179 /nfs/dbraw/zinc/47/61/79/278476179.db2.gz SJHAMXRBVKHXDC-WCQYABFASA-N 0 3 337.807 2.947 20 5 EFBDHN C[C@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000133514779 279323346 /nfs/dbraw/zinc/32/33/46/279323346.db2.gz DAJIIBXEGKLXQP-FRRDWIJNSA-N 0 3 337.395 2.830 20 5 EFBDHN C[C@H](N[C@@H]1CCCN(c2ccnn2C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000365736735 279506112 /nfs/dbraw/zinc/50/61/12/279506112.db2.gz UPPHLHLHTCAKDV-DZGCQCFKSA-N 0 3 329.404 2.648 20 5 EFBDHN CC[C@@H]1CCCCN1CCNC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000113601528 280251888 /nfs/dbraw/zinc/25/18/88/280251888.db2.gz CPHDNFYQBBIUFE-MRXNPFEDSA-N 0 3 348.447 2.701 20 5 EFBDHN O=[N+]([O-])c1ccc(CNC[C@]2(CO)C[C@@H]2c2ccc(F)cc2)cc1 ZINC000428541794 280364296 /nfs/dbraw/zinc/36/42/96/280364296.db2.gz CTOONODKUWZKFK-MSOLQXFVSA-N 0 3 330.359 2.990 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C/CN[C@H](C1CC1)[C@@]1(CO)CCCO1 ZINC000354720723 280374361 /nfs/dbraw/zinc/37/43/61/280374361.db2.gz PATFTTHRZKYALK-VCPQXCNPSA-N 0 3 332.400 2.518 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)n1 ZINC000268817245 281009684 /nfs/dbraw/zinc/00/96/84/281009684.db2.gz NZABXNQBYNBTNT-HUUCEWRRSA-N 0 3 348.447 2.624 20 5 EFBDHN C[C@@H](CNC(=O)CCOc1ccccc1[N+](=O)[O-])N1CCC(C)CC1 ZINC000067269847 292694007 /nfs/dbraw/zinc/69/40/07/292694007.db2.gz KUCOPIUMERCTLS-HNNXBMFYSA-N 0 3 349.431 2.600 20 5 EFBDHN CN1CC[C@H]2[C@H](CCCN2C(=O)C(C)(C)c2ccccc2[N+](=O)[O-])C1 ZINC000410592850 290240985 /nfs/dbraw/zinc/24/09/85/290240985.db2.gz QEPUWUUMYRREPY-ZBFHGGJFSA-N 0 3 345.443 2.815 20 5 EFBDHN CCCCN1CCCC[C@@H]1CNC(=O)c1cc(OC)ccc1[N+](=O)[O-] ZINC000126300404 293034550 /nfs/dbraw/zinc/03/45/50/293034550.db2.gz WXXMVVFNOPOMNF-CQSZACIVSA-N 0 3 349.431 2.988 20 5 EFBDHN CCOc1ccc([C@H](C)NCCOC[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000153812237 293395042 /nfs/dbraw/zinc/39/50/42/293395042.db2.gz XFTLMROWVFFUBW-ZFWWWQNUSA-N 0 3 338.404 2.840 20 5 EFBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCC1(CO)CCOCC1 ZINC000290843377 294200832 /nfs/dbraw/zinc/20/08/32/294200832.db2.gz JBLSZPGJMGQEHH-UHFFFAOYSA-N 0 3 349.214 2.780 20 5 EFBDHN CC(C)NC(=O)c1ccc(N[C@@H]2C[C@@H](C)N(C3CC3)C2)c([N+](=O)[O-])c1 ZINC000290865975 294206837 /nfs/dbraw/zinc/20/68/37/294206837.db2.gz ZDURZDMPSMLDMU-TZMCWYRMSA-N 0 3 346.431 2.770 20 5 EFBDHN C[C@H]1C[C@H](Nc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CN1C1CC1 ZINC000290871276 294208260 /nfs/dbraw/zinc/20/82/60/294208260.db2.gz ZSTQVZSJAGDHPD-FZMZJTMJSA-N 0 3 344.415 2.524 20 5 EFBDHN COCC[C@@](C)(O)CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000290893541 294214174 /nfs/dbraw/zinc/21/41/74/294214174.db2.gz NEDOQJYBUZKEBS-CYBMUJFWSA-N 0 3 337.203 2.779 20 5 EFBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCC1(O)CCOCC1 ZINC000290899644 294215571 /nfs/dbraw/zinc/21/55/71/294215571.db2.gz NUPNFVDVOCKSLN-UHFFFAOYSA-N 0 3 335.187 2.533 20 5 EFBDHN C[C@@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H](c1ccccc1)N(C)C ZINC000290920378 294220781 /nfs/dbraw/zinc/22/07/81/294220781.db2.gz IFQKSFFSSLQBDH-SJKOYZFVSA-N 0 3 342.399 2.797 20 5 EFBDHN CN(C)C[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000291977283 294540421 /nfs/dbraw/zinc/54/04/21/294540421.db2.gz WQSXDXRCWNMIKH-KRWDZBQOSA-N 0 3 345.374 2.696 20 5 EFBDHN C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2F)CCN(C2CCC2)C1 ZINC000293639690 295016884 /nfs/dbraw/zinc/01/68/84/295016884.db2.gz HFQRINKSZWZEIO-LBPRGKRZSA-N 0 3 335.379 2.680 20 5 EFBDHN COc1ccc(C(=O)N2CCN(C3CCC3)C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000293780009 295047801 /nfs/dbraw/zinc/04/78/01/295047801.db2.gz WATCZWOBLRAWFN-CYBMUJFWSA-N 0 3 347.415 2.550 20 5 EFBDHN CSc1ccc([C@H](CNc2ncc([N+](=O)[O-])cn2)N(C)C)cc1 ZINC000293994602 295095272 /nfs/dbraw/zinc/09/52/72/295095272.db2.gz JCEFXTLQYHOKSZ-AWEZNQCLSA-N 0 3 333.417 2.822 20 5 EFBDHN CSc1ccc([C@@H](CNc2c([N+](=O)[O-])ncn2C)N(C)C)cc1 ZINC000294161380 295120806 /nfs/dbraw/zinc/12/08/06/295120806.db2.gz RMSFSQZVVSKGCE-CYBMUJFWSA-N 0 3 335.433 2.765 20 5 EFBDHN CSc1ccc([C@H](CNC(=O)c2ccc([N+](=O)[O-])o2)N(C)C)cc1 ZINC000294262600 295137163 /nfs/dbraw/zinc/13/71/63/295137163.db2.gz GBURCGLFOBTXML-ZDUSSCGKSA-N 0 3 349.412 2.942 20 5 EFBDHN CSc1ccc([C@@H](CNC(=O)c2ccc([N+](=O)[O-])o2)N(C)C)cc1 ZINC000294262595 295137192 /nfs/dbraw/zinc/13/71/92/295137192.db2.gz GBURCGLFOBTXML-CYBMUJFWSA-N 0 3 349.412 2.942 20 5 EFBDHN CC(C)(CCC(=O)NC[C@H](c1ccccc1)N1CCCC1)[N+](=O)[O-] ZINC000294553665 295185049 /nfs/dbraw/zinc/18/50/49/295185049.db2.gz WBCWPROJGVWPJH-MRXNPFEDSA-N 0 3 333.432 2.775 20 5 EFBDHN Cc1ccccc1CN1CCC(NC(=O)CCC(C)(C)[N+](=O)[O-])CC1 ZINC000294627238 295196612 /nfs/dbraw/zinc/19/66/12/295196612.db2.gz YLSBCJFGCCEJLE-UHFFFAOYSA-N 0 3 347.459 2.911 20 5 EFBDHN Cc1ccc(NC(=O)CCC(C)(C)[N+](=O)[O-])c(OCCN(C)C)c1 ZINC000294799843 295229622 /nfs/dbraw/zinc/22/96/22/295229622.db2.gz BYNXQAFQFAZEFL-UHFFFAOYSA-N 0 3 337.420 2.709 20 5 EFBDHN C[C@@H]1CC[C@@H](C)[C@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000294928963 295247159 /nfs/dbraw/zinc/24/71/59/295247159.db2.gz BYJXVYCWDZCVKA-XJKCOSOUSA-N 0 3 340.445 2.783 20 5 EFBDHN Cc1nc(N[C@@H](CN2CCCC2)c2ccccc2)ncc1[N+](=O)[O-] ZINC000295004971 295256675 /nfs/dbraw/zinc/25/66/75/295256675.db2.gz AJKSMPSJQASAQP-HNNXBMFYSA-N 0 3 327.388 2.942 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)CCC(C)(C)[N+](=O)[O-])CCN1Cc1ccccc1 ZINC000295010722 295257241 /nfs/dbraw/zinc/25/72/41/295257241.db2.gz CRTMIEORZWNWAC-DOTOQJQBSA-N 0 3 347.459 2.991 20 5 EFBDHN Cc1cc(Cl)c(C(=O)N2CCC[C@H](N(C)C)C2)cc1[N+](=O)[O-] ZINC000295021481 295258585 /nfs/dbraw/zinc/25/85/85/295258585.db2.gz HLNSCYHQLMFKOJ-NSHDSACASA-N 0 3 325.796 2.723 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CNC[C@@H](O)Cc1cccc(F)c1 ZINC000295126404 295271371 /nfs/dbraw/zinc/27/13/71/295271371.db2.gz NZHSQAVDVVKJCZ-KRWDZBQOSA-N 0 3 348.374 2.826 20 5 EFBDHN COc1cccc(C(=O)N2CCN(C3CCC3)C[C@@H](C)C2)c1[N+](=O)[O-] ZINC000344767871 295284916 /nfs/dbraw/zinc/28/49/16/295284916.db2.gz FYEKIJHMLFULFL-CYBMUJFWSA-N 0 3 347.415 2.550 20 5 EFBDHN CC[C@H](C)N1CCN(Cc2cc(OC)c(OC)cc2[N+](=O)[O-])CC1 ZINC000295239352 295286577 /nfs/dbraw/zinc/28/65/77/295286577.db2.gz OUQONKGQPZCIER-ZDUSSCGKSA-N 0 3 337.420 2.528 20 5 EFBDHN C[C@H](NCCn1cc([N+](=O)[O-])ccc1=O)c1cccc(C2CC2)c1 ZINC000295315795 295299184 /nfs/dbraw/zinc/29/91/84/295299184.db2.gz GKGMQKKWQAVFJN-ZDUSSCGKSA-N 0 3 327.384 2.985 20 5 EFBDHN CC(C)(CCC(=O)NC[C@H]1CCCN1Cc1ccccc1)[N+](=O)[O-] ZINC000295330943 295301867 /nfs/dbraw/zinc/30/18/67/295301867.db2.gz UBSWHHZANCANGR-MRXNPFEDSA-N 0 3 333.432 2.603 20 5 EFBDHN C[C@H](CC(C)(C)C)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000295345581 295304366 /nfs/dbraw/zinc/30/43/66/295304366.db2.gz IGJDLLUMBSIRCI-GFCCVEGCSA-N 0 3 328.434 2.783 20 5 EFBDHN C[C@H]1[C@H](NC(=O)CCC(C)(C)[N+](=O)[O-])CCN1Cc1ccccc1 ZINC000295412761 295316222 /nfs/dbraw/zinc/31/62/22/295316222.db2.gz UMFHQMSLIOQXIW-GOEBONIOSA-N 0 3 333.432 2.601 20 5 EFBDHN CN1CCC[C@@]2(CCN(C(=O)c3ccc(Cl)c([N+](=O)[O-])c3)C2)C1 ZINC000295691207 295361442 /nfs/dbraw/zinc/36/14/42/295361442.db2.gz WOZABWJRPSZQJX-MRXNPFEDSA-N 0 3 337.807 2.806 20 5 EFBDHN C[C@@H](c1ccc([N+](=O)[O-])cc1)N1C[C@H]2C[C@H](Cn3c(=O)cccc32)C1 ZINC000295737717 295368452 /nfs/dbraw/zinc/36/84/52/295368452.db2.gz WKVPIVHFBVGDSC-OFQRWUPVSA-N 0 3 339.395 2.937 20 5 EFBDHN Cc1cc(Cl)c(C(=O)N(C)[C@H]2CCN(C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000295756053 295371539 /nfs/dbraw/zinc/37/15/39/295371539.db2.gz HJGPMKVLDLDGKF-RISCZKNCSA-N 0 3 339.823 2.969 20 5 EFBDHN C[C@H](c1ccc(N)c([N+](=O)[O-])c1)N1CCC[C@H](CC(C)(C)C(N)=O)C1 ZINC000295836777 295383534 /nfs/dbraw/zinc/38/35/34/295383534.db2.gz AGANHCALYUOJTP-CHWSQXEVSA-N 0 3 348.447 2.852 20 5 EFBDHN CC[C@@H](C)N1CCN(CCC(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000296007537 295410749 /nfs/dbraw/zinc/41/07/49/295410749.db2.gz LBPCANGTDHAKKW-CQSZACIVSA-N 0 3 348.447 2.648 20 5 EFBDHN COc1cc(CN[C@@H]2[C@H]3CCO[C@H]3C23CCC3)c([N+](=O)[O-])cc1F ZINC000296041231 295416085 /nfs/dbraw/zinc/41/60/85/295416085.db2.gz ODDSQROMRYTWQF-HFBAOOFYSA-N 0 3 336.363 2.790 20 5 EFBDHN COc1cc(CN[C@H](C)[C@H]2CCOC2)c([N+](=O)[O-])cc1OC(F)F ZINC000162778839 310721294 /nfs/dbraw/zinc/72/12/94/310721294.db2.gz LAHRIRMRLMVGQM-ZJUUUORDSA-N 0 3 346.330 2.719 20 5 EFBDHN C[C@H](NC(=O)N(C)CC1CCN(C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000171743458 310751250 /nfs/dbraw/zinc/75/12/50/310751250.db2.gz FRYBKMZUBXVWEX-ZDUSSCGKSA-N 0 3 334.420 2.639 20 5 EFBDHN CCc1ccc(C(C)(C)NCCn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC000180096281 310795216 /nfs/dbraw/zinc/79/52/16/310795216.db2.gz COJWZGBHSYHBAQ-UHFFFAOYSA-N 0 3 329.400 2.844 20 5 EFBDHN C[C@@H]1CN(C[C@H]2CCCN2Cc2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1 ZINC000299198167 311060835 /nfs/dbraw/zinc/06/08/35/311060835.db2.gz RCLKTGBCMQWZHI-IIDMSEBBSA-N 0 3 333.432 2.668 20 5 EFBDHN C[C@@H](CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)N1CCC[C@@H](C)C1 ZINC000299293924 311069869 /nfs/dbraw/zinc/06/98/69/311069869.db2.gz QRTCPZYGDUGHDH-OLZOCXBDSA-N 0 3 344.415 2.926 20 5 EFBDHN CCN(CC)Cc1cccc(NC(=O)c2n[nH]c(C)c2[N+](=O)[O-])c1 ZINC000299442350 311085454 /nfs/dbraw/zinc/08/54/54/311085454.db2.gz KVFBKBNUMNPRIX-UHFFFAOYSA-N 0 3 331.376 2.720 20 5 EFBDHN CC[C@@H]1CCCCN1CCNc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000301238251 311126356 /nfs/dbraw/zinc/12/63/56/311126356.db2.gz DZVCUCAQUDBAEV-GFCCVEGCSA-N 0 3 345.403 2.920 20 5 EFBDHN CCN1CCCC[C@@H]1CNc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000301562347 311144621 /nfs/dbraw/zinc/14/46/21/311144621.db2.gz VBORBPNNQXQTKI-LLVKDONJSA-N 0 3 331.376 2.530 20 5 EFBDHN CCOC(=O)c1cc(N2CCN(C3CCCC3)CC2)ccc1[N+](=O)[O-] ZINC000301600824 311146846 /nfs/dbraw/zinc/14/68/46/311146846.db2.gz ZCTIOHBDJPZCHK-UHFFFAOYSA-N 0 3 347.415 2.836 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CC[C@H](N3CCCC3)C2)c(OC(F)F)c1 ZINC000302030867 311173471 /nfs/dbraw/zinc/17/34/71/311173471.db2.gz BXZVFVYCKMLLKD-LBPRGKRZSA-N 0 3 327.331 2.871 20 5 EFBDHN Cc1cc(NCC(C)(C)N2CCOCC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302142044 311180345 /nfs/dbraw/zinc/18/03/45/311180345.db2.gz FRCLOQKGHHXDJP-UHFFFAOYSA-N 0 3 344.415 2.974 20 5 EFBDHN CC(C)CN1CCN(c2ccc([N+](=O)[O-])cc2OC(F)F)CC1 ZINC000302162683 311181831 /nfs/dbraw/zinc/18/18/31/311181831.db2.gz PZGAZTWSXCVCPT-UHFFFAOYSA-N 0 3 329.347 2.974 20 5 EFBDHN Cc1cc(N[C@@H](C)CCN2CCN(C)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000302228499 311186355 /nfs/dbraw/zinc/18/63/55/311186355.db2.gz ASZYDDTUFRKNOC-ZDUSSCGKSA-N 0 3 340.855 2.995 20 5 EFBDHN C[C@H]1CN(CCCCNc2c3c(ccc2[N+](=O)[O-])NCC3)C[C@H](C)O1 ZINC000302458935 311190601 /nfs/dbraw/zinc/19/06/01/311190601.db2.gz QYQVNRNOQZNEFQ-KBPBESRZSA-N 0 3 348.447 2.864 20 5 EFBDHN C[C@@H](c1cc2ccccc2o1)N(C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000304358614 311212107 /nfs/dbraw/zinc/21/21/07/311212107.db2.gz SVPSJYGSDGEEKR-WFASDCNBSA-N 0 3 344.371 2.591 20 5 EFBDHN C[C@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000330596880 311323734 /nfs/dbraw/zinc/32/37/34/311323734.db2.gz VUYYCCVOWSVBCQ-GRYCIOLGSA-N 0 3 325.434 2.753 20 5 EFBDHN C[C@H](C1CCN(C)CC1)N(C)C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000330750714 311332731 /nfs/dbraw/zinc/33/27/31/311332731.db2.gz WMAWFBKJUGUNMU-CQSZACIVSA-N 0 3 333.432 2.716 20 5 EFBDHN CCNc1ccc(C(=O)N(C)[C@@H](C)C2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000330820160 311336859 /nfs/dbraw/zinc/33/68/59/311336859.db2.gz DGYDFEHJZGCVIH-ZDUSSCGKSA-N 0 3 348.447 2.829 20 5 EFBDHN CC(C)c1n[nH]c(C(=O)N2CCC[C@H]2CN2CCCCC2)c1[N+](=O)[O-] ZINC000331449494 311378462 /nfs/dbraw/zinc/37/84/62/311378462.db2.gz YVGYBAFLKIHFBP-ZDUSSCGKSA-N 0 3 349.435 2.532 20 5 EFBDHN CC(C)c1[nH]nc(C(=O)N2CCC[C@H]2CN2CCCCC2)c1[N+](=O)[O-] ZINC000331449494 311378464 /nfs/dbraw/zinc/37/84/64/311378464.db2.gz YVGYBAFLKIHFBP-ZDUSSCGKSA-N 0 3 349.435 2.532 20 5 EFBDHN CCN(CCN1CCCCCC1)C(=O)c1csc([N+](=O)[O-])c1 ZINC000331589162 311393945 /nfs/dbraw/zinc/39/39/45/311393945.db2.gz XQBDUYRDRTZKST-UHFFFAOYSA-N 0 3 325.434 2.994 20 5 EFBDHN COC[C@@H]1C[C@H](O)CN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000414494204 312050287 /nfs/dbraw/zinc/05/02/87/312050287.db2.gz VAQYSMLAWANMGP-GJZGRUSLSA-N 0 3 348.424 2.905 20 5 EFBDHN CCC(=O)N1CC[C@@H](N[C@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417308220 312206918 /nfs/dbraw/zinc/20/69/18/312206918.db2.gz HQRHPKASBJVJDE-PBHICJAKSA-N 0 3 331.416 2.963 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](NC[C@H](O)COCC1CC1)CCCC2 ZINC000417345120 312211843 /nfs/dbraw/zinc/21/18/43/312211843.db2.gz TVFFPPRLGBRDLV-WMZOPIPTSA-N 0 3 334.416 2.739 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](NCCN1C[C@H]3CC[C@@H](C1)O3)CCCC2 ZINC000417349025 312212355 /nfs/dbraw/zinc/21/23/55/312212355.db2.gz JZODDHLJLNCFCC-ZIFCJYIRSA-N 0 3 345.443 2.815 20 5 EFBDHN CCN(CC)[C@H](CNc1c(C(N)=O)cccc1[N+](=O)[O-])c1ccco1 ZINC000420579472 312373372 /nfs/dbraw/zinc/37/33/72/312373372.db2.gz CSRVYSSRVGULMS-CQSZACIVSA-N 0 3 346.387 2.782 20 5 EFBDHN Cc1ccc([C@H](CNc2c(C(N)=O)cccc2[N+](=O)[O-])N(C)C)cc1 ZINC000420580121 312373462 /nfs/dbraw/zinc/37/34/62/312373462.db2.gz DPVYVXOGTSPXSL-INIZCTEOSA-N 0 3 342.399 2.717 20 5 EFBDHN CCc1ccccc1[C@@H](N)CNC(=O)c1cccc(OC)c1[N+](=O)[O-] ZINC000423937607 312485054 /nfs/dbraw/zinc/48/50/54/312485054.db2.gz HHWCTRHTDPKOME-HNNXBMFYSA-N 0 3 343.383 2.596 20 5 EFBDHN C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCNCc2ccccc21 ZINC000430959765 312546186 /nfs/dbraw/zinc/54/61/86/312546186.db2.gz DLVCJRKCBZOHNJ-ZDUSSCGKSA-N 0 3 340.383 2.532 20 5 EFBDHN CC(C)COC[C@@H](O)CN[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433144769 312595839 /nfs/dbraw/zinc/59/58/39/312595839.db2.gz NSOICTFJUDVBCN-WMLDXEAASA-N 0 3 336.432 2.940 20 5 EFBDHN CC(C)COC[C@@H](O)CN[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433144770 312595989 /nfs/dbraw/zinc/59/59/89/312595989.db2.gz NSOICTFJUDVBCN-YOEHRIQHSA-N 0 3 336.432 2.940 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N[C@H](CC(N)=O)c1ccccc1 ZINC000449343012 312686251 /nfs/dbraw/zinc/68/62/51/312686251.db2.gz HCWCUSVKEKLLHP-XJKSGUPXSA-N 0 3 327.384 2.732 20 5 EFBDHN CCc1cc(N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)ccn1 ZINC000450542556 312703297 /nfs/dbraw/zinc/70/32/97/312703297.db2.gz HXYUYAVJOAKDOY-UHFFFAOYSA-N 0 3 340.383 2.515 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN[C@@H]3[C@@H]4CCO[C@@H]4C34CCCC4)nc2c1 ZINC000450863043 312760847 /nfs/dbraw/zinc/76/08/47/312760847.db2.gz PROGPKONWGTXGR-VUCTXSBTSA-N 0 3 342.399 2.908 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN[C@@H]3[C@H]4CCO[C@@H]4C34CCCC4)nc2c1 ZINC000450863042 312761110 /nfs/dbraw/zinc/76/11/10/312761110.db2.gz PROGPKONWGTXGR-JLZZUVOBSA-N 0 3 342.399 2.908 20 5 EFBDHN CCC[C@@H](NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C1CCC1 ZINC000453194622 312877814 /nfs/dbraw/zinc/87/78/14/312877814.db2.gz OEKPIHJRZBKEQC-MRXNPFEDSA-N 0 3 340.445 2.927 20 5 EFBDHN C[C@H]1CC[C@H](CNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)O1 ZINC000453635365 312922203 /nfs/dbraw/zinc/92/22/03/312922203.db2.gz USDPLRAPXISLEK-BLLLJJGKSA-N 0 3 330.388 2.652 20 5 EFBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC[C@@H](CN2CCOCC2)C1 ZINC000470169855 313129030 /nfs/dbraw/zinc/12/90/30/313129030.db2.gz LAMXVWRFJAZKDO-FYXHJSOBSA-N 0 3 345.443 2.652 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCN(C[C@@H]2CCOC2)CC1 ZINC000470184820 313130218 /nfs/dbraw/zinc/13/02/18/313130218.db2.gz XRBJDRWRDXFOLF-QMJOVRGKSA-N 0 3 345.443 2.652 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCN(CC(C)(C)O)[C@@H](C)C1 ZINC000470211303 313130556 /nfs/dbraw/zinc/13/05/56/313130556.db2.gz HJEPYSBFBLLSOU-IZNAZMGOSA-N 0 3 347.459 2.775 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1NC(=O)CN[C@](C)(CO)C1CCCCC1 ZINC000471229194 313140858 /nfs/dbraw/zinc/14/08/58/313140858.db2.gz UUHWYPAQKSDPDH-GOSISDBHSA-N 0 3 349.431 2.763 20 5 EFBDHN COc1ccc(-c2ccc(CN3C[C@@H](O)C[C@@H]3C)o2)c([N+](=O)[O-])c1 ZINC000471809595 313162367 /nfs/dbraw/zinc/16/23/67/313162367.db2.gz IOCKMKCPEYJDQB-RYUDHWBXSA-N 0 3 332.356 2.819 20 5 EFBDHN Cc1c(CNC(=O)N(CCN(C)C)C2CCCC2)cccc1[N+](=O)[O-] ZINC000480059925 313278613 /nfs/dbraw/zinc/27/86/13/313278613.db2.gz NWPWBOMWUPFJLM-UHFFFAOYSA-N 0 3 348.447 2.919 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2noc(N3CC[C@@H](N4CCCCC4)C3)n2)cc1 ZINC000486966762 313353187 /nfs/dbraw/zinc/35/31/87/313353187.db2.gz KKYGDLXGAWDOQC-OAHLLOKOSA-N 0 3 343.387 2.709 20 5 EFBDHN COc1ccc(NC(=O)c2ccccc2CN(C)C)cc1[N+](=O)[O-] ZINC000487048082 313361195 /nfs/dbraw/zinc/36/11/95/313361195.db2.gz SDYSNQDTITXQRB-UHFFFAOYSA-N 0 3 329.356 2.917 20 5 EFBDHN CSc1cccc(C(=O)N[C@H](C)C2=CCN(C)CC2)c1[N+](=O)[O-] ZINC000487070450 313363422 /nfs/dbraw/zinc/36/34/22/313363422.db2.gz LQWBOLYRDUSFDW-LLVKDONJSA-N 0 3 335.429 2.697 20 5 EFBDHN O=C(/C=C/c1cccc([N+](=O)[O-])c1)N1CC[C@@H](N2CCCCC2)C1 ZINC000491564989 313765707 /nfs/dbraw/zinc/76/57/07/313765707.db2.gz ZWAMFCKSSSLEGN-IWAYRVGRSA-N 0 3 329.400 2.695 20 5 EFBDHN C[C@H]1CN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)CCN(C2CCC2)C1 ZINC000492805715 314133098 /nfs/dbraw/zinc/13/30/98/314133098.db2.gz ZHOWKWGBHGENED-YYRKOSNBSA-N 0 3 343.427 2.941 20 5 EFBDHN C[C@@H]1C[C@H]1N1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000492922250 314178190 /nfs/dbraw/zinc/17/81/90/314178190.db2.gz MXXFZJISGOHCRB-MLJBMGDYSA-N 0 3 343.427 2.797 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H](c1ccccc1)N(C)C ZINC000494801911 314637330 /nfs/dbraw/zinc/63/73/30/314637330.db2.gz WRNJEYCIIWHQAG-MRXNPFEDSA-N 0 3 343.383 2.636 20 5 EFBDHN C[C@@H](N[C@@H]1CCC[C@H]1OC(F)F)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000503517919 315444309 /nfs/dbraw/zinc/44/43/09/315444309.db2.gz UBYYALIDHHSYEB-OASPWFOLSA-N 0 3 343.330 2.672 20 5 EFBDHN C[C@@H](N[C@@H]1CCC[C@H]1OC(F)F)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000503531013 315444537 /nfs/dbraw/zinc/44/45/37/315444537.db2.gz QIIXKFLQXCINPG-IRUJWGPZSA-N 0 3 343.330 2.672 20 5 EFBDHN C[C@H](C1CCN(C)CC1)N(C)C(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000515115631 315593424 /nfs/dbraw/zinc/59/34/24/315593424.db2.gz ARMHUXXESXBWIG-UONOGXRCSA-N 0 3 333.432 2.887 20 5 EFBDHN CN(C)C[C@H]1CCCCN1C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000520497812 315960864 /nfs/dbraw/zinc/96/08/64/315960864.db2.gz FTNAZJXCDHZQJX-CQSZACIVSA-N 0 3 337.445 2.630 20 5 EFBDHN C[C@H](CNC(=O)NCc1cccc([N+](=O)[O-])c1)N1CCCC[C@@H]1C ZINC000522238000 316082798 /nfs/dbraw/zinc/08/27/98/316082798.db2.gz ZOYJFLWPFKSQQZ-UONOGXRCSA-N 0 3 334.420 2.657 20 5 EFBDHN COC[C@H](N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)C ZINC000541597048 317782339 /nfs/dbraw/zinc/78/23/39/317782339.db2.gz KQXFGEIHHPVPFJ-YGRLFVJLSA-N 0 3 343.811 2.836 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@@H]2CCN(C[C@H]3CCC4(CCCC4)O3)C2)nc1 ZINC000548921389 318157046 /nfs/dbraw/zinc/15/70/46/318157046.db2.gz VGMQWZAXZVGVMB-GDBMZVCRSA-N 0 3 346.431 2.968 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@@H]2CCN(C[C@@H]3CCC4(CCCC4)O3)C2)nc1 ZINC000548921396 318157165 /nfs/dbraw/zinc/15/71/65/318157165.db2.gz VGMQWZAXZVGVMB-ZBFHGGJFSA-N 0 3 346.431 2.968 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2ccc(Cl)cc2)c1 ZINC000549696965 318180040 /nfs/dbraw/zinc/18/00/40/318180040.db2.gz WIBTWCFPRWDFTB-OAHLLOKOSA-N 0 3 336.775 2.778 20 5 EFBDHN Cc1cc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)ccc1F ZINC000550084843 318187363 /nfs/dbraw/zinc/18/73/63/318187363.db2.gz ADTZDMPPHHPIAF-HNNXBMFYSA-N 0 3 334.347 2.572 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])c(C)cc1N[C@@H]1C[C@@H](C)N(C2CC2)C1 ZINC000553448053 318283481 /nfs/dbraw/zinc/28/34/81/318283481.db2.gz MDPKSOSJPHEFHB-VXGBXAGGSA-N 0 3 333.388 2.727 20 5 EFBDHN CNc1ccc(C(=O)N[C@@H](CC(C)C)CN2CCCC2)cc1[N+](=O)[O-] ZINC000556359327 318388225 /nfs/dbraw/zinc/38/82/25/318388225.db2.gz USUKEAFWXKUOBM-HNNXBMFYSA-N 0 3 348.447 2.877 20 5 EFBDHN COc1c(C(=O)Nc2ccccc2CN(C)C)cccc1[N+](=O)[O-] ZINC000562305537 318632966 /nfs/dbraw/zinc/63/29/66/318632966.db2.gz YBSOSYQINJPCDR-UHFFFAOYSA-N 0 3 329.356 2.917 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CNC[C@H](O)CCc1ccccc1 ZINC000565828656 319006240 /nfs/dbraw/zinc/00/62/40/319006240.db2.gz XXRNVZWECPXGNZ-QGZVFWFLSA-N 0 3 330.384 2.687 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@@H](O)CN[C@H]1CSc2ccccc21 ZINC000566116015 319035011 /nfs/dbraw/zinc/03/50/11/319035011.db2.gz MXBSKAXMMMVRAX-JSGCOSHPSA-N 0 3 346.408 2.771 20 5 EFBDHN CN1CCN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1(C)C ZINC000566416371 319072074 /nfs/dbraw/zinc/07/20/74/319072074.db2.gz LEXOUDKCKZMSAB-UHFFFAOYSA-N 0 3 344.415 2.818 20 5 EFBDHN Cc1c(NC(=O)CCN2CC[C@@H](OC(C)C)C2)cccc1[N+](=O)[O-] ZINC000567791453 319211556 /nfs/dbraw/zinc/21/15/56/319211556.db2.gz RWSNSVOICKWTHZ-CQSZACIVSA-N 0 3 335.404 2.731 20 5 EFBDHN CC1(C)CCCN(CCNC(=O)NCc2cccc([N+](=O)[O-])c2)C1 ZINC000569071307 319344287 /nfs/dbraw/zinc/34/42/87/319344287.db2.gz QXLKVZJHRJHQOS-UHFFFAOYSA-N 0 3 334.420 2.516 20 5 EFBDHN CCO[C@@H]1C[C@H](N[C@H]2CCc3c2cccc3[N+](=O)[O-])[C@]12CCCO2 ZINC000570650090 319498360 /nfs/dbraw/zinc/49/83/60/319498360.db2.gz OCWWBNXMDAPGFG-DZJNRPSUSA-N 0 3 332.400 2.898 20 5 EFBDHN CN(C)[C@@H](CNc1ncc([N+](=O)[O-])s1)c1ccc(Cl)cc1 ZINC000572685621 319693939 /nfs/dbraw/zinc/69/39/39/319693939.db2.gz LISZPJRSXYCQJW-NSHDSACASA-N 0 3 326.809 2.841 20 5 EFBDHN CCn1ccnc1[C@H]1OCC[C@@H]1N[C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000575329502 319940505 /nfs/dbraw/zinc/94/05/05/319940505.db2.gz ITWTXWDVQCGVSM-ZOBUZTSGSA-N 0 3 342.399 2.918 20 5 EFBDHN COc1ccc(CN[C@@H]2COc3cc(F)ccc3C2)cc1[N+](=O)[O-] ZINC000575816205 319956250 /nfs/dbraw/zinc/95/62/50/319956250.db2.gz LRRNAJHIXLESCS-AWEZNQCLSA-N 0 3 332.331 2.836 20 5 EFBDHN O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@@H]2C[C@H]2c2cccc(F)c2)c1 ZINC000577055346 320073179 /nfs/dbraw/zinc/07/31/79/320073179.db2.gz LUIWXBFYUGFEON-RYQLBKOJSA-N 0 3 346.358 2.619 20 5 EFBDHN CC(C)N1CCCC[C@@H]1Cn1c(=O)onc1-c1cccc([N+](=O)[O-])c1 ZINC000577848866 320150394 /nfs/dbraw/zinc/15/03/94/320150394.db2.gz KGCFOGDNHDBCGD-OAHLLOKOSA-N 0 3 346.387 2.674 20 5 EFBDHN CC(C)Oc1cc(C(=O)NC[C@@H](C)N2CCCC2)ccc1[N+](=O)[O-] ZINC000578603073 320220433 /nfs/dbraw/zinc/22/04/33/320220433.db2.gz RSKBXEYJJUDOGI-CYBMUJFWSA-N 0 3 335.404 2.596 20 5 EFBDHN Cc1ccc([C@H](C)NC[C@@H](O)COCc2ccco2)cc1[N+](=O)[O-] ZINC000181840323 323253102 /nfs/dbraw/zinc/25/31/02/323253102.db2.gz PZRHUJJGQSGNLR-DZGCQCFKSA-N 0 3 334.372 2.725 20 5 EFBDHN C[C@@H]1Cc2ccccc2CN1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000181912376 323255027 /nfs/dbraw/zinc/25/50/27/323255027.db2.gz MLYFAARCKVCOKM-PBHICJAKSA-N 0 3 342.395 2.781 20 5 EFBDHN O=[N+]([O-])c1ccccc1OC[C@H](O)CN(Cc1ccccc1)C1CC1 ZINC000182203122 323268498 /nfs/dbraw/zinc/26/84/98/323268498.db2.gz HUHUBKBYWRRYJE-QGZVFWFLSA-N 0 3 342.395 2.999 20 5 EFBDHN C[C@H](NC[C@@H](O)COCc1ccccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000296866112 323658337 /nfs/dbraw/zinc/65/83/37/323658337.db2.gz ZEHNVQYEBVMRNE-SUMWQHHRSA-N 0 3 348.374 2.962 20 5 EFBDHN Cn1cncc1CCCN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000579609097 323996608 /nfs/dbraw/zinc/99/66/08/323996608.db2.gz NLAIUHDMIKYYLQ-UHFFFAOYSA-N 0 3 344.415 2.804 20 5 EFBDHN C[C@@H]1CN(CCN[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CCO1 ZINC000580390672 324151381 /nfs/dbraw/zinc/15/13/81/324151381.db2.gz WCDMHQCNQSKTAP-DYVFJYSZSA-N 0 3 333.432 2.628 20 5 EFBDHN COc1ccc(CN2C[C@H](c3cnn(C)c3)C(C)(C)C2)cc1[N+](=O)[O-] ZINC000580782268 324236605 /nfs/dbraw/zinc/23/66/05/324236605.db2.gz BHVGTAQDUQXUJU-OAHLLOKOSA-N 0 3 344.415 2.963 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H](C)N1CCCC1 ZINC000581462528 324381853 /nfs/dbraw/zinc/38/18/53/324381853.db2.gz IRQVPSCYUBTHGZ-GOEBONIOSA-N 0 3 333.432 2.764 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@H]2CCN(Cc3ccc4c[nH]nc4c3)C2)nc1 ZINC000128900930 472510001 /nfs/dbraw/zinc/51/00/01/472510001.db2.gz HWVANTNZZLTQIL-AWEZNQCLSA-N 0 3 338.371 2.553 20 5 EFBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CNC[C@H]2CCCC[C@@H]2O)c1 ZINC000124307711 473230232 /nfs/dbraw/zinc/23/02/32/473230232.db2.gz NKIWHVMHEYTXSL-MFKMUULPSA-N 0 3 330.331 2.837 20 5 EFBDHN O=[N+]([O-])c1ccc(CN2CCC[C@H](c3nnc4n3CCC4)C2)cc1 ZINC000161399592 473232822 /nfs/dbraw/zinc/23/28/22/473232822.db2.gz XFTFDYJPUUXYFH-AWEZNQCLSA-N 0 3 327.388 2.512 20 5 EFBDHN C[C@@H](C(=O)N(C)Cc1ccccc1[N+](=O)[O-])[C@H](N)c1ccccc1 ZINC000095965556 473232787 /nfs/dbraw/zinc/23/27/87/473232787.db2.gz OHLRARAZESRZDZ-DYVFJYSZSA-N 0 3 327.384 2.889 20 5 EFBDHN C[C@H](C(=O)N(C)Cc1ccccc1[N+](=O)[O-])[C@H](N)c1ccccc1 ZINC000095965555 473232830 /nfs/dbraw/zinc/23/28/30/473232830.db2.gz OHLRARAZESRZDZ-GUYCJALGSA-N 0 3 327.384 2.889 20 5 EFBDHN CC1CCN(C[C@H](O)CNc2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000112080963 473241451 /nfs/dbraw/zinc/24/14/51/473241451.db2.gz YSWCYSJSBQMMEE-CQSZACIVSA-N 0 3 344.415 2.648 20 5 EFBDHN O=C(NC[C@@H]1CCCN(Cc2cccs2)C1)c1ccc([N+](=O)[O-])o1 ZINC000140188043 473243158 /nfs/dbraw/zinc/24/31/58/473243158.db2.gz CWVUAHWAPRHZNV-LBPRGKRZSA-N 0 3 349.412 2.891 20 5 EFBDHN Cc1cc(N2CCN(C(C)C)CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000140926472 473249958 /nfs/dbraw/zinc/24/99/58/473249958.db2.gz WOOIJRSAKGQTCR-UHFFFAOYSA-N 0 3 341.415 2.891 20 5 EFBDHN Cc1ccc([C@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]2)N2CCCC2)cc1 ZINC000143254834 473273546 /nfs/dbraw/zinc/27/35/46/473273546.db2.gz GGPGYEAWHFPEEI-KRWDZBQOSA-N 0 3 342.399 2.798 20 5 EFBDHN C[C@H]1CCC[N@H+](CC[N-]c2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000486952188 468015265 /nfs/dbraw/zinc/01/52/65/468015265.db2.gz AEGCLMAAJRVVOV-LBPRGKRZSA-N 0 3 331.376 2.789 20 5 EFBDHN C[C@H]1CCC[N@@H+](CC[N-]c2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000486952188 468015267 /nfs/dbraw/zinc/01/52/67/468015267.db2.gz AEGCLMAAJRVVOV-LBPRGKRZSA-N 0 3 331.376 2.789 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2noc(NC3CCN(CC4CC4)CC3)n2)cc1 