smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=[N+]([O-])c1cc(Cl)nc(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c1 ZINC001164626993 719054382 /nfs/dbraw/zinc/05/43/82/719054382.db2.gz SZWHGGICOOKZAJ-NVXWUHKLSA-N 1 1 372.856 3.744 20 5 FHBDMO C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2CNC(=O)c2ccc([N+](=O)[O-])o2)C1 ZINC000048885995 936383550 /nfs/dbraw/zinc/38/35/50/936383550.db2.gz OLRSBWHSWFDPGK-GASCZTMLSA-N 1 1 371.437 3.596 20 5 FHBDMO Cc1nn(C[N@H+](CCC(F)(F)F)CC2CC2)c2cc([N+](=O)[O-])ccc12 ZINC000121248728 927142813 /nfs/dbraw/zinc/14/28/13/927142813.db2.gz LIECSLIJMTVVMK-UHFFFAOYSA-N 1 1 356.348 3.875 20 5 FHBDMO Cc1nn(C[N@@H+](CCC(F)(F)F)CC2CC2)c2cc([N+](=O)[O-])ccc12 ZINC000121248728 927142820 /nfs/dbraw/zinc/14/28/20/927142820.db2.gz LIECSLIJMTVVMK-UHFFFAOYSA-N 1 1 356.348 3.875 20 5 FHBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000610178078 927288703 /nfs/dbraw/zinc/28/87/03/927288703.db2.gz NSAFHZMLFRLZLJ-RHSMWYFYSA-N 1 1 361.486 3.695 20 5 FHBDMO C[N@H+]1CCC[C@H]2CN(Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)CC[C@@H]21 ZINC000535806327 927684874 /nfs/dbraw/zinc/68/48/74/927684874.db2.gz QQLHUSWLNNSLRM-YJBOKZPZSA-N 1 1 355.438 3.771 20 5 FHBDMO CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000246864315 927707992 /nfs/dbraw/zinc/70/79/92/927707992.db2.gz DLAYTOQKYZOFMA-ZFWWWQNUSA-N 1 1 359.451 3.508 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000120298243 928019515 /nfs/dbraw/zinc/01/95/15/928019515.db2.gz KKKRIBQYQCGVLS-HZPDHXFCSA-N 1 1 374.485 3.986 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](Cc1cccs1)C[C@H]1CCCO1 ZINC000430211503 928125682 /nfs/dbraw/zinc/12/56/82/928125682.db2.gz AMCMLUKPTFRZRY-MRXNPFEDSA-N 1 1 362.451 3.846 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](Cc1cccs1)C[C@H]1CCCO1 ZINC000430211503 928125697 /nfs/dbraw/zinc/12/56/97/928125697.db2.gz AMCMLUKPTFRZRY-MRXNPFEDSA-N 1 1 362.451 3.846 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000610238822 929143041 /nfs/dbraw/zinc/14/30/41/929143041.db2.gz IUPKYLRHLUOCMT-SFHVURJKSA-N 1 1 367.449 3.545 20 5 FHBDMO O=C(CC[N@H+]1CCC[C@H]1c1cccc(F)c1)Nc1ccc([N+](=O)[O-])cc1 ZINC001167094496 929146783 /nfs/dbraw/zinc/14/67/83/929146783.db2.gz RXRQFKRUEJQIQN-SFHVURJKSA-N 1 1 357.385 3.900 20 5 FHBDMO CC[N@H+](Cc1ccc(OC)c(OC)c1)Cc1ccc([N+](=O)[O-])cc1OC ZINC000430195993 937316454 /nfs/dbraw/zinc/31/64/54/937316454.db2.gz KKNVRKBESWPYOP-UHFFFAOYSA-N 1 1 360.410 3.643 20 5 FHBDMO CC[N@@H+](Cc1ccc(OC)c(OC)c1)Cc1ccc([N+](=O)[O-])cc1OC ZINC000430195993 937316457 /nfs/dbraw/zinc/31/64/57/937316457.db2.gz KKNVRKBESWPYOP-UHFFFAOYSA-N 1 1 360.410 3.643 20 5 FHBDMO COc1ccc(OCC[N@H+]2CCS[C@H](c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000610369720 930172773 /nfs/dbraw/zinc/17/27/73/930172773.db2.gz FOHLBZVCQVLOMA-IBGZPJMESA-N 1 1 374.462 3.772 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1CN[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379654503 930497951 /nfs/dbraw/zinc/49/79/51/930497951.db2.gz IRFPXDDDBBKQJM-VQIMIIECSA-N 1 1 369.465 3.746 20 5 FHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](c2ccccc2F)C1 ZINC000580577043 930872507 /nfs/dbraw/zinc/87/25/07/930872507.db2.gz DXZPMVJAUGOLPG-ZIAGYGMSSA-N 1 1 357.385 3.550 20 5 FHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](c2ccccc2F)C1 ZINC000580577043 930872510 /nfs/dbraw/zinc/87/25/10/930872510.db2.gz DXZPMVJAUGOLPG-ZIAGYGMSSA-N 1 1 357.385 3.550 20 5 FHBDMO Cc1cc(N2CC[C@H](c3[nH+]ccn3C)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000580821435 931198197 /nfs/dbraw/zinc/19/81/97/931198197.db2.gz ANLAFMDQOVQFIG-NSHDSACASA-N 1 1 354.332 3.649 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000581131981 931600846 /nfs/dbraw/zinc/60/08/46/931600846.db2.gz CZGXGPNYBLBZRB-LPHOPBHVSA-N 1 1 367.449 3.544 20 5 FHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+]([C@H]3CCCc4ccc(F)cc43)C2)nc1 ZINC000510383287 931812003 /nfs/dbraw/zinc/81/20/03/931812003.db2.gz ZYVBGQMUKDZMQA-YJBOKZPZSA-N 1 1 356.401 3.693 20 5 FHBDMO COc1cc(C[N@H+]2CCC[C@H]2Cc2cccc(F)c2)c([N+](=O)[O-])cc1OC ZINC000510398385 931906095 /nfs/dbraw/zinc/90/60/95/931906095.db2.gz XZPNESKMVAWSBR-KRWDZBQOSA-N 1 1 374.412 3.958 20 5 FHBDMO CCC[N@@H+](CC)Cc1ccc(C(=O)NCc2ccccc2[N+](=O)[O-])cc1 ZINC000511729816 931934330 /nfs/dbraw/zinc/93/43/30/931934330.db2.gz KJAOTBLQKXKGTE-UHFFFAOYSA-N 1 1 355.438 3.757 20 5 FHBDMO Cc1c(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000247340871 932009134 /nfs/dbraw/zinc/00/91/34/932009134.db2.gz ZWWFQPCVWABJCX-MAUKXSAKSA-N 1 1 367.449 3.686 20 5 FHBDMO CCOc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)CCO2 ZINC000178072522 932269469 /nfs/dbraw/zinc/26/94/69/932269469.db2.gz VTIKHTLWBJLWQC-MRXNPFEDSA-N 1 1 358.394 3.616 20 5 FHBDMO Cc1cc(C(=O)NC[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)cc([N+](=O)[O-])c1 ZINC000247365353 932610309 /nfs/dbraw/zinc/61/03/09/932610309.db2.gz KKAVDOAIWJXWTH-RDTXWAMCSA-N 1 1 373.478 3.778 20 5 FHBDMO C[C@H]1C[C@@H](NC(=O)OC(C)(C)C)CC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000134661810 932836687 /nfs/dbraw/zinc/83/66/87/932836687.db2.gz HOIXBUXLJMBWCL-HOCLYGCPSA-N 1 1 363.458 3.515 20 5 FHBDMO C[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000134664368 932891231 /nfs/dbraw/zinc/89/12/31/932891231.db2.gz GRKIKEOHDTUWGB-OCCSQVGLSA-N 1 1 367.421 3.612 20 5 FHBDMO C[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000134664368 932891246 /nfs/dbraw/zinc/89/12/46/932891246.db2.gz GRKIKEOHDTUWGB-OCCSQVGLSA-N 1 1 367.421 3.612 20 5 FHBDMO Cc1c([C@@H](C)[NH2+]Cc2ccncc2OC[C@H]2CCOC2)cccc1[N+](=O)[O-] ZINC000287217412 933070613 /nfs/dbraw/zinc/07/06/13/933070613.db2.gz FUBJZYAKMCGODW-CVEARBPZSA-N 1 1 371.437 3.564 20 5 FHBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCCCC[N@@H+]1CCCC[C@@H]1C ZINC000588444430 933100830 /nfs/dbraw/zinc/10/08/30/933100830.db2.gz GLTFWGPRKOXBJP-BHWVZIDZSA-N 1 1 359.470 3.769 20 5 FHBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)c1 ZINC000588444651 933106641 /nfs/dbraw/zinc/10/66/41/933106641.db2.gz MKVXOSHHUZARHO-VBKFSLOCSA-N 1 1 367.449 3.766 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@H](c4ncc[nH]4)C3)o2)cc1 ZINC000510524853 933181061 /nfs/dbraw/zinc/18/10/61/933181061.db2.gz REWWAZFDEWJZBH-HNNXBMFYSA-N 1 1 352.394 3.958 20 5 FHBDMO O=[N+]([O-])c1cc(F)c(C[NH2+][C@@H]2CCO[C@@H]2c2ccc(F)c(F)c2)c(F)c1 ZINC000510793444 933731149 /nfs/dbraw/zinc/73/11/49/933731149.db2.gz AFILTMRZAAMPKZ-IAGOWNOFSA-N 1 1 370.302 3.771 20 5 FHBDMO COc1cc(N2CCC[N@@H+](Cc3ccccc3C)CC2)c([N+](=O)[O-])cc1F ZINC000610715024 933900057 /nfs/dbraw/zinc/90/00/57/933900057.db2.gz PHMXMLVPGFZFTE-UHFFFAOYSA-N 1 1 373.428 3.763 20 5 FHBDMO O=C(C[C@H]1CCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccccc1 ZINC000610720136 933958029 /nfs/dbraw/zinc/95/80/29/933958029.db2.gz UFJSVWAANHCBPV-OAHLLOKOSA-N 1 1 365.389 3.973 20 5 FHBDMO O=C(C[C@H]1CCC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccccc1 ZINC000610720136 933958034 /nfs/dbraw/zinc/95/80/34/933958034.db2.gz UFJSVWAANHCBPV-OAHLLOKOSA-N 1 1 365.389 3.973 20 5 FHBDMO CCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC)C[C@@H]1COc2ccccc2O1 ZINC000610795968 934222645 /nfs/dbraw/zinc/22/26/45/934222645.db2.gz NKBYIQRKOBQPJU-QGZVFWFLSA-N 1 1 372.421 3.655 20 5 FHBDMO CCC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC)C[C@@H]1COc2ccccc2O1 ZINC000610795968 934222652 /nfs/dbraw/zinc/22/26/52/934222652.db2.gz NKBYIQRKOBQPJU-QGZVFWFLSA-N 1 1 372.421 3.655 20 5 FHBDMO CC[C@@H]1C[N@@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)C[C@@H]1O ZINC000535810288 934401393 /nfs/dbraw/zinc/40/13/93/934401393.db2.gz BOOOBWONVHBRJP-UZLBHIALSA-N 1 1 355.438 3.565 20 5 FHBDMO C[N@@H+](Cc1ccccc1)CC(C)(C)NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000091075423 934474284 /nfs/dbraw/zinc/47/42/84/934474284.db2.gz KQVQCCNTUQUSKR-UHFFFAOYSA-N 1 1 368.437 3.736 20 5 FHBDMO Cc1ccc(C[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C(C)C)s1 ZINC000065161897 934516559 /nfs/dbraw/zinc/51/65/59/934516559.db2.gz ZWYWRRJPQQDITP-MRXNPFEDSA-N 1 1 364.467 3.615 20 5 FHBDMO Cc1[nH+]ccn1-c1ccc([C@@H](C)NC(=O)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000176190667 934559202 /nfs/dbraw/zinc/55/92/02/934559202.db2.gz ZHQMPZONIFXXLR-GFCCVEGCSA-N 1 1 368.368 3.719 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C[NH+](C)C)c(Cl)c1 ZINC000478020071 934788983 /nfs/dbraw/zinc/78/89/83/934788983.db2.gz BVRLHCNLTOXMJK-UHFFFAOYSA-N 1 1 363.801 3.571 20 5 FHBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000071808896 