ZINC000486967459 468015465 /nfs/dbraw/zinc/01/54/65/468015465.db2.gz NCWAEVQBVTTXGP-UHFFFAOYSA-N 0 3 343.387 2.931 20 5 EFBDHN CN[C@H](CC(C)(C)C)C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000517134367 468072146 /nfs/dbraw/zinc/07/21/46/468072146.db2.gz NGQVHCVXEKYAGV-CQSZACIVSA-N 0 3 345.403 2.948 20 5 EFBDHN COc1cc(CNCCSC(F)(F)F)c([N+](=O)[O-])cc1O ZINC000171128282 473294613 /nfs/dbraw/zinc/29/46/13/473294613.db2.gz LDIHCQRVSIRMDS-UHFFFAOYSA-N 0 3 326.296 2.652 20 5 EFBDHN C[C@H](CCc1ccccc1[N+](=O)[O-])N[C@H](C)C(=O)NCc1ccco1 ZINC000162022738 473295633 /nfs/dbraw/zinc/29/56/33/473295633.db2.gz NTKFTAVOQNKZAJ-ZIAGYGMSSA-N 0 3 345.399 2.803 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1C(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1 ZINC000083025980 473312082 /nfs/dbraw/zinc/31/20/82/473312082.db2.gz WMJZGIHLCWJKBY-HUUCEWRRSA-N 0 3 349.431 2.522 20 5 EFBDHN CSc1ccc(C(=O)N[C@H]2C[C@H](C)N(C3CC3)C2)cc1[N+](=O)[O-] ZINC000177134484 473313283 /nfs/dbraw/zinc/31/32/83/473313283.db2.gz OWEORFDEALYLPJ-JQWIXIFHSA-N 0 3 335.429 2.672 20 5 EFBDHN Cc1c(C(=O)NCCCCN2C[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000083040697 473317046 /nfs/dbraw/zinc/31/70/46/473317046.db2.gz UNYJSLXWKHKROB-OKILXGFUSA-N 0 3 349.431 2.522 20 5 EFBDHN CCC[C@@H]1CN(c2ccc([N+](=O)[O-])c(OC)c2)CCN1CCOC ZINC000162489575 473346594 /nfs/dbraw/zinc/34/65/94/473346594.db2.gz ZEMMVDMQMWNEHF-OAHLLOKOSA-N 0 3 337.420 2.541 20 5 EFBDHN CN(C(=O)c1ccc([N+](=O)[O-])o1)C1CCN(Cc2ccccc2)CC1 ZINC000113094277 473355431 /nfs/dbraw/zinc/35/54/31/473355431.db2.gz JOFOXZSOLKOIRN-UHFFFAOYSA-N 0 3 343.383 2.924 20 5 EFBDHN CC[C@H]1CCCCN1CCNC(=O)c1ccc([N+](=O)[O-])c(OC)c1 ZINC000113198148 473365341 /nfs/dbraw/zinc/36/53/41/473365341.db2.gz AABVJWJSPDMIPF-AWEZNQCLSA-N 0 3 335.404 2.598 20 5 EFBDHN O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1NC[C@@H](O)C(F)(F)F ZINC000616362981 479888954 /nfs/dbraw/zinc/88/89/54/479888954.db2.gz MROCXCDJZRNSQM-ZKYQVNSYSA-N 0 3 332.322 2.819 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN[C@H]3[C@@H]4CCO[C@@H]4C34CCCC4)nc2c1 ZINC000602637972 479441188 /nfs/dbraw/zinc/44/11/88/479441188.db2.gz PROGPKONWGTXGR-ZLIFDBKOSA-N 0 3 342.399 2.908 20 5 EFBDHN O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1NC[C@@H](O)C(F)(F)F ZINC000616362979 479889326 /nfs/dbraw/zinc/88/93/26/479889326.db2.gz MROCXCDJZRNSQM-SCDSUCTJSA-N 0 3 332.322 2.819 20 5 EFBDHN O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc([N+](=O)[O-])o1 ZINC000005603144 471512789 /nfs/dbraw/zinc/51/27/89/471512789.db2.gz VPJFNEDGNLYBTE-UHFFFAOYSA-N 0 3 329.356 2.582 20 5 EFBDHN C[C@@H](NC[C@@H](O)COc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000006603056 471553864 /nfs/dbraw/zinc/55/38/64/471553864.db2.gz XFEQPLYOXMIRKI-MLGOLLRUSA-N 0 3 334.347 2.824 20 5 EFBDHN CN(CCCNC(=O)c1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000009982004 471724554 /nfs/dbraw/zinc/72/45/54/471724554.db2.gz AERWIYLZESROPM-UHFFFAOYSA-N 0 3 327.384 2.847 20 5 EFBDHN O=C(NC1CC1)c1ccc(NC2CCN(C3CC3)CC2)c([N+](=O)[O-])c1 ZINC000014327713 471868682 /nfs/dbraw/zinc/86/86/82/471868682.db2.gz SKFKSSPSZVXNCN-UHFFFAOYSA-N 0 3 344.415 2.526 20 5 EFBDHN Cc1cccc(C(=O)NC[C@H](c2ccccc2)N(C)C)c1[N+](=O)[O-] ZINC000016599009 471942903 /nfs/dbraw/zinc/94/29/03/471942903.db2.gz WOJRJBPOICSLLK-MRXNPFEDSA-N 0 3 327.384 2.936 20 5 EFBDHN Cc1cccc(C(=O)NC[C@@H](c2ccccc2)N(C)C)c1[N+](=O)[O-] ZINC000016599008 471942937 /nfs/dbraw/zinc/94/29/37/471942937.db2.gz WOJRJBPOICSLLK-INIZCTEOSA-N 0 3 327.384 2.936 20 5 EFBDHN Cc1cc(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)ccc1[N+](=O)[O-] ZINC000017794038 471964142 /nfs/dbraw/zinc/96/41/42/471964142.db2.gz GHBWYLIXBMHYPN-QGZVFWFLSA-N 0 3 341.411 2.806 20 5 EFBDHN CN(C)Cc1ccccc1CNC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000018174896 471971205 /nfs/dbraw/zinc/97/12/05/471971205.db2.gz OMIGBBQNSLAOOL-UHFFFAOYSA-N 0 3 328.372 2.978 20 5 EFBDHN CCN(CC)[C@H](CNc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccco1 ZINC000067383280 472026770 /nfs/dbraw/zinc/02/67/70/472026770.db2.gz AOBQZYPPAGCCHS-OAHLLOKOSA-N 0 3 346.387 2.782 20 5 EFBDHN Cc1cccc(C(=O)NCc2ccc(CN(C)C)cc2)c1[N+](=O)[O-] ZINC000023961900 472041315 /nfs/dbraw/zinc/04/13/15/472041315.db2.gz CBSSJDVQPSLTDO-UHFFFAOYSA-N 0 3 327.384 2.895 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)N(C)C2CCN(C(C)C)CC2)c1 ZINC000067544525 472048164 /nfs/dbraw/zinc/04/81/64/472048164.db2.gz NVASSCCJOZTWAI-UHFFFAOYSA-N 0 3 335.404 2.548 20 5 EFBDHN C[C@@H](CNC(=O)NCCc1ccc([N+](=O)[O-])cc1)N1CCCC[C@@H]1C ZINC000054647057 472104877 /nfs/dbraw/zinc/10/48/77/472104877.db2.gz OYFONNBVPLSBNS-GJZGRUSLSA-N 0 3 348.447 2.699 20 5 EFBDHN O=C(CCN1CCc2ccccc2C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000026156199 472125567 /nfs/dbraw/zinc/12/55/67/472125567.db2.gz JIMBDZLECYDLEW-UHFFFAOYSA-N 0 3 325.368 2.982 20 5 EFBDHN Cc1c(C(=O)N2CCC[C@@H]2CN2CCCCC2)cccc1[N+](=O)[O-] ZINC000068134765 472140090 /nfs/dbraw/zinc/14/00/90/472140090.db2.gz PEYGKFOTFCAFAT-OAHLLOKOSA-N 0 3 331.416 2.994 20 5 EFBDHN Cc1ccc(C(=O)N2CCC[C@H]2CN2CCCCC2)cc1[N+](=O)[O-] ZINC000068135284 472140717 /nfs/dbraw/zinc/14/07/17/472140717.db2.gz AABUCPAYCUAMQY-INIZCTEOSA-N 0 3 331.416 2.994 20 5 EFBDHN CN(C)[C@H](CNC(=O)c1ccc([N+](=O)[O-])s1)Cc1ccccc1 ZINC000027583175 472184316 /nfs/dbraw/zinc/18/43/16/472184316.db2.gz DFBHKQOARLWVOR-ZDUSSCGKSA-N 0 3 333.413 2.559 20 5 EFBDHN CCOc1ccc(C(=O)N[C@H](C)CN2CCCCC2)cc1[N+](=O)[O-] ZINC000027748504 472194661 /nfs/dbraw/zinc/19/46/61/472194661.db2.gz JHIAOFHUKWDOKG-CYBMUJFWSA-N 0 3 335.404 2.598 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](C)N1CCCC[C@H]1C ZINC000043085093 472196380 /nfs/dbraw/zinc/19/63/80/472196380.db2.gz UNMLAVZIRQKLDQ-OLZOCXBDSA-N 0 3 335.404 2.596 20 5 EFBDHN Cc1sc(C(=O)NCc2ccc(CN(C)C)cc2)cc1[N+](=O)[O-] ZINC000043731979 472258466 /nfs/dbraw/zinc/25/84/66/472258466.db2.gz GLMWOVQULLQGNA-UHFFFAOYSA-N 0 3 333.413 2.956 20 5 EFBDHN COc1ccc(C(=O)Nc2ccc(CN(C)C)cc2)cc1[N+](=O)[O-] ZINC000029278914 472264547 /nfs/dbraw/zinc/26/45/47/472264547.db2.gz FGWGNWCMOQFBHN-UHFFFAOYSA-N 0 3 329.356 2.917 20 5 EFBDHN O=C(NCCCN1CCc2ccccc2C1)c1ccc([N+](=O)[O-])s1 ZINC000029839203 472299841 /nfs/dbraw/zinc/29/98/41/472299841.db2.gz NIKQMFLMJLGZAY-UHFFFAOYSA-N 0 3 345.424 2.835 20 5 EFBDHN C[C@@H](NC(=O)NC1CCN(C2CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000056382384 472313605 /nfs/dbraw/zinc/31/36/05/472313605.db2.gz GRPZQVJBBPZQMB-GFCCVEGCSA-N 0 3 332.404 2.582 20 5 EFBDHN Cc1nn(C)c(NC[C@@H](c2ccccc2)N2CCCC2)c1[N+](=O)[O-] ZINC000076461397 472350967 /nfs/dbraw/zinc/35/09/67/472350967.db2.gz SQXVINOBEMGEMS-HNNXBMFYSA-N 0 3 329.404 2.886 20 5 EFBDHN CN(C)CCOc1cccc(CNC(=O)c2csc([N+](=O)[O-])c2)c1 ZINC000056891372 472362713 /nfs/dbraw/zinc/36/27/13/472362713.db2.gz UYEDTOSKDYBUCR-UHFFFAOYSA-N 0 3 349.412 2.527 20 5 EFBDHN CCCCN(C)CCNC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000154170591 472397553 /nfs/dbraw/zinc/39/75/53/472397553.db2.gz ITURZCYOWXMYNV-UHFFFAOYSA-N 0 3 330.388 2.605 20 5 EFBDHN CNc1ccc(C(=O)NC[C@H](C)N2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000032730645 472459665 /nfs/dbraw/zinc/45/96/65/472459665.db2.gz JCOWBRAXYZPMKJ-STQMWFEESA-N 0 3 334.420 2.629 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](C)N1CCCC[C@@H]1C ZINC000032733391 472461521 /nfs/dbraw/zinc/46/15/21/472461521.db2.gz UNMLAVZIRQKLDQ-QWHCGFSZSA-N 0 3 335.404 2.596 20 5 EFBDHN CCN(Cc1cccc(F)c1)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000032771647 472466777 /nfs/dbraw/zinc/46/67/77/472466777.db2.gz RMLKFMJQDXCBER-KRWDZBQOSA-N 0 3 348.374 2.996 20 5 EFBDHN C[C@H](CNC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)N(C)C1CC1 ZINC000057716864 472467432 /nfs/dbraw/zinc/46/74/32/472467432.db2.gz HIIOEDKEJPCANG-NEPJUHHUSA-N 0 3 337.445 2.674 20 5 EFBDHN O=[N+]([O-])c1cc(F)c(NC2CCN([C@H]3CCOC3)CC2)c(F)c1 ZINC000089603393 472468794 /nfs/dbraw/zinc/46/87/94/472468794.db2.gz GUIAUSGNVPTUNZ-NSHDSACASA-N 0 3 327.331 2.538 20 5 EFBDHN O=[N+]([O-])c1cc(F)ccc1NC[C@H]1C[C@H](O)CN1Cc1ccccc1 ZINC000089644553 472479002 /nfs/dbraw/zinc/47/90/02/472479002.db2.gz VGKACJPZKQEZEM-CVEARBPZSA-N 0 3 345.374 2.781 20 5 EFBDHN CCCN1CCN(c2cc(C)nc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000057825266 472479738 /nfs/dbraw/zinc/47/97/38/472479738.db2.gz COCSTHHTBWVHKQ-UHFFFAOYSA-N 0 3 341.415 2.892 20 5 EFBDHN CN(C)C[C@@H]1CCCCN1C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000117788829 472479622 /nfs/dbraw/zinc/47/96/22/472479622.db2.gz KYIRZLGLYHGNGO-AWEZNQCLSA-N 0 3 339.823 2.733 20 5 EFBDHN C[C@@H]1SCCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)[C@H]1C ZINC000128671851 472482707 /nfs/dbraw/zinc/48/27/07/472482707.db2.gz SYLIHKHDKAIUQF-QWRGUYRKSA-N 0 3 341.408 2.888 20 5 EFBDHN Cc1ccc(C(=O)NCc2cccc(CN(C)C)c2)cc1[N+](=O)[O-] ZINC000033084070 472494879 /nfs/dbraw/zinc/49/48/79/472494879.db2.gz KCQSFFMVERCKHV-UHFFFAOYSA-N 0 3 327.384 2.895 20 5 EFBDHN Cc1ccc([C@@H](C)NCc2cccc(OCC(N)=O)c2)cc1[N+](=O)[O-] ZINC000128836411 472502466 /nfs/dbraw/zinc/50/24/66/472502466.db2.gz FRMBRUYYBXTKGD-CYBMUJFWSA-N 0 3 343.383 2.618 20 5 EFBDHN COc1ccc([C@@H](CNc2c([N+](=O)[O-])ncn2C)N2CCCC2)cc1 ZINC000070790744 472512935 /nfs/dbraw/zinc/51/29/35/472512935.db2.gz SVVXITWFSCYLPJ-OAHLLOKOSA-N 0 3 345.403 2.586 20 5 EFBDHN CC(C)(NCCOc1cccc([N+](=O)[O-])c1)C(=O)NCC1CCCC1 ZINC000155184017 472517816 /nfs/dbraw/zinc/51/78/16/472517816.db2.gz IXZVKYPCJIFESB-UHFFFAOYSA-N 0 3 349.431 2.648 20 5 EFBDHN O=C(NCC1CCN(c2ccncc2)CC1)c1ccccc1[N+](=O)[O-] ZINC000070928493 472524845 /nfs/dbraw/zinc/52/48/45/472524845.db2.gz HDHSDXJMTUWLIU-UHFFFAOYSA-N 0 3 340.383 2.636 20 5 EFBDHN O=[N+]([O-])c1cc(CN(CCO)C2CCCCC2)c2c(c1)COCO2 ZINC000071081435 472539631 /nfs/dbraw/zinc/53/96/31/472539631.db2.gz BGGPHUXWXIHSIV-UHFFFAOYSA-N 0 3 336.388 2.588 20 5 EFBDHN CN(C)c1cccc(CN(C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000089921819 472546557 /nfs/dbraw/zinc/54/65/57/472546557.db2.gz FNOAAYLARLSFRP-GOSISDBHSA-N 0 3 329.400 2.826 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[C@@H](OCC(C)C)C1 ZINC000119831008 472587632 /nfs/dbraw/zinc/58/76/32/472587632.db2.gz ACKWFRNKPQNZAF-MRXNPFEDSA-N 0 3 349.431 2.979 20 5 EFBDHN CN(C)Cc1cccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2F)c1 ZINC000130423450 472604799 /nfs/dbraw/zinc/60/47/99/472604799.db2.gz BYLVORFSZXFFQY-UHFFFAOYSA-N 0 3 331.347 2.977 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)CCN1CCCC1 ZINC000103119574 472611886 /nfs/dbraw/zinc/61/18/86/472611886.db2.gz DHXYZIHIOWTBFZ-CYBMUJFWSA-N 0 3 337.445 2.630 20 5 EFBDHN O=C1CCCCN1CC1CCN(CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000071912002 472616627 /nfs/dbraw/zinc/61/66/27/472616627.db2.gz BRVBKOHVBLKSDE-UHFFFAOYSA-N 0 3 345.443 2.862 20 5 EFBDHN CN(C)[C@@H](CNc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000059394190 472625050 /nfs/dbraw/zinc/62/50/50/472625050.db2.gz VPUKFMCTYJOJHD-INIZCTEOSA-N 0 3 346.362 2.548 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H](C(C)C)N1CCOCC1 ZINC000120092922 472629481 /nfs/dbraw/zinc/62/94/81/472629481.db2.gz JMHVACQSORKCQO-YJBOKZPZSA-N 0 3 335.448 2.911 20 5 EFBDHN C[C@H](NCCn1cc([N+](=O)[O-])cn1)c1cccc(OC(F)F)c1 ZINC000090538941 472632193 /nfs/dbraw/zinc/63/21/93/472632193.db2.gz XELVLZQPTMQKQU-JTQLQIEISA-N 0 3 326.303 2.744 20 5 EFBDHN CC[C@@H]1c2ccccc2CCN1CCn1cc([N+](=O)[O-])ccc1=O ZINC000090549327 472632894 /nfs/dbraw/zinc/63/28/94/472632894.db2.gz NKIUKKUDCOTLRE-QGZVFWFLSA-N 0 3 327.384 2.766 20 5 EFBDHN C[C@H]1CN(CCn2cc([N+](=O)[O-])ccc2=O)CC[C@@H]1c1ccccc1 ZINC000090550748 472633489 /nfs/dbraw/zinc/63/34/89/472633489.db2.gz MJSQNKNSHXRRLP-YJBOKZPZSA-N 0 3 341.411 2.882 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCCN2CCc3ccccc3[C@@H]2CO)cc1 ZINC000130888323 472634630 /nfs/dbraw/zinc/63/46/30/472634630.db2.gz VQOQISSJBQUNKW-IBGZPJMESA-N 0 3 342.395 2.955 20 5 EFBDHN C[C@H]1CCCN(CCNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000047145546 472661398 /nfs/dbraw/zinc/66/13/98/472661398.db2.gz RQPVWKXKLXRXEI-NSHDSACASA-N 0 3 325.796 2.710 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(C[C@@H](C)O)C1CCCCC1 ZINC000072600480 472684019 /nfs/dbraw/zinc/68/40/19/472684019.db2.gz WZTDBLXKAYCDCO-CQSZACIVSA-N 0 3 349.431 2.857 20 5 EFBDHN Cc1n[nH]c(C)c1[C@@H]1CCCN1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000091081277 472698196 /nfs/dbraw/zinc/69/81/96/472698196.db2.gz WFBOAUCKXGNQFW-HOTGVXAUSA-N 0 3 330.388 2.805 20 5 EFBDHN CCc1ccc(C(=O)N(CCN(C)C)Cc2ccco2)cc1[N+](=O)[O-] ZINC000156398652 472700854 /nfs/dbraw/zinc/70/08/54/472700854.db2.gz YIZUEYBEHAAOFU-UHFFFAOYSA-N 0 3 345.399 2.954 20 5 EFBDHN C[C@H]1CCN(CCOc2ccccc2[N+](=O)[O-])C[C@@H]1n1ccnc1 ZINC000156506658 472716014 /nfs/dbraw/zinc/71/60/14/472716014.db2.gz VFXVHHKCGPYSEX-HOCLYGCPSA-N 0 3 330.388 2.753 20 5 EFBDHN C[C@H]1CCN(CCOc2cccc([N+](=O)[O-])c2)C[C@@H]1n1ccnc1 ZINC000156530319 472719750 /nfs/dbraw/zinc/71/97/50/472719750.db2.gz MNUJDIUFHUCQNK-YOEHRIQHSA-N 0 3 330.388 2.753 20 5 EFBDHN CCCNC(=O)C1(NCCOc2cccc([N+](=O)[O-])c2)CCCCC1 ZINC000078655991 472747950 /nfs/dbraw/zinc/74/79/50/472747950.db2.gz BCIHZHFXCWCJKD-UHFFFAOYSA-N 0 3 349.431 2.792 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)NCC(C)(C)N2CCC[C@H](C)C2)c1 ZINC000063097816 472754283 /nfs/dbraw/zinc/75/42/83/472754283.db2.gz JGIPLVODFKUHHE-ZDUSSCGKSA-N 0 3 349.431 2.844 20 5 EFBDHN C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000120925040 472769223 /nfs/dbraw/zinc/76/92/23/472769223.db2.gz QHSAYQKWIHJYNJ-ABAIWWIYSA-N 0 3 339.823 2.589 20 5 EFBDHN C[C@H]1C[C@@H](Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)CN1C1CC1 ZINC000133520815 472813112 /nfs/dbraw/zinc/81/31/12/472813112.db2.gz FMYFHCFLFHOEIJ-CMPLNLGQSA-N 0 3 330.388 2.517 20 5 EFBDHN CN(Cc1ccc(Br)c([N+](=O)[O-])c1)C[C@H]1CCC[C@@H]1O ZINC000091899063 472823797 /nfs/dbraw/zinc/82/37/97/472823797.db2.gz CGCLJSKNKYQSLR-RISCZKNCSA-N 0 3 343.221 2.950 20 5 EFBDHN CN(C)C[C@@H]1CN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)CCO1 ZINC000133672893 472829750 /nfs/dbraw/zinc/82/97/50/472829750.db2.gz FZERDYVOVZROMD-CQSZACIVSA-N 0 3 337.420 2.539 20 5 EFBDHN CCN(CCNC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)C1CC1 ZINC000121451813 472853495 /nfs/dbraw/zinc/85/34/95/472853495.db2.gz VWPRCALNEJVQDA-UHFFFAOYSA-N 0 3 346.431 2.753 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CCC(c3nc4ccccc4[nH]3)CC2)c1 ZINC000157965378 472879047 /nfs/dbraw/zinc/87/90/47/472879047.db2.gz IYNYNGVFZJYBRJ-UHFFFAOYSA-N 0 3 340.387 2.547 20 5 EFBDHN C[C@@H](CNC(=O)NCCc1ccccc1[N+](=O)[O-])N1CCC(C)CC1 ZINC000073897735 472897331 /nfs/dbraw/zinc/89/73/31/472897331.db2.gz KOBJRXMLRWFOPH-HNNXBMFYSA-N 0 3 348.447 2.557 20 5 EFBDHN CCN(Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C[C@@H]1CCCO1 ZINC000092406807 472908170 /nfs/dbraw/zinc/90/81/70/472908170.db2.gz QCHRUQXECSPUCX-KRWDZBQOSA-N 0 3 344.415 2.996 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CCCCC[C@H]2C[C@@H](O)c2ccco2)n1 ZINC000121841518 472927848 /nfs/dbraw/zinc/92/78/48/472927848.db2.gz PKLIWKHQQAJDEI-LSDHHAIUSA-N 0 3 348.403 2.753 20 5 EFBDHN CC(C)NC(=O)c1ccc(NCCN2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000079914664 472940537 /nfs/dbraw/zinc/94/05/37/472940537.db2.gz QSHNAURRUMBGRI-CQSZACIVSA-N 0 3 348.447 2.877 20 5 EFBDHN Cc1cc([N+](=O)[O-])cnc1NCc1ccccc1OCCN(C)C ZINC000092627289 472948354 /nfs/dbraw/zinc/94/83/54/472948354.db2.gz KZMHCUZKLYEGFS-UHFFFAOYSA-N 0 3 330.388 2.851 20 5 EFBDHN CCCNC(=O)[C@@H]1CCCN(C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000092733855 472974080 /nfs/dbraw/zinc/97/40/80/472974080.db2.gz UKYABIPMSAQKHH-CDVVCGDMSA-N 0 3 331.416 2.846 20 5 EFBDHN CC(C)CN(CCN(C)C)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000134850037 472976757 /nfs/dbraw/zinc/97/67/57/472976757.db2.gz SNXOITGWZXMYFH-UHFFFAOYSA-N 0 3 327.812 2.908 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000134904956 472986978 /nfs/dbraw/zinc/98/69/78/472986978.db2.gz GRZBEZHNBWFELZ-ZDUSSCGKSA-N 0 3 325.796 2.852 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCN1CC[C@H]2[C@H](CCCN2C2CC2)C1 ZINC000134913370 472987477 /nfs/dbraw/zinc/98/74/77/472987477.db2.gz HODWYJOKSHEMQQ-WBVHZDCISA-N 0 3 345.443 2.922 20 5 EFBDHN COc1cc(C(=O)NCc2ccccc2CN(C)C)ccc1[N+](=O)[O-] ZINC000159149850 473002985 /nfs/dbraw/zinc/00/29/85/473002985.db2.gz ILPXZIWQYPDYAC-UHFFFAOYSA-N 0 3 343.383 2.595 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)C(C1CC1)C1CC1 ZINC000050989626 473016039 /nfs/dbraw/zinc/01/60/39/473016039.db2.gz DHCQLYHQQNGCOU-UHFFFAOYSA-N 0 3 333.388 2.662 20 5 EFBDHN COc1ccc(NC(=O)CN(C)C(C2CC2)C2CC2)c([N+](=O)[O-])c1 ZINC000050989345 473016975 /nfs/dbraw/zinc/01/69/75/473016975.db2.gz RWBWGAMIYVZTBP-UHFFFAOYSA-N 0 3 333.388 2.662 20 5 EFBDHN O=C(CN1CC[C@@H]2CCCC[C@@H]21)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000159600474 473042880 /nfs/dbraw/zinc/04/28/80/473042880.db2.gz CGNLNEYEXNPAMF-BBRMVZONSA-N 0 3 329.400 2.748 20 5 EFBDHN CN1CCC[C@@H]1CNC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000051383495 473045800 /nfs/dbraw/zinc/04/58/00/473045800.db2.gz ADUNIULMLPNIIQ-CYBMUJFWSA-N 0 3 346.412 2.542 20 5 EFBDHN O=C(NCCN1CCCC1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000051468364 473051272 /nfs/dbraw/zinc/05/12/72/473051272.db2.gz VUCBIRDKTWOVGX-UHFFFAOYSA-N 0 3 346.412 2.544 20 5 EFBDHN Cc1cc(N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)ncc1[N+](=O)[O-] ZINC000074746546 473055926 /nfs/dbraw/zinc/05/59/26/473055926.db2.gz MBHAJJZHKIMBEK-GASCZTMLSA-N 0 3 348.447 2.624 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)N(CCN(C)C)CC(C)C ZINC000122807735 473060770 /nfs/dbraw/zinc/06/07/70/473060770.db2.gz MRYDJCPUHYZURW-UHFFFAOYSA-N 0 3 338.408 2.655 20 5 EFBDHN C[C@H]1C[C@@H](N(C)C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CCN1C ZINC000135655180 473104166 /nfs/dbraw/zinc/10/41/66/473104166.db2.gz IVGAUQYVYJMNMA-JSGCOSHPSA-N 0 3 344.415 2.560 20 5 EFBDHN O=C(CCN1CCC[C@@H](c2ncc[nH]2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000080961631 473113433 /nfs/dbraw/zinc/11/34/33/473113433.db2.gz YZKRVBPTMXEGNJ-CYBMUJFWSA-N 0 3 343.387 2.526 20 5 EFBDHN CN(Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)CC1(O)CCCC1 ZINC000093502974 473114557 /nfs/dbraw/zinc/11/45/57/473114557.db2.gz QVDLZIIPQCEGKU-UHFFFAOYSA-N 0 3 344.415 2.732 20 5 EFBDHN C[C@@H]1C[C@H](N(C)C(=O)/C=C/c2ccc(F)cc2[N+](=O)[O-])CCN1C ZINC000123232423 473114680 /nfs/dbraw/zinc/11/46/80/473114680.db2.gz CSDZZNNSSDMMRR-QKOWSDGPSA-N 0 3 335.379 2.688 20 5 EFBDHN COCc1ccc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000093534375 473115862 /nfs/dbraw/zinc/11/58/62/473115862.db2.gz OCUKOVJBSMVFOS-INIZCTEOSA-N 0 3 342.399 2.823 20 5 EFBDHN C[C@H](c1cccc(O)c1)N(C)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000109782452 473119767 /nfs/dbraw/zinc/11/97/67/473119767.db2.gz VXKZQWKGLYKZDO-DYVFJYSZSA-N 0 3 346.383 2.733 20 5 EFBDHN CN(Cc1ccccc1)[C@@H]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000081125898 473153018 /nfs/dbraw/zinc/15/30/18/473153018.db2.gz BIGABNRLYKTHOC-GOSISDBHSA-N 0 3 339.395 2.941 20 5 EFBDHN O=C1C[C@H](c2ccccc2)N(CCc2ccc([N+](=O)[O-])cc2)CCN1 ZINC000052835593 473153816 /nfs/dbraw/zinc/15/38/16/473153816.db2.gz IKCIIVWJMRTRDU-GOSISDBHSA-N 0 3 339.395 2.701 20 5 EFBDHN COC[C@@H](N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000136652284 473170377 /nfs/dbraw/zinc/17/03/77/473170377.db2.gz OYVFUTHLFSJZRU-YMTOWFKASA-N 0 3 341.795 2.590 20 5 EFBDHN COC[C@H]1CCCCN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC000613548314 480034079 /nfs/dbraw/zinc/03/40/79/480034079.db2.gz LCGBGYORLMZUIB-ZDUSSCGKSA-N 0 3 336.388 2.615 20 5 EFBDHN COC[C@@H]1CCCCN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC000613548313 480034122 /nfs/dbraw/zinc/03/41/22/480034122.db2.gz LCGBGYORLMZUIB-CYBMUJFWSA-N 0 3 336.388 2.615 20 5 EFBDHN CC(=O)Nc1cccc([C@H](C)NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000136914330 473184277 /nfs/dbraw/zinc/18/42/77/473184277.db2.gz ZPZRIJVNXPCZCW-SGTLLEGYSA-N 0 3 343.383 2.937 20 5 EFBDHN Cn1ccnc1C[C@H]1CCCN(CCOc2ccccc2[N+](=O)[O-])C1 ZINC000123838266 473192063 /nfs/dbraw/zinc/19/20/63/473192063.db2.gz XQAMOWRTLQBLJS-OAHLLOKOSA-N 0 3 344.415 2.662 20 5 EFBDHN O=C1CC[C@@H]2CN(CCc3ccc([N+](=O)[O-])cc3)CC[C@H]2N1C1CC1 ZINC000125382595 473402341 /nfs/dbraw/zinc/40/23/41/473402341.db2.gz RUHKNSIRJNKLDX-CRAIPNDOSA-N 0 3 343.427 2.613 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000177683192 473416978 /nfs/dbraw/zinc/41/69/78/473416978.db2.gz MVKCHJWGONZPIP-CABCVRRESA-N 0 3 332.404 2.994 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)CN2CCCCCC2)c1 ZINC000185417758 473420697 /nfs/dbraw/zinc/42/06/97/473420697.db2.gz OTFDYQXFMYZPHS-CYBMUJFWSA-N 0 3 335.404 2.598 20 5 EFBDHN CCN1CCC(NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1 ZINC000125600430 473432346 /nfs/dbraw/zinc/43/23/46/473432346.db2.gz ZXSHXADLFFKAJS-UHFFFAOYSA-N 0 3 345.321 2.828 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)/C=C/c1ccccc1[N+](=O)[O-] ZINC000177782775 473433708 /nfs/dbraw/zinc/43/37/08/473433708.db2.gz KIDRHDWFRHSDEZ-ZHANPKHBSA-N 0 3 329.400 2.693 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000177781990 473434267 /nfs/dbraw/zinc/43/42/67/473434267.db2.gz UUVMIBAUOXZGRQ-UKMLVYKYSA-N 0 3 329.400 2.693 20 5 EFBDHN CC(C)CN(C(=O)c1ccc([N+](=O)[O-])cc1F)C1CCN(C)CC1 ZINC000114383547 473458276 /nfs/dbraw/zinc/45/82/76/473458276.db2.gz HCKQFPWLCHHXJE-UHFFFAOYSA-N 0 3 337.395 2.926 20 5 EFBDHN O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCC[C@H](N2CCCC2)C1 ZINC000126147841 473492156 /nfs/dbraw/zinc/49/21/56/473492156.db2.gz GISNDVJIKLWWTH-ZDUSSCGKSA-N 0 3 337.807 2.949 20 5 EFBDHN CC[C@H](N[C@@H](C(=O)N1CCOCC1)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000164952663 473503231 /nfs/dbraw/zinc/50/32/31/473503231.db2.gz ZIXOBQGGHGDLAX-DLBZAZTESA-N 0 3 349.431 2.519 20 5 EFBDHN CCC(CC)N(CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)C1CC1 ZINC000165345481 473510624 /nfs/dbraw/zinc/51/06/24/473510624.db2.gz SJDMWMQWYOQHKO-UHFFFAOYSA-N 0 3 349.387 2.915 20 5 EFBDHN COc1cc(C(=O)N(CCN(C)C)CC(C)C)cc([N+](=O)[O-])c1C ZINC000191279312 473522806 /nfs/dbraw/zinc/52/28/06/473522806.db2.gz RCFMSWFQASUVRQ-UHFFFAOYSA-N 0 3 337.420 2.572 20 5 EFBDHN O=[N+]([O-])c1ccccc1CN1CCC[C@H](c2nnc(C3CC3)[nH]2)C1 ZINC000152114721 473526371 /nfs/dbraw/zinc/52/63/71/473526371.db2.gz NYGYEHXDURDZBY-AWEZNQCLSA-N 0 3 327.388 2.970 20 5 EFBDHN O=[N+]([O-])c1ccccc1CN1CCC[C@H](c2nc(C3CC3)n[nH]2)C1 ZINC000152114721 473526375 /nfs/dbraw/zinc/52/63/75/473526375.db2.gz NYGYEHXDURDZBY-AWEZNQCLSA-N 0 3 327.388 2.970 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000191569947 473555352 /nfs/dbraw/zinc/55/53/52/473555352.db2.gz XMVKFXSZHIMSMA-AWEZNQCLSA-N 0 3 335.404 2.516 20 5 EFBDHN CCC[C@@H](N[C@H](C)CCS(C)(=O)=O)c1cccc([N+](=O)[O-])c1 ZINC000127307802 473598117 /nfs/dbraw/zinc/59/81/17/473598117.db2.gz MRRMGXQUKBYFCS-IUODEOHRSA-N 0 3 328.434 2.849 20 5 EFBDHN O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCC[C@H]1CN1CCCC1 ZINC000172511347 473628643 /nfs/dbraw/zinc/62/86/43/473628643.db2.gz GGAOXDIPAYFWDZ-AWEZNQCLSA-N 0 3 337.807 2.949 20 5 EFBDHN CC(C)C[C@H]1OCCC[C@@H]1NCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000186340073 473655199 /nfs/dbraw/zinc/65/51/99/473655199.db2.gz RSTAYKLOAQVTEM-GOEBONIOSA-N 0 3 335.404 2.717 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1OC[C@H](O)CN(C)Cc1ccccc1 ZINC000154016245 473659280 /nfs/dbraw/zinc/65/92/80/473659280.db2.gz JMXCBSWFWHBPQE-QGZVFWFLSA-N 0 3 330.384 2.775 20 5 EFBDHN CC(C)CN1CCCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])s1 ZINC000154102947 473667720 /nfs/dbraw/zinc/66/77/20/473667720.db2.gz IEUYJPZRXQQFSX-LBPRGKRZSA-N 0 3 325.434 2.897 20 5 EFBDHN C[C@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)[C@H](c1ccccc1)N(C)C ZINC000186496854 473682069 /nfs/dbraw/zinc/68/20/69/473682069.db2.gz QCFCJODTXAVOMO-YVEFUNNKSA-N 0 3 342.399 2.598 20 5 EFBDHN CCOc1ccc([C@H](C)NCCNC(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000179395497 473684442 /nfs/dbraw/zinc/68/44/42/473684442.db2.gz XFSILSXUIFTOBH-LBPRGKRZSA-N 0 3 347.371 2.667 20 5 EFBDHN CSc1cccc(C(=O)N(C)[C@H]2CCN(C)C[C@H]2C)c1[N+](=O)[O-] ZINC000186570391 473691667 /nfs/dbraw/zinc/69/16/67/473691667.db2.gz LYJNBCCRVUJYOO-YPMHNXCESA-N 0 3 337.445 2.729 20 5 EFBDHN CC(C)CN1CCO[C@@H](CN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000192610938 473696458 /nfs/dbraw/zinc/69/64/58/473696458.db2.gz PKWKVCIVIAJYOG-PKOBYXMFSA-N 0 3 347.459 2.919 20 5 EFBDHN C[C@H]1CCCC[C@@H]1N(C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000192632111 473698111 /nfs/dbraw/zinc/69/81/11/473698111.db2.gz NFFXHKXVLGHQKD-BBRMVZONSA-N 0 3 331.416 2.994 20 5 EFBDHN COc1cccc([C@@H](CNc2cc(N)ccc2[N+](=O)[O-])N(C)C)c1 ZINC000192765046 473720101 /nfs/dbraw/zinc/72/01/01/473720101.db2.gz UCFQBXIVMKNEAU-QGZVFWFLSA-N 0 3 330.388 2.900 20 5 EFBDHN O=C(C1CCN(C2CC2)CC1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000192766151 473721043 /nfs/dbraw/zinc/72/10/43/473721043.db2.gz HMRYVBDAJGQYOM-UHFFFAOYSA-N 0 3 343.427 2.960 20 5 EFBDHN CC(=O)c1cc([N+](=O)[O-])ccc1NCCCN1CCCO[C@H](C)C1 ZINC000287680544 473732708 /nfs/dbraw/zinc/73/27/08/473732708.db2.gz JLKMWMGPFQQSRR-CYBMUJFWSA-N 0 3 335.404 2.710 20 5 EFBDHN CC1(C)CN(CCN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)CCO1 ZINC000192831890 473734217 /nfs/dbraw/zinc/73/42/17/473734217.db2.gz DVTNVPXFRNUZBO-KRWDZBQOSA-N 0 3 333.432 2.673 20 5 EFBDHN Cc1ccc(CN(C)C[C@H](O)COc2ccccc2[N+](=O)[O-])cc1 ZINC000193315182 473780505 /nfs/dbraw/zinc/78/05/05/473780505.db2.gz AGFUFFAOBXMFCU-INIZCTEOSA-N 0 3 330.384 2.775 20 5 EFBDHN Cc1ccc(CN(C)C[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1 ZINC000193315196 473781202 /nfs/dbraw/zinc/78/12/02/473781202.db2.gz AGFUFFAOBXMFCU-MRXNPFEDSA-N 0 3 330.384 2.775 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCN(CC3CCCC3)C2)c1 ZINC000173259540 473783961 /nfs/dbraw/zinc/78/39/61/473783961.db2.gz IRJYGIDGAVTZMR-HNNXBMFYSA-N 0 3 331.416 2.898 20 5 EFBDHN Cc1c(CN2CC[C@H]3[C@@H](CCC(=O)N3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000246282924 473815123 /nfs/dbraw/zinc/81/51/23/473815123.db2.gz NVFFJICULGKUOK-YJBOKZPZSA-N 0 3 