934875662 /nfs/dbraw/zinc/87/56/62/934875662.db2.gz FCGMEGINDMJUPG-QGZVFWFLSA-N 1 1 368.437 3.553 20 5 FHBDMO C[NH+]1CCC[C@H]2C[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)CC[C@H]21 ZINC000538795874 934905999 /nfs/dbraw/zinc/90/59/99/934905999.db2.gz BLFUZHSWHYAXGB-QFBILLFUSA-N 1 1 355.438 3.771 20 5 FHBDMO C[N@@H+]1CCC[C@H]2CN(Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)CC[C@H]21 ZINC000538795874 934906005 /nfs/dbraw/zinc/90/60/05/934906005.db2.gz BLFUZHSWHYAXGB-QFBILLFUSA-N 1 1 355.438 3.771 20 5 FHBDMO C[N@H+]1CCC[C@H]2CN(Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)CC[C@H]21 ZINC000538795874 934906011 /nfs/dbraw/zinc/90/60/11/934906011.db2.gz BLFUZHSWHYAXGB-QFBILLFUSA-N 1 1 355.438 3.771 20 5 FHBDMO COc1ccc(-c2ccc(C[NH2+][C@H](CO)c3ccsc3)o2)c([N+](=O)[O-])c1 ZINC000472066156 934934117 /nfs/dbraw/zinc/93/41/17/934934117.db2.gz QFVUXCLXUQNFFQ-MRXNPFEDSA-N 1 1 374.418 3.748 20 5 FHBDMO COc1cccc(C[C@@H]2CCC[N@H+]2CCOc2ccc([N+](=O)[O-])cc2)c1 ZINC000065535751 934980496 /nfs/dbraw/zinc/98/04/96/934980496.db2.gz TVXULGCLKMTFOW-SFHVURJKSA-N 1 1 356.422 3.689 20 5 FHBDMO CC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1ccc(OC)c(OC)c1 ZINC000065532782 934981372 /nfs/dbraw/zinc/98/13/72/934981372.db2.gz JHIAWKQJJYISID-UHFFFAOYSA-N 1 1 360.410 3.513 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1CCC1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000157462240 935079406 /nfs/dbraw/zinc/07/94/06/935079406.db2.gz HISAIZMMZOXUCZ-CQSZACIVSA-N 1 1 365.499 3.773 20 5 FHBDMO CCC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C[C@@H]1COc2ccccc2O1 ZINC000071969812 935129469 /nfs/dbraw/zinc/12/94/69/935129469.db2.gz SQEIGOMBZRTDNT-GOSISDBHSA-N 1 1 356.422 3.689 20 5 FHBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCCCC[C@@H]1/C=C\c1ccccc1 ZINC000551269969 935236797 /nfs/dbraw/zinc/23/67/97/935236797.db2.gz AIBWCRCIIOVAAB-OEIFXAAASA-N 1 1 367.449 3.715 20 5 FHBDMO COc1ccccc1-c1cnc(C[N@H+](C)CCc2ccccc2[N+](=O)[O-])o1 ZINC000375685530 935481258 /nfs/dbraw/zinc/48/12/58/935481258.db2.gz RIQIWZAGALFLDK-UHFFFAOYSA-N 1 1 367.405 3.933 20 5 FHBDMO COc1ccccc1-c1cnc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])o1 ZINC000375685530 935481261 /nfs/dbraw/zinc/48/12/61/935481261.db2.gz RIQIWZAGALFLDK-UHFFFAOYSA-N 1 1 367.405 3.933 20 5 FHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc(OC[C@H]2CCCO2)cc1 ZINC000511104630 935578907 /nfs/dbraw/zinc/57/89/07/935578907.db2.gz FNYQPMSKJIXDFY-HXUWFJFHSA-N 1 1 370.449 3.827 20 5 FHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CC[C@H](OCCCc3ccccc3)C2)cc1 ZINC001167568081 935585275 /nfs/dbraw/zinc/58/52/75/935585275.db2.gz MWVPLQGUWUVXLW-NRFANRHFSA-N 1 1 370.449 3.697 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21 ZINC000511785137 945111142 /nfs/dbraw/zinc/11/11/42/945111142.db2.gz IYROCCUZXZUGIR-AQNXPRMDSA-N 1 1 368.433 3.608 20 5 FHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CC[C@@H](OCCCc2ccccc2)C1 ZINC001167568375 935594160 /nfs/dbraw/zinc/59/41/60/935594160.db2.gz QVQBIFASXPHFDJ-LJQANCHMSA-N 1 1 358.413 3.958 20 5 FHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CC[C@@H](OCCCc2ccccc2)C1 ZINC001167568375 935594164 /nfs/dbraw/zinc/59/41/64/935594164.db2.gz QVQBIFASXPHFDJ-LJQANCHMSA-N 1 1 358.413 3.958 20 5 FHBDMO COC(=O)COc1ccc(C[N@@H+](C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000187743450 935630560 /nfs/dbraw/zinc/63/05/60/935630560.db2.gz OBUUBPYMKMNTPL-OAHLLOKOSA-N 1 1 372.421 3.648 20 5 FHBDMO CC(C)c1cccc(NC(=O)C[N@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511118657 935665401 /nfs/dbraw/zinc/66/54/01/935665401.db2.gz BETFYCWHVXUSRC-UHFFFAOYSA-N 1 1 355.438 3.831 20 5 FHBDMO CC(C)c1cccc(NC(=O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511118657 935665403 /nfs/dbraw/zinc/66/54/03/935665403.db2.gz BETFYCWHVXUSRC-UHFFFAOYSA-N 1 1 355.438 3.831 20 5 FHBDMO Cc1ccc([C@@H](C)NC(=O)C[N@H+](C)CCc2ccccc2[N+](=O)[O-])cc1C ZINC000511125858 935701197 /nfs/dbraw/zinc/70/11/97/935701197.db2.gz NLPRZBREMCLBAQ-QGZVFWFLSA-N 1 1 369.465 3.563 20 5 FHBDMO Cc1ccc([C@@H](C)NC(=O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1C ZINC000511125858 935701198 /nfs/dbraw/zinc/70/11/98/935701198.db2.gz NLPRZBREMCLBAQ-QGZVFWFLSA-N 1 1 369.465 3.563 20 5 FHBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[S@@](=O)C1 ZINC000277599709 935703989 /nfs/dbraw/zinc/70/39/89/935703989.db2.gz VNUNYYQFMIYSFM-YEBMWUKDSA-N 1 1 364.492 3.524 20 5 FHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[S@@](=O)C1 ZINC000277599709 935703993 /nfs/dbraw/zinc/70/39/93/935703993.db2.gz VNUNYYQFMIYSFM-YEBMWUKDSA-N 1 1 364.492 3.524 20 5 FHBDMO CC[C@H](c1ccccc1)[C@@H]1CCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000480107520 935963942 /nfs/dbraw/zinc/96/39/42/935963942.db2.gz XDRTZACMIPVMTB-MOPGFXCFSA-N 1 1 367.449 3.852 20 5 FHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@H](c3cccnc3)C2)c1 ZINC000582724393 935990163 /nfs/dbraw/zinc/99/01/63/935990163.db2.gz RFIVUJILOIWPSS-ZDUSSCGKSA-N 1 1 351.328 3.998 20 5 FHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](c2nnc3n2CCCCC3)C1 ZINC000075623578 936013723 /nfs/dbraw/zinc/01/37/23/936013723.db2.gz REJJCIHUNUVRKM-HOTGVXAUSA-N 1 1 369.469 3.853 20 5 FHBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2cc(C)nc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000078563780 936203567 /nfs/dbraw/zinc/20/35/67/936203567.db2.gz OMDHURLOCVOOCL-INIZCTEOSA-N 1 1 369.469 3.528 20 5 FHBDMO CC[N@@H+](C)C[C@@H]1CCN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C1 ZINC000078583612 936211595 /nfs/dbraw/zinc/21/15/95/936211595.db2.gz ATCSLNINXPTEKB-INIZCTEOSA-N 1 1 367.449 3.604 20 5 FHBDMO CCc1ccc([C@@H](N[C@H]2CC[N@@H+](CC3CC3)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612410062 936240411 /nfs/dbraw/zinc/24/04/11/936240411.db2.gz YCVUASLUDRINSX-UWJYYQICSA-N 1 1 369.465 3.914 20 5 FHBDMO O=[N+]([O-])c1cnn(CC[N@@H+]2CC=C(c3ccc(Cl)c(Cl)c3)CC2)c1 ZINC000511211618 936249875 /nfs/dbraw/zinc/24/98/75/936249875.db2.gz PNGSWPYLAMREBY-UHFFFAOYSA-N 1 1 367.236 3.887 20 5 FHBDMO O=[N+]([O-])c1ccn(CC[N@@H+]2CC=C(c3ccc(Cl)c(Cl)c3)CC2)n1 ZINC000511216841 936304346 /nfs/dbraw/zinc/30/43/46/936304346.db2.gz NBLMXXIDAMUIQV-UHFFFAOYSA-N 1 1 367.236 3.887 20 5 FHBDMO COc1ccc(C[N@H+]2C[C@H](c3ccccc3)[C@@H]3COCC[C@@H]32)cc1[N+](=O)[O-] ZINC000511798331 945156531 /nfs/dbraw/zinc/15/65/31/945156531.db2.gz SAPFUESCHKBZPN-QYZOEREBSA-N 1 1 368.433 3.608 20 5 FHBDMO CN(C[C@@H]1CC[N@@H+](C)[C@H]1c1cccnc1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000432134259 945159179 /nfs/dbraw/zinc/15/91/79/945159179.db2.gz SKOKIHMLDXDPNB-YOEHRIQHSA-N 1 1 360.845 3.772 20 5 FHBDMO COc1ccc(CN[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000080338498 938249089 /nfs/dbraw/zinc/24/90/89/938249089.db2.gz CZJYIETVOVNXKF-LPHOPBHVSA-N 1 1 369.465 3.746 20 5 FHBDMO COc1ccc(C[NH2+][C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000080338498 938249091 /nfs/dbraw/zinc/24/90/91/938249091.db2.gz CZJYIETVOVNXKF-LPHOPBHVSA-N 1 1 369.465 3.746 20 5 FHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2C[C@H]3CN(c4ccccc4)C[C@H]3C2)c(Cl)c1 ZINC000611774756 938284849 /nfs/dbraw/zinc/28/48/49/938284849.db2.gz UUBCEFBWWIULDE-IYBDPMFKSA-N 1 1 357.841 3.816 20 5 FHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cnn(-c2ccc(F)cc2)c1 ZINC000583591741 938311358 /nfs/dbraw/zinc/31/13/58/938311358.db2.gz DTWPSKIZFDIHGH-UHFFFAOYSA-N 1 1 354.385 3.594 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000573012121 938489274 /nfs/dbraw/zinc/48/92/74/938489274.db2.gz ADQYTSSXDLGINU-BETUJISGSA-N 1 1 373.375 3.895 20 5 FHBDMO Cc1c(NC(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C)cccc1[N+](=O)[O-] ZINC000584191555 938637036 /nfs/dbraw/zinc/63/70/36/938637036.db2.gz MICLLDJMCXUWRS-MAUKXSAKSA-N 1 1 368.437 3.688 20 5 FHBDMO CC[N@H+](Cc1ccccc1Cl)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000106268961 945200670 /nfs/dbraw/zinc/20/06/70/945200670.db2.gz HFDGCEABSNQFKO-INIZCTEOSA-N 1 1 364.829 3.510 20 5 FHBDMO O=C(NC[C@H]1CCC[N@H+]1C1CCCCC1)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000437869697 945203856 /nfs/dbraw/zinc/20/38/56/945203856.db2.gz NLKXGOGFQVDKBP-MRXNPFEDSA-N 1 1 370.453 3.603 20 5 FHBDMO Cc1c(CNC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000708540177 938815735 /nfs/dbraw/zinc/81/57/35/938815735.db2.gz SWEYEAQMSPPPKI-JXFKEZNVSA-N 1 1 353.466 3.761 20 5 FHBDMO Cc1c(CNC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000708540177 938815740 /nfs/dbraw/zinc/81/57/40/938815740.db2.gz SWEYEAQMSPPPKI-JXFKEZNVSA-N 1 1 353.466 3.761 20 5 FHBDMO Cc1c(CNC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000708540180 938816010 /nfs/dbraw/zinc/81/60/10/938816010.db2.gz SWEYEAQMSPPPKI-OXQOHEQNSA-N 1 1 353.466 3.761 20 5 FHBDMO Cc1c(CNC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000708540180 938816012 /nfs/dbraw/zinc/81/60/12/938816012.db2.gz SWEYEAQMSPPPKI-OXQOHEQNSA-N 1 1 353.466 3.761 20 5 FHBDMO Cc1[nH+]ccn1-c1ccc([C@H](C)NC(=O)c2cc(C)ccc2[N+](=O)[O-])cc1 ZINC000086248221 938843446 /nfs/dbraw/zinc/84/34/46/938843446.db2.gz ZBKJXMQINAUSBC-AWEZNQCLSA-N 1 1 364.405 3.888 20 5 FHBDMO Cc1[nH+]ccn1-c1ccc([C@@H](C)NC(=O)c2cc(C)ccc2[N+](=O)[O-])cc1 ZINC000086248223 938843491 /nfs/dbraw/zinc/84/34/91/938843491.db2.gz ZBKJXMQINAUSBC-CQSZACIVSA-N 1 1 364.405 3.888 20 5 FHBDMO COc1ccc(C[N@H+]2CCCC[C@@H]2[C@@H]2C[C@H](C)CC[C@@H]2O)cc1[N+](=O)[O-] ZINC000573263488 938908660 /nfs/dbraw/zinc/90/86/60/938908660.db2.gz UQGUQHWZQKPEQV-XZKMEQPCSA-N 1 1 362.470 3.755 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)[C@@H]1CCCc2ccccc21 ZINC000198695065 938962526 /nfs/dbraw/zinc/96/25/26/938962526.db2.gz RLZVZCXEDQLOKQ-QGZVFWFLSA-N 1 1 353.422 3.851 20 5 FHBDMO COc1cc(C[N@@H+](C)C(C2CC2)C2CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000050989065 938972346 /nfs/dbraw/zinc/97/23/46/938972346.db2.gz BYZJQSAZTJGUAF-UHFFFAOYSA-N 1 1 356.369 3.825 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2nc(CN3CCC[N@H+](C4CCCC4)CC3)co2)cc1 ZINC000179206014 938990450 /nfs/dbraw/zinc/99/04/50/938990450.db2.gz ZYNTWERCBHKRRC-UHFFFAOYSA-N 1 1 370.453 3.700 20 5 FHBDMO C[C@H]1[C@H](Cc2ccccc2)CC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000472336993 938995427 /nfs/dbraw/zinc/99/54/27/938995427.db2.gz GPBZOEUJODAIBE-WMZOPIPTSA-N 1 1 367.449 3.511 20 5 FHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@H](C3OCCO3)C2)s1 ZINC000179370164 939105258 /nfs/dbraw/zinc/10/52/58/939105258.db2.gz DRYWOZRCRORVBH-AWEZNQCLSA-N 1 1 374.462 3.908 20 5 FHBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000614261261 939903402 /nfs/dbraw/zinc/90/34/02/939903402.db2.gz QHWQBNDIZPLEQO-JKSUJKDBSA-N 1 1 371.485 3.558 20 5 FHBDMO O=C(NC[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1csc([N+](=O)[O-])c1 ZINC000570092825 940133396 /nfs/dbraw/zinc/13/33/96/940133396.db2.gz JPXSYKKEBOLIKN-MRXNPFEDSA-N 1 1 373.478 3.688 20 5 FHBDMO COc1ccc(C[N@H+](Cc2csc([N+](=O)[O-])c2)[C@H](CO)C(C)C)cc1 ZINC000179929683 940135411 /nfs/dbraw/zinc/13/54/11/940135411.db2.gz MYFVMICFKBZTGO-QGZVFWFLSA-N 1 1 364.467 3.684 20 5 FHBDMO COc1ccc(C[N@@H+](Cc2csc([N+](=O)[O-])c2)[C@H](CO)C(C)C)cc1 ZINC000179929683 940135414 /nfs/dbraw/zinc/13/54/14/940135414.db2.gz MYFVMICFKBZTGO-QGZVFWFLSA-N 1 1 364.467 3.684 20 5 FHBDMO NC(=O)c1ccc(C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)cc1 ZINC000179983646 940197018 /nfs/dbraw/zinc/19/70/18/940197018.db2.gz FEJOICSPVKXEOU-FQEVSTJZSA-N 1 1 361.401 3.573 20 5 FHBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000177544522 940269015 /nfs/dbraw/zinc/26/90/15/940269015.db2.gz NRXJIUYAEGUMFD-UPJWGTAASA-N 1 1 351.834 3.697 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCC[C@H](c4ncc[nH]4)C3)cs2)c1 ZINC000092071447 940311247 /nfs/dbraw/zinc/31/12/47/940311247.db2.gz KVHXUEOIYNNPFI-AWEZNQCLSA-N 1 1 369.450 3.821 20 5 FHBDMO CC(=O)c1cc(N[C@@H]2CC[N@@H+](Cc3ccccn3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000376177161 940422863 /nfs/dbraw/zinc/42/28/63/940422863.db2.gz ZZMPTIRSBROWJR-AUUYWEPGSA-N 1 1 368.437 3.515 20 5 FHBDMO CC(=O)c1cc(N[C@@H]2CC[N@H+](Cc3ccccn3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000376177161 940422866 /nfs/dbraw/zinc/42/28/66/940422866.db2.gz ZZMPTIRSBROWJR-AUUYWEPGSA-N 1 1 368.437 3.515 20 5 FHBDMO CN(C)c1ncccc1C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180112474 940483858 /nfs/dbraw/zinc/48/38/58/940483858.db2.gz WBIFRZXRYYYYPM-HXUWFJFHSA-N 1 1 362.433 3.935 20 5 FHBDMO O=C1O[C@H](C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)CN1c1ccccc1 ZINC000177999535 940503531 /nfs/dbraw/zinc/50/35/31/940503531.db2.gz ARYCQGQHRROFKN-LJQANCHMSA-N 1 1 367.405 3.585 20 5 FHBDMO CCC[N@H+]1Cc2cccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])cc3)c2C1 ZINC000066515079 940595969 /nfs/dbraw/zinc/59/59/69/940595969.db2.gz