343.427 2.879 20 5 EFBDHN C[C@H](NCCN1C(=O)c2ccccc2C1=O)c1cccc([N+](=O)[O-])c1 ZINC000173357943 473815230 /nfs/dbraw/zinc/81/52/30/473815230.db2.gz BNNWJPRMKKNZND-LBPRGKRZSA-N 0 3 339.351 2.542 20 5 EFBDHN C[C@H](CCN1CCN(C)CC1)Nc1ccc([N+](=O)[O-])c2cnccc12 ZINC000274433205 473821280 /nfs/dbraw/zinc/82/12/80/473821280.db2.gz FHHQPYIJTXEERM-CQSZACIVSA-N 0 3 343.431 2.581 20 5 EFBDHN C[C@H]1CCCN(CCNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1 ZINC000193970472 473824698 /nfs/dbraw/zinc/82/46/98/473824698.db2.gz IHUBSOVCQSVKNV-LBPRGKRZSA-N 0 3 332.404 2.623 20 5 EFBDHN COc1ccc(CN[C@H](C)CNC(=O)OC(C)(C)C)cc1[N+](=O)[O-] ZINC000274451318 473829180 /nfs/dbraw/zinc/82/91/80/473829180.db2.gz WEDOGJDJJMSYEA-LLVKDONJSA-N 0 3 339.392 2.606 20 5 EFBDHN CN1CCN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)Cc2ccccc21 ZINC000269648106 473849907 /nfs/dbraw/zinc/84/99/07/473849907.db2.gz FPQPRIWNQPGWCU-GOSISDBHSA-N 0 3 327.384 2.580 20 5 EFBDHN COCCN(CCc1ccccc1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000269649128 473852056 /nfs/dbraw/zinc/85/20/56/473852056.db2.gz LRZURHBAEZOJPM-LJQANCHMSA-N 0 3 344.411 2.819 20 5 EFBDHN O=[N+]([O-])c1cc(F)c(NCC2(N3CCCC3)CCOCC2)c(F)c1 ZINC000269678360 473857629 /nfs/dbraw/zinc/85/76/29/473857629.db2.gz ZGHQKXTUBFYONL-UHFFFAOYSA-N 0 3 341.358 2.930 20 5 EFBDHN CCn1c(C)nc([N+](=O)[O-])c1NC[C@H](c1ccc(F)cc1)N(C)C ZINC000288185209 473869631 /nfs/dbraw/zinc/86/96/31/473869631.db2.gz RKRIXFRGJRZDEP-CQSZACIVSA-N 0 3 335.383 2.974 20 5 EFBDHN C[C@@H](NC[C@H](O)COCc1ccccc1F)c1cccc([N+](=O)[O-])c1 ZINC000180443730 473879370 /nfs/dbraw/zinc/87/93/70/473879370.db2.gz FQTNOOAVONOHKR-DYVFJYSZSA-N 0 3 348.374 2.962 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCN1CC[C@H]2[C@@H](CCCN2C2CC2)C1 ZINC000246499951 473882171 /nfs/dbraw/zinc/88/21/71/473882171.db2.gz HODWYJOKSHEMQQ-RDJZCZTQSA-N 0 3 345.443 2.922 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](N3CCCC3)C[C@@H]2C)c1 ZINC000288264780 473891987 /nfs/dbraw/zinc/89/19/87/473891987.db2.gz GQROWFNNBQNNEX-KBPBESRZSA-N 0 3 347.415 2.692 20 5 EFBDHN CS[C@@H]1CN(c2ncc(Cl)cc2[N+](=O)[O-])C[C@H]1N1CCCC1 ZINC000274634962 473904275 /nfs/dbraw/zinc/90/42/75/473904275.db2.gz CXIGUIKKXAKKFQ-CHWSQXEVSA-N 0 3 342.852 2.659 20 5 EFBDHN C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)c1cc(F)c([N+](=O)[O-])cc1F ZINC000288360217 473920187 /nfs/dbraw/zinc/92/01/87/473920187.db2.gz KOTXAZNREBNRGA-GHMZBOCLSA-N 0 3 339.342 2.572 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C/CN[C@H](CO)C[C@H](O)c1ccccc1 ZINC000269934065 473923521 /nfs/dbraw/zinc/92/35/21/473923521.db2.gz NRUQSHUOWVFTEN-HXLFFGMLSA-N 0 3 342.395 2.682 20 5 EFBDHN CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCN(C)C1 ZINC000180811984 473970828 /nfs/dbraw/zinc/97/08/28/473970828.db2.gz RTTNVGYEZPNHAQ-LBPRGKRZSA-N 0 3 337.445 2.777 20 5 EFBDHN C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000288560595 473982212 /nfs/dbraw/zinc/98/22/12/473982212.db2.gz WFCIUTILTCCGQD-DGCLKSJQSA-N 0 3 337.807 2.947 20 5 EFBDHN C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000288582858 473988976 /nfs/dbraw/zinc/98/89/76/473988976.db2.gz XNUFRDUVDSQIQN-VXGBXAGGSA-N 0 3 337.807 2.947 20 5 EFBDHN CC(C)Oc1ccc([C@H](CNc2c([N+](=O)[O-])ncn2C)N(C)C)cc1 ZINC000288591476 473992786 /nfs/dbraw/zinc/99/27/86/473992786.db2.gz SKSAIFWRSQKXDG-HNNXBMFYSA-N 0 3 347.419 2.830 20 5 EFBDHN O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CC[C@@H](N2CCCCC2)C1 ZINC000264462251 474001034 /nfs/dbraw/zinc/00/10/34/474001034.db2.gz JEFQTYIMJWJVGW-CYBMUJFWSA-N 0 3 337.807 2.949 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@H](CCO)C1CCCCC1 ZINC000181504142 474042274 /nfs/dbraw/zinc/04/22/74/474042274.db2.gz KHMFZAWJFIUBKV-QGZVFWFLSA-N 0 3 349.431 2.763 20 5 EFBDHN O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N1CC[C@H](N2CCCCC2)C1 ZINC000264575939 474045827 /nfs/dbraw/zinc/04/58/27/474045827.db2.gz INUMWBIUOQZDGF-NADMHLTPSA-N 0 3 329.400 2.695 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)C2CCN(C(C)C)CC2)c1 ZINC000282390080 474047407 /nfs/dbraw/zinc/04/74/07/474047407.db2.gz BSLSZZAUSQEFQM-UHFFFAOYSA-N 0 3 349.431 2.938 20 5 EFBDHN O=C(CSc1ccc([N+](=O)[O-])cc1)N1CC[C@@H](N2CCCCC2)C1 ZINC000264590562 474050228 /nfs/dbraw/zinc/05/02/28/474050228.db2.gz WCLIBUZNQUGAHA-OAHLLOKOSA-N 0 3 349.456 2.774 20 5 EFBDHN CC(C)N1CCCN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CC1 ZINC000270300741 474062653 /nfs/dbraw/zinc/06/26/53/474062653.db2.gz OCOGFZTYHJORCO-UHFFFAOYSA-N 0 3 344.415 2.561 20 5 EFBDHN CNC(=O)c1ccc(CN(C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000282445840 474068706 /nfs/dbraw/zinc/06/87/06/474068706.db2.gz LKFJINZYCWRLBO-UHFFFAOYSA-N 0 3 327.384 2.629 20 5 EFBDHN C[C@H]1CN(C)CC[C@H]1N(C)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000247148524 474075656 /nfs/dbraw/zinc/07/56/56/474075656.db2.gz ABJRHMVHGSZDGH-IINYFYTJSA-N 0 3 325.796 2.660 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCCN2CCC[C@@H]2[C@@H](O)C(F)(F)F)cc1 ZINC000264679173 474085505 /nfs/dbraw/zinc/08/55/05/474085505.db2.gz CALYOCMJOBBPPS-ZIAGYGMSSA-N 0 3 348.321 2.751 20 5 EFBDHN Cn1cccc1[C@H]1CCCN1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182043884 474087023 /nfs/dbraw/zinc/08/70/23/474087023.db2.gz MMJBCWIEZYNKSP-GOEBONIOSA-N 0 3 345.399 2.510 20 5 EFBDHN CCN1CCN(c2cccc(Nc3cccnc3[N+](=O)[O-])c2)CC1 ZINC000613704810 480084624 /nfs/dbraw/zinc/08/46/24/480084624.db2.gz SYONAIKLPJKUME-UHFFFAOYSA-N 0 3 327.388 2.875 20 5 EFBDHN CS[C@@H]1CN(c2ccc([N+](=O)[O-])c3cnccc32)C[C@H]1N(C)C ZINC000270399460 474104646 /nfs/dbraw/zinc/10/46/46/474104646.db2.gz UZVQLSFOQYKCME-HZPDHXFCSA-N 0 3 332.429 2.625 20 5 EFBDHN CO[C@H]1CCCC[C@@H]1NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000275209620 474105443 /nfs/dbraw/zinc/10/54/43/474105443.db2.gz JMCQISHHNZRVJI-KBPBESRZSA-N 0 3 341.795 2.734 20 5 EFBDHN CN(CCc1cccc([N+](=O)[O-])c1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000282566079 474112564 /nfs/dbraw/zinc/11/25/64/474112564.db2.gz ZAQOTHRLPWMXHK-QGZVFWFLSA-N 0 3 345.355 2.711 20 5 EFBDHN CCN(Cc1cccs1)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182178643 474115306 /nfs/dbraw/zinc/11/53/06/474115306.db2.gz AYVKLNJWGFWGCN-ZDUSSCGKSA-N 0 3 336.413 2.918 20 5 EFBDHN Cc1nn(C)c(C)c1[C@H]1OCC[C@@H]1NCc1ccc(C)c([N+](=O)[O-])c1 ZINC000275249091 474118873 /nfs/dbraw/zinc/11/88/73/474118873.db2.gz GMMASEQESAAFFD-YJBOKZPZSA-N 0 3 344.415 2.873 20 5 EFBDHN CN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000247331543 474121758 /nfs/dbraw/zinc/12/17/58/474121758.db2.gz VBSNZECEUMWDMB-FZMZJTMJSA-N 0 3 337.807 2.805 20 5 EFBDHN CN(C)Cc1ccccc1CNC(=O)/C=C\c1cccc([N+](=O)[O-])c1 ZINC000214314155 474136766 /nfs/dbraw/zinc/13/67/66/474136766.db2.gz HSOWEKREDXFABF-KHPPLWFESA-N 0 3 339.395 2.986 20 5 EFBDHN CC(C)C[C@@H](C)CNCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000289071865 474139735 /nfs/dbraw/zinc/13/97/35/474139735.db2.gz AJJJQGJNHABWAE-CYBMUJFWSA-N 0 3 328.434 2.640 20 5 EFBDHN O=[N+]([O-])c1cc(CN[C@H]2CCCC23CCOCC3)c2c(c1)COCO2 ZINC000282648119 474142463 /nfs/dbraw/zinc/14/24/63/474142463.db2.gz KXGQMUKCAWJLJD-INIZCTEOSA-N 0 3 348.399 2.900 20 5 EFBDHN Cc1ccccc1[C@@H]1CCN(CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000270579556 474176412 /nfs/dbraw/zinc/17/64/12/474176412.db2.gz QGOHJFVZAYLYOR-OAHLLOKOSA-N 0 3 327.384 2.554 20 5 EFBDHN CS[C@@H]1CN(c2cccc(F)c2[N+](=O)[O-])C[C@@H]1N1CCCC1 ZINC000275431896 474182957 /nfs/dbraw/zinc/18/29/57/474182957.db2.gz ISGFOKDNZFAGPA-UONOGXRCSA-N 0 3 325.409 2.750 20 5 EFBDHN Cc1ccc([C@H]2CCCCN2C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000247703276 474202036 /nfs/dbraw/zinc/20/20/36/474202036.db2.gz YILLCPAKJSJRLD-QZTJIDSGSA-N 0 3 344.415 2.688 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2nc(CNC[C@@H]3CC[C@@H](O)C3)cs2)c1 ZINC000188846976 474215290 /nfs/dbraw/zinc/21/52/90/474215290.db2.gz XAJNOTXOSKWBHV-IAQYHMDHSA-N 0 3 333.413 2.969 20 5 EFBDHN CC(C)Oc1ccc([C@@H](C)NCCn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC000182626869 474221265 /nfs/dbraw/zinc/22/12/65/474221265.db2.gz HBVQOMJWJVZURQ-CQSZACIVSA-N 0 3 345.399 2.895 20 5 EFBDHN CC1(C)CN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC[C@@H]1O ZINC000275533190 474224300 /nfs/dbraw/zinc/22/43/00/474224300.db2.gz XKAVHPBRUTZRJC-INIZCTEOSA-N 0 3 345.399 2.885 20 5 EFBDHN CCCCO[C@H]1C[C@@H](NCc2ccc(C(N)=O)cc2[N+](=O)[O-])C1(C)C ZINC000289352269 474233171 /nfs/dbraw/zinc/23/31/71/474233171.db2.gz NDFMCODRHCVWTQ-CVEARBPZSA-N 0 3 349.431 2.767 20 5 EFBDHN Cc1c(Br)c(N[C@@H]2CCN(C)[C@@H](C)C2)ncc1[N+](=O)[O-] ZINC000228016398 474247804 /nfs/dbraw/zinc/24/78/04/474247804.db2.gz UVBDHYDYMXNADP-WCBMZHEXSA-N 0 3 343.225 2.955 20 5 EFBDHN C[C@@H]1C[C@H](Nc2c(Br)cncc2[N+](=O)[O-])CCN1C ZINC000231630164 474263876 /nfs/dbraw/zinc/26/38/76/474263876.db2.gz WFDCYOAPTHQXAZ-RKDXNWHRSA-N 0 3 329.198 2.647 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCN(C[C@H]2CCOC2)CC1 ZINC000182829748 474266665 /nfs/dbraw/zinc/26/66/65/474266665.db2.gz TZDOOWGPGFXGSR-HZPDHXFCSA-N 0 3 333.432 2.618 20 5 EFBDHN CN(C)CCN(Cc1cccs1)C(=O)c1csc([N+](=O)[O-])c1 ZINC000175658838 474275872 /nfs/dbraw/zinc/27/58/72/474275872.db2.gz GFGPHLAMQBRWIR-UHFFFAOYSA-N 0 3 339.442 2.922 20 5 EFBDHN Cn1ccnc1[C@H]1OCCC[C@@H]1NC/C=C/c1ccccc1[N+](=O)[O-] ZINC000275676659 474276523 /nfs/dbraw/zinc/27/65/23/474276523.db2.gz VYLXBJLWRVWPQY-FWLFOBHPSA-N 0 3 342.399 2.851 20 5 EFBDHN O=[N+]([O-])c1cccc(-c2ccc(CNCCN3CCCOCC3)o2)c1 ZINC000289451268 474277099 /nfs/dbraw/zinc/27/70/99/474277099.db2.gz NCZXDHRIIBUMGJ-UHFFFAOYSA-N 0 3 345.399 2.667 20 5 EFBDHN COc1ccc(NC(=O)CCN[C@@H](C)c2cccnc2)c([N+](=O)[O-])c1 ZINC000182883347 474277819 /nfs/dbraw/zinc/27/78/19/474277819.db2.gz XXTXNSSEOIYCSY-LBPRGKRZSA-N 0 3 344.371 2.678 20 5 EFBDHN Cc1c(NC(=O)CCN[C@@H](C)c2cccnc2)cccc1[N+](=O)[O-] ZINC000182885355 474278246 /nfs/dbraw/zinc/27/82/46/474278246.db2.gz ZTPIXDLOCXCLFK-ZDUSSCGKSA-N 0 3 328.372 2.978 20 5 EFBDHN CN(CCN(C)C1CC1)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000283130708 474313729 /nfs/dbraw/zinc/31/37/29/474313729.db2.gz NKTYTLWZBUKEBL-UHFFFAOYSA-N 0 3 342.237 2.883 20 5 EFBDHN COC[C@@H](CCO)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000265750336 474322353 /nfs/dbraw/zinc/32/23/53/474322353.db2.gz HJVYPSDKOWYLKL-CYBMUJFWSA-N 0 3 336.413 2.810 20 5 EFBDHN CCN(CCNC(=O)Nc1cccc([N+](=O)[O-])c1Cl)C1CC1 ZINC000289564977 474326100 /nfs/dbraw/zinc/32/61/00/474326100.db2.gz GIQXYIDKEILDAT-UHFFFAOYSA-N 0 3 326.784 2.854 20 5 EFBDHN CN(Cc1ccc([N+](=O)[O-])c(F)c1)CC(C)(C)CN1CCOCC1 ZINC000283176100 474327399 /nfs/dbraw/zinc/32/73/99/474327399.db2.gz PVRBXGFABPARGI-UHFFFAOYSA-N 0 3 339.411 2.524 20 5 EFBDHN C[C@H]1Cc2ccccc2CN1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248457584 474329714 /nfs/dbraw/zinc/32/97/14/474329714.db2.gz MLYFAARCKVCOKM-WMLDXEAASA-N 0 3 342.395 2.781 20 5 EFBDHN C[C@@H]1Cc2ccccc2CN1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248457583 474330372 /nfs/dbraw/zinc/33/03/72/474330372.db2.gz MLYFAARCKVCOKM-RHSMWYFYSA-N 0 3 342.395 2.781 20 5 EFBDHN CS[C@@H]1CCCCN(C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000248469527 474335680 /nfs/dbraw/zinc/33/56/80/474335680.db2.gz URRMXYFKQQLPKR-ZIAGYGMSSA-N 0 3 340.445 2.552 20 5 EFBDHN CC(C)(C(=O)NC1CCN(C2CC2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000265794241 474340768 /nfs/dbraw/zinc/34/07/68/474340768.db2.gz MGWOMXXZZSGFIE-UHFFFAOYSA-N 0 3 331.416 2.615 20 5 EFBDHN CCc1ccc(C(=O)N(C)[C@@H](C)C2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000270965059 474342521 /nfs/dbraw/zinc/34/25/21/474342521.db2.gz SEZHIQBYHXTSJX-ZDUSSCGKSA-N 0 3 333.432 2.960 20 5 EFBDHN CCN(CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccncc1 ZINC000270975733 474348214 /nfs/dbraw/zinc/34/82/14/474348214.db2.gz FCMKVROBOGOGCR-UHFFFAOYSA-N 0 3 328.372 2.841 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F ZINC000248567263 474361293 /nfs/dbraw/zinc/36/12/93/474361293.db2.gz LDVAODMGIOLPIT-NFAWXSAZSA-N 0 3 349.406 2.923 20 5 EFBDHN CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000289676275 474374921 /nfs/dbraw/zinc/37/49/21/474374921.db2.gz FRTWXQAJYOAHIR-GFCCVEGCSA-N 0 3 332.404 2.929 20 5 EFBDHN C[C@@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])o2)CCN1Cc1ccccc1 ZINC000176126980 474390753 /nfs/dbraw/zinc/39/07/53/474390753.db2.gz PNILHWGXUBTCTA-HIFRSBDPSA-N 0 3 343.383 2.971 20 5 EFBDHN C[C@H]1CN(C)CC[C@H]1N(C)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000265941295 474395891 /nfs/dbraw/zinc/39/58/91/474395891.db2.gz HSUXNBNJJPUEOP-SMDDNHRTSA-N 0 3 331.372 2.753 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)NC[C@H]2CCCN(C)C2)cc1[N+](=O)[O-] ZINC000176173954 474400530 /nfs/dbraw/zinc/40/05/30/474400530.db2.gz AUSWJYMWTNBFSZ-UONOGXRCSA-N 0 3 334.420 2.605 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)NC[C@@H]2CCCN(C)C2)cc1[N+](=O)[O-] ZINC000176173919 474400998 /nfs/dbraw/zinc/40/09/98/474400998.db2.gz AUSWJYMWTNBFSZ-KBPBESRZSA-N 0 3 334.420 2.605 20 5 EFBDHN CCS[C@H]1CCCC[C@H]1NCc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000189489906 474417535 /nfs/dbraw/zinc/41/75/35/474417535.db2.gz UHDNMWHOOTXDLT-HIFRSBDPSA-N 0 3 337.445 2.848 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)[C@H](N)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000237504734 474417735 /nfs/dbraw/zinc/41/77/35/474417735.db2.gz REZBNCIVEWLEAQ-XJKSGUPXSA-N 0 3 327.384 2.650 20 5 EFBDHN CN(C)C1(CNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCC1 ZINC000276103916 474419255 /nfs/dbraw/zinc/41/92/55/474419255.db2.gz ZHLNQGUGZPFJMN-UHFFFAOYSA-N 0 3 345.321 2.828 20 5 EFBDHN C[C@H](CNCc1cc([N+](=O)[O-])ccc1OC(F)F)Cn1ccnc1 ZINC000237535240 474424781 /nfs/dbraw/zinc/42/47/81/474424781.db2.gz OZGMDJYKBMXCPO-LLVKDONJSA-N 0 3 340.330 2.819 20 5 EFBDHN CCN1CCC[C@H]1CNC(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000176316774 474438563 /nfs/dbraw/zinc/43/85/63/474438563.db2.gz JMDAEEVBHMSQBN-ZFWWWQNUSA-N 0 3 334.420 2.748 20 5 EFBDHN C[C@@H](C(=O)NCCc1ccccc1[N+](=O)[O-])[C@@H](N)c1ccccc1 ZINC000237611405 474439815 /nfs/dbraw/zinc/43/98/15/474439815.db2.gz SBAZXBUPAUTNPC-CXAGYDPISA-N 0 3 327.384 2.590 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)NCCN2CCCC[C@H]2C)c1 ZINC000283604113 474446317 /nfs/dbraw/zinc/44/63/17/474446317.db2.gz YSUZRIGHSKEHPP-CYBMUJFWSA-N 0 3 335.404 2.598 20 5 EFBDHN COc1cccc(CN(CCN(C)C)c2ncccc2[N+](=O)[O-])c1 ZINC000189630201 474453026 /nfs/dbraw/zinc/45/30/26/474453026.db2.gz VTXLQBBJZLJLJF-UHFFFAOYSA-N 0 3 330.388 2.567 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000176445807 474477376 /nfs/dbraw/zinc/47/73/76/474477376.db2.gz LDKWMCZVQLEVDV-LLVKDONJSA-N 0 3 325.796 2.852 20 5 EFBDHN Cc1cnn([C@@H]2CCN(CCCOc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000289910533 474481985 /nfs/dbraw/zinc/48/19/85/474481985.db2.gz NXYMNEWUUFRIJU-MRXNPFEDSA-N 0 3 330.388 2.816 20 5 EFBDHN O=[N+]([O-])c1ccc2[nH]c(CN[C@H]3CCO[C@@H](C(F)(F)F)C3)nc2c1 ZINC000289908807 474482203 /nfs/dbraw/zinc/48/22/03/474482203.db2.gz XUUOEEYLUXFZKE-QPUJVOFHSA-N 0 3 344.293 2.671 20 5 EFBDHN C[C@H](N[C@H]1CCC[C@@H](S(C)(=O)=O)C1)c1cccc([N+](=O)[O-])c1 ZINC000266792401 474483772 /nfs/dbraw/zinc/48/37/72/474483772.db2.gz PQPHDYXDOAKIJG-CORIIIEPSA-N 0 3 326.418 2.601 20 5 EFBDHN C[C@@H]1CN(C)CC[C@H]1N(C)c1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000271304392 474484012 /nfs/dbraw/zinc/48/40/12/474484012.db2.gz HHJDWUJCXFIJON-ZYHUDNBSSA-N 0 3 329.347 2.973 20 5 EFBDHN CS[C@@H]1CN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)C[C@H]1N(C)C ZINC000271308062 474487153 /nfs/dbraw/zinc/48/71/53/474487153.db2.gz IAVFRLBCPZUFOA-DGCLKSJQSA-N 0 3 347.387 2.678 20 5 EFBDHN N[C@@H](CC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC000237878998 474492291 /nfs/dbraw/zinc/49/22/91/474492291.db2.gz GKILFNBQTOLTCM-KRWDZBQOSA-N 0 3 325.368 2.570 20 5 EFBDHN Cc1nc([C@@H]2CCCN(CC=Cc3ccccc3[N+](=O)[O-])C2)n[nH]1 ZINC000271341609 474499197 /nfs/dbraw/zinc/49/91/97/474499197.db2.gz OLGRDYSRTOUTBY-NFBGWVBBSA-N 0 3 327.388 2.914 20 5 EFBDHN Cc1n[nH]c([C@@H]2CCCN(CC=Cc3ccccc3[N+](=O)[O-])C2)n1 ZINC000271341609 474499205 /nfs/dbraw/zinc/49/92/05/474499205.db2.gz OLGRDYSRTOUTBY-NFBGWVBBSA-N 0 3 327.388 2.914 20 5 EFBDHN Cc1nnc([C@@H]2CCCN(CC=Cc3ccccc3[N+](=O)[O-])C2)[nH]1 ZINC000271341609 474499211 /nfs/dbraw/zinc/49/92/11/474499211.db2.gz OLGRDYSRTOUTBY-NFBGWVBBSA-N 0 3 327.388 2.914 20 5 EFBDHN Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CC[C@@H]2CCN(C)C[C@H]21 ZINC000276383644 474520019 /nfs/dbraw/zinc/52/00/19/474520019.db2.gz GXJOEEGBJVGYEF-XJKSGUPXSA-N 0 3 332.404 2.770 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2c1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000176728721 474521927 /nfs/dbraw/zinc/52/19/27/474521927.db2.gz DPZYFZMEFFCHAH-KGLIPLIRSA-N 0 3 344.415 2.543 20 5 EFBDHN COC[C@H](Cc1ccccc1)NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000266937344 474538064 /nfs/dbraw/zinc/53/80/64/474538064.db2.gz BGHLSYAASDUXIC-INIZCTEOSA-N 0 3 330.384 2.951 20 5 EFBDHN CCc1ccc(C(=O)N2CC[C@@H](N3CCCCC3)C2)cc1[N+](=O)[O-] ZINC000266955019 474545777 /nfs/dbraw/zinc/54/57/77/474545777.db2.gz SMEQAXURRBGRMS-MRXNPFEDSA-N 0 3 331.416 2.858 20 5 EFBDHN C[C@H](N[C@H](CO)C[C@@H](O)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000271476120 474563585 /nfs/dbraw/zinc/56/35/85/474563585.db2.gz IBRZFNMWMJTFLD-QANKJYHBSA-N 0 3 330.384 2.730 20 5 EFBDHN C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000245389957 474577576 /nfs/dbraw/zinc/57/75/76/474577576.db2.gz KCMDUTJXTQGNBZ-CABCVRRESA-N 0 3 348.447 2.557 20 5 EFBDHN C[C@H](CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-])N1CCC[C@H](C)C1 ZINC000249526187 474586042 /nfs/dbraw/zinc/58/60/42/474586042.db2.gz UFVLEKFZAGSIAF-LSDHHAIUSA-N 0 3 348.447 2.857 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCN1CCc2ccc(O)cc2CC1 ZINC000609133333 480115315 /nfs/dbraw/zinc/11/53/15/480115315.db2.gz MVLHZMCUXFUHSW-UHFFFAOYSA-N 0 3 328.368 2.780 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)CC1CCN(C)CC1 ZINC000184758324 474601964 /nfs/dbraw/zinc/60/19/64/474601964.db2.gz HDUCUXNNICAFKJ-QGZVFWFLSA-N 0 3 347.459 2.964 20 5 EFBDHN Cc1cc([N+](=O)[O-])cc(C(=O)N(C)[C@H](C)C2CCN(C)CC2)c1F ZINC000284241953 474601902 /nfs/dbraw/zinc/60/19/02/474601902.db2.gz PENPFTCMYVLEFR-GFCCVEGCSA-N 0 3 337.395 2.845 20 5 EFBDHN C[C@H]1CN(Cc2ccccc2)CC[C@@H]1Nc1c([N+](=O)[O-])ncn1C ZINC000267189704 474613319 /nfs/dbraw/zinc/61/33/19/474613319.db2.gz HCFGOLOOOUCEKC-ZFWWWQNUSA-N 0 3 329.404 2.651 20 5 EFBDHN CN1CC[C@H](CNC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000291555869 474618155 /nfs/dbraw/zinc/61/81/55/474618155.db2.gz XGIRYZBOJVDXBB-MRVPVSSYSA-N 0 3 332.187 2.583 20 5 EFBDHN C[C@H](CNC(=O)NCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](C)C1 ZINC000250032120 474626958 /nfs/dbraw/zinc/62/69/58/474626958.db2.gz DZBCVDRMUOIHDV-ZIAGYGMSSA-N 0 3 334.420 2.514 20 5 EFBDHN Cc1cc([N+](=O)[O-])cc(C(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)c1F ZINC000284365367 474628271 /nfs/dbraw/zinc/62/82/71/474628271.db2.gz ZMAVYCBHSGJRSE-IUODEOHRSA-N 0 3 335.379 2.599 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N[C@H](C)C2=CCN(C)CC2)cc1[N+](=O)[O-] ZINC000272885035 474633184 /nfs/dbraw/zinc/63/31/84/474633184.db2.gz YMCQDPKVXMBLKQ-KGLIPLIRSA-N 0 3 346.431 2.914 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@H](C)C1=CCN(C)CC1 ZINC000272949553 474648447 /nfs/dbraw/zinc/64/84/47/474648447.db2.gz MQGAMUDOHIOUDG-CQSZACIVSA-N 0 3 331.416 2.900 20 5 EFBDHN CN1CC[C@@]2(CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)C2)C1 ZINC000291711598 474656010 /nfs/dbraw/zinc/65/60/10/474656010.db2.gz GKQBANXONXKZLC-OAHLLOKOSA-N 0 3 338.795 2.808 20 5 EFBDHN CN1CC=C(CNC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000291714226 474656136 /nfs/dbraw/zinc/65/61/36/474656136.db2.gz QGNWHLFYFVNTGI-UHFFFAOYSA-N 0 3 344.198 2.893 20 5 EFBDHN O=[N+]([O-])c1ccc(OCCCN2CCC[C@H](c3ncc[nH]3)C2)cc1 ZINC000267477628 474671539 /nfs/dbraw/zinc/67/15/39/474671539.db2.gz ZTIAXMWVZPMVHQ-AWEZNQCLSA-N 0 3 330.388 2.966 20 5 EFBDHN COc1cc(CNCC[C@@H]2CCO[C@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000273034625 474682794 /nfs/dbraw/zinc/68/27/94/474682794.db2.gz GXIYWWULUWGZNL-CHWSQXEVSA-N 0 3 338.404 2.907 20 5 EFBDHN C[C@@]1(NCc2cc([N+](=O)[O-])cc3c2OCOC3)CCO[C@@H]1C1CC1 ZINC000273052904 474692360 /nfs/dbraw/zinc/69/23/60/474692360.db2.gz KTVGKAWZWZGSHQ-IAGOWNOFSA-N 0 3 334.372 2.509 20 5 EFBDHN C[C@H](NC[C@@H](O)COc1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000305115036 474694850 /nfs/dbraw/zinc/69/48/50/474694850.db2.gz HOIMEOAHAOFTAR-BLLLJJGKSA-N 0 3 334.347 2.824 20 5 EFBDHN C[C@H](NC[C@H](O)COc1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000305115037 474695152 /nfs/dbraw/zinc/69/51/52/474695152.db2.gz HOIMEOAHAOFTAR-LRDDRELGSA-N 0 3 334.347 2.824 20 5 EFBDHN C[C@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)C1=CCN(C)CC1 ZINC000273058852 474695677 /nfs/dbraw/zinc/69/56/77/474695677.db2.gz YFCVXAGADJSUDV-NSHDSACASA-N 0 3 329.356 2.721 20 5 EFBDHN CO[C@]1(C)C[C@H](N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1(C)C ZINC000340847918 474712675 /nfs/dbraw/zinc/71/26/75/474712675.db2.gz HWKPBJIOFDFAIX-HYSWKAIVSA-N 0 3 335.404 2.715 20 5 EFBDHN CO[C@]1(C)C[C@@H](N[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1(C)C ZINC000340854698 474718845 /nfs/dbraw/zinc/71/88/45/474718845.db2.gz WHAXNXMMJCGWDO-JDSLSITLSA-N 0 3 335.404 2.715 20 5 EFBDHN CCOc1ccc([C@@H](C)NCC2(N3CCOCC3)CC2)cc1[N+](=O)[O-] ZINC000278590860 474724192 /nfs/dbraw/zinc/72/41/92/474724192.db2.gz YWZWBKNTXQOOFL-CQSZACIVSA-N 0 3 349.431 2.509 20 5 EFBDHN CCOC1CC(O)(CN[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000278594626 474724995 /nfs/dbraw/zinc/72/49/95/474724995.db2.gz AHPRQNUJDWIZJJ-MNQCNDSGSA-N 0 3 334.416 2.837 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(OC[C@@H](O)CN(C)Cc2ccccc2)c1 ZINC000305277298 474725718 /nfs/dbraw/zinc/72/57/18/474725718.db2.gz BHQZYSFDBRXRAL-INIZCTEOSA-N 0 3 330.384 2.775 20 5 EFBDHN Cc1ccc(NCCCNC(=O)CC2CCN(C)CC2)c([N+](=O)[O-])c1 ZINC000273155108 474746439 /nfs/dbraw/zinc/74/64/39/474746439.db2.gz ALNSMLYJHQBWGZ-UHFFFAOYSA-N 0 3 348.447 2.553 20 5 EFBDHN CCc1oc(CNCCc2cccc([N+](=O)[O-])c2)cc1C(=O)OC ZINC000338933960 474748411 /nfs/dbraw/zinc/74/84/11/474748411.db2.gz BFRMOVYPKYNPDK-UHFFFAOYSA-N 0 3 332.356 2.869 20 5 EFBDHN CN1CCC[C@@H]1CNC(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291919617 474752265 /nfs/dbraw/zinc/75/22/65/474752265.db2.gz LQFJBHZWNYGJDO-SECBINFHSA-N 0 3 332.187 2.726 20 5 EFBDHN O=[N+]([O-])c1ccc(CNCc2cccc(N3CCOCC3)c2)cc1 ZINC000293006019 474761296 /nfs/dbraw/zinc/76/12/96/474761296.db2.gz PHMHZUOGZTYAIB-UHFFFAOYSA-N 0 3 327.384 2.721 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N[C@H]2CN(C3CC3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000268096321 474795570 /nfs/dbraw/zinc/79/55/70/474795570.db2.gz CQKUPOYSXXTXBE-WWGRRREGSA-N 0 3 346.431 2.746 20 5 EFBDHN COc1cccc([C@@H](C)NC[C@@H](O)COc2ccccc2[N+](=O)[O-])c1 ZINC000273253625 474804198 /nfs/dbraw/zinc/80/41/98/474804198.db2.gz YPXXNPYLUKMFQS-UKRRQHHQSA-N 0 3 346.383 2.694 20 5 EFBDHN COc1cccc([C@@H](C)NC[C@H](O)COc2ccccc2[N+](=O)[O-])c1 ZINC000273253621 474804788 /nfs/dbraw/zinc/80/47/88/474804788.db2.gz YPXXNPYLUKMFQS-HIFRSBDPSA-N 0 3 346.383 2.694 20 5 EFBDHN CN(C)CCOc1cccc(NC(=O)c2csc([N+](=O)[O-])c2)c1 ZINC000337241463 474816568 /nfs/dbraw/zinc/81/65/68/474816568.db2.gz FPEUSWHXGGRFMI-UHFFFAOYSA-N 0 3 335.385 2.849 20 5 EFBDHN CC(C)N1C[C@H](NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)[C@@H](C)C1 ZINC000268138437 474819366 /nfs/dbraw/zinc/81/93/66/474819366.db2.gz PEUAMFHRQDRZPY-FZMZJTMJSA-N 0 3 330.388 2.535 20 5 EFBDHN CC(C)N1C[C@@H](C)[C@@H](NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC000268138440 474821823 /nfs/dbraw/zinc/82/18/23/474821823.db2.gz PEUAMFHRQDRZPY-RISCZKNCSA-N 0 3 330.388 2.535 20 5 EFBDHN CSc1ccc(C(=O)N[C@@H]2CN(C3CC3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000268149361 474826198 /nfs/dbraw/zinc/82/61/98/474826198.db2.gz FYGSWRZATSTREU-GXFFZTMASA-N 0 3 335.429 2.529 20 5 EFBDHN CSc1ccc(C(=O)N[C@H]2CN(C3CC3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000268149366 474826441 /nfs/dbraw/zinc/82/64/41/474826441.db2.gz FYGSWRZATSTREU-MFKMUULPSA-N 0 3 335.429 2.529 20 5 EFBDHN Nc1ccc(NC[C@@H]2CCCN(Cc3ccccc3)C2)nc1[N+](=O)[O-] ZINC000310778886 474829394 /nfs/dbraw/zinc/82/93/94/474829394.db2.gz BDDRMULYWNPYGM-HNNXBMFYSA-N 0 3 341.415 2.896 20 5 EFBDHN C[C@@H]1CCC[C@]1(O)CNCc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000293174960 474854746 /nfs/dbraw/zinc/85/47/46/474854746.db2.gz WKDHZHBZHVYVFI-BMIGLBTASA-N 0 3 330.331 2.837 20 5 EFBDHN CS[C@H]1CN(c2cc(C)nc3c2cccc3[N+](=O)[O-])C[C@H]1N(C)C ZINC000345077545 474869491 /nfs/dbraw/zinc/86/94/91/474869491.db2.gz USTYADXNGCMUMB-CVEARBPZSA-N 0 3 346.456 2.933 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@]2(CCN(C)C2)C1 ZINC000292146353 474872876 /nfs/dbraw/zinc/87/28/76/474872876.db2.gz JRJNCJFZWKHJCV-DYVFJYSZSA-N 0 3 349.456 2.630 20 5 EFBDHN CCCN(CCN1CCN(CC)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000341029763 474896096 /nfs/dbraw/zinc/89/60/96/474896096.db2.gz DJZGXWNKDVXQRR-UHFFFAOYSA-N 0 3 338.427 2.588 20 5 EFBDHN C[C@@H](N[C@@H]1CCCN(C(=O)N2CCCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000285142074 474904293 /nfs/dbraw/zinc/90/42/93/474904293.db2.gz OSNVQJFRAFZTJX-GDBMZVCRSA-N 0 3 346.431 2.926 20 5 EFBDHN O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@@H](N2CCCC2)C1 ZINC000320571825 474913464 /nfs/dbraw/zinc/91/34/64/474913464.db2.gz MIHVOFLTXJJKTP-CYBMUJFWSA-N 0 3 337.807 2.949 20 5 EFBDHN CS[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2C)C[C@@H]1N1CCCC1 ZINC000273475199 474918384 /nfs/dbraw/zinc/91/83/84/474918384.db2.gz HQVXVVMCWWBZGH-JKSUJKDBSA-N 0 3 349.456 2.555 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CCCCC[C@@H]2C[C@H](O)c2ccco2)c1 ZINC000268348707 474935179 /nfs/dbraw/zinc/93/51/79/474935179.db2.gz CRTMXCXJPAGUNL-ZBFHGGJFSA-N 0 3 348.403 2.753 20 5 EFBDHN C[C@@H]1C[C@H](N(C)c2ncc([N+](=O)[O-])cn2)CCN1Cc1ccccc1 ZINC000273590467 474978776 /nfs/dbraw/zinc/97/87/76/474978776.db2.gz HFOIUFPBBMVILM-GDBMZVCRSA-N 0 3 341.415 2.874 20 5 EFBDHN CN(CCc1ccccc1[N+](=O)[O-])C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000285345486 474979886 /nfs/dbraw/zinc/97/98/86/474979886.db2.gz PEFJYTZXBCYCRF-KRWDZBQOSA-N 0 3 345.355 2.711 20 5 EFBDHN O=[N+]([O-])c1ccc(NC[C@@H]2CN3CCC[C@@H]3CO2)c(C(F)(F)F)c1 ZINC000325837853 474994267 /nfs/dbraw/zinc/99/42/67/474994267.db2.gz QYFCKMWKONAHRT-VXGBXAGGSA-N 0 3 345.321 2.889 20 5 EFBDHN C[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1OCCc2sccc21 ZINC000292380776 474994353 /nfs/dbraw/zinc/99/43/53/474994353.db2.gz JRSDIJQUJBGNQG-KCTSRDHCSA-N 0 3 348.424 2.982 20 5 EFBDHN O=[N+]([O-])c1ccc(NC[C@H]2CN3CCC[C@@H]3CO2)c(C(F)(F)F)c1 ZINC000325837846 474995003 /nfs/dbraw/zinc/99/50/03/474995003.db2.gz QYFCKMWKONAHRT-NEPJUHHUSA-N 0 3 345.321 2.889 20 5 EFBDHN O=[N+]([O-])c1ccc(NC[C@H]2CN3CCC[C@H]3CO2)c(C(F)(F)F)c1 ZINC000325837851 474995588 /nfs/dbraw/zinc/99/55/88/474995588.db2.gz QYFCKMWKONAHRT-RYUDHWBXSA-N 0 3 345.321 2.889 20 5 EFBDHN CCC[C@H](NC[C@@H]1CN2CCC[C@H]2CO1)c1cccc([N+](=O)[O-])c1 ZINC000325810943 474995974 /nfs/dbraw/zinc/99/59/74/474995974.db2.gz KDIYOUJVTFONGM-KSZLIROESA-N 0 3 333.432 2.889 20 5 EFBDHN C[C@H](NC(=O)c1cccc2c1CCNC2)c1cccc([N+](=O)[O-])c1 ZINC000326040699 474998575 /nfs/dbraw/zinc/99/85/75/474998575.db2.gz WUVAGIIXVNSLHP-LBPRGKRZSA-N 0 3 325.368 2.732 20 5 EFBDHN Cc1c(CNC(=O)[C@@H](C)[C@@H](N)c2ccccc2)cccc1[N+](=O)[O-] ZINC000261626398 475001610 /nfs/dbraw/zinc/00/16/10/475001610.db2.gz GUHVAVIFGKVRRL-SUMWQHHRSA-N 0 3 327.384 2.856 20 5 EFBDHN CCOc1cc(N2CCN([C@H](C)CCOC)CC2)ccc1[N+](=O)[O-] ZINC000280137574 475011352 /nfs/dbraw/zinc/01/13/52/475011352.db2.gz BQQBEZRWPQGILO-CQSZACIVSA-N 0 3 337.420 2.541 20 5 EFBDHN Cc1cccc(C(=O)NC[C@H]2NCCc3ccccc32)c1[N+](=O)[O-] ZINC000261667525 475017054 /nfs/dbraw/zinc/01/70/54/475017054.db2.gz LIUIQWGDQXYWDI-MRXNPFEDSA-N 0 3 325.368 2.520 20 5 EFBDHN CN(CCc1ccccc1[N+](=O)[O-])C[C@@H](O)COc1ccccc1F ZINC000285431573 475019798 /nfs/dbraw/zinc/01/97/98/475019798.db2.gz WTGJTQZVFQOPMS-OAHLLOKOSA-N 0 3 348.374 2.648 20 5 EFBDHN COc1ccc(CNCCC(=O)N(C)c2ccccc2)cc1[N+](=O)[O-] ZINC000609287636 480138842 /nfs/dbraw/zinc/13/88/42/480138842.db2.gz HGCVYFKJGQBLSJ-UHFFFAOYSA-N 0 3 343.383 2.746 20 5 EFBDHN COC(=O)[C@@H]1CN(c2cc(C)nc3ccc([N+](=O)[O-])cc32)C[C@H]1C ZINC000280347344 475021937 /nfs/dbraw/zinc/02/19/37/475021937.db2.gz WEZCKRKVJALCMW-QMTHXVAHSA-N 0 3 329.356 2.697 20 5 EFBDHN Cc1nc(N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)ccc1[N+](=O)[O-] ZINC000268515238 475025986 /nfs/dbraw/zinc/02/59/86/475025986.db2.gz SZNXSXYWOSBYNQ-KBPBESRZSA-N 0 3 348.447 2.624 20 5 EFBDHN Cc1c(C(=O)N2CCN(C3CCC3)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000292441269 475027210 /nfs/dbraw/zinc/02/72/10/475027210.db2.gz RPXKZXDCGQFLEO-CYBMUJFWSA-N 0 3 331.416 2.850 20 5 EFBDHN CN1CC[C@]2(CCN(C(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3F)C2)C1 ZINC000292486780 475052056 /nfs/dbraw/zinc/05/20/56/475052056.db2.gz FAGWTNNJPBIEMJ-SFHVURJKSA-N 0 3 349.406 2.566 20 5 EFBDHN Cc1c(NC(=O)[C@H](C)N2CCCN(C(C)C)CC2)cccc1[N+](=O)[O-] ZINC000292579222 475097712 /nfs/dbraw/zinc/09/77/12/475097712.db2.gz UEPQYZXJQRAIML-HNNXBMFYSA-N 0 3 348.447 2.646 20 5 EFBDHN COC[C@H](O)CN[C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000268965116 475099038 /nfs/dbraw/zinc/09/90/38/475099038.db2.gz YOIHUTNWXSIGJV-VXGBXAGGSA-N 0 3 336.413 2.981 20 5 EFBDHN C[C@@H]1C[C@H](Nc2ncc([N+](=O)[O-])cn2)CCN1Cc1ccccc1 ZINC000273959020 475138715 /nfs/dbraw/zinc/13/87/15/475138715.db2.gz NSSGUWISJHITMS-UKRRQHHQSA-N 0 3 327.388 2.850 20 5 EFBDHN CC(C)c1ccc([C@@H](N)CNC(=O)c2cc([N+](=O)[O-])ccc2N)cc1 ZINC000262012041 475144202 /nfs/dbraw/zinc/14/42/02/475144202.db2.gz UNKSEZPZSKOPIE-KRWDZBQOSA-N 0 3 342.399 2.730 20 5 EFBDHN C[C@H](N[C@@H]1CCC[C@H](S(C)(=O)=O)C1)c1ccc([N+](=O)[O-])cc1 ZINC000295975968 475152251 /nfs/dbraw/zinc/15/22/51/475152251.db2.gz JAOMUNXUVIOPJM-LNSITVRQSA-N 0 3 326.418 2.601 20 5 EFBDHN C[C@H](N[C@@H]1CCC[C@@H](S(C)(=O)=O)C1)c1ccc([N+](=O)[O-])cc1 ZINC000295975980 475152597 /nfs/dbraw/zinc/15/25/97/475152597.db2.gz JAOMUNXUVIOPJM-NJZAAPMLSA-N 0 3 326.418 2.601 20 5 EFBDHN CCc1nnc(CN[C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])[nH]1 ZINC000296035793 475174006 /nfs/dbraw/zinc/17/40/06/475174006.db2.gz NPWRQTBZKIYGRZ-TZMCWYRMSA-N 0 3 329.404 2.776 20 5 EFBDHN CCc1nnc(C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])[n-]1 ZINC000296035793 475174009 /nfs/dbraw/zinc/17/40/09/475174009.db2.gz NPWRQTBZKIYGRZ-TZMCWYRMSA-N 0 3 329.404 2.776 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CCC[C@@H](c3ccncc3)C2)c1 ZINC000296089793 475192716 /nfs/dbraw/zinc/19/27/16/475192716.db2.gz WLXWDKUDODYRFS-SJLPKXTDSA-N 0 3 327.384 2.903 20 5 EFBDHN COc1cc([C@@H](C)NCCn2ccc([N+](=O)[O-])n2)ccc1OC(C)C ZINC000341635229 475197763 /nfs/dbraw/zinc/19/77/63/475197763.db2.gz HXDFVFQHGNASPE-CYBMUJFWSA-N 0 3 348.403 2.938 20 5 EFBDHN CC[C@@H](NC[C@H](O)COCC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000292813032 475205350 /nfs/dbraw/zinc/20/53/50/475205350.db2.gz CLOOUYQHZLMMGA-QWHCGFSZSA-N 0 3 336.310 2.575 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CCC(Cc3ccccc3F)CC2)n1 ZINC000357904758 475247206 /nfs/dbraw/zinc/24/72/06/475247206.db2.gz HNMIVFJBFHHPAB-UHFFFAOYSA-N 0 3 332.379 2.885 20 5 EFBDHN O=[N+]([O-])c1ccccc1CNCCNc1ccc(-c2ccccc2)nn1 ZINC000337723817 475272555 /nfs/dbraw/zinc/27/25/55/475272555.db2.gz YFOMNLWHFMSHGW-UHFFFAOYSA-N 0 3 349.394 2.675 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(C)CCN1CCCC1 ZINC000361211919 475272899 /nfs/dbraw/zinc/27/28/99/475272899.db2.gz RPMLCZASIRJDIK-MRXNPFEDSA-N 0 3 333.432 2.718 20 5 EFBDHN CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1NCC1=CCN(C)CC1 ZINC000354588539 475273257 /nfs/dbraw/zinc/27/32/57/475273257.db2.gz QWYHIGKLRJALIL-UHFFFAOYSA-N 0 3 337.351 2.584 20 5 EFBDHN CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCN(C)[C@H](C)C1 ZINC000361213218 475274092 /nfs/dbraw/zinc/27/40/92/475274092.db2.gz QEPJPUGYMNXEEY-BMFZPTHFSA-N 0 3 333.432 2.762 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC[C@@H](CCC(N)=O)C1 ZINC000347371719 475274037 /nfs/dbraw/zinc/27/40/37/475274037.db2.gz VSXVOPUKJWFXBX-LTBFUDJGSA-N 0 3 331.416 2.976 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CC3(CCOCC3)[C@H]2C2CC2)c1 ZINC000296421813 475307208 /nfs/dbraw/zinc/30/72/08/475307208.db2.gz XZTRWWSUIXYQOL-IAGOWNOFSA-N 0 3 332.400 2.519 20 5 EFBDHN CC(C)C[C@@H]1CCCN1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000354681851 475334886 /nfs/dbraw/zinc/33/48/86/475334886.db2.gz JWRNWQUGKVVCAP-HNNXBMFYSA-N 0 3 331.416 2.994 20 5 EFBDHN Cc1nc(N[C@@H]2CCCN(Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000296485444 475336940 /nfs/dbraw/zinc/33/69/40/475336940.db2.gz KRJUNQXYLIVQQO-OAHLLOKOSA-N 0 3 327.388 2.770 20 5 EFBDHN C[C@H](NC(=O)NCCN1CCC[C@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000296495490 475342050 /nfs/dbraw/zinc/34/20/50/475342050.db2.gz YIHBLOLHPDVJIY-KBPBESRZSA-N 0 3 334.420 2.687 20 5 EFBDHN CC(C)(C)[C@@H]1CCCN1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000331723143 475392185 /nfs/dbraw/zinc/39/21/85/475392185.db2.gz LNAUFVMPXMROKY-INIZCTEOSA-N 0 3 331.416 2.994 20 5 EFBDHN CN1CCC[C@]2(CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3F)C2)C1 ZINC000296605242 475392472 /nfs/dbraw/zinc/39/24/72/475392472.db2.gz OVJAAMSEYLWUCH-INIZCTEOSA-N 0 3 336.367 2.684 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1CN[C@H]1CCO[C@@H](C(F)(F)F)C1 ZINC000348103483 475392607 /nfs/dbraw/zinc/39/26/07/475392607.db2.gz CFZZMDRKGCUUNE-GXFFZTMASA-N 0 3 334.294 2.803 20 5 EFBDHN Cc1nn(C)c2ncc(CN(C)CCc3ccccc3[N+](=O)[O-])cc12 ZINC000352543813 475396829 /nfs/dbraw/zinc/39/68/29/475396829.db2.gz KCOVNINJPBEAEP-UHFFFAOYSA-N 0 3 339.399 2.859 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H](C(=O)N2CCCC2)C1 ZINC000331737976 475399212 /nfs/dbraw/zinc/39/92/12/475399212.db2.gz USPGGZRYWCIJFG-CABCVRRESA-N 0 3 331.416 2.990 20 5 EFBDHN CN(c1ccc([N+](=O)[O-])c(C(F)(F)F)c1)C1CCN(CCO)CC1 ZINC000339682169 475405486 /nfs/dbraw/zinc/40/54/86/475405486.db2.gz JBZSMQROBFACNB-UHFFFAOYSA-N 0 3 347.337 2.507 20 5 EFBDHN Cc1ccc(NC(=O)CCN(C)CCc2ccccc2[N+](=O)[O-])nc1 ZINC000352562968 475414805 /nfs/dbraw/zinc/41/48/05/475414805.db2.gz OAXBZOCYKYEYDU-UHFFFAOYSA-N 0 3 342.399 2.801 20 5 EFBDHN CN(CCN1CCCC1)C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000358127620 475423138 /nfs/dbraw/zinc/42/31/38/475423138.db2.gz QXEFWYVISDALNJ-UHFFFAOYSA-N 0 3 337.395 2.566 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@]2(CCN(C)C2)C1 ZINC000296685650 475429638 /nfs/dbraw/zinc/42/96/38/475429638.db2.gz IZJNTIOGYSVMRQ-KRWDZBQOSA-N 0 3 348.403 2.553 20 5 EFBDHN C[C@H](NC[C@H](O)COc1ccccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000296687148 475429877 /nfs/dbraw/zinc/42/98/77/475429877.db2.gz JGLPSUSYYHPCNW-WFASDCNBSA-N 0 3 334.347 2.824 20 5 EFBDHN NC(=O)c1cccc(CN(CCc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000296721356 475446279 /nfs/dbraw/zinc/44/62/79/475446279.db2.gz NNVGOGKTWGJGAG-UHFFFAOYSA-N 0 3 339.395 2.901 20 5 EFBDHN CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000345817967 475479580 /nfs/dbraw/zinc/47/95/80/475479580.db2.gz QKWBWCGXGPTSPN-QGZVFWFLSA-N 0 3 344.415 2.809 20 5 EFBDHN O=[N+]([O-])c1cccc(N2CCN(CCCC3CCOCC3)CC2)c1 ZINC000332011255 475485473 /nfs/dbraw/zinc/48/54/73/475485473.db2.gz DEWXQZQQIYJXAW-UHFFFAOYSA-N 0 3 333.432 2.924 20 5 EFBDHN CS[C@H]1CN(C(=O)c2cc(C)ccc2[N+](=O)[O-])C[C@H]1N1CCCC1 ZINC000332070156 475500076 /nfs/dbraw/zinc/50/00/76/475500076.db2.gz BMMODXNMCKQEDI-CVEARBPZSA-N 0 3 349.456 2.555 20 5 EFBDHN C[C@H](NC(=O)NC[C@@H]1CCCCN1C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000296852834 475506987 /nfs/dbraw/zinc/50/69/87/475506987.db2.gz LCCCFUWVWVROQK-GUYCJALGSA-N 0 3 346.431 2.972 20 5 EFBDHN CCOc1ccc([C@H](C)N[C@@H]2CCC[C@H]2C(=O)NC)cc1[N+](=O)[O-] ZINC000358231725 475511675 /nfs/dbraw/zinc/51/16/75/475511675.db2.gz ASKYEOBLFAVDHI-IACUBPJLSA-N 0 3 335.404 2.559 20 5 EFBDHN CC[C@@H]1[C@@H](C)CCN1Cc1ccc(OCC(=O)OC)c([N+](=O)[O-])c1 ZINC000354914540 475515689 /nfs/dbraw/zinc/51/56/89/475515689.db2.gz DPCQUNFLUKXTJP-GXTWGEPZSA-N 0 3 336.388 2.767 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@@]2(C1)CCCN(C)C2 ZINC000296997896 475567997 /nfs/dbraw/zinc/56/79/97/475567997.db2.gz UUOMDNNRIPEIHM-KRWDZBQOSA-N 0 3 348.403 2.553 20 5 EFBDHN Cc1nc(N(C)C[C@H]2CCN(Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000296996292 475568728 /nfs/dbraw/zinc/56/87/28/475568728.db2.gz FRGZECGRODPHIN-MRXNPFEDSA-N 0 3 341.415 2.652 20 5 EFBDHN CC(C)[C@H](CN(C)Cc1ccccc1)Nc1ncc([N+](=O)[O-])cn1 ZINC000346202847 475569737 /nfs/dbraw/zinc/56/97/37/475569737.db2.gz AMXFGJDIGMKZCA-INIZCTEOSA-N 0 3 329.404 2.953 20 5 EFBDHN C[C@H]1C[C@@H](N(C)C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)CCN1C ZINC000332240998 475571161 /nfs/dbraw/zinc/57/11/61/475571161.db2.gz IZQJQBZVUDEXEJ-RYUDHWBXSA-N 0 3 330.388 2.631 20 5 EFBDHN C[C@@H]1C[C@@H](N(C)C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)CCN1C ZINC000332240996 475571251 /nfs/dbraw/zinc/57/12/51/475571251.db2.gz IZQJQBZVUDEXEJ-NEPJUHHUSA-N 0 3 330.388 2.631 20 5 EFBDHN COC(=O)[C@@H]1CSCCN([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000332258412 475577775 /nfs/dbraw/zinc/57/77/75/475577775.db2.gz ZZQDZDRCTWRTHQ-OLZOCXBDSA-N 0 3 338.429 2.802 20 5 EFBDHN CCCN1CCC[C@@H]1CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000358312210 475582323 /nfs/dbraw/zinc/58/23/23/475582323.db2.gz LLLJYKPIKKGJLN-OAHLLOKOSA-N 0 3 334.420 2.611 20 5 EFBDHN COC(=O)COc1ccc(CN2CC[C@H]3CCC[C@@H]32)cc1[N+](=O)[O-] ZINC000355034382 475612725 /nfs/dbraw/zinc/61/27/25/475612725.db2.gz HCWBDZARJMMTDD-KGLIPLIRSA-N 0 3 334.372 2.521 20 5 EFBDHN C[C@@H](C1CCN(C)CC1)N(C)C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000332378785 475617949 /nfs/dbraw/zinc/61/79/49/475617949.db2.gz UJOFICQMQLAZJU-LBPRGKRZSA-N 0 3 344.415 2.878 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@@H](N2CCN(C)CC2)[C@H](C)C1 ZINC000332398323 475624356 /nfs/dbraw/zinc/62/43/56/475624356.db2.gz QRTJQZQGXAGOQZ-JFIYKMOQSA-N 0 3 346.475 2.614 20 5 EFBDHN CC(C)c1[nH]nc(C(=O)N2CCN(C3CCCCC3)CC2)c1[N+](=O)[O-] ZINC000332415833 475631716 /nfs/dbraw/zinc/63/17/16/475631716.db2.gz MOJHAGZXTBHYHD-UHFFFAOYSA-N 0 3 349.435 2.532 20 5 EFBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])N[C@H]1CC(=O)N(C2CC2)C1 ZINC000358391758 475643385 /nfs/dbraw/zinc/64/33/85/475643385.db2.gz FOEIZXBQAQFSLP-STQMWFEESA-N 0 3 349.456 2.818 20 5 EFBDHN C[C@@H](CNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12)N1CCC[C@@H](C)C1 ZINC000342923722 475655569 /nfs/dbraw/zinc/65/55/69/475655569.db2.gz FYWRPMAKWNTMGR-OLZOCXBDSA-N 0 3 344.415 2.926 20 5 EFBDHN CN(C)CCN(C(=O)CNc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000346566206 475662822 /nfs/dbraw/zinc/66/28/22/475662822.db2.gz DSTQAJPCKFNNJJ-UHFFFAOYSA-N 0 3 348.447 2.730 20 5 EFBDHN CN(Cc1ccccc1)CC(C)(C)NC(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000338232563 475695354 /nfs/dbraw/zinc/69/53/54/475695354.db2.gz PLHRUIHNTVSPGT-UHFFFAOYSA-N 0 3 330.388 2.563 20 5 EFBDHN CCCN(CCN(C)C)C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000343061623 475733029 /nfs/dbraw/zinc/73/30/29/475733029.db2.gz HCZDVDLRMBHYMG-CYBMUJFWSA-N 0 3 339.461 2.876 20 5 EFBDHN C[C@H](N[C@@H]1CCC[C@@H]1OC(F)F)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000348538568 475736460 /nfs/dbraw/zinc/73/64/60/475736460.db2.gz UBYYALIDHHSYEB-BIMULSAOSA-N 0 3 343.330 2.672 20 5 EFBDHN C[C@H](N[C@H]1CCC[C@@H]1OC(F)F)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000348538570 475737406 /nfs/dbraw/zinc/73/74/06/475737406.db2.gz UBYYALIDHHSYEB-XDTLVQLUSA-N 0 3 343.330 2.672 20 5 EFBDHN CN(Cc1ccccc1)CC(C)(C)NC(=O)c1ccc([N+](=O)[O-])n1C ZINC000338293216 475754141 /nfs/dbraw/zinc/75/41/41/475754141.db2.gz SQLODYSTVXLLCZ-UHFFFAOYSA-N 0 3 344.415 2.574 20 5 EFBDHN NC(=O)[C@@H](CNCc1cccc([N+](=O)[O-])c1)Cc1ccccc1Cl ZINC000346674137 475754663 /nfs/dbraw/zinc/75/46/63/475754663.db2.gz TYDIQNOEIXYSIY-CQSZACIVSA-N 0 3 347.802 2.682 20 5 EFBDHN O=C(CN[C@@H]1CCc2ccccc2OC1)Nc1ccccc1[N+](=O)[O-] ZINC000338316278 475777371 /nfs/dbraw/zinc/77/73/71/475777371.db2.gz PWDFBJWVTCMACI-CQSZACIVSA-N 0 3 341.367 2.517 20 5 EFBDHN C[C@H](NC(=O)N1CCN(C2CC2)C[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000297489112 475779143 /nfs/dbraw/zinc/77/91/43/475779143.db2.gz FJWMOQANNNQFNH-KGLIPLIRSA-N 0 3 346.431 2.782 20 5 EFBDHN C[C@H](NC(=O)N1CCN(C2CC2)C[C@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000297489101 475780074 /nfs/dbraw/zinc/78/00/74/475780074.db2.gz FJWMOQANNNQFNH-KBPBESRZSA-N 0 3 346.431 2.782 20 5 EFBDHN COCC[C@H](NCC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C(C)(C)C ZINC000338362864 475827493 /nfs/dbraw/zinc/82/74/93/475827493.db2.gz PUSDFYBACXJXOP-INIZCTEOSA-N 0 3 349.431 2.525 20 5 EFBDHN Cc1nc(N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000297667671 475850624 /nfs/dbraw/zinc/85/06/24/475850624.db2.gz ZQIHCOJZHOACJH-DOMZBBRYSA-N 0 3 327.388 2.768 20 5 EFBDHN Cc1ncc(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)c(=O)[n-]1 ZINC000346786529 475859145 /nfs/dbraw/zinc/85/91/45/475859145.db2.gz DDIANSVKKOWWRD-OAHLLOKOSA-N 0 3 328.372 2.510 20 5 EFBDHN C[C@H](NC(=O)N1CCC[C@H]2CN(C)CC[C@H]21)c1ccc([N+](=O)[O-])cc1 ZINC000297816757 475895421 /nfs/dbraw/zinc/89/54/21/475895421.db2.gz ZBCGLDSVDOMZKU-JLJPHGGASA-N 0 3 346.431 2.782 20 5 EFBDHN COCC1(C)CCN(CCOc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC000358747980 475903945 /nfs/dbraw/zinc/90/39/45/475903945.db2.gz UYBMWDVQOIKJBV-UHFFFAOYSA-N 0 3 338.404 2.731 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@H](C)C2CCN(C)CC2)c1 ZINC000338468532 475934517 /nfs/dbraw/zinc/93/45/17/475934517.db2.gz DHVZKWPANOAGPQ-CYBMUJFWSA-N 0 3 349.431 2.796 20 5 EFBDHN COc1cc(C[NH2+]CCC2C[C@@H](C)O[C@H](C)C2)c([N+](=O)[O-])cc1[O-] ZINC000338477650 475941656 /nfs/dbraw/zinc/94/16/56/475941656.db2.gz OAJOSALDCYCCEC-VXGBXAGGSA-N 0 3 338.404 2.992 20 5 EFBDHN CCOc1cc(N2CCN(C[C@H]3CCCOC3)CC2)ccc1[N+](=O)[O-] ZINC000355516673 476000177 /nfs/dbraw/zinc/00/01/77/476000177.db2.gz QCQWFIUKTIIRHU-OAHLLOKOSA-N 0 3 349.431 2.542 20 5 EFBDHN CN(CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC1(O)CCC1 ZINC000353484626 476008849 /nfs/dbraw/zinc/00/88/49/476008849.db2.gz KDYKWASDDYDNHV-UHFFFAOYSA-N 0 3 331.372 2.639 20 5 EFBDHN Cc1nn(C)c(N[C@@H]2CCN([C@H](C)c3ccccc3)C2)c1[N+](=O)[O-] ZINC000358881194 476009272 /nfs/dbraw/zinc/00/92/72/476009272.db2.gz NJCQUGLZUCGIAV-UKRRQHHQSA-N 0 3 329.404 2.884 20 5 EFBDHN COc1ccc(CN[C@@H]2CCO[C@@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000343399379 476026894 /nfs/dbraw/zinc/02/68/94/476026894.db2.gz VELRRAVSHXZSTF-RHSMWYFYSA-N 0 3 329.356 2.618 20 5 EFBDHN CN(CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](CO)c1ccccc1 ZINC000298245248 476033006 /nfs/dbraw/zinc/03/30/06/476033006.db2.gz SRKQGDVXVJKDPX-QGZVFWFLSA-N 0 3 343.383 2.589 20 5 EFBDHN CCn1ncnc1CN[C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000355578750 476041751 /nfs/dbraw/zinc/04/17/51/476041751.db2.gz FVQWBMFSDUJFPI-UKRRQHHQSA-N 0 3 329.404 2.707 20 5 EFBDHN O=[N+]([O-])c1cnn(CCN2CCC(Cc3ccccc3F)CC2)c1 ZINC000350114211 476052268 /nfs/dbraw/zinc/05/22/68/476052268.db2.gz KFJFFVAUTNAESC-UHFFFAOYSA-N 0 3 332.379 2.885 20 5 EFBDHN C[C@@H]1[C@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCCN1C ZINC000343425355 476053431 /nfs/dbraw/zinc/05/34/31/476053431.db2.gz YQCZJEDZQSTKNN-NOZJJQNGSA-N 0 3 345.321 2.826 20 5 EFBDHN CC(C)CN(CCN(C)C)C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000340540916 476096803 /nfs/dbraw/zinc/09/68/03/476096803.db2.gz YTDNACNZFGDSGV-UHFFFAOYSA-N 0 3 339.461 2.733 20 5 EFBDHN COc1cccc(C(=O)N(CC(C)C)C2CCN(C)CC2)c1[N+](=O)[O-] ZINC000362249638 476111329 /nfs/dbraw/zinc/11/13/29/476111329.db2.gz KEQFSFJVUWCKII-UHFFFAOYSA-N 0 3 349.431 2.796 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(NC[C@@H]2C[C@H](O)CN2Cc2ccccc2)c1 ZINC000340573723 476115575 /nfs/dbraw/zinc/11/55/75/476115575.db2.gz MTFJCZTXIFVUSB-IRXDYDNUSA-N 0 3 341.411 2.951 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@H]2CCO[C@@]3(CCSC3)C2)c(F)c1 ZINC000350311732 476129187 /nfs/dbraw/zinc/12/91/87/476129187.db2.gz KCRIGXBFNJGKDO-WFASDCNBSA-N 0 3 326.393 2.878 20 5 EFBDHN CN(C)c1cccnc1CN[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000353633052 476141419 /nfs/dbraw/zinc/14/14/19/476141419.db2.gz VRXOPMJQQRLXPI-CZUORRHYSA-N 0 3 344.419 2.526 20 5 EFBDHN O=C(CSc1ccc([N+](=O)[O-])cc1)N[C@H]1CCN(C2CCCC2)C1 ZINC000359058351 476152390 /nfs/dbraw/zinc/15/23/90/476152390.db2.gz CXGGINVHHNBKNQ-ZDUSSCGKSA-N 0 3 349.456 2.820 20 5 EFBDHN O=[N+]([O-])c1ccc(CCNCc2cnn(CC(F)(F)F)c2)cc1 ZINC000336875268 476159865 /nfs/dbraw/zinc/15/98/65/476159865.db2.gz DFWYUFDFLTVLOU-UHFFFAOYSA-N 0 3 328.294 2.686 20 5 EFBDHN C[C@@H]1[C@@H](C)N(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CCN1C ZINC000357031885 476174566 /nfs/dbraw/zinc/17/45/66/476174566.db2.gz CTZDTNLJNQNNQG-ZIAGYGMSSA-N 0 3 344.415 2.817 20 5 EFBDHN CCCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCN(C)C ZINC000347225932 476185133 /nfs/dbraw/zinc/18/51/33/476185133.db2.gz CIQUFMLZHJHPNF-UHFFFAOYSA-N 0 3 325.434 2.778 20 5 EFBDHN COc1ccc(NC(=O)N2CCCC23CCN(C)CC3)cc1[N+](=O)[O-] ZINC000360391159 476301335 /nfs/dbraw/zinc/30/13/35/476301335.db2.gz CPHBJRWGSYCDQR-UHFFFAOYSA-N 0 3 348.403 2.696 20 5 EFBDHN Cc1occc1C(=O)N1CCC(NCc2cccc([N+](=O)[O-])c2)CC1 ZINC000373941416 476442618 /nfs/dbraw/zinc/44/26/18/476442618.db2.gz MIQCUSACTVTCSH-UHFFFAOYSA-N 0 3 343.383 2.891 20 5 EFBDHN CSC1(CNc2nc3ccccc3cc2[N+](=O)[O-])CCN(C)CC1 ZINC000357557679 476453604 /nfs/dbraw/zinc/45/36/04/476453604.db2.gz INXQBZKEFPUQEU-UHFFFAOYSA-N 0 3 346.456 2.804 20 5 EFBDHN COCc1cccc(CN2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1 ZINC000369683111 476476093 /nfs/dbraw/zinc/47/60/93/476476093.db2.gz IXWRAPRHORACCH-UHFFFAOYSA-N 0 3 330.388 2.775 20 5 EFBDHN CSc1cccc(C(=O)N[C@H]2CN(C3CC3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000362927178 476486397 /nfs/dbraw/zinc/48/63/97/476486397.db2.gz GVNHLQYPLBSSDC-GWCFXTLKSA-N 0 3 335.429 2.529 20 5 EFBDHN CN(C)Cc1ccccc1C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000362930007 476487100 /nfs/dbraw/zinc/48/71/00/476487100.db2.gz IWJITLZBQAJHQS-UHFFFAOYSA-N 0 3 339.395 2.855 20 5 EFBDHN O=C1CC[C@@H](N[C@H]2CCCc3ccc([N+](=O)[O-])cc32)C2(CCC2)N1 ZINC000374808885 476537933 /nfs/dbraw/zinc/53/79/33/476537933.db2.gz OJJVLKBOUMERQX-JKSUJKDBSA-N 0 3 329.400 2.763 20 5 EFBDHN O=c1oc2ccc([N+](=O)[O-])cc2n1CCCN1CCCC2(CC2)C1 ZINC000352278727 476605477 /nfs/dbraw/zinc/60/54/77/476605477.db2.gz DVBKQIDQJRPLRO-UHFFFAOYSA-N 0 3 331.372 2.769 20 5 EFBDHN Cc1ccccc1[C@H]([C@@H](C)NC(=O)c1ccc([N+](=O)[O-])[nH]1)N(C)C ZINC000354383864 476625798 /nfs/dbraw/zinc/62/57/98/476625798.db2.gz GZUWLICUZJLWKQ-WBMJQRKESA-N 0 3 330.388 2.653 20 5 EFBDHN Cn1ccnc1[C@H]1CCCN(CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000365620639 476650476 /nfs/dbraw/zinc/65/04/76/476650476.db2.gz CULPFLBTAXELHS-AWEZNQCLSA-N 0 3 330.388 2.587 20 5 EFBDHN Cc1c([C@H](C)N[C@@H]2CCCN(c3ccnn3C)C2)cccc1[N+](=O)[O-] ZINC000365804877 476708000 /nfs/dbraw/zinc/70/80/00/476708000.db2.gz HGMNVZNZMMEUOT-LSDHHAIUSA-N 0 3 343.431 2.956 20 5 EFBDHN Cc1c([C@@H](C)N[C@H]2CCCN(c3ccnn3C)C2)cccc1[N+](=O)[O-] ZINC000365804874 476709239 /nfs/dbraw/zinc/70/92/39/476709239.db2.gz HGMNVZNZMMEUOT-CABCVRRESA-N 0 3 343.431 2.956 20 5 EFBDHN CC(C)Oc1cc(C(=O)N[C@@H](C)C2=CCN(C)CC2)ccc1[N+](=O)[O-] ZINC000413739376 476714372 /nfs/dbraw/zinc/71/43/72/476714372.db2.gz ZGBFLKMUINALNF-ZDUSSCGKSA-N 0 3 347.415 2.762 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCN(CC)CC1 ZINC000370386138 476783917 /nfs/dbraw/zinc/78/39/17/476783917.db2.gz DKHSHUUWLPSKDW-INIZCTEOSA-N 0 3 333.432 2.718 20 5 EFBDHN CCO[C@@H]1CCCC[C@H]1NCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000452035243 476784704 /nfs/dbraw/zinc/78/47/04/476784704.db2.gz NPYGEZJKCPDKLV-HZPDHXFCSA-N 0 3 335.404 2.779 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1CN[C@H](CC(N)=O)C1CCCCC1 ZINC000430225920 476786004 /nfs/dbraw/zinc/78/60/04/476786004.db2.gz ZMCLELRZVHLEBP-OAHLLOKOSA-N 0 3 335.404 2.517 20 5 EFBDHN CC(C)(CN1CCCC1)NC(=O)CSc1ccccc1[N+](=O)[O-] ZINC000457024535 476835044 /nfs/dbraw/zinc/83/50/44/476835044.db2.gz HDMDXJQBDKKOLC-UHFFFAOYSA-N 0 3 337.445 2.678 20 5 EFBDHN Cc1cc(NC(=O)c2csc([N+](=O)[O-])c2)n(C2CCN(C)CC2)n1 ZINC000430466268 476837765 /nfs/dbraw/zinc/83/77/65/476837765.db2.gz SPTWAUKCCYSLCI-UHFFFAOYSA-N 0 3 349.416 2.680 20 5 EFBDHN CC1(C)CCCN1CCNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000457049957 476847328 /nfs/dbraw/zinc/84/73/28/476847328.db2.gz GFJNYDRLLXVJBN-UHFFFAOYSA-N 0 3 325.796 2.852 20 5 EFBDHN Cc1nn(C)cc1[C@H]1CCCN1CCOc1cccc([N+](=O)[O-])c1 ZINC000366071443 476847460 /nfs/dbraw/zinc/84/74/60/476847460.db2.gz FNYURUBBXNEHDS-QGZVFWFLSA-N 0 3 330.388 2.853 20 5 EFBDHN CC1(C)CCCN1CCNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000457078104 476861534 /nfs/dbraw/zinc/86/15/34/476861534.db2.gz QDBDNUWURPQBQZ-UHFFFAOYSA-N 0 3 346.431 2.773 20 5 EFBDHN CC(C)N1CC[C@@H](N(C)C(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000457080899 476864533 /nfs/dbraw/zinc/86/45/33/476864533.db2.gz CPWVNQOJUHNGKJ-LLVKDONJSA-N 0 3 325.796 2.803 20 5 EFBDHN CSc1cccc(C(=O)N(C)[C@H]2CCN(C(C)C)C2)c1[N+](=O)[O-] ZINC000457083670 476865119 /nfs/dbraw/zinc/86/51/19/476865119.db2.gz GBOBPRQXFGCDJE-LBPRGKRZSA-N 0 3 337.445 2.871 20 5 EFBDHN CC(C)N1CC[C@H](N(C)C(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000457096610 476872832 /nfs/dbraw/zinc/87/28/32/476872832.db2.gz RAXDLLGTTCJGDC-OCCSQVGLSA-N 0 3 337.395 2.779 20 5 EFBDHN O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCNC2(CCCCC2)C1 ZINC000400623275 476893953 /nfs/dbraw/zinc/89/39/53/476893953.db2.gz LSCICDUUHKOMOZ-UHFFFAOYSA-N 0 3 337.807 2.997 20 5 EFBDHN C[C@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)[C@@H](C)CN1 ZINC000415429213 476925195 /nfs/dbraw/zinc/92/51/95/476925195.db2.gz AXLSQKPKLJHGCA-IUCAKERBSA-N 0 3 346.309 2.828 20 5 EFBDHN CC(C)C[C@@H](CN1CCCC1)NC(=O)c1csc([N+](=O)[O-])c1 ZINC000452344788 476925215 /nfs/dbraw/zinc/92/52/15/476925215.db2.gz PLZKGABEKVMXQX-ZDUSSCGKSA-N 0 3 325.434 2.897 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)N1C[C@@H](c2ccccc2)[C@H](N)C1 ZINC000415510741 476933642 /nfs/dbraw/zinc/93/36/42/476933642.db2.gz ZKTLYOSBEVHRAT-JKSUJKDBSA-N 0 3 340.383 2.862 20 5 EFBDHN C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCNCc2ccccc21 ZINC000430928772 476938145 /nfs/dbraw/zinc/93/81/45/476938145.db2.gz MIIQTZNEWZOPJR-ZDUSSCGKSA-N 0 3 340.383 2.532 20 5 EFBDHN COC(=O)[C@@](C)(CNCc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000447094615 476953252 /nfs/dbraw/zinc/95/32/52/476953252.db2.gz UBPDRNAZHHJIQB-SFHVURJKSA-N 0 3 346.358 2.954 20 5 EFBDHN O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2NCc2cn3ccccc3n2)n1 ZINC000447505801 477000392 /nfs/dbraw/zinc/00/03/92/477000392.db2.gz ASTWWXZHNQOIPZ-HUUCEWRRSA-N 0 3 340.387 2.713 20 5 EFBDHN CN1CC[C@H]2[C@@H](CCCN2C(=O)C(C)(C)c2ccccc2[N+](=O)[O-])C1 ZINC000410592849 477026029 /nfs/dbraw/zinc/02/60/29/477026029.db2.gz QEPUWUUMYRREPY-HOCLYGCPSA-N 0 3 345.443 2.815 20 5 EFBDHN Cc1cc(OCC(=O)NCC(C)(C)N2CCCCC2)ccc1[N+](=O)[O-] ZINC000431470605 477034839 /nfs/dbraw/zinc/03/48/39/477034839.db2.gz MAPFFAHQHHADNY-UHFFFAOYSA-N 0 3 349.431 2.663 20 5 EFBDHN CC(C)N1CCN([C@H]2CCN([C@@H](C)c3cccc([N+](=O)[O-])c3)C2)CC1 ZINC000375892989 477066089 /nfs/dbraw/zinc/06/60/89/477066089.db2.gz WSPWVNSMMUYCFA-LPHOPBHVSA-N 0 3 346.475 2.756 20 5 EFBDHN C[C@H]1C[C@H](NC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)CCN1C ZINC000431666436 477071943 /nfs/dbraw/zinc/07/19/43/477071943.db2.gz TYLBXHPCNIQZGL-GXTWGEPZSA-N 0 3 334.420 2.612 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H](CO)[C@@H]3CCCO3)s2)cc1 ZINC000447974066 477107626 /nfs/dbraw/zinc/10/76/26/477107626.db2.gz WGIZCLJLZBLSAI-HOTGVXAUSA-N 0 3 348.424 2.953 20 5 EFBDHN CSc1cccc(C(=O)NC(C)(C)CN2CCCC2)c1[N+](=O)[O-] ZINC000411088889 477109963 /nfs/dbraw/zinc/10/99/63/477109963.db2.gz VPRKUKJSADMKAZ-UHFFFAOYSA-N 0 3 337.445 2.921 20 5 EFBDHN