PLBCLMBKMNQKDE-DHZHZOJOSA-N 1 1 351.406 3.972 20 5 FHBDMO COc1ccc(OCC[N@@H+](C)[C@H](C)c2sc(C)nc2C)c([N+](=O)[O-])c1 ZINC000173712606 940662179 /nfs/dbraw/zinc/66/21/79/940662179.db2.gz SKOQRLUXNQGUNB-GFCCVEGCSA-N 1 1 365.455 3.749 20 5 FHBDMO COc1cc(C[N@@H+]2CCC[C@H](CC(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000540907720 940758135 /nfs/dbraw/zinc/75/81/35/940758135.db2.gz LPEQLMCEUWXUIM-CQSZACIVSA-N 1 1 364.442 3.547 20 5 FHBDMO COc1cc(C[N@H+]2CCC[C@H](CC(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000540907720 940758137 /nfs/dbraw/zinc/75/81/37/940758137.db2.gz LPEQLMCEUWXUIM-CQSZACIVSA-N 1 1 364.442 3.547 20 5 FHBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)NCCCC[N@H+]1CCCC[C@@H]1C ZINC000582756136 940864063 /nfs/dbraw/zinc/86/40/63/940864063.db2.gz UMCGVPRXMZEEJY-HNNXBMFYSA-N 1 1 362.474 3.933 20 5 FHBDMO COc1c(O)ccc(C[NH2+][C@H](C)c2ccccc2OC(C)C)c1[N+](=O)[O-] ZINC000892600139 940901671 /nfs/dbraw/zinc/90/16/71/940901671.db2.gz PQFOJFPRSJCUQX-CYBMUJFWSA-N 1 1 360.410 3.947 20 5 FHBDMO CCN(C(=O)c1cccc([N+](=O)[O-])c1C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000186308088 940979922 /nfs/dbraw/zinc/97/99/22/940979922.db2.gz GIVIPMISCNIFJK-GOSISDBHSA-N 1 1 367.449 3.640 20 5 FHBDMO C[C@@H](O)[C@H]1CCC[N@@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000540962418 940994453 /nfs/dbraw/zinc/99/44/53/940994453.db2.gz VJPZCPREILYAPD-AEFFLSMTSA-N 1 1 369.465 3.956 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCS[C@H]4COCC[C@@H]43)o2)c1 ZINC000180456585 941022843 /nfs/dbraw/zinc/02/28/43/941022843.db2.gz JGGFWWAVYYRTRC-WMZOPIPTSA-N 1 1 360.435 3.561 20 5 FHBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)CC1(CO)CC1 ZINC000188951020 941133077 /nfs/dbraw/zinc/13/30/77/941133077.db2.gz GYXCUSTXFOIXHI-UHFFFAOYSA-N 1 1 350.802 3.713 20 5 FHBDMO Cc1ccc(NC(=O)[C@@H](C)[N@H+](C)CCc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000549156394 941549260 /nfs/dbraw/zinc/54/92/60/941549260.db2.gz CTUYAUKYIASHBM-MRXNPFEDSA-N 1 1 355.438 3.713 20 5 FHBDMO Cc1ccc(NC(=O)[C@@H](C)[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000549156394 941549263 /nfs/dbraw/zinc/54/92/63/941549263.db2.gz CTUYAUKYIASHBM-MRXNPFEDSA-N 1 1 355.438 3.713 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1nc(C[NH+]2CCCCCC2)cs1 ZINC000549171430 941581022 /nfs/dbraw/zinc/58/10/22/941581022.db2.gz FPTDKDJZBNOCTM-UHFFFAOYSA-N 1 1 374.466 3.988 20 5 FHBDMO Cc1ccc([C@H]2CCC[N@H+]2Cc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1C ZINC000122510371 941785274 /nfs/dbraw/zinc/78/52/74/941785274.db2.gz YKBGETNJYGLNPG-GOSISDBHSA-N 1 1 353.422 3.648 20 5 FHBDMO C[C@H]1C[C@@H](c2ccccc2)[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000513272578 941825137 /nfs/dbraw/zinc/82/51/37/941825137.db2.gz RKIDHVOLXQOYOJ-KXBFYZLASA-N 1 1 365.433 3.567 20 5 FHBDMO CC(C)[N@H+](CC(=O)N([C@H](C)C1CC1)C1CC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000513397189 941890722 /nfs/dbraw/zinc/89/07/22/941890722.db2.gz JUDRYIQZYJDGQS-OAHLLOKOSA-N 1 1 359.470 3.595 20 5 FHBDMO CC(C)[N@@H+](CC(=O)N([C@H](C)C1CC1)C1CC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000513397189 941890726 /nfs/dbraw/zinc/89/07/26/941890726.db2.gz JUDRYIQZYJDGQS-OAHLLOKOSA-N 1 1 359.470 3.595 20 5 FHBDMO Cc1cc(C)cc(OC[C@@H](O)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000513488936 941959699 /nfs/dbraw/zinc/95/96/99/941959699.db2.gz CLJKDZLWLSZORC-FQEVSTJZSA-N 1 1 372.465 3.862 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H](CNC(=O)C(C)(C)C)C1 ZINC000182785419 941967003 /nfs/dbraw/zinc/96/70/03/941967003.db2.gz QYKRCNSOVZTPNQ-JKSUJKDBSA-N 1 1 361.486 3.839 20 5 FHBDMO Cc1c(NC(=O)NC[C@@H]2CC[N@H+](C)[C@@H]2c2cccs2)cccc1[N+](=O)[O-] ZINC000377772861 941981195 /nfs/dbraw/zinc/98/11/95/941981195.db2.gz QNLGXDZECLWOHJ-GUYCJALGSA-N 1 1 374.466 3.779 20 5 FHBDMO O=C(NC[C@H]1CCC[N@H+]1C1CCCCC1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412311543 942149074 /nfs/dbraw/zinc/14/90/74/942149074.db2.gz OAVCZVYXAAEGQA-HSALFYBXSA-N 1 1 371.481 3.612 20 5 FHBDMO Cc1ccn(C2CC[NH+](Cc3ccc([N+](=O)[O-])cc3C(F)(F)F)CC2)n1 ZINC000366733731 942273874 /nfs/dbraw/zinc/27/38/74/942273874.db2.gz AUJHNQKLYXEELS-UHFFFAOYSA-N 1 1 368.359 3.956 20 5 FHBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420955965 