CCNc1ccc(C(=O)NC[C@H]2N(C)CCCC2(C)C)cc1[N+](=O)[O-] ZINC000448056826 477124152 /nfs/dbraw/zinc/12/41/52/477124152.db2.gz RTZPKHODHHAATF-MRXNPFEDSA-N 0 3 348.447 2.877 20 5 EFBDHN O=[N+]([O-])c1ccc(OC(F)F)c(CN[C@@H]2CCc3c[nH]nc3C2)c1 ZINC000371138953 477145678 /nfs/dbraw/zinc/14/56/78/477145678.db2.gz ILGFISRGMZEQIW-LLVKDONJSA-N 0 3 338.314 2.566 20 5 EFBDHN COc1nccc(CN[C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)n1 ZINC000453245588 477197873 /nfs/dbraw/zinc/19/78/73/477197873.db2.gz IEZZYQFYVYUDGX-OAHLLOKOSA-N 0 3 328.372 2.504 20 5 EFBDHN CCCN1CCC(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000448593833 477206483 /nfs/dbraw/zinc/20/64/83/477206483.db2.gz FWYZSEVNOVWDJP-UHFFFAOYSA-N 0 3 347.415 2.548 20 5 EFBDHN C[C@H]1CCCN(CCNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000411414420 477226508 /nfs/dbraw/zinc/22/65/08/477226508.db2.gz MANJFIJCKGTTNI-RRQGHBQHSA-N 0 3 331.416 2.546 20 5 EFBDHN CCc1ccccc1[C@@H](N)CNC(=O)c1cccc(C)c1[N+](=O)[O-] ZINC000423983319 477246085 /nfs/dbraw/zinc/24/60/85/477246085.db2.gz SUVLHCBAAMUECU-INIZCTEOSA-N 0 3 327.384 2.895 20 5 EFBDHN Cc1cc(C(=O)N2C[C@@H](c3cccc(F)c3)[C@H](N)C2)cc([N+](=O)[O-])c1 ZINC000424014461 477261772 /nfs/dbraw/zinc/26/17/72/477261772.db2.gz UVSLRIQKNWZGIZ-DLBZAZTESA-N 0 3 343.358 2.609 20 5 EFBDHN CN(C)c1ccc(C2CCN(CCn3cc([N+](=O)[O-])cn3)CC2)cc1 ZINC000376330003 477286165 /nfs/dbraw/zinc/28/61/65/477286165.db2.gz ATVZENAUGJTGTE-UHFFFAOYSA-N 0 3 343.431 2.737 20 5 EFBDHN CC(C)COC[C@H](O)CN[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433144768 477310964 /nfs/dbraw/zinc/31/09/64/477310964.db2.gz NSOICTFJUDVBCN-RHSMWYFYSA-N 0 3 336.432 2.940 20 5 EFBDHN CC(=O)c1cc([N+](=O)[O-])ccc1N1CC[C@@H](C2CCN(C)CC2)C1 ZINC000376403511 477317594 /nfs/dbraw/zinc/31/75/94/477317594.db2.gz OBCVDDZPQXOURJ-OAHLLOKOSA-N 0 3 331.416 2.966 20 5 EFBDHN CC1(C)CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H]2CCC[C@H]2O1 ZINC000411699595 477335001 /nfs/dbraw/zinc/33/50/01/477335001.db2.gz WYAJKAZKNQPGIH-HZPDHXFCSA-N 0 3 347.415 2.955 20 5 EFBDHN C[C@H]1[C@H](N2CCCC2)CCN1C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000376446140 477338433 /nfs/dbraw/zinc/33/84/33/477338433.db2.gz FJBUQZRCDIVYKY-XHDPSFHLSA-N 0 3 337.807 2.947 20 5 EFBDHN O=[N+]([O-])c1ccc(CCN2CC[C@@](O)(c3ccc(F)cc3)C2)cc1 ZINC000371525912 477370685 /nfs/dbraw/zinc/37/06/85/477370685.db2.gz OWRSXCGAEVWGGE-SFHVURJKSA-N 0 3 330.359 2.870 20 5 EFBDHN CCN1CCCC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412086847 477409314 /nfs/dbraw/zinc/40/93/14/477409314.db2.gz BQIKBZJLJLTPPW-YESZJQIVSA-N 0 3 331.416 2.689 20 5 EFBDHN O=[N+]([O-])c1ccc(Cl)cc1NC1CCN([C@@H]2CCOC2)CC1 ZINC000367263146 477421745 /nfs/dbraw/zinc/42/17/45/477421745.db2.gz BTMSHZMASDRIDH-CYBMUJFWSA-N 0 3 325.796 2.913 20 5 EFBDHN O=C(N[C@@H]1CCN(C2CCCC2)C1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000376620864 477433039 /nfs/dbraw/zinc/43/30/39/477433039.db2.gz UCQVIORINUSERZ-GFCCVEGCSA-N 0 3 337.807 2.995 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N[C@H]1CC(=O)N(c2ccccc2)C1 ZINC000449108018 477442508 /nfs/dbraw/zinc/44/25/08/477442508.db2.gz RVJRQWJBBGFQPH-ZBFHGGJFSA-N 0 3 339.395 2.921 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N[C@H]1CCN(c2ccccc2)C1=O ZINC000449121861 477448790 /nfs/dbraw/zinc/44/87/90/477448790.db2.gz IXHWNFSYPZSJPK-PBHICJAKSA-N 0 3 339.395 2.921 20 5 EFBDHN COc1cccc([C@@H]2C[C@@H](C)CN2CCn2ccc([N+](=O)[O-])n2)c1 ZINC000371716034 477460830 /nfs/dbraw/zinc/46/08/30/477460830.db2.gz MRPOCXPGKYTKEQ-CJNGLKHVSA-N 0 3 330.388 2.883 20 5 EFBDHN CCN(CCNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)C1CC1 ZINC000436321917 477461475 /nfs/dbraw/zinc/46/14/75/477461475.db2.gz ZIKKHFREPJUVIL-UHFFFAOYSA-N 0 3 349.434 2.895 20 5 EFBDHN CC(C)N1CCCC[C@H]1Cn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O ZINC000413001376 477468279 /nfs/dbraw/zinc/46/82/79/477468279.db2.gz PJTLWNZZLNXJKB-HNNXBMFYSA-N 0 3 346.387 2.674 20 5 EFBDHN CC[C@@H](NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC000449235784 477498837 /nfs/dbraw/zinc/49/88/37/477498837.db2.gz HNZCNUIVEAXQRI-MRXNPFEDSA-N 0 3 340.445 2.927 20 5 EFBDHN Cc1cc([N+](=O)[O-])cc(Cl)c1NC[C@H]1CCCN1CCCO ZINC000450594836 477647654 /nfs/dbraw/zinc/64/76/54/477647654.db2.gz LEWMUWXRSYGCHA-GFCCVEGCSA-N 0 3 327.812 2.815 20 5 EFBDHN O=[N+]([O-])c1ccc(NC[C@H]2CCCN2CCCO)c(C(F)(F)F)c1 ZINC000450599580 477648942 /nfs/dbraw/zinc/64/89/42/477648942.db2.gz STWSTTOJHDXSJY-GFCCVEGCSA-N 0 3 347.337 2.872 20 5 EFBDHN CCOc1ccc([C@@H](C)N[C@H]2CCn3ccnc3C2)cc1[N+](=O)[O-] ZINC000427881902 477783738 /nfs/dbraw/zinc/78/37/38/477783738.db2.gz KJAIQKKBFHBWRZ-OCCSQVGLSA-N 0 3 330.388 2.856 20 5 EFBDHN CC[C@H]1CN(Cc2c(Cl)cccc2[N+](=O)[O-])CCN1C[C@@H](C)O ZINC000493819330 477842072 /nfs/dbraw/zinc/84/20/72/477842072.db2.gz MQESFAODTAYTGG-OLZOCXBDSA-N 0 3 341.839 2.525 20 5 EFBDHN C[C@H]1CN(Cc2ccccc2)CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C1 ZINC000456350412 477878269 /nfs/dbraw/zinc/87/82/69/477878269.db2.gz WDGDHJNLXVVHDH-AWEZNQCLSA-N 0 3 342.399 2.517 20 5 EFBDHN C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)C[C@H]1CCCN1C ZINC000421001725 477889705 /nfs/dbraw/zinc/88/97/05/477889705.db2.gz LTMJRXZUTSGXLM-SWLSCSKDSA-N 0 3 345.403 2.732 20 5 EFBDHN Cn1ccnc1[C@H]1OCCC[C@@H]1N[C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000516491919 477941556 /nfs/dbraw/zinc/94/15/56/477941556.db2.gz MQJSGVNMGKDBQR-VYDXJSESSA-N 0 3 342.399 2.826 20 5 EFBDHN Cc1cccc(OC[C@@H](O)CN(C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000516632378 477965967 /nfs/dbraw/zinc/96/59/67/477965967.db2.gz XWYGZRLOGIUCMF-SFHVURJKSA-N 0 3 344.411 2.817 20 5 EFBDHN C[C@H](N[C@@H]1[C@H]2CCCO[C@@H]2C1(C)C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000439615283 478006484 /nfs/dbraw/zinc/00/64/84/478006484.db2.gz FOZQPVVRHAIWIT-SRMUXQRQSA-N 0 3 347.415 2.715 20 5 EFBDHN CC(C)CN1CCCC[C@@H]1CNC(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000439699682 478019536 /nfs/dbraw/zinc/01/95/36/478019536.db2.gz FHJMSYMSBPVTDC-OAHLLOKOSA-N 0 3 337.395 2.974 20 5 EFBDHN C[C@@H]1C[C@@H]1N1CCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@@H](C)C1 ZINC000428999576 478029520 /nfs/dbraw/zinc/02/95/20/478029520.db2.gz VDSPKHHVCBKGDJ-IOASZLSFSA-N 0 3 344.415 2.898 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@@H]1[C@@H]2CCCO[C@H]2C1(C)C ZINC000451474531 478036588 /nfs/dbraw/zinc/03/65/88/478036588.db2.gz APSGHPUYRSTOAL-IAOVAPTHSA-N 0 3 347.415 2.635 20 5 EFBDHN COC(=O)c1ccc(CN(C)CCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000533494297 478089583 /nfs/dbraw/zinc/08/95/83/478089583.db2.gz RSBCOSQTWFLPCI-UHFFFAOYSA-N 0 3 344.367 2.892 20 5 EFBDHN COc1ccc(CCN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000440497920 478124325 /nfs/dbraw/zinc/12/43/25/478124325.db2.gz WSTGJLRQCOYWLC-HNNXBMFYSA-N 0 3 342.399 2.727 20 5 EFBDHN CN1CC[C@@H]2CN(Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)C[C@@H]21 ZINC000451624057 478130781 /nfs/dbraw/zinc/13/07/81/478130781.db2.gz LYFIFMJCYVJUMF-YGRLFVJLSA-N 0 3 329.322 2.750 20 5 EFBDHN CO[C@@H]1CCC[C@H]1N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000451632294 478133538 /nfs/dbraw/zinc/13/35/38/478133538.db2.gz NUVLGXGIBKNXLJ-CUOATXAZSA-N 0 3 341.795 2.732 20 5 EFBDHN CC(C)(C(=O)N1C[C@@H](N)Cc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000518169337 478147001 /nfs/dbraw/zinc/14/70/01/478147001.db2.gz RZAWLXROBTWMLP-HNNXBMFYSA-N 0 3 339.395 2.789 20 5 EFBDHN COC(=O)N1CCC[C@H]([C@H](C)NCc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000495480930 478205592 /nfs/dbraw/zinc/20/55/92/478205592.db2.gz ODOIYLNIHCAUIS-RYUDHWBXSA-N 0 3 339.367 2.690 20 5 EFBDHN COc1cccc(CNCCC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000519540741 478231359 /nfs/dbraw/zinc/23/13/59/478231359.db2.gz BRYIVRXPENBEBF-UHFFFAOYSA-N 0 3 329.356 2.722 20 5 EFBDHN C[C@@H]1C[C@H](NC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])CCN1C ZINC000489401650 478241648 /nfs/dbraw/zinc/24/16/48/478241648.db2.gz LKMPWSBHVQFQPV-CHWSQXEVSA-N 0 3 334.420 2.612 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N[C@@H]2CCN(C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000489624034 478261718 /nfs/dbraw/zinc/26/17/18/478261718.db2.gz HXILKZPLAINFTN-KCQAQPDRSA-N 0 3 334.420 2.746 20 5 EFBDHN Cc1ccc([C@H](C)NC(=O)N[C@H]2CCN(C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000489624036 478261751 /nfs/dbraw/zinc/26/17/51/478261751.db2.gz HXILKZPLAINFTN-YDHLFZDLSA-N 0 3 334.420 2.746 20 5 EFBDHN O=[N+]([O-])c1ccc([C@@H]2CCCN(CCOC[C@H]3CCCO3)C2)cc1 ZINC000562545298 478266137 /nfs/dbraw/zinc/26/61/37/478266137.db2.gz RVRRMOOHPGQACF-SJLPKXTDSA-N 0 3 334.416 2.970 20 5 EFBDHN COC(=O)c1cc(NC(=O)C(C)C(F)(F)F)c(C)c([N+](=O)[O-])c1 ZINC000489742752 478267829 /nfs/dbraw/zinc/26/78/29/478267829.db2.gz ITINLYZJAAYOSS-ZETCQYMHSA-N 0 3 334.250 2.827 20 5 EFBDHN C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)N[C@H]1CCCc2c[nH]nc21 ZINC000536843487 478277408 /nfs/dbraw/zinc/27/74/08/478277408.db2.gz CXOPJDGZGPJUMZ-NHYWBVRUSA-N 0 3 343.387 2.702 20 5 EFBDHN CC(C)Oc1cc(C(=O)N2[C@@H]3CC[C@H]2CCN(C)C3)ccc1[N+](=O)[O-] ZINC000579374962 478284282 /nfs/dbraw/zinc/28/42/82/478284282.db2.gz UENFHFKUZNURMZ-LSDHHAIUSA-N 0 3 347.415 2.691 20 5 EFBDHN COc1cc(C(=O)N2CCCN(C(C)(C)C)CC2)cc([N+](=O)[O-])c1C ZINC000570104074 478284563 /nfs/dbraw/zinc/28/45/63/478284563.db2.gz UBWGOKPZCULMBT-UHFFFAOYSA-N 0 3 349.431 2.858 20 5 EFBDHN COC1CCN(CCNc2nccc3c2cccc3[N+](=O)[O-])CC1 ZINC000590692794 478293933 /nfs/dbraw/zinc/29/39/33/478293933.db2.gz SONUDPMPKZABEA-UHFFFAOYSA-N 0 3 330.388 2.666 20 5 EFBDHN O=c1ccccn1CCN1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000590757321 478323268 /nfs/dbraw/zinc/32/32/68/478323268.db2.gz MRNTYRSJGNOQEN-MRXNPFEDSA-N 0 3 327.384 2.636 20 5 EFBDHN CC(C)Oc1nc(N2CC[C@@]3(C2)CCCN(C)C3)ccc1[N+](=O)[O-] ZINC000579614246 478343338 /nfs/dbraw/zinc/34/33/38/478343338.db2.gz WSBPZVHOOJARLJ-KRWDZBQOSA-N 0 3 334.420 2.699 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CCCC[C@H]2CN(C)C)c1 ZINC000538413139 478359554 /nfs/dbraw/zinc/35/95/54/478359554.db2.gz XAEOTXROMMWSGH-HNNXBMFYSA-N 0 3 349.431 2.615 20 5 EFBDHN O=C(N[C@H]1CCCN2CCCC[C@H]12)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000594422337 478376808 /nfs/dbraw/zinc/37/68/08/478376808.db2.gz XVUPHKVOSUHIMN-DOTOQJQBSA-N 0 3 342.399 2.823 20 5 EFBDHN O=C(N[C@@H]1CCCN2CCCC[C@@H]12)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000594422340 478377029 /nfs/dbraw/zinc/37/70/29/478377029.db2.gz XVUPHKVOSUHIMN-WBVHZDCISA-N 0 3 342.399 2.823 20 5 EFBDHN CC(COC(=O)CN(C(=O)OC(C)(C)C)c1ccccc1)[N+](=O)[O-] ZINC000495902927 478399242 /nfs/dbraw/zinc/39/92/42/478399242.db2.gz KVYIOQMYCGYVFB-GFCCVEGCSA-N 0 3 338.360 2.637 20 5 EFBDHN Cc1c(CC(=O)Nc2cccc3c2CCNC3)cccc1[N+](=O)[O-] ZINC000562976650 478400136 /nfs/dbraw/zinc/40/01/36/478400136.db2.gz NAADYHDMSUKUJY-UHFFFAOYSA-N 0 3 325.368 2.730 20 5 EFBDHN CCO[C@@H]1C[C@H](N[C@@H]2CCc3c2cccc3[N+](=O)[O-])[C@@]12CCCO2 ZINC000570650094 478408757 /nfs/dbraw/zinc/40/87/57/478408757.db2.gz OCWWBNXMDAPGFG-SPUZQDLCSA-N 0 3 332.400 2.898 20 5 EFBDHN O=C(C1CCCC1)N1CC[C@@H](N[C@H]2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000594502800 478415766 /nfs/dbraw/zinc/41/57/66/478415766.db2.gz OUUAHGVQLZXCRO-PBHICJAKSA-N 0 3 343.427 2.963 20 5 EFBDHN O=C(C1CCCC1)N1CC[C@H](N[C@@H]2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000594502802 478416446 /nfs/dbraw/zinc/41/64/46/478416446.db2.gz OUUAHGVQLZXCRO-WMLDXEAASA-N 0 3 343.427 2.963 20 5 EFBDHN C[C@H](N[C@H]1CCCN2CCCC[C@H]12)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000594554162 478434612 /nfs/dbraw/zinc/43/46/12/478434612.db2.gz OPIXAJONSAGRPU-RRQGHBQHSA-N 0 3 346.431 2.528 20 5 EFBDHN COC(=O)c1cc(C)nc(N[C@@H]2CCCN3CCCC[C@@H]23)c1[N+](=O)[O-] ZINC000594603780 478462357 /nfs/dbraw/zinc/46/23/57/478462357.db2.gz VTRMBSLUVKXXTK-KGLIPLIRSA-N 0 3 348.403 2.514 20 5 EFBDHN O=[N+]([O-])c1cnc(N[C@H]2CCN(CC3CC3)C2)c(C(F)(F)F)c1 ZINC000591146259 478474110 /nfs/dbraw/zinc/47/41/10/478474110.db2.gz RAGRZRVQQCIWQZ-JTQLQIEISA-N 0 3 330.310 2.905 20 5 EFBDHN CN1CC[C@]2(C1)CCCN(C(=O)c1cc3cc([N+](=O)[O-])ccc3o1)C2 ZINC000597713673 478476251 /nfs/dbraw/zinc/47/62/51/478476251.db2.gz FKSVXRGAUZOHAE-SFHVURJKSA-N 0 3 343.383 2.899 20 5 EFBDHN C[C@@H](NC[C@@H]1COCCN1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000600712235 478478706 /nfs/dbraw/zinc/47/87/06/478478706.db2.gz VEYNSEQQGHBNPB-CHWSQXEVSA-N 0 3 347.440 2.962 20 5 EFBDHN C[C@@H](NC[C@H]1COCCN1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000600712237 478479495 /nfs/dbraw/zinc/47/94/95/478479495.db2.gz VEYNSEQQGHBNPB-OLZOCXBDSA-N 0 3 347.440 2.962 20 5 EFBDHN CC(C)Oc1nc(N2CCC[C@H]3CN(C)CC[C@H]32)ccc1[N+](=O)[O-] ZINC000582013861 478491818 /nfs/dbraw/zinc/49/18/18/478491818.db2.gz ZECATHXHKKOSGO-UONOGXRCSA-N 0 3 334.420 2.698 20 5 EFBDHN CC(C)(CNCc1cc2c(cc1[N+](=O)[O-])OCCO2)OCC1CC1 ZINC000591263553 478501567 /nfs/dbraw/zinc/50/15/67/478501567.db2.gz MUVOIMCNQLGMTM-UHFFFAOYSA-N 0 3 336.388 2.661 20 5 EFBDHN CC(C)(CNCc1cc2c(cc1[N+](=O)[O-])OCCO2)c1cccnc1 ZINC000591266119 478501732 /nfs/dbraw/zinc/50/17/32/478501732.db2.gz OBZSPTAQVISAHV-UHFFFAOYSA-N 0 3 343.383 2.828 20 5 EFBDHN CC(C)(C)N1CC[C@H](NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])C1 ZINC000597923709 478577925 /nfs/dbraw/zinc/57/79/25/478577925.db2.gz OPTAHCDTRXRGKT-ZDUSSCGKSA-N 0 3 333.432 2.861 20 5 EFBDHN CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCN(C(C)(C)C)C2)c1 ZINC000597925782 478578801 /nfs/dbraw/zinc/57/88/01/478578801.db2.gz RDSORPZKZSCEPT-LLVKDONJSA-N 0 3 337.445 2.919 20 5 EFBDHN CC[C@@H]1CC[C@@H](C)N1Cc1ccc(OCC(=O)OC)c([N+](=O)[O-])c1 ZINC000582448070 478600333 /nfs/dbraw/zinc/60/03/33/478600333.db2.gz PZURWHYZRCVNOL-TZMCWYRMSA-N 0 3 336.388 2.910 20 5 EFBDHN C[C@]1(c2ccccc2)C[C@@H]1NC[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000591744295 478618512 /nfs/dbraw/zinc/61/85/12/478618512.db2.gz PEKQPWDWWJYOGS-ZYSHUDEJSA-N 0 3 342.395 2.654 20 5 EFBDHN CC(C)(CNCc1ccc([N+](=O)[O-])cc1Cl)[C@]1(O)CCCOC1 ZINC000594997499 478623673 /nfs/dbraw/zinc/62/36/73/478623673.db2.gz XMXYUUCJDMGGLI-INIZCTEOSA-N 0 3 342.823 2.906 20 5 EFBDHN O=C(CCN[C@@H]1COCc2ccccc21)Nc1ccccc1[N+](=O)[O-] ZINC000591770824 478625855 /nfs/dbraw/zinc/62/58/55/478625855.db2.gz LCSFSABQLVKEQM-MRXNPFEDSA-N 0 3 341.367 2.785 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@H]1CCc2nc(C)ncc2C1 ZINC000595006028 478626631 /nfs/dbraw/zinc/62/66/31/478626631.db2.gz DZUBARBHQYUEHI-FZMZJTMJSA-N 0 3 342.399 2.910 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC1CCN(C(=O)C2CC2)CC1 ZINC000595008536 478626799 /nfs/dbraw/zinc/62/67/99/478626799.db2.gz VAFRFUOUJDWFJS-GFCCVEGCSA-N 0 3 347.415 2.655 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC1CCN(C(=O)C2CC2)CC1 ZINC000595008537 478627156 /nfs/dbraw/zinc/62/71/56/478627156.db2.gz VAFRFUOUJDWFJS-LBPRGKRZSA-N 0 3 347.415 2.655 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H]1CCC[C@@H](C(=O)N(C)C)C1 ZINC000595007342 478627277 /nfs/dbraw/zinc/62/72/77/478627277.db2.gz HJVOKZCCQRWFON-BFHYXJOUSA-N 0 3 349.431 2.901 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H]1CCO[C@@]2(CCOC2)C1 ZINC000595028548 478634208 /nfs/dbraw/zinc/63/42/08/478634208.db2.gz UTEKANYDXYMMRR-AHIWAGSCSA-N 0 3 336.388 2.592 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H]1CCO[C@]2(CCOC2)C1 ZINC000595028555 478634521 /nfs/dbraw/zinc/63/45/21/478634521.db2.gz UTEKANYDXYMMRR-OGHNNQOOSA-N 0 3 336.388 2.592 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NCCCNC(=O)C1CCC1 ZINC000595027588 478634899 /nfs/dbraw/zinc/63/48/99/478634899.db2.gz QJSYSYNTMYDTLJ-LBPRGKRZSA-N 0 3 335.404 2.560 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@H](CO)Cc1ccc(F)cc1 ZINC000595036596 478637844 /nfs/dbraw/zinc/63/78/44/478637844.db2.gz SMCGUIQBWJIGCZ-WFASDCNBSA-N 0 3 348.374 2.997 20 5 EFBDHN O=[N+]([O-])c1ccc(OC[C@]2(O)CCN(Cc3ccccc3)C2)c(F)c1 ZINC000601068559 478639652 /nfs/dbraw/zinc/63/96/52/478639652.db2.gz HCMAWZXFCSGMLT-SFHVURJKSA-N 0 3 346.358 2.750 20 5 EFBDHN COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@H]1CCCN(C(C)=O)C1 ZINC000595046606 478640247 /nfs/dbraw/zinc/64/02/47/478640247.db2.gz CUWPEYXJCRAPHM-GXTWGEPZSA-N 0 3 335.404 2.513 20 5 EFBDHN CCOC(=O)Cc1ccc(NC2CCN(C3CC3)CC2)c([N+](=O)[O-])c1 ZINC000591892666 478679295 /nfs/dbraw/zinc/67/92/95/478679295.db2.gz KOXBUHSJGYZFDP-UHFFFAOYSA-N 0 3 347.415 2.739 20 5 EFBDHN COc1ccccc1C[C@@](C)(CO)NCc1ccc([N+](=O)[O-])cc1 ZINC000601152375 478690729 /nfs/dbraw/zinc/69/07/29/478690729.db2.gz CYWZDPBZLJRKJM-SFHVURJKSA-N 0 3 330.384 2.687 20 5 EFBDHN COc1ccccc1C[C@](C)(CO)NCc1ccc([N+](=O)[O-])cc1 ZINC000601152372 478691032 /nfs/dbraw/zinc/69/10/32/478691032.db2.gz CYWZDPBZLJRKJM-GOSISDBHSA-N 0 3 330.384 2.687 20 5 EFBDHN COc1ccccc1C[C@](C)(CO)NCc1ccc(C)c([N+](=O)[O-])c1 ZINC000601153162 478692680 /nfs/dbraw/zinc/69/26/80/478692680.db2.gz KLBIUQGCJTYCDS-LJQANCHMSA-N 0 3 344.411 2.995 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H]2COCC[C@H]2O)s1 ZINC000601160716 478698093 /nfs/dbraw/zinc/69/80/93/478698093.db2.gz ZBWWGVOMXRPJJL-UKRRQHHQSA-N 0 3 334.397 2.563 20 5 EFBDHN Cc1cccc2c1CC[C@H]2NC[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000582840403 478699427 /nfs/dbraw/zinc/69/94/27/478699427.db2.gz VZOHXJCNQVWAIO-DNVCBOLYSA-N 0 3 342.395 2.920 20 5 EFBDHN CCc1ccc([C@@H](CO)NCCOc2cccc([N+](=O)[O-])c2)cc1 ZINC000542913048 478706291 /nfs/dbraw/zinc/70/62/91/478706291.db2.gz CFANPDIBOGTDRY-GOSISDBHSA-N 0 3 330.384 2.859 20 5 EFBDHN O=C(N[C@H]1CCN(C2CCCCC2)C1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000598218536 478710055 /nfs/dbraw/zinc/71/00/55/478710055.db2.gz HNSYNSQQHFXEFC-AWEZNQCLSA-N 0 3 335.379 2.871 20 5 EFBDHN CCCN(C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)[C@@H]1CCN(C)C1 ZINC000591925659 478710078 /nfs/dbraw/zinc/71/00/78/478710078.db2.gz KEZMBJZSDAKINS-CZUORRHYSA-N 0 3 334.420 2.782 20 5 EFBDHN CCCN(C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)[C@H]1CCN(C)C1 ZINC000591925657 478710699 /nfs/dbraw/zinc/71/06/99/478710699.db2.gz KEZMBJZSDAKINS-CJNGLKHVSA-N 0 3 334.420 2.782 20 5 EFBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2NCCc1nnc2n1CCCCC2 ZINC000564226334 478711397 /nfs/dbraw/zinc/71/13/97/478711397.db2.gz VCMBEFSARZUEMP-OAHLLOKOSA-N 0 3 341.415 2.732 20 5 EFBDHN CC[C@@H](CC(F)F)CN1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000595289709 478714482 /nfs/dbraw/zinc/71/44/82/478714482.db2.gz VRVKVTZXCDGREG-LBPRGKRZSA-N 0 3 328.363 2.793 20 5 EFBDHN CC[C@H](CC(F)F)CN1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000595289708 478714619 /nfs/dbraw/zinc/71/46/19/478714619.db2.gz VRVKVTZXCDGREG-GFCCVEGCSA-N 0 3 328.363 2.793 20 5 EFBDHN C[C@H](CN1CCC(C)CC1)NC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000598265919 478733129 /nfs/dbraw/zinc/73/31/29/478733129.db2.gz VZLWESDLAZPYSE-OAHLLOKOSA-N 0 3 333.432 2.764 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1N[C@H](CO)CN1CCCCC1 ZINC000564494188 478751339 /nfs/dbraw/zinc/75/13/39/478751339.db2.gz FBIPHCTXHYRLAJ-LBPRGKRZSA-N 0 3 347.337 2.872 20 5 EFBDHN CCC[C@@H]1CN(Cc2ccc(F)cc2[N+](=O)[O-])CCN1CCOC ZINC000595403965 478762877 /nfs/dbraw/zinc/76/28/77/478762877.db2.gz KKWHRYYPPLOXOK-MRXNPFEDSA-N 0 3 339.411 2.667 20 5 EFBDHN CCN(Cc1onc(C)c1[N+](=O)[O-])[C@@H]1CCN(Cc2ccccc2)C1 ZINC000595438379 478781999 /nfs/dbraw/zinc/78/19/99/478781999.db2.gz OQGWYVVRZABOSL-MRXNPFEDSA-N 0 3 344.415 2.988 20 5 EFBDHN C[C@H](CN1CCC(C)CC1)NC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000595453078 478793427 /nfs/dbraw/zinc/79/34/27/478793427.db2.gz ORGXTLNWLXEOPF-CQSZACIVSA-N 0 3 334.420 2.514 20 5 EFBDHN CC[C@@H](CC(F)(F)F)NC[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000583259179 478806897 /nfs/dbraw/zinc/80/68/97/478806897.db2.gz XEYZRDQIZKAPBF-CMPLNLGQSA-N 0 3 336.310 2.655 20 5 EFBDHN CCCN1CC[C@@H](NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000595520984 478831907 /nfs/dbraw/zinc/83/19/07/478831907.db2.gz UVZZVIJIRFVZEI-MRXNPFEDSA-N 0 3 348.447 2.701 20 5 EFBDHN CN(CCOc1cccc([N+](=O)[O-])c1)[C@@H](CO)Cc1ccccc1 ZINC000595594613 478874514 /nfs/dbraw/zinc/87/45/14/478874514.db2.gz GMBKNSRAYQRQIN-QGZVFWFLSA-N 0 3 330.384 2.509 20 5 EFBDHN COc1ccc(CN(C)[C@@H](CO)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000595595167 478875097 /nfs/dbraw/zinc/87/50/97/478875097.db2.gz HPNJLGWCXXHZOK-MRXNPFEDSA-N 0 3 330.384 2.639 20 5 EFBDHN CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCCN1CC[C@H](C)C1 ZINC000545201457 478896801 /nfs/dbraw/zinc/89/68/01/478896801.db2.gz BQNDMOUJIPNAES-HOCLYGCPSA-N 0 3 333.432 2.622 20 5 EFBDHN CC(C)[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCN1 ZINC000598571153 478901836 /nfs/dbraw/zinc/90/18/36/478901836.db2.gz HANSCXKGLWBSEG-LBPRGKRZSA-N 0 3 345.321 2.684 20 5 EFBDHN C[C@@H](C1CCN(C)CC1)N(C)C(=O)/C=C/c1cccc([N+](=O)[O-])c1 ZINC000492320397 478928317 /nfs/dbraw/zinc/92/83/17/478928317.db2.gz OUBGDKALKLLBRD-NPQIQWPPSA-N 0 3 331.416 2.797 20 5 EFBDHN C[C@@H](C1CCN(C)CC1)N(C)C(=O)/C=C\c1ccc(F)cc1[N+](=O)[O-] ZINC000492344333 478941711 /nfs/dbraw/zinc/94/17/11/478941711.db2.gz XIAFKAUWTRLWEO-VGVVRCBHSA-N 0 3 349.406 2.936 20 5 EFBDHN O=[N+]([O-])c1ccc(S(=O)(=O)CCNCC2(C3CC3)CCC2)cc1 ZINC000583807651 478947016 /nfs/dbraw/zinc/94/70/16/478947016.db2.gz UGMWPXUTARTRNW-UHFFFAOYSA-N 0 3 338.429 2.538 20 5 EFBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@@H](CN2CCCC2=O)C1 ZINC000595828127 479020015 /nfs/dbraw/zinc/02/00/15/479020015.db2.gz HZUQBVWUQHXEGJ-LSDHHAIUSA-N 0 3 331.416 2.909 20 5 EFBDHN O=[N+]([O-])c1ccn(CCN2CCC3(CCc4ccccc4O3)CC2)n1 ZINC000595829669 479022959 /nfs/dbraw/zinc/02/29/59/479022959.db2.gz YPEOSFHKYXJRAW-UHFFFAOYSA-N 0 3 342.399 2.651 20 5 EFBDHN C[C@@H]1[C@H](C(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)CCN1C ZINC000592767316 479033723 /nfs/dbraw/zinc/03/37/23/479033723.db2.gz VPIFZRCGAQQPIF-XFJVYGCCSA-N 0 3 335.429 2.509 20 5 EFBDHN CC[C@H]1CCC[C@H]1CNCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000565654557 479054972 /nfs/dbraw/zinc/05/49/72/479054972.db2.gz MHXDOSYPTGAOEB-KBPBESRZSA-N 0 3 340.445 2.784 20 5 EFBDHN CCCN(C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(C)C1 ZINC000592829787 479062382 /nfs/dbraw/zinc/06/23/82/479062382.db2.gz YZUIWHUTOKLVKR-IXDOHACOSA-N 0 3 331.416 2.641 20 5 EFBDHN CCCN(C(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F)[C@@H]1CCN(C)C1 ZINC000592828036 479063329 /nfs/dbraw/zinc/06/33/29/479063329.db2.gz ADLILAVYQJGXPD-TZMCWYRMSA-N 0 3 337.395 2.780 20 5 EFBDHN COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N(C)C[C@H]1CC1(C)C ZINC000595908720 479064734 /nfs/dbraw/zinc/06/47/34/479064734.db2.gz KBBYQFZPMLTJKL-NWDGAFQWSA-N 0 3 335.404 2.908 20 5 EFBDHN C[C@H](NC(=O)c1cc2c(s1)CCNC2)c1cccc([N+](=O)[O-])c1 ZINC000595918425 479071626 /nfs/dbraw/zinc/07/16/26/479071626.db2.gz CJHGKJSCUZDXGB-JTQLQIEISA-N 0 3 331.397 2.793 20 5 EFBDHN C[C@@H](C(=O)NC[C@H](C)N1CCC(C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000573654083 479110882 /nfs/dbraw/zinc/11/08/82/479110882.db2.gz DKNQEVILYRMNDR-LSDHHAIUSA-N 0 3 333.432 2.935 20 5 EFBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCC(N2CCOC[C@H]2C)CC1 ZINC000573664533 479115644 /nfs/dbraw/zinc/11/56/44/479115644.db2.gz FCDABZKMQZGEFX-HUUCEWRRSA-N 0 3 333.432 2.841 20 5 EFBDHN CCN(CC)[C@H](CNc1ccc(N)c([N+](=O)[O-])n1)c1ccsc1 ZINC000596072821 479122098 /nfs/dbraw/zinc/12/20/98/479122098.db2.gz AAKILDAMTYSCRJ-CYBMUJFWSA-N 0 3 335.433 2.550 20 5 EFBDHN Cc1cc(N2CCC(CN3CCOCC3)CC2)c([N+](=O)[O-])s1 ZINC000596076483 479123601 /nfs/dbraw/zinc/12/36/01/479123601.db2.gz GAGLKTSVJWUPLG-UHFFFAOYSA-N 0 3 325.434 2.513 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)F)ccc1NCCCN1CCC(O)CC1 ZINC000596085915 479128614 /nfs/dbraw/zinc/12/86/14/479128614.db2.gz OFFIGDIDWMHAPB-UHFFFAOYSA-N 0 3 329.347 2.791 20 5 EFBDHN Cc1ccc(CNCC[C@@H](O)COCc2ccccc2)cc1[N+](=O)[O-] ZINC000599023037 479129893 /nfs/dbraw/zinc/12/98/93/479129893.db2.gz QHVSAXMCHHJVRI-GOSISDBHSA-N 0 3 344.411 2.961 20 5 EFBDHN O=c1[nH]ccc(NC2CCN(Cc3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000596087981 479130605 /nfs/dbraw/zinc/13/06/05/479130605.db2.gz IXXPWSTVYSQVOW-UHFFFAOYSA-N 0 3 346.362 2.911 20 5 EFBDHN CN(C)Cc1cccc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)c1 ZINC000515190276 479130784 /nfs/dbraw/zinc/13/07/84/479130784.db2.gz LZIIYOKLZZPMPH-UHFFFAOYSA-N 0 3 343.339 2.637 20 5 EFBDHN C[C@@H](CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-])N1CCCC[C@@H]1C ZINC000593027964 479132694 /nfs/dbraw/zinc/13/26/94/479132694.db2.gz HKNQPTMBXOHRAC-STQMWFEESA-N 0 3 337.395 2.656 20 5 EFBDHN CC1CC[NH+](C[C@@H]2CCCN(c3cc[n-]c(=O)c3[N+](=O)[O-])C2)CC1 ZINC000596097193 479136844 /nfs/dbraw/zinc/13/68/44/479136844.db2.gz FYORIGYCHUDFRZ-AWEZNQCLSA-N 0 3 334.420 2.644 20 5 EFBDHN CC(C)O[C@H]1CCCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000593055594 479146811 /nfs/dbraw/zinc/14/68/11/479146811.db2.gz MRIOWMXXRLBEEQ-AWEZNQCLSA-N 0 3 335.404 2.813 20 5 EFBDHN CN(C)C/C=C\C(=O)N[C@H](c1cccc([N+](=O)[O-])c1F)C(F)(F)F ZINC000493759962 479149190 /nfs/dbraw/zinc/14/91/90/479149190.db2.gz RYABGMHBVHYHMB-LLPBQKLSSA-N 0 3 349.284 2.571 20 5 EFBDHN O=c1ccc([C@@H]2OCC[C@H]2N[C@@H]2CCc3c2cccc3[N+](=O)[O-])c[nH]1 ZINC000599078873 479152763 /nfs/dbraw/zinc/15/27/63/479152763.db2.gz GOMXZQHTXAHXHW-RKVPGOIHSA-N 0 3 341.367 2.803 20 5 EFBDHN CCOc1ccc(NC(=O)CNC2(C3CCC3)CC2)c([N+](=O)[O-])c1 ZINC000593081033 479161646 /nfs/dbraw/zinc/16/16/46/479161646.db2.gz PXUUAEBNYAMQBB-UHFFFAOYSA-N 0 3 333.388 2.854 20 5 EFBDHN CN1CCC[C@H](CNc2ccc(N)c([N+](=O)[O-])n2)[C@H]1c1cccs1 ZINC000596146069 479162823 /nfs/dbraw/zinc/16/28/23/479162823.db2.gz KWYKLXKQXUUEFL-ABAIWWIYSA-N 0 3 347.444 2.550 20 5 EFBDHN Cc1nc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)ccc1[N+](=O)[O-] ZINC000593088014 479166496 /nfs/dbraw/zinc/16/64/96/479166496.db2.gz ZZAIKHLIUNVFPC-VHSXEESVSA-N 0 3 347.293 2.984 20 5 EFBDHN Cc1cc(N2CC[C@H](N3CCN(C(C)C)CC3)C2)c([N+](=O)[O-])s1 ZINC000596157907 479169484 /nfs/dbraw/zinc/16/94/84/479169484.db2.gz JREOJHIRCPBCCY-AWEZNQCLSA-N 0 3 338.477 2.569 20 5 EFBDHN C[C@H]1C[C@H](Nc2cc[n-]c(=O)c2[N+](=O)[O-])C[N@@H+]1Cc1ccccc1 ZINC000596163374 479173037 /nfs/dbraw/zinc/17/30/37/479173037.db2.gz SNMGZPJCDOCIAU-JSGCOSHPSA-N 