942274855 /nfs/dbraw/zinc/27/48/55/942274855.db2.gz XJDGOGFKXLZOMN-RYUDHWBXSA-N 1 1 359.348 3.586 20 5 FHBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420955965 942274863 /nfs/dbraw/zinc/27/48/63/942274863.db2.gz XJDGOGFKXLZOMN-RYUDHWBXSA-N 1 1 359.348 3.586 20 5 FHBDMO O=C(CC[N@H+]1CCC[C@H](CC(F)(F)F)C1)Nc1ccccc1[N+](=O)[O-] ZINC000420957451 942276365 /nfs/dbraw/zinc/27/63/65/942276365.db2.gz ZOBSUSPVUIHYSM-GFCCVEGCSA-N 1 1 359.348 3.588 20 5 FHBDMO CC(C)(C)c1ccc(NC(=O)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000501086736 942291268 /nfs/dbraw/zinc/29/12/68/942291268.db2.gz XAGXIHZBJFVAKI-CABCVRRESA-N 1 1 360.458 3.641 20 5 FHBDMO CC(C)[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@@H](C)c1ccsc1 ZINC000421005477 942298645 /nfs/dbraw/zinc/29/86/45/942298645.db2.gz JIQLGEYOGRMLHL-HOCLYGCPSA-N 1 1 364.467 3.868 20 5 FHBDMO Cc1ccccc1[C@@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000501112610 942315488 /nfs/dbraw/zinc/31/54/88/942315488.db2.gz ZSBDMHAGFGNCKL-MRXNPFEDSA-N 1 1 353.422 3.721 20 5 FHBDMO O=C(CC[N@H+]1CC[C@@H](c2cccc(F)c2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000501138285 942325231 /nfs/dbraw/zinc/32/52/31/942325231.db2.gz XOOZZQYNVJAKAN-OAHLLOKOSA-N 1 1 357.385 3.552 20 5 FHBDMO Cc1ccc(C[N@H+]2CCC[C@@H](c3ncc4n3CCCC4)C2)cc1[N+](=O)[O-] ZINC000502319726 942351757 /nfs/dbraw/zinc/35/17/57/942351757.db2.gz KECVIKJVBSEGNY-QGZVFWFLSA-N 1 1 354.454 3.816 20 5 FHBDMO O=[N+]([O-])c1cnc(N2CCC3(CC[N@@H+](Cc4ccccc4)C3)CC2)c(F)c1 ZINC000413216364 942490053 /nfs/dbraw/zinc/49/00/53/942490053.db2.gz RMWCLVDEHHQZBE-UHFFFAOYSA-N 1 1 370.428 3.621 20 5 FHBDMO COc1cc(C[N@H+]2CCC[C@H]2Cc2ccc(F)cc2)c([N+](=O)[O-])cc1OC ZINC000511542099 942620254 /nfs/dbraw/zinc/62/02/54/942620254.db2.gz NNVFEXMJJOCKOR-KRWDZBQOSA-N 1 1 374.412 3.958 20 5 FHBDMO CN(C[C@H]1CCC[N@H+]1C)C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000421700059 942771356 /nfs/dbraw/zinc/77/13/56/942771356.db2.gz CXWKRUWYAMXCJS-MRXNPFEDSA-N 1 1 369.421 3.553 20 5 FHBDMO COc1cc(C[NH+]2CCC(C(=O)c3ccc(F)cc3)CC2)ccc1[N+](=O)[O-] ZINC000434684867 942864189 /nfs/dbraw/zinc/86/41/89/942864189.db2.gz NHBDHCWASCDSHB-UHFFFAOYSA-N 1 1 372.396 3.837 20 5 FHBDMO CCc1ccc([C@@H]2CN(C(=O)c3ccc(CC)c([N+](=O)[O-])c3)CC[NH2+]2)cc1 ZINC000505483574 942889545 /nfs/dbraw/zinc/88/95/45/942889545.db2.gz KEWHPVTZGSMIHG-IBGZPJMESA-N 1 1 367.449 3.506 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H](c2ccccc2)[C@H]1C ZINC000434891418 943022149 /nfs/dbraw/zinc/02/21/49/943022149.db2.gz HRZYOCSGFYNSJP-CRAIPNDOSA-N 1 1 353.422 3.720 20 5 FHBDMO C[C@@H]1[C@H](c2ccccc2)CC[N@H+]1[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000434892330 943022487 /nfs/dbraw/zinc/02/24/87/943022487.db2.gz QJXMTNJSLLAQLB-YSGRDPCXSA-N 1 1 365.433 3.578 20 5 FHBDMO CCC[N@@H+](CC)Cc1cc(OC)c(OCC(F)(F)F)cc1[N+](=O)[O-] ZINC000434988468 943089537 /nfs/dbraw/zinc/08/95/37/943089537.db2.gz SLNJHZIUAGOAAO-UHFFFAOYSA-N 1 1 350.337 3.776 20 5 FHBDMO Cc1c(C(=O)N[C@H](C[N@@H+](C)Cc2ccccc2)C(C)C)cccc1[N+](=O)[O-] ZINC001269933360 943308146 /nfs/dbraw/zinc/30/81/46/943308146.db2.gz VIDLIQDOLRCCOC-LJQANCHMSA-N 1 1 369.465 3.790 20 5 FHBDMO Cc1ccc([C@H](C)N[C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1[N+](=O)[O-] ZINC000422916670 943330050 /nfs/dbraw/zinc/33/00/50/943330050.db2.gz BIAFHIPNTWNMDW-UQASEVPWSA-N 1 1 367.449 3.810 20 5 FHBDMO O=[N+]([O-])c1cccc(CN(Cc2ccsc2)[C@@H]2CC23CC[NH2+]CC3)c1 ZINC000435430934 943409646 /nfs/dbraw/zinc/40/96/46/943409646.db2.gz GCKXMOSLBWRJSY-GOSISDBHSA-N 1 1 357.479 3.801 20 5 FHBDMO C[C@@H]([NH2+][C@H](Cn1ccccc1=O)c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000503926907 943412437 /nfs/dbraw/zinc/41/24/37/943412437.db2.gz IAHQFCOQDAWMSL-VQIMIIECSA-N 1 1 363.417 3.849 20 5 FHBDMO C[C@@H](NC[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000423481487 943528095 /nfs/dbraw/zinc/52/80/95/943528095.db2.gz WVECJVGRGKJJCO-CFLQYTFWSA-N 1 1 357.429 3.778 20 5 FHBDMO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)c1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1 ZINC000515184418 943540512 /nfs/dbraw/zinc/54/05/12/943540512.db2.gz MBLVAIIJEQZNPP-CZUORRHYSA-N 1 1 358.417 3.572 20 5 FHBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2NC[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000584790526 