0 3 328.372 2.770 20 5 EFBDHN C[C@H]1C[C@H](Nc2cc[n-]c(=O)c2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000596163374 479173047 /nfs/dbraw/zinc/17/30/47/479173047.db2.gz SNMGZPJCDOCIAU-JSGCOSHPSA-N 0 3 328.372 2.770 20 5 EFBDHN CC(C)[C@@H]1CN(c2ncc([N+](=O)[O-])cn2)CCN1Cc1ccccc1 ZINC000599143052 479178911 /nfs/dbraw/zinc/17/89/11/479178911.db2.gz OMEHLNHLKUMZLM-KRWDZBQOSA-N 0 3 341.415 2.732 20 5 EFBDHN CS[C@H]1CN(c2cc(C)sc2[N+](=O)[O-])C[C@@H]1N1CCCC1 ZINC000596195872 479192342 /nfs/dbraw/zinc/19/23/42/479192342.db2.gz PEERCRARTFJUKQ-STQMWFEESA-N 0 3 327.475 2.981 20 5 EFBDHN CN(C)[C@@H](CC(=O)NCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000574022664 479196160 /nfs/dbraw/zinc/19/61/60/479196160.db2.gz SQSYUIPZPIVLFL-KRWDZBQOSA-N 0 3 327.384 2.904 20 5 EFBDHN CC(C)(NCCOc1ccccc1[N+](=O)[O-])C(=O)Nc1ccccc1 ZINC000610844331 479204766 /nfs/dbraw/zinc/20/47/66/479204766.db2.gz IRCJDGLJUCEPEB-UHFFFAOYSA-N 0 3 343.383 2.981 20 5 EFBDHN Cc1c(NC(=O)CCN(C)CCOC(C)(C)C)cccc1[N+](=O)[O-] ZINC000610859660 479212069 /nfs/dbraw/zinc/21/20/69/479212069.db2.gz GKNSTFLKSZPHHY-UHFFFAOYSA-N 0 3 337.420 2.979 20 5 EFBDHN CC[C@@H](C)N[C@@H](CNc1ccc([N+](=O)[O-])c(C(N)=O)c1)c1ccco1 ZINC000596231247 479213138 /nfs/dbraw/zinc/21/31/38/479213138.db2.gz OIQXFPIFADAYJQ-RISCZKNCSA-N 0 3 346.387 2.828 20 5 EFBDHN CN1CCN(c2ncnc3cccc([N+](=O)[O-])c32)CC12CCCCC2 ZINC000596251388 479224118 /nfs/dbraw/zinc/22/41/18/479224118.db2.gz RTUQEHNOENPDER-UHFFFAOYSA-N 0 3 341.415 2.993 20 5 EFBDHN Cc1cc(C(=O)N2CCCN(c3ccncc3)CC2)ccc1[N+](=O)[O-] ZINC000603081835 479237906 /nfs/dbraw/zinc/23/79/06/479237906.db2.gz DHFHYVDPHAXLOR-UHFFFAOYSA-N 0 3 340.383 2.651 20 5 EFBDHN C[C@@H]1[C@@H](C)N(Cc2ccccc2)[C@@H](C)CN1c1ncc([N+](=O)[O-])cn1 ZINC000585090419 479278889 /nfs/dbraw/zinc/27/88/89/479278889.db2.gz LUZLHCKTXNGPAX-RRFJBIMHSA-N 0 3 341.415 2.873 20 5 EFBDHN O=C(c1c[nH]c2cccc([N+](=O)[O-])c12)N1CC[C@H](N2CCCCC2)C1 ZINC000611195910 479307831 /nfs/dbraw/zinc/30/78/31/479307831.db2.gz MSFRMSIAUKNNNU-ZDUSSCGKSA-N 0 3 342.399 2.777 20 5 EFBDHN O=[N+]([O-])c1ccc(Cn2cc(CNC3CCCCC3)nn2)c(F)c1 ZINC000603223228 479309996 /nfs/dbraw/zinc/30/99/96/479309996.db2.gz GFYAHOLNQWKEOM-UHFFFAOYSA-N 0 3 333.367 2.796 20 5 EFBDHN CCOc1ccc([C@H](C)NCCOC[C@H]2CCOC2)cc1[N+](=O)[O-] ZINC000611248450 479322417 /nfs/dbraw/zinc/32/24/17/479322417.db2.gz GDCPUWUUPLBTQM-KBPBESRZSA-N 0 3 338.404 2.697 20 5 EFBDHN O=[N+]([O-])c1ccccc1/C=C\CN1CCCN(C[C@@H]2CCCO2)CC1 ZINC000611254048 479325199 /nfs/dbraw/zinc/32/51/99/479325199.db2.gz KFXRYXCSIAKSTJ-BHSUKZTGSA-N 0 3 345.443 2.795 20 5 EFBDHN CN1CCC2(CCCN2C(=O)CSc2ccc([N+](=O)[O-])cc2)CC1 ZINC000611260562 479326818 /nfs/dbraw/zinc/32/68/18/479326818.db2.gz YQXUBIYAZQKSLS-UHFFFAOYSA-N 0 3 349.456 2.774 20 5 EFBDHN C[C@H](CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-])N1CCC[C@@H](C)C1 ZINC000593407967 479328458 /nfs/dbraw/zinc/32/84/58/479328458.db2.gz PFDIIZXSFRFTJC-CHWSQXEVSA-N 0 3 337.395 2.513 20 5 EFBDHN CC(C)c1ccc(CN2CCN([C@H]3CCC[C@@H]3O)CC2)cc1[N+](=O)[O-] ZINC000611268466 479330467 /nfs/dbraw/zinc/33/04/67/479330467.db2.gz SWMNTISLJRXIMX-HKUYNNGSSA-N 0 3 347.459 2.749 20 5 EFBDHN C[C@H](CN1CCC[C@@H](C)C1)NC(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000593419315 479333414 /nfs/dbraw/zinc/33/34/14/479333414.db2.gz FKLZBYLQFUZMGS-CHWSQXEVSA-N 0 3 337.395 2.513 20 5 EFBDHN Cn1cc(C[C@@H]2CCN(C/C=C\c3ccccc3[N+](=O)[O-])C2)cn1 ZINC000611276250 479335329 /nfs/dbraw/zinc/33/53/29/479335329.db2.gz FMDRCLSNFNMVES-VOKGJARPSA-N 0 3 326.400 2.906 20 5 EFBDHN O=C(Cc1ccc(F)cc1[N+](=O)[O-])N1CCCN(C2CCCC2)CC1 ZINC000593479298 479359632 /nfs/dbraw/zinc/35/96/32/479359632.db2.gz AHMKFMYNLXGSRC-UHFFFAOYSA-N 0 3 349.406 2.753 20 5 EFBDHN COC(=O)c1ccc(-c2ccc(OCCN(C)C)cc2)c([N+](=O)[O-])c1 ZINC000596635595 479366289 /nfs/dbraw/zinc/36/62/89/479366289.db2.gz FVMFMASJLJWROL-UHFFFAOYSA-N 0 3 344.367 2.989 20 5 EFBDHN CC(=O)N1CCC(NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602501409 479370927 /nfs/dbraw/zinc/37/09/27/479370927.db2.gz GMZVIISUGXCIOI-UHFFFAOYSA-N 0 3 345.321 2.714 20 5 EFBDHN CC(C)N1CCN(C2CCN(c3sccc3[N+](=O)[O-])CC2)CC1 ZINC000611414013 479371981 /nfs/dbraw/zinc/37/19/81/479371981.db2.gz AXALMZPAPJZHBQ-UHFFFAOYSA-N 0 3 338.477 2.651 20 5 EFBDHN CN1CCC(NCc2cc(Br)c([N+](=O)[O-])s2)CC1 ZINC000602504080 479372148 /nfs/dbraw/zinc/37/21/48/479372148.db2.gz RSBSAWJCSARYFY-UHFFFAOYSA-N 0 3 334.239 2.603 20 5 EFBDHN CCN1CCC[C@@H]1CNCc1cc(Br)c([N+](=O)[O-])s1 ZINC000602510125 479375280 /nfs/dbraw/zinc/37/52/80/479375280.db2.gz QZSCTPRAUORFKV-SECBINFHSA-N 0 3 348.266 2.993 20 5 EFBDHN C[C@@H](CN1CCC[C@H](C)C1)NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602524512 479381516 /nfs/dbraw/zinc/38/15/16/479381516.db2.gz KVJHZCMUFBHBGP-STQMWFEESA-N 0 3 332.404 2.946 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN[C@H]1CCN(C2CC2)C1 ZINC000602545814 479391828 /nfs/dbraw/zinc/39/18/28/479391828.db2.gz PYGIGSBYSQXYHM-LBPRGKRZSA-N 0 3 329.322 2.940 20 5 EFBDHN C[C@@H](CNCc1cc(Br)c([N+](=O)[O-])s1)C[C@H](C)O ZINC000602557773 479396325 /nfs/dbraw/zinc/39/63/25/479396325.db2.gz ILKUPTNOTDRITE-SFYZADRCSA-N 0 3 337.239 2.915 20 5 EFBDHN O=[N+]([O-])c1ccc2oc(CN[C@H]3CCO[C@]4(CCSC4)C3)nc2c1 ZINC000602566668 479400610 /nfs/dbraw/zinc/40/06/10/479400610.db2.gz AKWRLOGXOWLHOP-MEDUHNTESA-N 0 3 349.412 2.880 20 5 EFBDHN O=[N+]([O-])c1ccc2oc(CN[C@@H]3CCOC4(CCOCC4)C3)nc2c1 ZINC000602568769 479400719 /nfs/dbraw/zinc/40/07/19/479400719.db2.gz MFENVOPEPIFDKK-GFCCVEGCSA-N 0 3 347.371 2.554 20 5 EFBDHN O=[N+]([O-])c1ccn(C2CCN(Cc3cc4cnccc4o3)CC2)n1 ZINC000593620148 479405121 /nfs/dbraw/zinc/40/51/21/479405121.db2.gz GKUANPKPEFZUQS-UHFFFAOYSA-N 0 3 327.344 2.770 20 5 EFBDHN CN1CCN(CCCCNc2ccc([N+](=O)[O-])c3cnccc23)CC1 ZINC000603628841 479415282 /nfs/dbraw/zinc/41/52/82/479415282.db2.gz DITWHPCTSCIZIM-UHFFFAOYSA-N 0 3 343.431 2.583 20 5 EFBDHN COC[C@H]1C[C@@H](O)CN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000593674469 479419637 /nfs/dbraw/zinc/41/96/37/479419637.db2.gz VAQYSMLAWANMGP-HUUCEWRRSA-N 0 3 348.424 2.905 20 5 EFBDHN COc1ccc(-c2ccc(CN[C@H](CO)CCF)o2)c([N+](=O)[O-])c1 ZINC000593690496 479423870 /nfs/dbraw/zinc/42/38/70/479423870.db2.gz ZYTOIAIKDFVJJK-NSHDSACASA-N 0 3 338.335 2.674 20 5 EFBDHN Cn1ccc(CCNCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 ZINC000602616539 479425346 /nfs/dbraw/zinc/42/53/46/479425346.db2.gz LQMJPIFFVMUQBL-UHFFFAOYSA-N 0 3 328.294 2.679 20 5 EFBDHN CCOc1ccc([C@H](C)NCC[C@@]2(O)CCCOC2)cc1[N+](=O)[O-] ZINC000593720959 479434350 /nfs/dbraw/zinc/43/43/50/479434350.db2.gz NMXWLSFFWNCOEM-GUYCJALGSA-N 0 3 338.404 2.576 20 5 EFBDHN CN(C[C@@]1(O)CCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])s1 ZINC000614533753 479437232 /nfs/dbraw/zinc/43/72/32/479437232.db2.gz ULGYDBKEPPBXGX-KRWDZBQOSA-N 0 3 347.440 2.730 20 5 EFBDHN O=[N+]([O-])c1sc(CNCCC2(O)CCC2)cc1Br ZINC000602653990 479452078 /nfs/dbraw/zinc/45/20/78/479452078.db2.gz QKAMIPLGFBEMFW-UHFFFAOYSA-N 0 3 335.223 2.814 20 5 EFBDHN CCCN1CC[C@H](NC(=O)Nc2cc([N+](=O)[O-])ccc2OCC)C1 ZINC000596889578 479474658 /nfs/dbraw/zinc/47/46/58/479474658.db2.gz IBSPNUVPZRZEOJ-LBPRGKRZSA-N 0 3 336.392 2.599 20 5 EFBDHN CN(C)[C@H](CNc1c(Cl)cncc1[N+](=O)[O-])c1cccc(F)c1 ZINC000589104174 479477657 /nfs/dbraw/zinc/47/76/57/479477657.db2.gz VUYIYOHZARCKPE-CYBMUJFWSA-N 0 3 338.770 2.919 20 5 EFBDHN CC(C)[C@H](NCCOc1cccc([N+](=O)[O-])c1)[C@H](O)C(F)(F)F ZINC000589162060 479487499 /nfs/dbraw/zinc/48/74/99/479487499.db2.gz GFBMCPKZMGSYIR-STQMWFEESA-N 0 3 336.310 2.511 20 5 EFBDHN COC(=O)C[C@](C)(NCCc1ccc([N+](=O)[O-])cc1)c1ccncc1 ZINC000589165094 479489066 /nfs/dbraw/zinc/48/90/66/479489066.db2.gz SYQQUPKAWASUEY-SFHVURJKSA-N 0 3 343.383 2.600 20 5 EFBDHN O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2NCc2ccccc2CO)n1 ZINC000618564654 479494800 /nfs/dbraw/zinc/49/48/00/479494800.db2.gz BJDRXOMGGFLQOM-CVEARBPZSA-N 0 3 330.388 2.557 20 5 EFBDHN CN(CCN1CCCCC1)C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000593883611 479496649 /nfs/dbraw/zinc/49/66/49/479496649.db2.gz QTZGHXRCKUDWMN-UHFFFAOYSA-N 0 3 330.388 2.634 20 5 EFBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC[C@H](C(=O)N2CCCC2)C1 ZINC000575907891 479498783 /nfs/dbraw/zinc/49/87/83/479498783.db2.gz VQDCMEBWJWQMGN-HKBKRHGFSA-N 0 3 343.427 2.942 20 5 EFBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])NCCN1CCCC1=O ZINC000575994737 479519287 /nfs/dbraw/zinc/51/92/87/479519287.db2.gz UZUXVJODPKSITR-CYBMUJFWSA-N 0 3 337.445 2.678 20 5 EFBDHN CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCN(CC2CC2)C1 ZINC000589374887 479519622 /nfs/dbraw/zinc/51/96/22/479519622.db2.gz NRHVTAZRHZNVJD-CQSZACIVSA-N 0 3 332.404 2.763 20 5 EFBDHN COCCN(CCn1c(C)ncc1[N+](=O)[O-])[C@H](C)c1ccccc1 ZINC000602767104 479537100 /nfs/dbraw/zinc/53/71/00/479537100.db2.gz VWAJJVPZIYBSAB-CQSZACIVSA-N 0 3 332.404 2.809 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN1CCC(N(C)c2ccccc2)CC1 ZINC000602781407 479547820 /nfs/dbraw/zinc/54/78/20/479547820.db2.gz XBAPPHUORLIDBP-UHFFFAOYSA-N 0 3 343.431 2.701 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN(CCc1cccc(F)c1)C1CC1 ZINC000602782915 479550143 /nfs/dbraw/zinc/55/01/43/479550143.db2.gz BUHXIJWZQNVAMB-UHFFFAOYSA-N 0 3 332.379 2.946 20 5 EFBDHN CCC(C)(C)N1CCN(CC(=O)Nc2c(C)cccc2[N+](=O)[O-])CC1 ZINC000594019902 479552785 /nfs/dbraw/zinc/55/27/85/479552785.db2.gz CBQFPXCKFDXLPC-UHFFFAOYSA-N 0 3 348.447 2.648 20 5 EFBDHN CN(Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@H]1CCC(=O)N(C)C1 ZINC000600179254 479566330 /nfs/dbraw/zinc/56/63/30/479566330.db2.gz XCANYPZSUVIHKI-ZDUSSCGKSA-N 0 3 343.383 2.907 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN[C@@H](C)c1cccc(-n2cccn2)c1 ZINC000602808762 479569075 /nfs/dbraw/zinc/56/90/75/479569075.db2.gz ZAJKXNPISAVJDG-ZDUSSCGKSA-N 0 3 340.387 2.636 20 5 EFBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@H]1CC[C@@](O)(C(F)(F)F)C1 ZINC000589938046 479583974 /nfs/dbraw/zinc/58/39/74/479583974.db2.gz BLWVIPYSCVQWDY-FZMZJTMJSA-N 0 3 348.321 2.929 20 5 EFBDHN Cc1ncc([N+](=O)[O-])n1CCN1CCC[C@H]1COc1ccccc1 ZINC000602837748 479585861 /nfs/dbraw/zinc/58/58/61/479585861.db2.gz ZRYOZICBTUQGBP-HNNXBMFYSA-N 0 3 330.388 2.643 20 5 EFBDHN C[C@@H]1CN(C2CCOCC2)CCN1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000618826823 479606552 /nfs/dbraw/zinc/60/65/52/479606552.db2.gz CJCSELGIFHVJIX-DQOPKJQZSA-N 0 3 345.443 2.793 20 5 EFBDHN C[C@@H]1C[C@@H](CCNCc2cc3c(cc2[N+](=O)[O-])OCCO3)CCO1 ZINC000612201776 479609872 /nfs/dbraw/zinc/60/98/72/479609872.db2.gz XUSPMJNWHLFQQL-OLZOCXBDSA-N 0 3 336.388 2.661 20 5 EFBDHN COCC1(CCNCc2cc3c(cc2[N+](=O)[O-])OCCO3)CCC1 ZINC000590192600 479616755 /nfs/dbraw/zinc/61/67/55/479616755.db2.gz VVWYPLHKFFBGRW-UHFFFAOYSA-N 0 3 336.388 2.662 20 5 EFBDHN CC1(C)CN(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)[C@H]2CCC[C@@H]21 ZINC000590203732 479617103 /nfs/dbraw/zinc/61/71/03/479617103.db2.gz QPFJBCSMGLAYFW-RDJZCZTQSA-N 0 3 343.427 2.994 20 5 EFBDHN COC(=O)[C@H]1C[C@@H](NCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000597217992 479626240 /nfs/dbraw/zinc/62/62/40/479626240.db2.gz LRGXECNEWOSNIS-BETUJISGSA-N 0 3 330.340 2.896 20 5 EFBDHN COc1cc(C(=O)N[C@H]2CCCN3CCCC[C@@H]23)cc([N+](=O)[O-])c1C ZINC000594197500 479627816 /nfs/dbraw/zinc/62/78/16/479627816.db2.gz OUGYQDIVJYQSLA-GJZGRUSLSA-N 0 3 347.415 2.659 20 5 EFBDHN CCc1ccc(C(=O)N[C@H]2CCCN3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC000594197845 479628563 /nfs/dbraw/zinc/62/85/63/479628563.db2.gz QPTWHWJLZMPWJC-JKSUJKDBSA-N 0 3 331.416 2.904 20 5 EFBDHN Cc1c(CC(=O)N[C@@H]2CCCN3CCCC[C@H]23)cccc1[N+](=O)[O-] ZINC000594198682 479629610 /nfs/dbraw/zinc/62/96/10/479629610.db2.gz UVMJNBQPILKCGB-NVXWUHKLSA-N 0 3 331.416 2.579 20 5 EFBDHN CCNc1ccc(C(=O)N[C@H]2CCCN3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000594200262 479629856 /nfs/dbraw/zinc/62/98/56/479629856.db2.gz KHQRSRYOEQBXGE-HOTGVXAUSA-N 0 3 346.431 2.773 20 5 EFBDHN C[C@@H]1[C@@H](N(C)C)CCN1C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000615303177 479652220 /nfs/dbraw/zinc/65/22/20/479652220.db2.gz GGEZNBMHAWKDNJ-YJYMSZOUSA-N 0 3 349.434 2.846 20 5 EFBDHN CC1(C)C[C@@H](NCCOC[C@H]2CCOC2)c2cc([N+](=O)[O-])ccc21 ZINC000618984305 479659532 /nfs/dbraw/zinc/65/95/32/479659532.db2.gz ZSXUGZNJZQGOHQ-SUMWQHHRSA-N 0 3 334.416 2.960 20 5 EFBDHN C[C@H](N[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)[C@@H]1CN(C)CCO1 ZINC000618986663 479660097 /nfs/dbraw/zinc/66/00/97/479660097.db2.gz BCHIKYMPBHVCBK-VUCTXSBTSA-N 0 3 333.432 2.626 20 5 EFBDHN CC[C@@H]1CN(C)CCCN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000619566937 479829800 /nfs/dbraw/zinc/82/98/00/479829800.db2.gz BGDYUUFOGFHNJD-OAHLLOKOSA-N 0 3 346.431 2.725 20 5 EFBDHN CC[C@H]1CN(C)CCCN1C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000619578962 479834161 /nfs/dbraw/zinc/83/41/61/479834161.db2.gz WZNSBRFBMKNYCN-AWEZNQCLSA-N 0 3 344.415 2.561 20 5 EFBDHN CC[C@H](CN1CCCC1)NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000609878580 480216951 /nfs/dbraw/zinc/21/69/51/480216951.db2.gz XWWASVKXCDNIPM-CYBMUJFWSA-N 0 3 325.796 2.852 20 5 EFBDHN C[C@@H]1CCCCC[C@@H]1NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000614191511 480220402 /nfs/dbraw/zinc/22/04/02/480220402.db2.gz HDAMIGQVZQGRIK-CJNGLKHVSA-N 0 3 340.445 2.927 20 5 EFBDHN Cc1cccc(C)c1CN1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000610000980 480227472 /nfs/dbraw/zinc/22/74/72/480227472.db2.gz KIRYMZKESBWYNZ-UHFFFAOYSA-N 0 3 326.400 2.929 20 5 EFBDHN C[C@@H](O)CN(CCOc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000610161208 480245071 /nfs/dbraw/zinc/24/50/71/480245071.db2.gz PFROJPSWGMGQIG-OAHLLOKOSA-N 0 3 330.384 2.857 20 5 EFBDHN CCC1(CNCc2cc3c(cc2[N+](=O)[O-])OCCO3)CCOCC1 ZINC000610395597 480295539 /nfs/dbraw/zinc/29/55/39/480295539.db2.gz QBXFFWSJKJNKAN-UHFFFAOYSA-N 0 3 336.388 2.662 20 5 EFBDHN COCCN1CCC[C@@H](Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000610550190 480335234 /nfs/dbraw/zinc/33/52/34/480335234.db2.gz HNCDPSCKUPFYFT-GFCCVEGCSA-N 0 3 345.346 2.719 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000617746236 480350802 /nfs/dbraw/zinc/35/08/02/480350802.db2.gz HNQHICHMWJDSQJ-UNEWFSDZSA-N 0 3 331.416 2.784 20 5 EFBDHN CCN1CC[C@H]2CC[C@@H](C1)N2Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000618284487 480606169 /nfs/dbraw/zinc/60/61/69/480606169.db2.gz MFEMZEUBPCAAEC-OCCSQVGLSA-N 0 3 329.404 2.530 20 5 EFBDHN C[C@H](c1ccccc1)[C@H](CO)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000618306370 480613853 /nfs/dbraw/zinc/61/38/53/480613853.db2.gz AKRAMMUHMJOGPM-PXAZEXFGSA-N 0 3 340.383 2.725 20 5 EFBDHN C[C@H]([NH2+]CCCNC(=O)c1cccc([O-])c1)c1ccc([N+](=O)[O-])cc1 ZINC000155081423 533852268 /nfs/dbraw/zinc/85/22/68/533852268.db2.gz VWDYWMZBPURPCN-ZDUSSCGKSA-N 0 3 343.383 2.771 20 5 EFBDHN Cc1ccc(CN(C)C)cc1NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000177340172 533868106 /nfs/dbraw/zinc/86/81/06/533868106.db2.gz RMHNBQXCRRZFMO-UHFFFAOYSA-N 0 3 343.383 2.982 20 5 EFBDHN C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000158408121 533896163 /nfs/dbraw/zinc/89/61/63/533896163.db2.gz MTDMHWYZGZSXCH-GWCFXTLKSA-N 0 3 325.796 2.660 20 5 EFBDHN C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H]2CC[C@@H](C1)N2C ZINC000174682548 534005597 /nfs/dbraw/zinc/00/55/97/534005597.db2.gz CVMUZAUOXOEORT-NFAWXSAZSA-N 0 3 349.456 2.771 20 5 EFBDHN CC(C)(C)N1C[C@H](N[C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1=O ZINC000090177806 518722493 /nfs/dbraw/zinc/72/24/93/518722493.db2.gz RSDAIHHNGZHDGS-CVEARBPZSA-N 0 3 345.443 2.905 20 5 EFBDHN O=C(Nc1ccncc1[N+](=O)[O-])N1CCN(CC2CCCCC2)CC1 ZINC000183591107 534423503 /nfs/dbraw/zinc/42/35/03/534423503.db2.gz NEOJHOOHQITIQH-UHFFFAOYSA-N 0 3 347.419 2.720 20 5 EFBDHN NC(=O)c1ccc(CN[C@H](Cc2ccccc2)C2CC2)c([N+](=O)[O-])c1 ZINC000181546238 534485226 /nfs/dbraw/zinc/48/52/26/534485226.db2.gz NGOKEKIZVPFUTK-QGZVFWFLSA-N 0 3 339.395 2.805 20 5 EFBDHN CN(C)Cc1ccc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000072728294 521904903 /nfs/dbraw/zinc/90/49/03/521904903.db2.gz TXHROBUQJJBNEN-UHFFFAOYSA-N 0 3 328.372 2.978 20 5 EFBDHN CN(C)[C@@H]1Cc2ccccc2N(C(=O)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000067207699 522059920 /nfs/dbraw/zinc/05/99/20/522059920.db2.gz KSNNOFRALQQGQL-QGZVFWFLSA-N 0 3 339.395 2.657 20 5 EFBDHN COc1cc(C(=O)N(CCN(C)C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000155088971 522063131 /nfs/dbraw/zinc/06/31/31/522063131.db2.gz IUXQSBKOITUGJS-UHFFFAOYSA-N 0 3 343.383 2.812 20 5 EFBDHN CN(CCOc1cccc([N+](=O)[O-])c1)[C@H]1CCCc2c1cnn2C ZINC000135569921 522912164 /nfs/dbraw/zinc/91/21/64/522912164.db2.gz VPZZMCHYQDQPEA-INIZCTEOSA-N 0 3 330.388 2.717 20 5 EFBDHN COc1ccc(CNCCCO)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000072713140 524070482 /nfs/dbraw/zinc/07/04/82/524070482.db2.gz XACCZZHCLYPSOW-UHFFFAOYSA-N 0 3 346.383 2.654 20 5 EFBDHN C[C@H](CN(C)Cc1ccccc1)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000182103940 524301175 /nfs/dbraw/zinc/30/11/75/524301175.db2.gz PMLUAKMJQJWAMB-CQSZACIVSA-N 0 3 327.384 2.845 20 5 EFBDHN Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[C@H](N2CCCC2)C1 ZINC000119838227 524337993 /nfs/dbraw/zinc/33/79/93/524337993.db2.gz KBWZXXXPBZMRMC-AWEZNQCLSA-N 0 3 332.404 2.914 20 5 EFBDHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccccc1[N+](=O)[O-] ZINC000119852617 524633274 /nfs/dbraw/zinc/63/32/74/524633274.db2.gz GMRJOBWJJPHRHL-YOEHRIQHSA-N 0 3 339.395 2.845 20 5 EFBDHN Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCN(CC2CCCC2)C1 ZINC000194771526 524903532 /nfs/dbraw/zinc/90/35/32/524903532.db2.gz RJSSIVMAHOGJOK-OAHLLOKOSA-N 0 3 331.416 2.898 20 5 EFBDHN C[C@H](NC(=O)N1CC[C@H](N2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000066186115 525040054 /nfs/dbraw/zinc/04/00/54/525040054.db2.gz CVOPWZZWFSIVKD-BBRMVZONSA-N 0 3 332.404 2.536 20 5 EFBDHN Cc1cc([N+](=O)[O-])ccc1CN1CCC[C@@H](c2nc(N(C)C)no2)C1 ZINC000194936982 525563155 /nfs/dbraw/zinc/56/31/55/525563155.db2.gz DIHJQIJACIXPDA-CQSZACIVSA-N 0 3 345.403 2.732 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[C@@H](N2CCCC2)C1 ZINC000085621065 526057317 /nfs/dbraw/zinc/05/73/17/526057317.db2.gz IUAWNBMBTIWQPH-CQSZACIVSA-N 0 3 332.404 2.914 20 5 EFBDHN O=C(CCN1CCC[C@@H](c2cc[nH]n2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000193860501 526485737 /nfs/dbraw/zinc/48/57/37/526485737.db2.gz YFBOJOQBZGMOBM-CYBMUJFWSA-N 0 3 343.387 2.526 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN2CCCN(c3ccccc3)CC2)c1 ZINC000246215580 527394853 /nfs/dbraw/zinc/39/48/53/527394853.db2.gz CZJIFXBWYHNZSA-LJQANCHMSA-N 0 3 341.411 2.841 20 5 EFBDHN O=[N+]([O-])c1ccccc1CN1CCC(CCCN2CCOCC2)CC1 ZINC000182963694 527399022 /nfs/dbraw/zinc/39/90/22/527399022.db2.gz OMXIZPXLXGVGJI-UHFFFAOYSA-N 0 3 347.459 2.919 20 5 EFBDHN Cn1ccnc1C[C@@H]1CCCN(CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000090003485 527442898 /nfs/dbraw/zinc/44/28/98/527442898.db2.gz JZOQZIIONZNGTJ-HNNXBMFYSA-N 0 3 344.415 2.662 20 5 EFBDHN CC(C)N(CCn1cc([N+](=O)[O-])cn1)Cc1ccc([N+](=O)[O-])cc1 ZINC000174832794 528915947 /nfs/dbraw/zinc/91/59/47/528915947.db2.gz CVATZQXLDMKVIM-UHFFFAOYSA-N 0 3 333.348 2.610 20 5 EFBDHN CC[C@H]1CN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CCS1 ZINC000181725952 529290854 /nfs/dbraw/zinc/29/08/54/529290854.db2.gz CYDKMYOCUITQED-LBPRGKRZSA-N 0 3 341.408 2.890 20 5 EFBDHN CC(C)Oc1cc(C(=O)N(C)C[C@@H]2CCCN(C)C2)ccc1[N+](=O)[O-] ZINC000412114934 534941256 /nfs/dbraw/zinc/94/12/56/534941256.db2.gz SQXRNKSADFYKGI-CQSZACIVSA-N 0 3 349.431 2.796 20 5 EFBDHN CC(C)Oc1cc(C(=O)N(C)C[C@H]2CCCN(C)C2)ccc1[N+](=O)[O-] ZINC000412114931 534941509 /nfs/dbraw/zinc/94/15/09/534941509.db2.gz SQXRNKSADFYKGI-AWEZNQCLSA-N 0 3 349.431 2.796 20 5 EFBDHN CC(C)Oc1cc(C(=O)N(C)CC2(N(C)C)CCC2)ccc1[N+](=O)[O-] ZINC000412272518 534941834 /nfs/dbraw/zinc/94/18/34/534941834.db2.gz FDGOPGAFHKIENJ-UHFFFAOYSA-N 0 3 349.431 2.938 20 5 EFBDHN CC(C)Oc1cc(C(=O)N2CCC[C@@H](N(C)C)C2)ccc1[N+](=O)[O-] ZINC000411932643 534942644 /nfs/dbraw/zinc/94/26/44/534942644.db2.gz CHRRNCUHLUVXLW-CQSZACIVSA-N 0 3 335.404 2.548 20 5 EFBDHN CC(C)Oc1cc(C(=O)N[C@@H]2CCN(C)[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000412134060 534949794 /nfs/dbraw/zinc/94/97/94/534949794.db2.gz LGWUKKMTNYQVDO-TZMCWYRMSA-N 0 3 335.404 2.595 20 5 EFBDHN CC(C)Oc1cc(C(=O)N[C@@H]2CN(C3CC3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000412182372 534949858 /nfs/dbraw/zinc/94/98/58/534949858.db2.gz JTRSIHYJORCMFI-IUODEOHRSA-N 0 3 347.415 2.595 20 5 EFBDHN CC(C)N(Cc1cccnc1)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000343724793 535108412 /nfs/dbraw/zinc/10/84/12/535108412.db2.gz YYYABCXRNAGJJH-INIZCTEOSA-N 0 3 345.399 2.640 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)CCOc1cc(C)ccc1[N+](=O)[O-] ZINC000344757952 535480515 /nfs/dbraw/zinc/48/05/15/535480515.db2.gz ITVONHFRJODVJR-OAHLLOKOSA-N 0 3 349.431 2.663 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000346459593 535489072 /nfs/dbraw/zinc/48/90/72/535489072.db2.gz IBTSBFNVSBVZPH-OAHLLOKOSA-N 0 3 346.431 2.773 20 5 EFBDHN CC[C@@H](C)N[C@H](CNC(=O)Cc1ccccc1[N+](=O)[O-])c1ccco1 ZINC000359541376 535605256 /nfs/dbraw/zinc/60/52/56/535605256.db2.gz DDPKWUHQHQGOHS-UKRRQHHQSA-N 0 3 345.399 2.976 20 5 EFBDHN CCO[C@H]1C[C@@H](O)C12CCN(Cc1cccc([N+](=O)[O-])c1C)CC2 ZINC000266019958 535648612 /nfs/dbraw/zinc/64/86/12/535648612.db2.gz RAJZTHWTZPFRSC-SJORKVTESA-N 0 3 334.416 2.655 20 5 EFBDHN CN(C)CCOC1CCN(c2ccc([N+](=O)[O-])c3cccnc32)CC1 ZINC000356224149 535893239 /nfs/dbraw/zinc/89/32/39/535893239.db2.gz QVACMXXNFDYURU-UHFFFAOYSA-N 0 3 344.415 2.690 20 5 EFBDHN CC[C@H](NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CC1(C)C ZINC000414124018 535903836 /nfs/dbraw/zinc/90/38/36/535903836.db2.gz BQTJADXJILWWST-GJZGRUSLSA-N 0 3 340.445 2.783 20 5 EFBDHN CN1CCCC(C)(C)[C@H]1CNC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000344693321 536351129 /nfs/dbraw/zinc/35/11/29/536351129.db2.gz RXTXHPSZIYEXQY-MRXNPFEDSA-N 0 3 348.447 2.633 20 5 EFBDHN COC(=O)[C@@]12CN(Cc3ccc([N+](=O)[O-])cc3OC)C[C@@H]1CCCC2 ZINC000342185159 536587882 /nfs/dbraw/zinc/58/78/82/536587882.db2.gz ZTKLRPOTGKSBEK-KSSFIOAISA-N 0 3 348.399 2.769 20 5 EFBDHN CO[C@@H]1[C@H](C)[C@H](N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1(C)C ZINC000344473466 536816349 /nfs/dbraw/zinc/81/63/49/536816349.db2.gz LRGZWWACCSLDKE-FDRIWYBQSA-N 0 3 335.404 2.571 20 5 EFBDHN CO[C@](C)([C@@H](C)NCC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000411972698 536834928 /nfs/dbraw/zinc/83/49/28/536834928.db2.gz QIMQVONTLVVPHN-SJKOYZFVSA-N 0 3 335.404 2.635 20 5 EFBDHN COc1cccc(C(=O)NCC(C)(C)N2CCCCC2)c1[N+](=O)[O-] ZINC000195320690 537084713 /nfs/dbraw/zinc/08/47/13/537084713.db2.gz QWQJPSOVIDSNJW-UHFFFAOYSA-N 0 3 335.404 2.598 20 5 EFBDHN CN(CCNCc1ccc([N+](=O)[O-])c(Cl)c1)CC(F)(F)F ZINC000761520258 576174205 /nfs/dbraw/zinc/17/42/05/576174205.db2.gz NMQVGHHSSNVZCI-UHFFFAOYSA-N 0 3 325.718 2.832 20 5 EFBDHN C[C@@H](CNC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F)N1CCCCC1 ZINC000754364013 575425218 /nfs/dbraw/zinc/42/52/18/575425218.db2.gz DZIKZIKCFWJUQS-STQMWFEESA-N 0 3 337.395 2.828 20 5 EFBDHN CC[C@@H](NCC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])[C@@H]1CCCO1 ZINC000754520724 575446360 /nfs/dbraw/zinc/44/63/60/575446360.db2.gz WDUUZBFQQGTLCG-RISCZKNCSA-N 0 3 341.795 2.734 20 5 EFBDHN CN(C)CCN(Cc1ccco1)C(=O)c1cc([N+](=O)[O-])ccc1F ZINC000755633171 575611320 /nfs/dbraw/zinc/61/13/20/575611320.db2.gz PBFUKAOMLGGYHB-UHFFFAOYSA-N 0 3 335.335 2.531 20 5 EFBDHN C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000757795346 575853197 /nfs/dbraw/zinc/85/31/97/575853197.db2.gz KXZMNGFCWGPOSJ-ZANVPECISA-N 0 3 338.795 2.852 20 5 EFBDHN CS[C@@H]1CN(c2ccc([N+](=O)[O-])cc2OC(F)F)C[C@@H]1N(C)C ZINC000760576871 576049110 /nfs/dbraw/zinc/04/91/10/576049110.db2.gz MXSVBVULXIPAGJ-WCQYABFASA-N 0 3 347.387 2.678 20 5 EFBDHN O=C(CCN1CC[C@@H](C(F)(F)F)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000761040720 576103318 /nfs/dbraw/zinc/10/33/18/576103318.db2.gz JLUFATRTCZEBCF-SNVBAGLBSA-N 0 3 331.294 2.808 20 5 EFBDHN C[C@H]1CCCN1CCNc1ncc(Br)cc1[N+](=O)[O-] ZINC000761907453 576227029 /nfs/dbraw/zinc/22/70/29/576227029.db2.gz AHMZXUFRTUGQBG-VIFPVBQESA-N 0 3 329.198 2.649 20 5 EFBDHN C[C@@H](CNC(=O)c1cc(F)c([N+](=O)[O-])cc1F)N1CCCC[C@@H]1C ZINC000763407605 576376135 /nfs/dbraw/zinc/37/61/35/576376135.db2.gz NOHVOWQUNQKBFB-QWRGUYRKSA-N 0 3 341.358 2.866 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCC(NCc3ccc(F)cn3)CC2)cc1 ZINC000766607590 577170500 /nfs/dbraw/zinc/17/05/00/577170500.db2.gz GSAJZOUJMHFGNT-UHFFFAOYSA-N 0 3 330.363 2.888 20 5 EFBDHN CN1CC[C@@H]2[C@H](CCCN2C(=S)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000768480475 577277660 /nfs/dbraw/zinc/27/76/60/577277660.db2.gz RWMIWLMXPXSSNS-IUODEOHRSA-N 0 3 334.445 2.708 20 5 EFBDHN CC1(C)CCc2cc(CNCCn3cc([N+](=O)[O-])cn3)ccc2O1 ZINC000769423684 577361518 /nfs/dbraw/zinc/36/15/18/577361518.db2.gz NOZGEKNEDULPKX-UHFFFAOYSA-N 0 3 330.388 2.685 20 5 EFBDHN CCN(CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O)[C@@H](C)C(C)C ZINC000726589852 577374278 /nfs/dbraw/zinc/37/42/78/577374278.db2.gz YWBFSUSWWNYHLD-ZDUSSCGKSA-N 0 3 348.403 2.687 20 5 EFBDHN Cc1cc(F)cc(C(=O)NCCN2CCCC(C)(C)C2)c1[N+](=O)[O-] ZINC000769706601 577379909 /nfs/dbraw/zinc/37/99/09/577379909.db2.gz BDUJETBTUVCFOA-UHFFFAOYSA-N 0 3 337.395 2.894 20 5 EFBDHN Cc1c(CN2CCC[C@@H]([C@@H](O)c3nccn3C)C2)cccc1[N+](=O)[O-] ZINC000769939721 577394593 /nfs/dbraw/zinc/39/45/93/577394593.db2.gz AGURYVFFSWPLNJ-NVXWUHKLSA-N 0 3 344.415 2.582 20 5 EFBDHN CN(CCN(C)C1CC1)c1cc(Br)ccc1[N+](=O)[O-] ZINC000770222305 577407668 /nfs/dbraw/zinc/40/76/68/577407668.db2.gz OFYKFOMFDSJLEV-UHFFFAOYSA-N 0 3 328.210 2.888 20 5 EFBDHN O=[N+]([O-])c1ccc(Cl)cc1CN[C@@H]1CCO[C@]2(CCOC2)C1 ZINC000770752891 581133596 /nfs/dbraw/zinc/13/35/96/581133596.db2.gz WKODOXSZASYMCP-UKRRQHHQSA-N 0 3 326.780 2.676 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCC(N[C@H]3CCCc4c[nH]nc43)CC2)cc1 ZINC000773064850 581392887 /nfs/dbraw/zinc/39/28/87/581392887.db2.gz IQFLWUZKARRUJK-KRWDZBQOSA-N 0 3 341.415 2.954 20 5 EFBDHN CC(C)(CNCc1cc(Cl)ccc1[N+](=O)[O-])[C@]1(O)CCCOC1 ZINC000850400287 1250466652 /nfs/dbraw/zinc/46/66/52/1250466652.db2.gz FATZYTXGCRSHNL-INIZCTEOSA-N 0 3 342.823 2.906 20 5 EFBDHN CC(COC(=O)Cc1c(Cl)cccc1Br)[N+](=O)[O-] ZINC000851036563 1250765665 /nfs/dbraw/zinc/76/56/65/1250765665.db2.gz KJMUVVYVGWCAJC-ZETCQYMHSA-N 0 3 336.569 2.853 20 5 EFBDHN CCCn1nccc1C(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000851108068 1250802571 /nfs/dbraw/zinc/80/25/71/1250802571.db2.gz IZDKCOZHJDXWII-IAQYHMDHSA-N 0 3 335.335 2.996 20 5 EFBDHN NC(=O)CN1CCN(Cc2c3ccccc3cc3ccccc32)CC1 ZINC000179834686 1252133471 /nfs/dbraw/zinc/13/34/71/1252133471.db2.gz ZPSXXCNFYKZRPZ-UHFFFAOYSA-N 0 3 333.435 2.596 20 5 EFBDHN Cc1cc(C(F)(F)F)nn1CCNCc1cccc([N+](=O)[O-])c1 ZINC000922430564 1266001642 /nfs/dbraw/zinc/00/16/42/1266001642.db2.gz DQIABODXJSRIFK-UHFFFAOYSA-N 0 3 328.294 2.908 20 5 EFBDHN Cc1c(F)cccc1C(=O)NCCNCc1cccc([N+](=O)[O-])c1 ZINC001127822909 1256402153 /nfs/dbraw/zinc/40/21/53/1256402153.db2.gz SJSRKAIOTZYKNL-UHFFFAOYSA-N 0 3 331.347 2.562 20 5 EFBDHN O=C(CC1CC1)N1CCC(CNCc2csc([N+](=O)[O-])c2)CC1 ZINC000997466533 1257628054 /nfs/dbraw/zinc/62/80/54/1257628054.db2.gz NIZDWAURULTNRT-UHFFFAOYSA-N 0 3 337.445 2.785 20 5 EFBDHN O=C(/C=C/C1CC1)N1CCC(CNCc2csc([N+](=O)[O-])c2)CC1 ZINC000997637944 1258141818 /nfs/dbraw/zinc/14/18/18/1258141818.db2.gz OWDLQTXEOYWQGD-ONEGZZNKSA-N 0 3 349.456 2.951 20 5 EFBDHN CC(C)N(C)CC(=O)NCCC1(CNc2ccccc2[N+](=O)[O-])CC1 ZINC001089943363 1260725140 /nfs/dbraw/zinc/72/51/40/1260725140.db2.gz FRBXINZIORFFNI-UHFFFAOYSA-N 0 3 348.447 2.633 20 5 EFBDHN CCN(CC)CC(=O)NCCC1(CNc2ccccc2[N+](=O)[O-])CC1 ZINC001089943868 1260906541 /nfs/dbraw/zinc/90/65/41/1260906541.db2.gz OBMUOGFLEZMUJX-UHFFFAOYSA-N 0 3 348.447 2.635 20 5 EFBDHN Cc1cc(C)c(C(=O)NCCNCc2ccc([N+](=O)[O-])cc2)s1 ZINC001128288876 1264138933 /nfs/dbraw/zinc/13/89/33/1264138933.db2.gz BQENMFUMJMPIQA-UHFFFAOYSA-N 0 3 333.413 2.793 20 5 EFBDHN COc1cc(CNC[C@]2(C)CC2(Cl)Cl)c([N+](=O)[O-])cc1O ZINC000824765673 1278270647 /nfs/dbraw/zinc/27/06/47/1278270647.db2.gz OMVNBBMWCAWFID-LBPRGKRZSA-N 0 3 335.187 2.983 20 5 EFBDHN CC1CCC(N2CCN(c3nc4ccccn4c3[N+](=O)[O-])CC2)CC1 ZINC000734481975 1266986879 /nfs/dbraw/zinc/98/68/79/1266986879.db2.gz GFDMZLXLTRCFCL-UHFFFAOYSA-N 0 3 343.431 2.943 20 5 EFBDHN CCCN(CCN(C)C)C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000740738855 1269018499 /nfs/dbraw/zinc/01/84/99/1269018499.db2.gz RSABUUSDXSCDPV-UHFFFAOYSA-N 0 3 348.447 2.609 20 5 EFBDHN O=[N+]([O-])c1cn(CN(CC2CC2)CC2CC2)nc1-c1ccncc1 ZINC000742150365 1269914190 /nfs/dbraw/zinc/91/41/90/1269914190.db2.gz XZDBRAOXZFZMMD-UHFFFAOYSA-N 0 3 327.388 2.933 20 5 EFBDHN Cc1cc[nH]c1C(=O)NC[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1 ZINC001086355990 1271126678 /nfs/dbraw/zinc/12/66/78/1271126678.db2.gz RZIFREHNVPGVQK-CTYIDZIISA-N 0 3 342.399 2.530 20 5 EFBDHN Cc1coc(C(=O)NC[C@H]2C[C@H](NCc3ccccc3[N+](=O)[O-])C2)c1 ZINC001086453968 1271551033 /nfs/dbraw/zinc/55/10/33/1271551033.db2.gz LKMAEDIHURICLY-CTYIDZIISA-N 0 3 343.383 2.794 20 5 EFBDHN O=c1[nH]c2ccccc2n1C1CCN([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169012422 1272584626 /nfs/dbraw/zinc/58/46/26/1272584626.db2.gz QAKHLYNOILAQRJ-HIFRSBDPSA-N 0 3 344.415 2.824 20 5 EFBDHN CC(C)(C)OC(=O)N1CC2(C1)CCCN2[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169011348 1272585172 /nfs/dbraw/zinc/58/51/72/1272585172.db2.gz KABSSAJQINCGNP-KGLIPLIRSA-N 0 3 339.436 2.517 20 5 EFBDHN CC(C)(C)OC(=O)N1C[C@@H]2[C@@H]1CCCN2[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169011847 1272585759 /nfs/dbraw/zinc/58/57/59/1272585759.db2.gz MTVVVWVVGADXIA-APIJFGDWSA-N 0 3 339.436 2.516 20 5 EFBDHN O=[N+]([O-])C[C@@H]1CC[C@@H](NCc2cc(O)ccc2Br)C1 ZINC001168988160 1272588946 /nfs/dbraw/zinc/58/89/46/1272588946.db2.gz OOYFHHOMIOIYAG-MWLCHTKSSA-N 0 3 329.194 2.690 20 5 EFBDHN O=[N+]([O-])C[C@H]1CC[C@@H](NCc2cc(O)ccc2Br)C1 ZINC001168988158 1272589180 /nfs/dbraw/zinc/58/91/80/1272589180.db2.gz OOYFHHOMIOIYAG-GXSJLCMTSA-N 0 3 329.194 2.690 20 5 EFBDHN O=[N+]([O-])C[C@@H]1CC[C@H](N2CCN(Cc3cccc(Cl)c3)CC2)C1 ZINC001169028493 1272592403 /nfs/dbraw/zinc/59/24/03/1272592403.db2.gz SRBAWJBYCFCDDE-WBVHZDCISA-N 0 3 337.851 2.903 20 5 EFBDHN CC[C@@H]1CN(C(=O)OC(C)(C)C)CCN1[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169033229 1272595936 /nfs/dbraw/zinc/59/59/36/1272595936.db2.gz BLVFFQGSEAYJDF-KFWWJZLASA-N 0 3 341.452 2.763 20 5 EFBDHN CC[C@H]1CN([C@H]2CC[C@H](C[N+](=O)[O-])C2)CCN1C(=O)OC(C)(C)C ZINC001169034582 1272596299 /nfs/dbraw/zinc/59/62/99/1272596299.db2.gz IAYMXWPTDIBTGT-KKUMJFAQSA-N 0 3 341.452 2.763 20 5 EFBDHN C[C@@H]1CN(C(=O)OC(C)(C)C)[C@@H](C)CN1[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169017541 1272617117 /nfs/dbraw/zinc/61/71/17/1272617117.db2.gz AKSLWYWRZGGDBS-QPSCCSFWSA-N 0 3 341.452 2.762 20 5 EFBDHN C[C@H]1CN([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C[C@H](C)N1C(=O)OC(C)(C)C ZINC001169047878 1272627525 /nfs/dbraw/zinc/62/75/25/1272627525.db2.gz SEDOFOLAONWQEW-BYNSBNAKSA-N 0 3 341.452 2.762 20 5 EFBDHN O=[N+]([O-])C[C@@H]1CC[C@H](N2CCN(Cc3c(F)cccc3F)CC2)C1 ZINC001169050483 1272628140 /nfs/dbraw/zinc/62/81/40/1272628140.db2.gz ZVHDGZCATHDUCE-KGLIPLIRSA-N 0 3 339.386 2.528 20 5 EFBDHN O=[N+]([O-])C[C@H]1CC[C@H](N2CCN(Cc3c(F)cccc3F)CC2)C1 ZINC001169050481 1272628593 /nfs/dbraw/zinc/62/85/93/1272628593.db2.gz ZVHDGZCATHDUCE-KBPBESRZSA-N 0 3 339.386 2.528 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1NCc1cc(F)cc3c1OCOC3)CNC2 ZINC001169097314 1272651756 /nfs/dbraw/zinc/65/17/56/1272651756.db2.gz NEOTYLAQSRMMKE-UHFFFAOYSA-N 0 3 345.330 2.816 20 5 EFBDHN C[C@H](N)c1ccn(-c2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)n1 ZINC001169230515 1272747573 /nfs/dbraw/zinc/74/75/73/1272747573.db2.gz STNOJAVJRGCPPR-LBPRGKRZSA-N 0 3 339.355 2.774 20 5 EFBDHN O=c1c(Nc2cc3c(cc2[N+](=O)[O-])CNC3)cccn1CC1CC1 ZINC001169450527 1272925191 /nfs/dbraw/zinc/92/51/91/1272925191.db2.gz KZYBKLIFGWEFFV-UHFFFAOYSA-N 0 3 326.356 2.513 20 5 EFBDHN O=C(NCCCNCc1ccccc1[N+](=O)[O-])c1c[nH]cc1C1CC1 ZINC001169692139 1273093881 /nfs/dbraw/zinc/09/38/81/1273093881.db2.gz LZMQQXVGMJWGAV-UHFFFAOYSA-N 0 3 342.399 2.710 20 5 EFBDHN O=[N+]([O-])c1ccc(Cl)cc1N1CCCN(C[C@H]2CCCO2)CC1 ZINC000804344506 1273328123 /nfs/dbraw/zinc/32/81/23/1273328123.db2.gz UKHKDKMHETUGAW-CQSZACIVSA-N 0 3 339.823 2.939 20 5 EFBDHN CCN1CCN([C@@H](C)CNc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000804349180 1273413013 /nfs/dbraw/zinc/41/30/13/1273413013.db2.gz JZIKFXJLPMUJPI-LBPRGKRZSA-N 0 3 326.828 2.686 20 5 EFBDHN CC(C)c1oncc1C(=O)NCCCNCc1ccccc1[N+](=O)[O-] ZINC001170009339 1274367761 /nfs/dbraw/zinc/36/77/61/1274367761.db2.gz ZBATWOFCPZMPQH-UHFFFAOYSA-N 0 3 346.387 2.616 20 5 EFBDHN O=C(Cc1ccc([N+](=O)[O-])cc1Cl)OCCN1CCCCC1 ZINC000785954818 1275250346 /nfs/dbraw/zinc/25/03/46/1275250346.db2.gz RFFHEXGVMPCVBH-UHFFFAOYSA-N 0 3 326.780 2.820 20 5 EFBDHN Cc1nn(CN(C)CCCn2ccnc2C)c2ccc([N+](=O)[O-])cc12 ZINC000746632185 1275671823 /nfs/dbraw/zinc/67/18/23/1275671823.db2.gz WEDJQBSSPMGPKT-UHFFFAOYSA-N 0 3 342.403 2.737 20 5 EFBDHN COc1ccc(C[C@H](C)NCc2cn3ccccc3n2)c([N+](=O)[O-])c1 ZINC001170297429 1278980594 /nfs/dbraw/zinc/98/05/94/1278980594.db2.gz ODUCEBLWUDLVDS-ZDUSSCGKSA-N 0 3 340.383 2.972 20 5 EFBDHN C[C@@H](N[C@@H]1CCN(C(=O)C2CCCC2)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788634482 1276250263 /nfs/dbraw/zinc/25/02/63/1276250263.db2.gz ZGCPTTBWDRJLAY-IUODEOHRSA-N 0 3 346.431 2.619 20 5 EFBDHN COc1ccc(C[C@@H](C)N[C@H]2CCCc3nccnc32)c([N+](=O)[O-])c1 ZINC001170323463 1279014688 /nfs/dbraw/zinc/01/46/88/1279014688.db2.gz KVTOUQDNUOKMIF-WBMJQRKESA-N 0 3 342.399 2.992 20 5 EFBDHN Cc1ccc(F)c(-n2nc(C(=O)OCC(C)[N+](=O)[O-])c3c2CCC3)c1 ZINC000817739577 1276286439 /nfs/dbraw/zinc/28/64/39/1276286439.db2.gz MVIDRKOIXDXMQW-LLVKDONJSA-N 0 3 347.346 2.631 20 5 EFBDHN COc1ccc(-c2ccc(CN[C@H]3C[C@H](CO)C3)o2)c([N+](=O)[O-])c1 ZINC000923006888 1276499351 /nfs/dbraw/zinc/49/93/51/1276499351.db2.gz HJDOBTVJAGUXRI-HAQNSBGRSA-N 0 3 332.356 2.724 20 5 EFBDHN O=[N+]([O-])c1ccc([C@H](O)CNCc2ccc(OCC3CC3)nc2)cc1 ZINC000818990855 1276564654 /nfs/dbraw/zinc/56/46/54/1276564654.db2.gz QIIJVRGWTKPWQZ-QGZVFWFLSA-N 0 3 343.383 2.602 20 5 EFBDHN O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCOc3ccc(F)cc32)c1 ZINC000819048655 1276581018 /nfs/dbraw/zinc/58/10/18/1276581018.db2.gz OEPNFPFMYHBXNH-JKSUJKDBSA-N 0 3 332.331 2.881 20 5 EFBDHN CC(C)Oc1cc(CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)ccn1 ZINC000819186105 1276665285 /nfs/dbraw/zinc/66/52/85/1276665285.db2.gz PCSPSBGXLUPVLK-MRXNPFEDSA-N 0 3 331.372 2.600 20 5 EFBDHN CC[C@H](C)Oc1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)ccn1 ZINC000819216510 1276693997 /nfs/dbraw/zinc/69/39/97/1276693997.db2.gz VFYAOOXOQLPXRU-SUMWQHHRSA-N 0 3 345.399 2.990 20 5 EFBDHN COc1ccc2c(c1)[C@@H](NC[C@@H](O)c1ccc([N+](=O)[O-])cc1)CCO2 ZINC000819233140 1276701650 /nfs/dbraw/zinc/70/16/50/1276701650.db2.gz RZJAOCNOUXDEAU-DLBZAZTESA-N 0 3 344.367 2.750 20 5 EFBDHN COc1ccc2c(c1)[C@@H](NC[C@H](O)c1ccc([N+](=O)[O-])cc1)CCO2 ZINC000819233142 1276701682 /nfs/dbraw/zinc/70/16/82/1276701682.db2.gz RZJAOCNOUXDEAU-IRXDYDNUSA-N 0 3 344.367 2.750 20 5 EFBDHN Cc1c(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cccc1[N+](=O)[O-] ZINC000819259060 1276714460 /nfs/dbraw/zinc/71/44/60/1276714460.db2.gz FGCQLBGMESIMHI-MRXNPFEDSA-N 0 3 331.328 2.635 20 5 EFBDHN Cc1cc([N+](=O)[O-])c(C(=O)N2CCC[C@H]3CN(C)C[C@H]32)cc1Cl ZINC000819719944 1276893866 /nfs/dbraw/zinc/89/38/66/1276893866.db2.gz KZRKQOTXDWXIBU-XHDPSFHLSA-N 0 3 337.807 2.723 20 5 EFBDHN COc1ccc(C[C@@H](C)NCc2cncc(Cl)n2)c([N+](=O)[O-])c1 ZINC001170306605 1279028075 /nfs/dbraw/zinc/02/80/75/1279028075.db2.gz YJMANCMTCJZYQT-SNVBAGLBSA-N 0 3 336.779 2.768 20 5 EFBDHN CCCN(CCN(C)C)C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000790894407 1277835140 /nfs/dbraw/zinc/83/51/40/1277835140.db2.gz LMVIHOYWHSYVLW-UHFFFAOYSA-N 0 3 345.802 2.730 20 5 EFBDHN O=C(NCCCNCc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC001175071884 1287316687 /nfs/dbraw/zinc/31/66/87/1287316687.db2.gz XCLXPEBOUNRNFR-UHFFFAOYSA-N 0 3 349.337 2.783 20 5 EFBDHN COc1cc(C(=O)OC[C@@H]2CCN2C(C)(C)C)cc([N+](=O)[O-])c1C ZINC000845736048 1279809109 /nfs/dbraw/zinc/80/91/09/1279809109.db2.gz OCVDIVRWSWAHAH-ZDUSSCGKSA-N 0 3 336.388 2.941 20 5 EFBDHN CC([C@H](OC(=O)c1n[nH]c2c1CCCC2)c1ccccc1F)[N+](=O)[O-] ZINC000845872129 1279900585 /nfs/dbraw/zinc/90/05/85/1279900585.db2.gz CISUBHODFZDDGX-HWPZZCPQSA-N 0 3 347.346 2.991 20 5 EFBDHN CC([C@@H](OC(=O)c1n[nH]c2c1CCCC2)c1ccccc1F)[N+](=O)[O-] ZINC000845872130 1279900836 /nfs/dbraw/zinc/90/08/36/1279900836.db2.gz CISUBHODFZDDGX-MGPLVRAMSA-N 0 3 347.346 2.991 20 5 EFBDHN Cc1nccc(CCC(=O)O[C@H](c2ccccc2F)C(C)[N+](=O)[O-])n1 ZINC000845875332 1279902623 /nfs/dbraw/zinc/90/26/23/1279902623.db2.gz BIBQIBMAJGRUBZ-DIFFPNOSSA-N 0 3 347.346 2.806 20 5 EFBDHN CC([C@H](OC(=O)[C@@H]1CSCCS1)c1ccccc1F)[N+](=O)[O-] ZINC000845876719 1279903028 /nfs/dbraw/zinc/90/30/28/1279903028.db2.gz OATUOBHVYZNOEW-ICCXJUOJSA-N 0 3 345.417 2.924 20 5 EFBDHN CCOc1cnc(C(=O)O[C@@H](c2ccccc2F)C(C)[N+](=O)[O-])cn1 ZINC000845876769 1279903157 /nfs/dbraw/zinc/90/31/57/1279903157.db2.gz OOMHCIQKRNGCLD-MEBBXXQBSA-N 0 3 349.318 2.578 20 5 EFBDHN CC([C@@H](OC(=O)[C@H](C)OCC1CC1)c1ccccc1F)[N+](=O)[O-] ZINC000845878756 1279903487 /nfs/dbraw/zinc/90/34/87/1279903487.db2.gz VUWHSOXXHXKDDH-ZIBATOQPSA-N 0 3 325.336 2.890 20 5 EFBDHN COc1cccnc1CC(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC000845881465 1279904376 /nfs/dbraw/zinc/90/43/76/1279904376.db2.gz KVZYAHWRJMWCKI-PIGZYNQJSA-N 0 3 348.330 2.722 20 5 EFBDHN CC([C@@H](OC(=O)Cn1cc(Cl)cn1)c1ccccc1F)[N+](=O)[O-] ZINC000845880062 1279904513 /nfs/dbraw/zinc/90/45/13/1279904513.db2.gz KKQSISGURLJIPO-LKFCYVNXSA-N 0 3 341.726 2.625 20 5 EFBDHN CC([C@@H](OC(=O)CCC(C)(C)[N+](=O)[O-])c1ccccc1F)[N+](=O)[O-] ZINC000845882712 1279905119 /nfs/dbraw/zinc/90/51/19/1279905119.db2.gz PYDKYHGMVJDATG-IINYFYTJSA-N 0 3 342.323 2.911 20 5 EFBDHN CC([C@H](OC(=O)c1cnc2n1CCCC2)c1ccccc1F)[N+](=O)[O-] ZINC000845883274 1279905994 /nfs/dbraw/zinc/90/59/94/1279905994.db2.gz RJDQLBYMLRGIMZ-BZNIZROVSA-N 0 3 347.346 2.922 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](C)CN1CCOCC1 ZINC000872021369 1287402823 /nfs/dbraw/zinc/40/28/23/1287402823.db2.gz CGZVKUROHOGFJP-OLZOCXBDSA-N 0 3 339.461 2.688 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](C)CN1CCCC1=O ZINC000872024323 1287404019 /nfs/dbraw/zinc/40/40/19/1287404019.db2.gz QGGHDZGVHLUTNA-NEPJUHHUSA-N 0 3 337.445 2.978 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H](O)COCC1CC1 ZINC000872030324 1287405749 /nfs/dbraw/zinc/40/57/49/1287405749.db2.gz CWRNYXHGPARZFA-RISCZKNCSA-N 0 3 340.445 2.755 20 5 EFBDHN CCCN(CCN1CCCCC1)C(=O)c1cc(C)cc([N+](=O)[O-])c1N ZINC000804567155 1280288903 /nfs/dbraw/zinc/28/89/03/1280288903.db2.gz LOVPBKRCXJYOFU-UHFFFAOYSA-N 0 3 348.447 2.824 20 5 EFBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C)[C@@H]1CN(C)CCO1 ZINC000872051230 1287412581 /nfs/dbraw/zinc/41/25/81/1287412581.db2.gz GOFPSPXDETYKTO-HUBLWGQQSA-N 0 3 339.461 2.686 20 5 EFBDHN O=[N+]([O-])c1ccc(Cl)cc1CN[C@@H](C1CC1)[C@@]1(CO)CCCO1 ZINC000815289267 1287412791 /nfs/dbraw/zinc/41/27/91/1287412791.db2.gz XKMMSCMSTUSFGY-HOTGVXAUSA-N 0 3 340.807 2.658 20 5 EFBDHN O=C(NCCNCc1cccc([N+](=O)[O-])c1)c1cscc1Cl ZINC001130003570 1280408493 /nfs/dbraw/zinc/40/84/93/1280408493.db2.gz JUUHARRFUYMWJP-UHFFFAOYSA-N 0 3 339.804 2.829 20 5 EFBDHN CCN(C)C(C)(C)C(=O)NC[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001091380156 1280462151 /nfs/dbraw/zinc/46/21/51/1280462151.db2.gz IAJIRPVKJYTXJF-OTVXOJSOSA-N 0 3 348.447 2.632 20 5 EFBDHN O=C(CCc1ccc(F)cc1)NCCNCc1cccc([N+](=O)[O-])c1 ZINC001130918121 1281295155 /nfs/dbraw/zinc/29/51/55/1281295155.db2.gz NLVSKNFZVGADCJ-UHFFFAOYSA-N 0 3 345.374 2.573 20 5 EFBDHN Cc1cc(C(=O)NCCNCc2cccc([N+](=O)[O-])c2)c(C)s1 ZINC001130954193 1281332035 /nfs/dbraw/zinc/33/20/35/1281332035.db2.gz SFWGHUQIKBXBRZ-UHFFFAOYSA-N 0 3 333.413 2.793 20 5 EFBDHN Cc1ccc(CCC(=O)NCCNCc2ccc([N+](=O)[O-])cc2)cc1 ZINC001131094526 1281470775 /nfs/dbraw/zinc/47/07/75/1281470775.db2.gz YVRVIPNNMIPXMK-UHFFFAOYSA-N 0 3 341.411 2.742 20 5 EFBDHN O=C(CCc1cccs1)NCCCNCc1ccccc1[N+](=O)[O-] ZINC001175718639 1287526580 /nfs/dbraw/zinc/52/65/80/1287526580.db2.gz POAVKAMFHHHKIY-UHFFFAOYSA-N 0 3 347.440 2.885 20 5 EFBDHN CC(C)(CC(=O)NCCNCc1cccc([N+](=O)[O-])c1)CC(F)F ZINC001131486987 1281925797 /nfs/dbraw/zinc/92/57/97/1281925797.db2.gz UBISTAUFFOFNKT-UHFFFAOYSA-N 0 3 343.374 2.872 20 5 EFBDHN Cc1ccccc1CC(=O)NCCCNCc1csc([N+](=O)[O-])c1 ZINC001175704294 1287539756 /nfs/dbraw/zinc/53/97/56/1287539756.db2.gz LCWBXUZKFFLQDG-UHFFFAOYSA-N 0 3 347.440 2.803 20 5 EFBDHN C[C@@H](N[C@@H]1CC(=O)N(c2ccccc2)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815567294 1287601868 /nfs/dbraw/zinc/60/18/68/1287601868.db2.gz SYAYOHJRJITUIK-TZMCWYRMSA-N 0 3 340.383 2.633 20 5 EFBDHN CC(C)OCCN1CCC(Nc2nc3ccccn3c2[N+](=O)[O-])CC1 ZINC000747621337 1283433753 /nfs/dbraw/zinc/43/37/53/1283433753.db2.gz QOVNIFXLBPDZHA-UHFFFAOYSA-N 0 3 347.419 2.544 20 5 EFBDHN C[C@H](NCc1ccc2cnn(C)c2c1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815628199 1287645774 /nfs/dbraw/zinc/64/57/74/1287645774.db2.gz UHLRWWRLBKWKAX-NSHDSACASA-N 0 3 325.372 2.915 20 5 EFBDHN CC(C)c1ccoc1C(=O)NCCNCc1ccc([N+](=O)[O-])cc1 ZINC001132783998 1284278237 /nfs/dbraw/zinc/27/82/37/1284278237.db2.gz DWFYAWKINULCME-UHFFFAOYSA-N 0 3 331.372 2.831 20 5 EFBDHN Cc1cc(C)cc(CC(=O)NCCNCc2cccc([N+](=O)[O-])c2)c1 ZINC001133239742 1285033332 /nfs/dbraw/zinc/03/33/32/1285033332.db2.gz XRVOZTUIBSEGJW-UHFFFAOYSA-N 0 3 341.411 2.660 20 5 EFBDHN COc1ccnc(-n2c(-c3ccccc3)cnc2[C@H](C)N)c1[N+](=O)[O-] ZINC001170679787 1285254807 /nfs/dbraw/zinc/25/48/07/1285254807.db2.gz WBBUGAQAOVMRCB-NSHDSACASA-N 0 3 339.355 2.871 20 5 EFBDHN CCN(C)C(C)(C)C(=O)NCCCNc1cc(C)ccc1[N+](=O)[O-] ZINC001094639958 1285465920 /nfs/dbraw/zinc/46/59/20/1285465920.db2.gz JHXKHLDYVQNUGZ-UHFFFAOYSA-N 0 3 336.436 2.552 20 5 EFBDHN CC(COC(=O)c1c[nH]nc1-c1cccc(OC(F)F)c1)[N+](=O)[O-] ZINC000813099897 1285650439 /nfs/dbraw/zinc/65/04/39/1285650439.db2.gz GQLOTROLJMWUPI-QMMMGPOBSA-N 0 3 341.270 2.500 20 5 EFBDHN CC(COC(=O)CCc1nnc(-c2cc3ccccc3o2)o1)[N+](=O)[O-] ZINC000813100575 1285651759 /nfs/dbraw/zinc/65/17/59/1285651759.db2.gz URPYFTHMJWWWNT-SNVBAGLBSA-N 0 3 345.311 2.624 20 5 EFBDHN CC(COC(=O)c1ccc(NC(=O)c2cccs2)cc1)[N+](=O)[O-] ZINC000813101888 1285652773 /nfs/dbraw/zinc/65/27/73/1285652773.db2.gz KUCWOLPNVYJWRN-SNVBAGLBSA-N 0 3 334.353 2.822 20 5 EFBDHN COc1ccc(C2(C(=O)OCC(C)[N+](=O)[O-])CCCC2)cc1OC ZINC000813102696 1285653386 /nfs/dbraw/zinc/65/33/86/1285653386.db2.gz IWLPVZBILHYIAR-GFCCVEGCSA-N 0 3 337.372 2.724 20 5 EFBDHN CC(COC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)[N+](=O)[O-] ZINC000813104498 1285653975 /nfs/dbraw/zinc/65/39/75/1285653975.db2.gz NKUYKMFPLQKKRI-MRVPVSSYSA-N 0 3 337.313 2.540 20 5 EFBDHN CC(COC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)[N+](=O)[O-] ZINC000813104499 1285654379 /nfs/dbraw/zinc/65/43/79/1285654379.db2.gz NKUYKMFPLQKKRI-QMMMGPOBSA-N 0 3 337.313 2.540 20 5 EFBDHN Cc1cc(C)cc(-n2ccnc2SCC(=O)OCC(C)[N+](=O)[O-])c1 ZINC000813103690 1285654490 /nfs/dbraw/zinc/65/44/90/1285654490.db2.gz FJCNSHDBPKKGEX-CYBMUJFWSA-N 0 3 349.412 2.790 20 5 EFBDHN Cc1sc2ncnc(SCC(=O)OCC(C)[N+](=O)[O-])c2c1C ZINC000813104899 1285654614 /nfs/dbraw/zinc/65/46/14/1285654614.db2.gz SSXZWEWLJFOTQH-SSDOTTSWSA-N 0 3 341.414 2.609 20 5 EFBDHN COc1cc(-n2cccc2)c(Cl)cc1C(=O)OCC(C)[N+](=O)[O-] ZINC000813102418 1285655079 /nfs/dbraw/zinc/65/50/79/1285655079.db2.gz RFPPNGZUJLWXPD-SNVBAGLBSA-N 0 3 338.747 2.961 20 5 EFBDHN CC(COC(=O)CCc1nc(-c2ccc(Cl)cc2)no1)[N+](=O)[O-] ZINC000813106969 1285677665 /nfs/dbraw/zinc/67/76/65/1285677665.db2.gz JENYOVCFYJFXOR-SECBINFHSA-N 0 3 339.735 2.531 20 5 EFBDHN Cc1cc(C(=O)OCC(C)[N+](=O)[O-])nc(-c2ccc(Cl)cc2)n1 ZINC000813108023 1285678886 /nfs/dbraw/zinc/67/88/86/1285678886.db2.gz TZFGATGVMLRZHJ-SNVBAGLBSA-N 0 3 335.747 2.927 20 5 EFBDHN CC(C)COc1cn(-c2ccccc2)nc1C(=O)OCC(C)[N+](=O)[O-] ZINC000813112676 1285683577 /nfs/dbraw/zinc/68/35/77/1285683577.db2.gz SRWWSRSXEWNOHK-CYBMUJFWSA-N 0 3 347.371 2.729 20 5 EFBDHN CC(COC(=O)[C@H]1CCCN(c2nc3ccccc3s2)C1)[N+](=O)[O-] ZINC000813111492 1285684172 /nfs/dbraw/zinc/68/41/72/1285684172.db2.gz IOBBQZWWDPOPQL-RYUDHWBXSA-N 0 3 349.412 2.721 20 5 EFBDHN COc1cccc(C(=O)NCCCNCc2csc([N+](=O)[O-])c2)c1 ZINC001171903765 1285892739 /nfs/dbraw/zinc/89/27/39/1285892739.db2.gz QWMZTKPPDWSODR-UHFFFAOYSA-N 0 3 349.412 2.575 20 5 EFBDHN O=C(NCCNCc1cccc([N+](=O)[O-])c1)c1cc2occc2s1 ZINC001133766901 1285920015 /nfs/dbraw/zinc/92/00/15/1285920015.db2.gz OWDRVYDRCOCAIX-UHFFFAOYSA-N 0 3 345.380 2.922 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)CC[C@@H](NCc1cc3n(n1)CCCO3)CC2 ZINC001172910350 1286352495 /nfs/dbraw/zinc/35/24/95/1286352495.db2.gz XVYJXUUIGQGDJO-HNNXBMFYSA-N 0 3 342.399 2.611 20 5 EFBDHN O=C(NCCNCc1ccc([N+](=O)[O-])cc1)c1cccc2cc[nH]c21 ZINC001134150683 1286380110 /nfs/dbraw/zinc/38/01/10/1286380110.db2.gz NUGSLDXJJKGGCY-UHFFFAOYSA-N 0 3 338.367 2.596 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@H](C)NCc2cccnc2F)c1F ZINC001173175605 1286451440 /nfs/dbraw/zinc/45/14/40/1286451440.db2.gz DQZRIVYFHTVQHY-JTQLQIEISA-N 0 3 337.326 2.997 20 5 EFBDHN COC[C@H]1CCN([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173178311 1286453685 /nfs/dbraw/zinc/45/36/85/1286453685.db2.gz AOIPCRCVPKIUPP-RYUDHWBXSA-N 0 3 326.368 2.642 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)NCc2cc(C)nn2C)c1F ZINC001173180061 1286454687 /nfs/dbraw/zinc/45/46/87/1286454687.db2.gz SNJNHQKKNUWYST-SNVBAGLBSA-N 0 3 336.367 2.505 20 5 EFBDHN COc1ccc([N+](=O)[O-])c(C[C@@H](C)N2CCC[C@@H](CO)CC2)c1F ZINC001173180037 1286454896 /nfs/dbraw/zinc/45/48/96/1286454896.db2.gz ICRXHIQWTZNJMR-CHWSQXEVSA-N 0 3 340.395 2.768 20 5 EFBDHN COc1ccc(CN[C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])nc1 ZINC001173190848 1286457719 /nfs/dbraw/zinc/45/77/19/1286457719.db2.gz HYWWEWWQGGQYEZ-LLVKDONJSA-N 0 3 349.362 2.867 20 5 EFBDHN CCN1CCN([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C[C@H]1C ZINC001173192116 1286458804 /nfs/dbraw/zinc/45/88/04/1286458804.db2.gz HZZDCDONJADHJK-QWHCGFSZSA-N 0 3 339.411 2.700 20 5 EFBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CCC(Oc2ncccn2)CC1 ZINC001173226410 1286481013 /nfs/dbraw/zinc/48/10/13/1286481013.db2.gz JVOFFLJDZGVRTA-CQSZACIVSA-N 0 3 342.399 2.859 20 5 EFBDHN Cc1cccn2c(CN[C@@H](C)Cc3ccc([N+](=O)[O-])cc3)nnc12 ZINC001173209490 1286485292 /nfs/dbraw/zinc/48/52/92/1286485292.db2.gz CGSLDHXQUQMVFF-ZDUSSCGKSA-N 0 3 325.372 2.667 20 5 EFBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[C@@H](Oc2ncc(F)cn2)C1 ZINC001173238318 1286496151 /nfs/dbraw/zinc/49/61/51/1286496151.db2.gz PHWBACCWTURABT-BLLLJJGKSA-N 0 3 346.362 2.608 20 5 EFBDHN Cc1cnc(O[C@@H]2CCN([C@@H](C)Cc3ccc([N+](=O)[O-])cc3)C2)nc1 ZINC001173238586 1286496278 /nfs/dbraw/zinc/49/62/78/1286496278.db2.gz VVGLUOOQBSEUDY-WMLDXEAASA-N 0 3 342.399 2.778 20 5 EFBDHN CC(C)C(=O)N[C@@H]1CCCN([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173238725 1286497148 /nfs/dbraw/zinc/49/71/48/1286497148.db2.gz WUHJLOTXYODMQI-GOEBONIOSA-N 0 3 333.432 2.762 20 5 EFBDHN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)CCC(C)(C)[N+](=O)[O-])C1 ZINC000822712657 1289088589 /nfs/dbraw/zinc/08/85/89/1289088589.db2.gz ZRUIFRQPXMFDKS-HOCLYGCPSA-N 0 3 333.432 2.774 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(NC2CCN(C(=O)CN(C)C(C)C)CC2)c1 ZINC001095228335 1286711011 /nfs/dbraw/zinc/71/10/11/1286711011.db2.gz FLHCQYAQVIRTPC-UHFFFAOYSA-N 0 3 348.447 2.646 20 5 EFBDHN Cc1ccc(NC2CCN(C(=O)CN(C)C(C)C)CC2)c([N+](=O)[O-])c1 ZINC001095228809 1286711614 /nfs/dbraw/zinc/71/16/14/1286711614.db2.gz YVHTWUVNMFJQEV-UHFFFAOYSA-N 0 3 348.447 2.646 20 5 EFBDHN O=[N+]([O-])c1cc(Br)ccc1CN[C@H](CCO)C1CC1 ZINC000822845375 1289130860 /nfs/dbraw/zinc/13/08/60/1289130860.db2.gz NYOCCXPJKDXSBR-GFCCVEGCSA-N 0 3 329.194 2.608 20 5 EFBDHN O=C(NCCNCc1ccc([N+](=O)[O-])cc1)c1cc(Cl)cs1 ZINC001134789066 1287190809 /nfs/dbraw/zinc/19/08/09/1287190809.db2.gz QUBJLOKMBYRUOC-UHFFFAOYSA-N 0 3 339.804 2.829 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@@H](C2CC2)[C@@]2(CO)CCCO2)cc1Cl ZINC000816667565 1288235936 /nfs/dbraw/zinc/23/59/36/1288235936.db2.gz PXVRRKWSJVOCIU-HOTGVXAUSA-N 0 3 340.807 2.658 20 5 EFBDHN O=C(NCCCNCc1ccccc1[N+](=O)[O-])c1ccc(CF)cc1 ZINC001177169429 1288279075 /nfs/dbraw/zinc/27/90/75/1288279075.db2.gz JQOHKFZKKASTAN-UHFFFAOYSA-N 0 3 345.374 2.974 20 5 EFBDHN CCc1ncc(C(=O)NCCCNCc2ccccc2[N+](=O)[O-])s1 ZINC001177293157 1288359206 /nfs/dbraw/zinc/35/92/06/1288359206.db2.gz UFGSPRBHWLYGQI-UHFFFAOYSA-N 0 3 348.428 2.523 20 5 EFBDHN Cc1cc(F)cc(C(=O)N2CCN(C3CCC3)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000817021522 1288376448 /nfs/dbraw/zinc/37/64/48/1288376448.db2.gz LAYVYIUPVOVXAR-LBPRGKRZSA-N 0 3 349.406 2.989 20 5 EFBDHN Cc1cc(Cl)c(C(=O)N(C)C[C@@H]2CCCN2C)cc1[N+](=O)[O-] ZINC000817494122 1288618542 /nfs/dbraw/zinc/61/85/42/1288618542.db2.gz IJHNVPQQQOPEHP-NSHDSACASA-N 0 3 325.796 2.723 20 5 EFBDHN CCCN(C(=O)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1)[C@@H]1CCN(C)C1 ZINC000823500292 1289322827 /nfs/dbraw/zinc/32/28/27/1289322827.db2.gz WHNMZCNDUDVKBG-IXDOHACOSA-N 0 3 331.416 2.641 20 5 EFBDHN CCCN(CCN1CCCCC1)C(=O)Nc1ccc(N)c([N+](=O)[O-])c1 ZINC000823938621 1289495408 /nfs/dbraw/zinc/49/54/08/1289495408.db2.gz KAHSSBHPUWWXQR-UHFFFAOYSA-N 0 3 349.435 2.907 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1CNC[C@@H](O)COc1ccccc1 ZINC000873011391 1289517929 /nfs/dbraw/zinc/51/79/29/1289517929.db2.gz WTYJTPJSMMRCEE-OAHLLOKOSA-N 0 3 330.384 2.741 20 5 EFBDHN Cc1c(CNCCCS(=O)(=O)c2ccccc2)cccc1[N+](=O)[O-] ZINC000873026758 1289528523 /nfs/dbraw/zinc/52/85/23/1289528523.db2.gz OMXMYGQWMATRMW-UHFFFAOYSA-N 0 3 348.424 2.857 20 5 EFBDHN COc1ccc(OC)c([C@H](O)[C@H](C)NCc2cccc([N+](=O)[O-])c2)c1 ZINC000873196459 1289635610 /nfs/dbraw/zinc/63/56/10/1289635610.db2.gz SIFCGYSLNMEGPJ-KPZWWZAWSA-N 0 3 346.383 2.824 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1CCC(N2CCCNC2=O)CC1 ZINC000876770240 1291016556 /nfs/dbraw/zinc/01/65/56/1291016556.db2.gz KMNQKSOVIKOSDV-UHFFFAOYSA-N 0 3 346.431 2.591 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1CCC(O[C@H]2CCOC2)CC1 ZINC000876783431 1291023438 /nfs/dbraw/zinc/02/34/38/1291023438.db2.gz BVONSPKOGNMATH-INIZCTEOSA-N 0 3 334.416 2.982 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NC[C@H]1NCCc2ccccc21 ZINC000876846038 1291045738 /nfs/dbraw/zinc/04/57/38/1291045738.db2.gz LTKITNZTXDGRAE-MRXNPFEDSA-N 0 3 339.395 2.828 20 5 EFBDHN C[C@](CO)(NCc1cc(Br)c([N+](=O)[O-])s1)C1CC1 ZINC000877159029 1291150833 /nfs/dbraw/zinc/15/08/33/1291150833.db2.gz RBASXEBCFSJCTE-LLVKDONJSA-N 0 3 335.223 2.669 20 5 EFBDHN Cc1ccc(CN(C)[C@H](CC(N)=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000878541567 1291707914 /nfs/dbraw/zinc/70/79/14/1291707914.db2.gz DDBRFDNMYONXKB-QGZVFWFLSA-N 0 3 327.384 2.952 20 5 EFBDHN O=[N+]([O-])c1ccc(CN[C@@H]([C@H]2CCCO2)C2(CO)CCC2)cc1F ZINC000878870352 1291836518 /nfs/dbraw/zinc/83/65/18/1291836518.db2.gz ZHFAGRILLLOMKS-CVEARBPZSA-N 0 3 338.379 2.534 20 5 EFBDHN CCN1CC[C@@H](Oc2c([N+](=O)[O-])cc([N+](=O)[O-])c3cccnc32)C1 ZINC001233901945 1313014687 /nfs/dbraw/zinc/01/46/87/1313014687.db2.gz PKUSCXFGWSWNLG-SNVBAGLBSA-N 0 3 332.316 2.524 20 5 EFBDHN CN1CCC(Oc2c([N+](=O)[O-])cc([N+](=O)[O-])c3cccnc32)CC1 ZINC001233902945 1313015330 /nfs/dbraw/zinc/01/53/30/1313015330.db2.gz YVHAIKVAANRGQY-UHFFFAOYSA-N 0 3 332.316 2.524 20 5 EFBDHN Cc1ccccc1OCCN(C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136869057 1294691051 /nfs/dbraw/zinc/69/10/51/1294691051.db2.gz PHGQQOWLKXGADH-KRWDZBQOSA-N 0 3 330.384 2.947 20 5 EFBDHN CCCSCC(=O)NCCCN(C)Cc1ccc([N+](=O)[O-])cc1 ZINC001234520604 1313144749 /nfs/dbraw/zinc/14/47/49/1313144749.db2.gz AXCOKLAOPGRDMO-UHFFFAOYSA-N 0 3 339.461 2.676 20 5 EFBDHN C/C(=C/C(=O)NCCCN(C)Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001234530808 1313148230 /nfs/dbraw/zinc/14/82/30/1313148230.db2.gz ZOAGURGEPPUFJO-KAMYIIQDSA-N 0 3 331.416 2.889 20 5 EFBDHN CC1(C)CCN(CCNC(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000890082018 1295894824 /nfs/dbraw/zinc/89/48/24/1295894824.db2.gz PKKFONKWJZJPRE-UHFFFAOYSA-N 0 3 325.796 2.710 20 5 EFBDHN CN(CCOc1ccc(F)cc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776275951 1297338991 /nfs/dbraw/zinc/33/89/91/1297338991.db2.gz MATDCPGDPHIEMU-KRWDZBQOSA-N 0 3 334.347 2.778 20 5 EFBDHN COC[C@H](NC[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1cccc(OC)c1 ZINC000852443019 1299705606 /nfs/dbraw/zinc/70/56/06/1299705606.db2.gz HZSNKNNYDUTDET-ZWKOTPCHSA-N 0 3 346.383 2.614 20 5 EFBDHN COc1cccc(C2(NC[C@@H](O)c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000776606392 1299751424 /nfs/dbraw/zinc/75/14/24/1299751424.db2.gz WMSCTVMOWKWDEL-QGZVFWFLSA-N 0 3 328.368 2.916 20 5 EFBDHN O=[N+]([O-])c1cc(NC[C@@H]2CN3CCC[C@@H]3CO2)ccc1C(F)(F)F ZINC000853241471 1300062359 /nfs/dbraw/zinc/06/23/59/1300062359.db2.gz KBKIKTXLEVBQCC-VXGBXAGGSA-N 0 3 345.321 2.889 20 5 EFBDHN O=[N+]([O-])c1cc(NC[C@H]2CN3CCC[C@H]3CO2)ccc1C(F)(F)F ZINC000853241469 1300062399 /nfs/dbraw/zinc/06/23/99/1300062399.db2.gz KBKIKTXLEVBQCC-RYUDHWBXSA-N 0 3 345.321 2.889 20 5 EFBDHN CN(CCNC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000112085339 1300502242 /nfs/dbraw/zinc/50/22/42/1300502242.db2.gz VGSMXNHOQTZHFV-UHFFFAOYSA-N 0 3 349.337 2.735 20 5 EFBDHN Cc1cc([N+](=O)[O-])c(F)c(C(=O)NCCN2CCCC2(C)C)c1F ZINC000854894059 1300725166 /nfs/dbraw/zinc/72/51/66/1300725166.db2.gz VJADFQLSEISGPJ-UHFFFAOYSA-N 0 3 341.358 2.786 20 5 EFBDHN Cc1cc([N+](=O)[O-])c(F)c(C(=O)N(C)[C@@H]2CCN(C(C)C)C2)c1F ZINC000854896009 1300725968 /nfs/dbraw/zinc/72/59/68/1300725968.db2.gz FSMNKZHXTDIJGU-LLVKDONJSA-N 0 3 341.358 2.736 20 5 EFBDHN CCCN1CC[C@H](NC(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)C1 ZINC000856072501 1301224126 /nfs/dbraw/zinc/22/41/26/1301224126.db2.gz BANBQLRLNXMFGT-NSHDSACASA-N 0 3 325.796 2.771 20 5 EFBDHN O=[N+]([O-])c1ccccc1OCCN1CCC[C@](O)(c2ccccc2)C1 ZINC000859583168 1301496845 /nfs/dbraw/zinc/49/68/45/1301496845.db2.gz BVKGGLWYLGSWEQ-LJQANCHMSA-N 0 3 342.395 2.957 20 5 EFBDHN C[C@@H](CN(C)CCc1ccc([N+](=O)[O-])cc1)NC(=O)OC(C)(C)C ZINC000860096122 1301699605 /nfs/dbraw/zinc/69/96/05/1301699605.db2.gz UPCOYSNTMFRWQT-ZDUSSCGKSA-N 0 3 337.420 2.982 20 5 EFBDHN CN1CCN(CCCNc2c(Cl)c(Cl)ccc2[N+](=O)[O-])CC1 ZINC000865414752 1303244602 /nfs/dbraw/zinc/24/46/02/1303244602.db2.gz AXJZCOBVQIFKSV-UHFFFAOYSA-N 0 3 347.246 2.951 20 5 EFBDHN O=[N+]([O-])c1ccc(N2CCN(C[C@@H]3CCOC3)CC2)c(C(F)F)c1 ZINC000865592652 1303324758 /nfs/dbraw/zinc/32/47/58/1303324758.db2.gz WXZZSKHFHDTJIG-LBPRGKRZSA-N 0 3 341.358 2.691 20 5 EFBDHN O=[N+]([O-])c1cc(CO)c(N2CCN(C3CCCCC3)CC2)cc1F ZINC000865619539 1303336363 /nfs/dbraw/zinc/33/63/63/1303336363.db2.gz JLMWAPZVVVYJNH-UHFFFAOYSA-N 0 3 337.395 2.681 20 5 EFBDHN CN1CCCC(C)(C)[C@@H]1CNC(=O)Cc1cccc(F)c1[N+](=O)[O-] ZINC000867910628 1304014716 /nfs/dbraw/zinc/01/47/16/1304014716.db2.gz NGTAYDZXTWFEEJ-AWEZNQCLSA-N 0 3 337.395 2.513 20 5 EFBDHN COc1ccc(CN2CCC[C@@H](Cc3nccn3C)C2)cc1[N+](=O)[O-] ZINC000090003449 1314032414 /nfs/dbraw/zinc/03/24/14/1314032414.db2.gz GREHWHAFRPZNQF-AWEZNQCLSA-N 0 3 344.415 2.792 20 5 EFBDHN CC(COC(=O)Cc1ccc(Br)cc1Cl)[N+](=O)[O-] ZINC000870376109 1305291181 /nfs/dbraw/zinc/29/11/81/1305291181.db2.gz ASSBYFIVSOTCOC-ZETCQYMHSA-N 0 3 336.569 2.853 20 5 EFBDHN CC([C@@H](OC(=O)c1ncc2n1CCCC2)c1ccccc1F)[N+](=O)[O-] ZINC000870455146 1305331369 /nfs/dbraw/zinc/33/13/69/1305331369.db2.gz WDOHQCWZZCGTOT-XHDPSFHLSA-N 0 3 347.346 2.922 20 5 EFBDHN CC(=O)O[C@H]1C[C@@H]2C[C@H](OCc3cccc([N+](=O)[O-])c3C)C[C@H]1N2C ZINC001223330425 1311245558 /nfs/dbraw/zinc/24/55/58/1311245558.db2.gz PHYCPAGHFYGUDM-ONIAQPFYSA-N 0 3 348.399 2.587 20 5 EFBDHN CC(=O)O[C@@H]1C[C@@H]2C[C@H](OCc3cccc(C)c3[N+](=O)[O-])C[C@H]1N2C ZINC001223665153 1311289029 /nfs/dbraw/zinc/28/90/29/1311289029.db2.gz OXUALENWRASVQJ-MWDXBVQZSA-N 0 3 348.399 2.587 20 5 EFBDHN CC(=O)O[C@H]1C[C@@H]2C[C@H](O[C@H](C)c3ccc([N+](=O)[O-])cc3)C[C@H]1N2C ZINC001224027124 1311333818 /nfs/dbraw/zinc/33/38/18/1311333818.db2.gz UPNDIMWPXFHSEF-AJAORCOTSA-N 0 3 348.399 2.839 20 5 EFBDHN O=[N+]([O-])c1cc([O-])cc(Nc2ccc(OCC3CC[NH2+]CC3)nc2)c1 ZINC001159343796 1311499200 /nfs/dbraw/zinc/49/92/00/1311499200.db2.gz MMCMZEHMGYBRQD-UHFFFAOYSA-N 0 3 344.371 2.817 20 5 EFBDHN C[C@@H](Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)[C@H]1CNCCO1 ZINC001159499508 1311527852 /nfs/dbraw/zinc/52/78/52/1311527852.db2.gz ANLMGNIVUKBSFX-IAQYHMDHSA-N 0 3 346.362 2.585 20 5 EFBDHN CC(C)N1CC[C@@H](Oc2ncc(Br)cc2[N+](=O)[O-])C1 ZINC001225748762 1311572470 /nfs/dbraw/zinc/57/24/70/1311572470.db2.gz VWFPGRCKBCXOHU-SNVBAGLBSA-N 0 3 330.182 2.614 20 5 EFBDHN NCc1cc(-c2ccncc2)nn1-c1nccc2cc([N+](=O)[O-])ccc21 ZINC001160344441 1311694832 /nfs/dbraw/zinc/69/48/32/1311694832.db2.gz MZGXGATYGOVPSD-UHFFFAOYSA-N 0 3 346.350 2.849 20 5 EFBDHN CN(Cc1c2ccccc2cc2ccccc21)C(=O)[C@H]1CNCCN1C ZINC001160739646 1311772290 /nfs/dbraw/zinc/77/22/90/1311772290.db2.gz VJMFECDURUZKIJ-OAQYLSRUSA-N 0 3 347.462 2.855 20 5 EFBDHN Cc1nn(CN2CCN(C)C[C@@H]2CC(C)C)c2cc([N+](=O)[O-])ccc12 ZINC000902541978 1311853753 /nfs/dbraw/zinc/85/37/53/1311853753.db2.gz KORCOZZXVUSDJA-INIZCTEOSA-N 0 3 345.447 2.873 20 5 EFBDHN CN1CCC(Oc2c(F)cc(Br)cc2[N+](=O)[O-])CC1 ZINC001228484121 1311954899 /nfs/dbraw/zinc/95/48/99/1311954899.db2.gz PJBBOIPNQPUIPX-UHFFFAOYSA-N 0 3 333.157 2.969 20 5 EFBDHN C[C@H]1CN(Cc2ccccc2)CC[C@H]1Oc1ncncc1[N+](=O)[O-] ZINC001228655076 1311976494 /nfs/dbraw/zinc/97/64/94/1311976494.db2.gz PGZVDJRBNJQXTP-XJKSGUPXSA-N 0 3 328.372 2.674 20 5 EFBDHN O=[N+]([O-])c1cc2c(cc1NCc1ccc(Br)nc1)CNC2 ZINC001162015302 1312030624 /nfs/dbraw/zinc/03/06/24/1312030624.db2.gz RXJVOUDQACWVRX-UHFFFAOYSA-N 0 3 349.188 2.968 20 5 EFBDHN CCC(CC)C(=O)N1C[C@H]2CN(Cc3cccc([N+](=O)[O-])c3)C[C@H]2C1 ZINC001048689601 1312047248 /nfs/dbraw/zinc/04/72/48/1312047248.db2.gz NFEDCEAHADYTDL-CALCHBBNSA-N 0 3 345.443 2.921 20 5 EFBDHN O=C(CCC1CC1)N1C[C@H]2CN(Cc3cccc([N+](=O)[O-])c3)C[C@H]2C1 ZINC001048731331 1312084546 /nfs/dbraw/zinc/08/45/46/1312084546.db2.gz VYDZWDNLQKKTNA-CALCHBBNSA-N 0 3 343.427 2.675 20 5 EFBDHN CCOc1cnc(-n2c3ccccc3nc2[C@H](C)N)c([N+](=O)[O-])c1 ZINC001162759686 1312169557 /nfs/dbraw/zinc/16/95/57/1312169557.db2.gz SRIFNCPFMKNUMW-JTQLQIEISA-N 0 3 327.344 2.747 20 5 EFBDHN Cc1cnc(C(=O)NCCCNCc2csc([N+](=O)[O-])c2)cc1C ZINC001162974514 1312216025 /nfs/dbraw/zinc/21/60/25/1312216025.db2.gz GJVQLTSNQQESKL-UHFFFAOYSA-N 0 3 348.428 2.578 20 5 EFBDHN O=C(CC1CC1)NCCC1(CNCc2ccccc2[N+](=O)[O-])CC1 ZINC001163138443 1312249721 /nfs/dbraw/zinc/24/97/21/1312249721.db2.gz RYXUBOMKUVKAAB-UHFFFAOYSA-N 0 3 331.416 2.771 20 5 EFBDHN CCCC(=O)NCCC1(CNCc2csc([N+](=O)[O-])c2)CC1 ZINC001163156686 1312252863 /nfs/dbraw/zinc/25/28/63/1312252863.db2.gz JKGFTSDOFGWNSA-UHFFFAOYSA-N 0 3 325.434 2.833 20 5 EFBDHN O=C(NCCC1(CNCc2ccccc2[N+](=O)[O-])CC1)c1ccco1 ZINC001163181160 1312259198 /nfs/dbraw/zinc/25/91/98/1312259198.db2.gz UJQVDGJJERYURD-UHFFFAOYSA-N 0 3 343.383 2.878 20 5 EFBDHN O=[N+]([O-])c1c(N[C@H]2CCCC[C@@]23CNCCO3)ccc2ncccc21 ZINC001163650298 1312354357 /nfs/dbraw/zinc/35/43/57/1312354357.db2.gz OIGICZZJHIBVIC-FUHWJXTLSA-N 0 3 342.399 2.856 20 5 EFBDHN O=[N+]([O-])c1ccc(N[C@H]2CCCC[C@@]23CNCCO3)c2ccncc21 ZINC001163650751 1312354898 /nfs/dbraw/zinc/35/48/98/1312354898.db2.gz SAJGJMWXZPQLBO-ZWKOTPCHSA-N 0 3 342.399 2.856 20 5 EFBDHN CCC(C)(C)C(=O)N1C[C@H]2CN(Cc3cccc([N+](=O)[O-])c3)C[C@H]2C1 ZINC001049017290 1312366048 /nfs/dbraw/zinc/36/60/48/1312366048.db2.gz JPHXPIBOQILDNF-IYBDPMFKSA-N 0 3 345.443 2.921 20 5 EFBDHN CCN1CCCN(c2cc3ncnc(Cl)c3cc2[N+](=O)[O-])CC1 ZINC001163771255 1312381499 /nfs/dbraw/zinc/38/14/99/1312381499.db2.gz IYJZGOKOWJCYIH-UHFFFAOYSA-N 0 3 335.795 2.723 20 5 EFBDHN CC1(C(=O)NCCC2(CNCc3ccccc3[N+](=O)[O-])CC2)CC1 ZINC001164608501 1312549599 /nfs/dbraw/zinc/54/95/99/1312549599.db2.gz LGLWIMMQRQOVDN-UHFFFAOYSA-N 0 3 331.416 2.771 20 5 EFBDHN O=[N+]([O-])c1cnc(N2C[C@H]3[C@@H](CCN3Cc3ccccc3)C2)c(F)c1 ZINC001165084639 1312565592 /nfs/dbraw/zinc/56/55/92/1312565592.db2.gz KSVWJYOFJPSOEW-YOEHRIQHSA-N 0 3 342.374 2.840 20 5 EFBDHN O=[N+]([O-])c1cc(F)cnc1N1C[C@H]2[C@@H](CCN2Cc2ccccc2)C1 ZINC001165089965 1312566110 /nfs/dbraw/zinc/56/61/10/1312566110.db2.gz WLFPZEPVKUJSKY-YOEHRIQHSA-N 0 3 342.374 2.840 20 5 EFBDHN CN(C)C1(C)CN(c2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)C1 ZINC001165122423 1312572238 /nfs/dbraw/zinc/57/22/38/1312572238.db2.gz ZXUNHVZMLJDRNU-UHFFFAOYSA-N 0 3 330.363 2.936 20 5 EFBDHN CC(C)N1CCN(c2ccc(-c3ccccc3[N+](=O)[O-])nn2)C[C@H]1C ZINC001165199579 1312583936 /nfs/dbraw/zinc/58/39/36/1312583936.db2.gz BWLNKWLMFUHIHM-CQSZACIVSA-N 0 3 341.415 2.971 20 5 EFBDHN Cc1cc(C)c(C(=O)N[C@H]2C[C@H](NCc3ccccc3[N+](=O)[O-])C2)[nH]1 ZINC001020301353 1314719516 /nfs/dbraw/zinc/71/95/16/1314719516.db2.gz YYZCZXYCZCOTJY-SHTZXODSSA-N 0 3 342.399 2.590 20 5 EFBDHN Cc1cc(-c2nc(-c3ccc4c(n3)CCNC4)no2)cc([N+](=O)[O-])c1 ZINC001216582417 1314975434 /nfs/dbraw/zinc/97/54/34/1314975434.db2.gz FFFNNNFTRQMYCU-UHFFFAOYSA-N 0 3 337.339 2.661 20 5 EFBDHN O=[N+]([O-])c1cc(Br)c(C(F)(F)F)cc1OC1CNC1 ZINC001218052569 1315139488 /nfs/dbraw/zinc/13/94/88/1315139488.db2.gz KFMOPNMVKRGCKO-UHFFFAOYSA-N 0 3 341.083 2.727 20 5 EFBDHN O=[N+]([O-])c1ccc(O[C@@H]2CNCCC2(F)F)c(C(F)(F)F)c1 ZINC001218447635 1315197226 /nfs/dbraw/zinc/19/72/26/1315197226.db2.gz IKEHGBVYZVOHJM-SNVBAGLBSA-N 0 3 326.221 2.990 20 5 EFBDHN O=[N+]([O-])c1ccc(Br)cc1O[C@@H]1CNCCC1(F)F ZINC001218449915 1315198298 /nfs/dbraw/zinc/19/82/98/1315198298.db2.gz XGMJQUOWUVTWOW-SNVBAGLBSA-N 0 3 337.120 2.733 20 5 EFBDHN COC(=O)c1cc([N+](=O)[O-])ccc1O[C@H]1CNCc2ccccc21 ZINC001218489718 1315204799 /nfs/dbraw/zinc/20/47/99/1315204799.db2.gz QJCBMEMIJLIQOY-INIZCTEOSA-N 0 3 328.324 2.605 20 5 EFBDHN COc1cc(CN2CCN(C(C)(C)C)CC2)c([N+](=O)[O-])cc1OC ZINC001253996565 1315663172 /nfs/dbraw/zinc/66/31/72/1315663172.db2.gz DXRHVWNFCJQTJR-UHFFFAOYSA-N 0 3 337.420 2.528 20 5 EFBDHN CC(C)[C@@H]1COCCN1C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001254479627 1315708384 /nfs/dbraw/zinc/70/83/84/1315708384.db2.gz FQFRTVHXCBIWQK-SFHVURJKSA-N 0 3 333.432 2.920 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])NCc1cc(OCC2CC2)ncn1 ZINC001254550067 1315722845 /nfs/dbraw/zinc/72/28/45/1315722845.db2.gz ZUSVMQYKNMFKRA-ZDUSSCGKSA-N 0 3 342.399 2.894 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N1CCCN(c2ncccn2)CC1 ZINC001254560578 1315723344 /nfs/dbraw/zinc/72/33/44/1315723344.db2.gz VUXLCWOKPVBGTI-OAHLLOKOSA-N 0 3 341.415 2.528 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N1CCC(N2CCCC2=O)CC1 ZINC001254563697 1315723927 /nfs/dbraw/zinc/72/39/27/1315723927.db2.gz BJSHNYXPCLXVJR-CQSZACIVSA-N 0 3 331.416 2.613 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N1CCC(NC(=O)C2CCC2)CC1 ZINC001254562880 1315724101 /nfs/dbraw/zinc/72/41/01/1315724101.db2.gz QLVAZPWQNVMNKL-CQSZACIVSA-N 0 3 345.443 2.907 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N1CCC(N2CCCC2=O)CC1 ZINC001254563696 1315724145 /nfs/dbraw/zinc/72/41/45/1315724145.db2.gz BJSHNYXPCLXVJR-AWEZNQCLSA-N 0 3 331.416 2.613 20 5 EFBDHN CC(C)C(=O)NC1CCN([C@@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC001254563107 1315724172 /nfs/dbraw/zinc/72/41/72/1315724172.db2.gz UANMSSCCHCKZTI-AWEZNQCLSA-N 0 3 333.432 2.762 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N1C[C@@H]2COC[C@H](C1)C2(F)F ZINC001254567603 1315724593 /nfs/dbraw/zinc/72/45/93/1315724593.db2.gz XPALFZYENIQMHB-FPMFFAJLSA-N 0 3 326.343 2.739 20 5 EFBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N1CCC[C@@H](Oc2cnccn2)C1 ZINC001254569093 1315725571 /nfs/dbraw/zinc/72/55/71/1315725571.db2.gz HTGKSGBHCDTQCK-GOEBONIOSA-N 0 3 342.399 2.859 20 5 EFBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N1CC[C@@H](Oc2ncc(F)cn2)C1 ZINC001254569984 1315725617 /nfs/dbraw/zinc/72/56/17/1315725617.db2.gz LMQMUQKNFLKNLQ-IUODEOHRSA-N 0 3 346.362 2.608 20 5 EFBDHN NCc1cc(-c2ccncc2)nn1[C@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254581103 1315727031 /nfs/dbraw/zinc/72/70/31/1315727031.db2.gz KLBPYDDYPDJUPO-INIZCTEOSA-N 0 3 335.367 2.652 20 5 EFBDHN COc1cccc2c1OC[C@H]2N[C@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254587911 1315727913 /nfs/dbraw/zinc/72/79/13/1315727913.db2.gz CEORYQAWWZEDFF-XJKSGUPXSA-N 0 3 326.352 2.794 20 5 EFBDHN COc1ccc2c(c1)c(CN)nn2[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254590860 1315728408 /nfs/dbraw/zinc/72/84/08/1315728408.db2.gz ZRCQXGJICBDBIL-CQSZACIVSA-N 0 3 338.367 2.752 20 5 EFBDHN O=[N+]([O-])c1ccc2c(c1)C[C@@H](N1CCC3(CC(F)(F)CO3)CC1)C2 ZINC001254595396 1315729044 /nfs/dbraw/zinc/72/90/44/1315729044.db2.gz WQFMPPCSXNGIDM-HNNXBMFYSA-N 0 3 338.354 2.952 20 5 EFBDHN CC(C)(C)OC(=O)[C@H]1CCN([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254597435 1315729249 /nfs/dbraw/zinc/72/92/49/1315729249.db2.gz DQIYUOYMJZDVRB-BBRMVZONSA-N 0 3 332.400 2.726 20 5 EFBDHN Cc1ccc(O[C@@H]2CCN([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)nc1 ZINC001254605296 1315730331 /nfs/dbraw/zinc/73/03/31/1315730331.db2.gz BDEAFWZYXSWOQW-QZTJIDSGSA-N 0 3 339.395 2.919 20 5 EFBDHN Cc1noc(C2CCN([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)CC2)n1 ZINC001254605516 1315730471 /nfs/dbraw/zinc/73/04/71/1315730471.db2.gz AXRVQLUEOAMEKE-MRXNPFEDSA-N 0 3 328.372 2.633 20 5 EFBDHN CN(Cc1cccc2c1OCO2)[C@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254605220 1315730633 /nfs/dbraw/zinc/73/06/33/1315730633.db2.gz AHRCZWZUOLKKDF-INIZCTEOSA-N 0 3 326.352 2.923 20 5 EFBDHN CN(Cc1cccc2c1OCO2)[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254605221 1315730639 /nfs/dbraw/zinc/73/06/39/1315730639.db2.gz AHRCZWZUOLKKDF-MRXNPFEDSA-N 0 3 326.352 2.923 20 5 EFBDHN COc1cc(N2CCC(n3ccc([C@@H](C)N)n3)CC2)ccc1[N+](=O)[O-] ZINC001256088641 1315903719 /nfs/dbraw/zinc/90/37/19/1315903719.db2.gz XRUNDQAXEOIUJY-GFCCVEGCSA-N 0 3 345.403 2.661 20 5 EFBDHN COc1cc(N2CCC(N3C[C@@H]4C[C@@H]4[C@H](F)C3)CC2)ccc1[N+](=O)[O-] ZINC001256093089 1315903906 /nfs/dbraw/zinc/90/39/06/1315903906.db2.gz GGJIHIAXLVAXFE-VBNZEHGJSA-N 0 3 349.406 2.862 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)c2ncnc(N[C@@H]3CCN(C4CC4)C3)c2c1 ZINC001261647978 1316422752 /nfs/dbraw/zinc/42/27/52/1316422752.db2.gz NREKGIISVQTPKX-SECBINFHSA-N 0 3 333.779 2.840 20 5 EFBDHN CN(C)C[C@@H](NC[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC001262562625 1316472530 /nfs/dbraw/zinc/47/25/30/1316472530.db2.gz GXWOQDQTDQUIEF-MSOLQXFVSA-N 0 3 347.390 2.660 20 5 EFBDHN CC([C@@H](OC(=O)COC(F)(F)F)c1ccccc1F)[N+](=O)[O-] ZINC001263534900 1316548680 /nfs/dbraw/zinc/54/86/80/1316548680.db2.gz LUPGDCJULQKGDW-WRWORJQWSA-N 0 3 325.214 2.612 20 5 EFBDHN C[C@@H]1CCCN(C(=O)CCN[C@H]2CCc3c2cccc3[N+](=O)[O-])C1 ZINC001326845696 1330373257 /nfs/dbraw/zinc/37/32/57/1330373257.db2.gz WYVDMDXIXFZTRB-CJNGLKHVSA-N 0 3 331.416 2.820 20 5 EFBDHN CCN1CCCC[C@@H]1CNC(=O)c1cccc([N+](=O)[O-])c1Cl ZINC001331587992 1330856656 /nfs/dbraw/zinc/85/66/56/1330856656.db2.gz LKQPFFOTYFYBMT-LLVKDONJSA-N 0 3 325.796 2.852 20 5 EFBDHN Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2Cc3ccccc3CN2)c1C ZINC001333643422 1331186071 /nfs/dbraw/zinc/18/60/71/1331186071.db2.gz QGQINWZCZPQBDB-MRXNPFEDSA-N 0 3 339.395 2.656 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]C[C@@H]2CCCO[C@H]2C(C)C)c1[N+](=O)[O-] ZINC001334185226 1331262992 /nfs/dbraw/zinc/26/29/92/1331262992.db2.gz AWMODTRXLLRPIL-BBRMVZONSA-N 0 3 338.404 2.850 20 5 EFBDHN O=[N+]([O-])c1ccccc1CNC[C@@H](O)CCOCc1ccccc1 ZINC001335361741 1331339251 /nfs/dbraw/zinc/33/92/51/1331339251.db2.gz SHDAHBGYPLEFBE-KRWDZBQOSA-N 0 3 330.384 2.652 20 5 EFBDHN CC(C)[C@@H](NC[C@@H](O)COc1ccccc1[N+](=O)[O-])c1ccccn1 ZINC001336722649 1331496428 /nfs/dbraw/zinc/49/64/28/1331496428.db2.gz LGENTQZBGBTHTD-RDTXWAMCSA-N 0 3 345.399 2.716 20 5 EFBDHN Cc1cc(C[C@@H](C)Nc2cc(C)nc3ccc([N+](=O)[O-])cc32)n[nH]1 ZINC001337901027 1331611015 /nfs/dbraw/zinc/61/10/15/1331611015.db2.gz CFQNRBFUWBQCHB-SNVBAGLBSA-N 0 3 325.372 2.948 20 5 EFBDHN Cc1cc(C[C@@H](C)Nc2cc(C)nc3ccc([N+](=O)[O-])cc32)[nH]n1 ZINC001337901027 1331611021 /nfs/dbraw/zinc/61/10/21/1331611021.db2.gz CFQNRBFUWBQCHB-SNVBAGLBSA-N 0 3 325.372 2.948 20 5 EFBDHN CC(C)N1CCC[C@@H]1C(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC001344024861 1332397699 /nfs/dbraw/zinc/39/76/99/1332397699.db2.gz ZANSQLJRTOUHMA-MAZHCROVSA-N 0 3 338.379 2.948 20 5 EFBDHN CC(C)N1CCC[C@@H]1C(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-] ZINC001344024862 1332397996 /nfs/dbraw/zinc/39/79/96/1332397996.db2.gz ZANSQLJRTOUHMA-WQVCFCJDSA-N 0 3 338.379 2.948 20 5 EFBDHN CC([C@H](OC(=O)COCc1ccncc1)c1ccccc1F)[N+](=O)[O-] ZINC001345037047 1332503680 /nfs/dbraw/zinc/50/36/80/1332503680.db2.gz PUHIJDYVTQIBTE-PXAZEXFGSA-N 0 3 348.330 2.687 20 5 EFBDHN Cc1cncc([N+](=O)[O-])c1N[C@@H]1CN(Cc2ccccc2)C[C@H]1C ZINC001346094317 1332598581 /nfs/dbraw/zinc/59/85/81/1332598581.db2.gz IFNULRMEDFLYJL-GDBMZVCRSA-N 0 3 326.400 2.653 20 5 EFBDHN Cc1cncc([N+](=O)[O-])c1N[C@H]1CN(Cc2ccccc2)C[C@H]1C ZINC001346094320 1332598676 /nfs/dbraw/zinc/59/86/76/1332598676.db2.gz IFNULRMEDFLYJL-ZBFHGGJFSA-N 0 3 326.400 2.653 20 5 EFBDHN O=[N+]([O-])c1ccc(CNC[C@H](O)COc2cccc3[nH]ccc32)cc1 ZINC001346110397 1332600089 /nfs/dbraw/zinc/60/00/89/1332600089.db2.gz QGJYCNKSYLKSQD-HNNXBMFYSA-N 0 3 341.367 2.606 20 5 EFBDHN O=[N+]([O-])c1cc(Cl)c2ncnc(N3CC[C@@H](N4CC=CC4)C3)c2c1 ZINC001350465239 1333085902 /nfs/dbraw/zinc/08/59/02/1333085902.db2.gz IHFPQPWVGFQIGW-LLVKDONJSA-N 0 3 345.790 2.642 20 5 EFBDHN O=C(N[C@H]1CCCN2CCCC[C@H]12)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000847253612 1333447867 /nfs/dbraw/zinc/44/78/67/1333447867.db2.gz JLBHWGGGLKMGAL-UONOGXRCSA-N 0 3 337.807 2.995 20 5 EFBDHN O=C(N[C@@H]1CCCN2CCCC[C@@H]12)c1cc([N+](=O)[O-])ccc1Cl ZINC000847253550 1333448012 /nfs/dbraw/zinc/44/80/12/1333448012.db2.gz HJCBEMUXSRDOSH-CABCVRRESA-N 0 3 337.807 2.995 20 5 EFBDHN O=C(N[C@H]1CCCN2CCCC[C@@H]12)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000847253407 1333448452 /nfs/dbraw/zinc/44/84/52/1333448452.db2.gz DESIUWQQWXLIHP-ZFWWWQNUSA-N 0 3 337.807 2.995 20 5 EFBDHN O=C(N[C@@H]1CCCN2CCCC[C@@H]12)c1cc(F)c([N+](=O)[O-])cc1F ZINC000847255363 1333450649 /nfs/dbraw/zinc/45/06/49/1333450649.db2.gz KOZFYRKVVKXGNC-KGLIPLIRSA-N 0 3 339.342 2.620 20 5 EFBDHN Cc1cc(N2CC[C@@]3(CCOC3=O)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC001354352317 1334246493 /nfs/dbraw/zinc/24/64/93/1334246493.db2.gz ANJJCEJZDVVILX-QGZVFWFLSA-N 0 3 327.340 2.595 20 5 EFBDHN C[C@H](NCc1cc([N+](=O)[O-])ccc1Br)[C@@H]1CCOC1 ZINC001354604402 1334403993 /nfs/dbraw/zinc/40/39/93/1334403993.db2.gz RPGIOQXLBDMQEH-VHSXEESVSA-N 0 3 329.194 2.872 20 5 EFBDHN Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N[C@H]1CCCN2CCCC[C@H]12 ZINC000848352219 1334685648 /nfs/dbraw/zinc/68/56/48/1334685648.db2.gz NLBOFJLYZGLKGW-UONOGXRCSA-N 0 3 335.379 2.789 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1cnn(CN(C[C@@H]2CCOC2)C2CC2)c1 ZINC000848474536 1334735165 /nfs/dbraw/zinc/73/51/65/1334735165.db2.gz FZNUSYRDCPRVNB-AWEZNQCLSA-N 0 3 342.399 2.917 20 5 EFBDHN O=[N+]([O-])c1ccccc1-c1cnn(CN2CCN(C3CCC3)CC2)c1 ZINC000848478862 1334737098 /nfs/dbraw/zinc/73/70/98/1334737098.db2.gz NJHLKODZIKXUQC-UHFFFAOYSA-N 0 3 341.415 2.586 20 5 EFBDHN O=C(N[C@H]1C[C@H](NCc2ccccc2[N+](=O)[O-])C1)C(C1CC1)C1CC1 ZINC001020900753 713435121 /nfs/dbraw/zinc/43/51/21/713435121.db2.gz KFMYCLVMAQVWDV-WKILWMFISA-N 0 3 343.427 2.768 20 5 EFBDHN Cc1ccc(C(=O)N[C@H]2C[C@H](NCc3ccccc3[N+](=O)[O-])C2)cc1 ZINC001020971728 713461945 /nfs/dbraw/zinc/46/19/45/713461945.db2.gz BWLCXCOSBCPOCF-QAQDUYKDSA-N 0 3 339.395 2.954 20 5 EFBDHN CC(COC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1)[N+](=O)[O-] ZINC000813101800 713520081 /nfs/dbraw/zinc/52/00/81/713520081.db2.gz JAEGBVPSVKTURP-JFUSQASVSA-N 0 3 328.162 2.761 20 5 EFBDHN O=C(N[C@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])C1)c1cccs1 ZINC001021791371 714479670 /nfs/dbraw/zinc/47/96/70/714479670.db2.gz HOUQGQMHNCHMOK-BETUJISGSA-N 0 3 331.397 2.707 20 5 EFBDHN CC(C)[C@@H](CNCc1ccc(Cl)cc1[N+](=O)[O-])N1CCOCC1 ZINC000892499960 717987890 /nfs/dbraw/zinc/98/78/90/717987890.db2.gz BMPACGGJGAPXCV-MRXNPFEDSA-N 0 3 341.839 2.695 20 5 EFBDHN COc1ccc(C[C@](C)(CO)NCc2ccccc2[N+](=O)[O-])cc1 ZINC000933424977 714775437 /nfs/dbraw/zinc/77/54/37/714775437.db2.gz VXOKMSCHBUERDN-GOSISDBHSA-N 0 3 330.384 2.687 20 5 EFBDHN O=[N+]([O-])c1ccc(-c2ncn(CN3C[C@@H]4CCCC[C@@H]4C3)n2)cc1 ZINC000176193225 715179813 /nfs/dbraw/zinc/17/98/13/715179813.db2.gz ZSRKDSPDLYHPFY-GASCZTMLSA-N 0 3 327.388 2.933 20 5 EFBDHN COc1c([O-])ccc(C[N@@H+]2CCC[C@@H]2[C@@H]2CCCOC2)c1[N+](=O)[O-] ZINC000895082010 723233632 /nfs/dbraw/zinc/23/36/32/723233632.db2.gz LRQYJCGUGLWVBN-ZIAGYGMSSA-N 0 3 336.388 2.700 20 5 EFBDHN COc1c([O-])ccc(C[N@H+]2CCC[C@@H]2[C@@H]2CCCOC2)c1[N+](=O)[O-] ZINC000895082010 723233637 /nfs/dbraw/zinc/23/36/37/723233637.db2.gz LRQYJCGUGLWVBN-ZIAGYGMSSA-N 0 3 336.388 2.700 20 5 EFBDHN COc1cc(CN[C@H](C)COc2ccccc2)c([N+](=O)[O-])cc1O ZINC000892697045 718768643 /nfs/dbraw/zinc/76/86/43/718768643.db2.gz QXSIGBKDUMWOBO-GFCCVEGCSA-N 0 3 332.356 2.866 20 5 EFBDHN C[C@@H]1CN(C)[C@@H](C)CN1c1cc([N+](=O)[O-])cc2c(Cl)ncnc21 ZINC001164638495 719256788 /nfs/dbraw/zinc/25/67/88/719256788.db2.gz ZZBJMTKPQZGBGA-VHSXEESVSA-N 0 3 335.795 2.720 20 5 EFBDHN CC(C)CN1CCN(c2ccc(-c3ccc([N+](=O)[O-])cc3)nn2)CC1 ZINC001164657501 719336919 /nfs/dbraw/zinc/33/69/19/719336919.db2.gz OMFXGBAAIKQCDC-UHFFFAOYSA-N 0 3 341.415 2.830 20 5 EFBDHN CC(C)CN1CCN(c2cc([N+](=O)[O-])cc3c(Cl)ncnc32)CC1 ZINC001164662603 719340086 /nfs/dbraw/zinc/34/00/86/719340086.db2.gz QEOBUSNBRFISRP-UHFFFAOYSA-N 0 3 349.822 2.969 20 5 EFBDHN COc1c(O)ccc(CNC[C@H](C)Oc2ccccc2)c1[N+](=O)[O-] ZINC000892977972 719380597 /nfs/dbraw/zinc/38/05/97/719380597.db2.gz ZPFYWORXKSHCFD-LBPRGKRZSA-N 0 3 332.356 2.866 20 5 EFBDHN COc1cc(CC[NH2+]Cc2ccc([O-])c(OC)c2[N+](=O)[O-])ccc1C ZINC000893038473 719508239 /nfs/dbraw/zinc/50/82/39/719508239.db2.gz XYKNGJFXMIXIQK-UHFFFAOYSA-N 0 3 346.383 2.958 20 5 EFBDHN CCOC(=O)c1ncc(CNCCc2ccccc2[N+](=O)[O-])s1 ZINC000893070102 719565291 /nfs/dbraw/zinc/56/52/91/719565291.db2.gz WNJZRWGUSBMCNL-UHFFFAOYSA-N 0 3 335.385 2.560 20 5 EFBDHN CC(C)N1CCN(c2cccc(Nc3c([N+](=O)[O-])cnn3C)c2)CC1 ZINC000893069961 719565315 /nfs/dbraw/zinc/56/53/15/719565315.db2.gz UXXBEDWYUGZQHZ-UHFFFAOYSA-N 0 3 344.419 2.602 20 5 EFBDHN COc1c([O-])ccc(C[NH2+][C@@H]2CCOC3(CCCC3)C2)c1[N+](=O)[O-] ZINC000893112817 719678618 /nfs/dbraw/zinc/67/86/18/719678618.db2.gz HVTPHANNHGSNCD-CYBMUJFWSA-N 0 3 336.388 2.890 20 5 EFBDHN COc1c(O)ccc(CN2CCC[C@@]2(CO)CC(C)C)c1[N+](=O)[O-] ZINC000893963770 720176651 /nfs/dbraw/zinc/17/66/51/720176651.db2.gz HLMKZMIYQUVDKH-KRWDZBQOSA-N 0 3 338.404 2.682 20 5 EFBDHN COc1c([O-])ccc(C[NH2+][C@H]2CCO[C@H](C(C)(C)C)C2)c1[N+](=O)[O-] ZINC000893256279 720282286 /nfs/dbraw/zinc/28/22/86/720282286.db2.gz OWBHEBKKUFMRMP-JSGCOSHPSA-N 0 3 338.404 2.992 20 5 EFBDHN O=C(N[C@H]1C[C@H](CNCc2csc([N+](=O)[O-])c2)C1)C1CCCC1 ZINC000982970291 721742225 /nfs/dbraw/zinc/74/22/25/721742225.db2.gz RIUZIMRQILLQAX-YEORSEQZSA-N 0 3 337.445 2.831 20 5 EFBDHN Cc1ccoc1C(=O)N[C@H]1C[C@H](CNCc2csc([N+](=O)[O-])c2)C1 ZINC000983176329 721877338 /nfs/dbraw/zinc/87/73/38/721877338.db2.gz UXBRWSJNIFOHHY-AULYBMBSSA-N 0 3 349.412 2.856 20 5 EFBDHN O=C(N[C@H]1C[C@H](CNCc2csc([N+](=O)[O-])c2)C1)C1CC=CC1 ZINC000983372933 722087402 /nfs/dbraw/zinc/08/74/02/722087402.db2.gz ZGSNTUHWCXDTJT-YEORSEQZSA-N 0 3 335.429 2.607 20 5 EFBDHN O=C(C=C1CCC1)N[C@H]1C[C@H](CNCc2csc([N+](=O)[O-])c2)C1 ZINC000983459883 722648144 /nfs/dbraw/zinc/64/81/44/722648144.db2.gz QPLSPYWDZGHYEY-MQMHXKEQSA-N 0 3 335.429 2.751 20 5 EFBDHN COc1c([O-])ccc(C[NH2+]CCCc2ncccc2C)c1[N+](=O)[O-] ZINC000894714994 722824239 /nfs/dbraw/zinc/82/42/39/722824239.db2.gz NIXYWSRWFGVZBP-UHFFFAOYSA-N 0 3 331.372 2.735 20 5 EFBDHN O=[N+]([O-])c1cc(CNC[C@@H]2COCO2)ccc1Oc1ccc(F)cc1 ZINC000894869592 722925774 /nfs/dbraw/zinc/92/57/74/722925774.db2.gz CGSSHPUWLQZHME-OAHLLOKOSA-N 0 3 348.330 2.989 20 5 EFBDHN CC(C)N1CC[C@H](N(C)C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)C1 ZINC000909438399 723209248 /nfs/dbraw/zinc/20/92/48/723209248.db2.gz KJMRQICEZYNMMG-NSHDSACASA-N 0 3 343.786 2.942 20 5 EFBDHN CC1(C)CNC(=O)[C@@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000895316876 724023404 /nfs/dbraw/zinc/02/34/04/724023404.db2.gz RXQRELMIOCTHAU-HNNXBMFYSA-N 0 3 345.424 2.938 20 5 EFBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN[C@H](CO)C[C@@H]1CCCO1 ZINC000895748322 724293554 /nfs/dbraw/zinc/29/35/54/724293554.db2.gz LQCRBDFDQLLIFQ-STQMWFEESA-N 0 3 348.321 2.633 20 5 EFBDHN O=C1N(CN2C[C@@H]3CCCC[C@@H]3C2)CCN1c1ccccc1[N+](=O)[O-] ZINC000154780873 728908128 /nfs/dbraw/zinc/90/81/28/728908128.db2.gz SQFOFIZFMJRZMT-GASCZTMLSA-N 0 3 344.415 2.916 20 5 EFBDHN C[C@@H](NC(=O)N1CCN(C2CCCC2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000925229576 724955793 /nfs/dbraw/zinc/95/57/93/724955793.db2.gz VYPZVPKOHRYBSC-CQSZACIVSA-N 0 3 346.431 2.926 20 5 EFBDHN CCN1CCCN(C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000910266770 727425199 /nfs/dbraw/zinc/42/51/99/727425199.db2.gz OTIUSZQJYLIDAK-JTQLQIEISA-N 0 3 343.786 2.944 20 5 EFBDHN CCN1CCCN(C(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)[C@@H](C)C1 ZINC000910269064 727425324 /nfs/dbraw/zinc/42/53/24/727425324.db2.gz DEQJVSYQDMHPFN-AWEZNQCLSA-N 0 3 349.431 2.938 20 5 EFBDHN CCN1CCCN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000910281932 727427097 /nfs/dbraw/zinc/42/70/97/727427097.db2.gz NQAOLWFUHKDRDR-CQSZACIVSA-N 0 3 333.432 2.815 20 5 EFBDHN CCN1CCCN(C(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)[C@@H](C)C1 ZINC000910284563 727427378 /nfs/dbraw/zinc/42/73/78/727427378.db2.gz QWHAIMNUAZEKJT-STQMWFEESA-N 0 3 337.395 2.780 20 5 EFBDHN CCN1CCCN(C(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)[C@H](C)C1 ZINC000910284560 727427384 /nfs/dbraw/zinc/42/73/84/727427384.db2.gz QWHAIMNUAZEKJT-CHWSQXEVSA-N 0 3 337.395 2.780 20 5 EFBDHN CCN1CCCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000910293804 727430930 /nfs/dbraw/zinc/43/09/30/727430930.db2.gz APYYNIBKPLXQPW-CYBMUJFWSA-N 0 3 346.431 2.725 20 5 EFBDHN CN1C[C@@H]2CCCN(C(=O)c3cc(Cl)c(F)c([N+](=O)[O-])c3)[C@@H]2C1 ZINC000911302838 727523872 /nfs/dbraw/zinc/52/38/72/727523872.db2.gz ZTHUOUMXTMTIHF-TVQRCGJNSA-N 0 3 341.770 2.554 20 5 EFBDHN CN(CCN1CCCCC1)C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC000911921527 727618755 /nfs/dbraw/zinc/61/87/55/727618755.db2.gz SAKKYWJTUVNKMI-UHFFFAOYSA-N 0 3 343.786 2.945 20 5 EFBDHN Cc1cc[nH]c1C(=O)N1CCC(NCc2csc([N+](=O)[O-])c2)CC1 ZINC000991925034 728604054 /nfs/dbraw/zinc/60/40/54/728604054.db2.gz CPCDPWPRCQBDHM-UHFFFAOYSA-N 0 3 348.428 2.687 20 5 EFBDHN