943610907 /nfs/dbraw/zinc/61/09/07/943610907.db2.gz QIFKAYXCBJFSNK-YLJYHZDGSA-N 1 1 351.450 3.694 20 5 FHBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000584790526 943610909 /nfs/dbraw/zinc/61/09/09/943610909.db2.gz QIFKAYXCBJFSNK-YLJYHZDGSA-N 1 1 351.450 3.694 20 5 FHBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C[C@H]1CCN(Cc2ccccc2)C1 ZINC000584790526 943610911 /nfs/dbraw/zinc/61/09/11/943610911.db2.gz QIFKAYXCBJFSNK-YLJYHZDGSA-N 1 1 351.450 3.694 20 5 FHBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@@H+](CC)C[C@H]1C ZINC000504591737 943703387 /nfs/dbraw/zinc/70/33/87/943703387.db2.gz JOTWUUMGKWQYFQ-ZIAGYGMSSA-N 1 1 365.499 3.652 20 5 FHBDMO Cc1ccsc1C[N@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000506046611 943788984 /nfs/dbraw/zinc/78/89/84/943788984.db2.gz ZZOFTXHEBWYAEG-UHFFFAOYSA-N 1 1 356.451 3.997 20 5 FHBDMO CCN(Cc1ccc(C[NH+](C)C)cc1)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000516997892 943901138 /nfs/dbraw/zinc/90/11/38/943901138.db2.gz MZXGMPSSODKCGJ-UHFFFAOYSA-N 1 1 357.454 3.687 20 5 FHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)cc1 ZINC000511645231 943992108 /nfs/dbraw/zinc/99/21/08/943992108.db2.gz FXOAJAGLMSSOBW-NJDAHSKKSA-N 1 1 352.434 3.642 20 5 FHBDMO COc1c(C)cc(C[N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1C ZINC000110296565 944017416 /nfs/dbraw/zinc/01/74/16/944017416.db2.gz KDUDOFGTMUYPNX-UHFFFAOYSA-N 1 1 371.437 3.599 20 5 FHBDMO COc1c(C)cc(C[N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1C ZINC000110296565 944017419 /nfs/dbraw/zinc/01/74/19/944017419.db2.gz KDUDOFGTMUYPNX-UHFFFAOYSA-N 1 1 371.437 3.599 20 5 FHBDMO O=C(CC[N@H+]1CC[C@H](c2ccc(F)cc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000500078220 944065814 /nfs/dbraw/zinc/06/58/14/944065814.db2.gz XQMSBRJAMABKJK-HNNXBMFYSA-N 1 1 357.385 3.552 20 5 FHBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000500116439 944124843 /nfs/dbraw/zinc/12/48/43/944124843.db2.gz OCYKLPUKLDXYNB-UONOGXRCSA-N 1 1 351.472 3.529 20 5 FHBDMO Cc1c(NC(=O)NC[C@H]2CCC[N@H+]2C2CCCCC2)cccc1[N+](=O)[O-] ZINC000436265781 944141540 /nfs/dbraw/zinc/14/15/40/944141540.db2.gz YLHLEEITJDQILQ-MRXNPFEDSA-N 1 1 360.458 3.822 20 5 FHBDMO Cc1cc(C(=O)Nc2ccc([C@@H](C)[NH+]3CCOCC3)cc2)ccc1[N+](=O)[O-] ZINC000517342063 944220396 /nfs/dbraw/zinc/22/03/96/944220396.db2.gz OVJALUIVMRMTQM-OAHLLOKOSA-N 1 1 369.421 3.549 20 5 FHBDMO Cc1c(C[N@H+](C)C2CCN(C(=O)c3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000500217098 944273899 /nfs/dbraw/zinc/27/38/99/944273899.db2.gz WRTLBPGKAJVZNJ-UHFFFAOYSA-N 1 1 367.449 3.640 20 5 FHBDMO CN(C(=O)C[N@@H+]1CCC[C@H]1/C=C/c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000505825148 944332092 /nfs/dbraw/zinc/33/20/92/944332092.db2.gz KGFKFIKRCDUBNY-YXBWYFRISA-N 1 1 365.433 3.735 20 5 FHBDMO CN(C(=O)C[N@H+]1CCC[C@H]1/C=C/c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000505825148 944332096 /nfs/dbraw/zinc/33/20/96/944332096.db2.gz KGFKFIKRCDUBNY-YXBWYFRISA-N 1 1 365.433 3.735 20 5 FHBDMO C[N@@H+]1C[C@H]2CN(Cc3ccc(Oc4ccc(F)cc4)c([N+](=O)[O-])c3)C[C@H]2C1 ZINC000425959063 944408182 /nfs/dbraw/zinc/40/81/82/944408182.db2.gz IPLROHWJQFYZOU-IYBDPMFKSA-N 1 1 371.412 3.520 20 5 FHBDMO Cc1cc(NC(=O)NC[C@@H](C)[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000473788361 944466961 /nfs/dbraw/zinc/46/69/61/944466961.db2.gz QQGYHWSXYWUJKR-OAHLLOKOSA-N 1 1 356.426 3.545 20 5 FHBDMO COc1cc2c(c(C[N@@H+](C)CCc3ccccc3[N+](=O)[O-])c1)O[C@H](C)C2 ZINC000516116900 944500280 /nfs/dbraw/zinc/50/02/80/944500280.db2.gz YYAIWWDVBMBFTC-CQSZACIVSA-N 1 1 356.422 3.601 20 5 FHBDMO C[C@@H]1C[C@H](c2ccccc2)CC[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000439315546 944521714 /nfs/dbraw/zinc/52/17/14/944521714.db2.gz JKCJOVRDEKBADC-NVXWUHKLSA-N 1 1 353.422 3.801 20 5 FHBDMO C[C@@H]1C[C@H](c2ccccc2)CC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000439315546 944521722 /nfs/dbraw/zinc/52/17/22/944521722.db2.gz JKCJOVRDEKBADC-NVXWUHKLSA-N 1 1 353.422 3.801 20 5 FHBDMO C[C@@H]1C[C@@H](c2ccccc2)CC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000439330334 944543045 /nfs/dbraw/zinc/54/30/45/944543045.db2.gz ZHLDDXRXZOTXOQ-NEWSRXKRSA-N 1 1 370.449 3.603 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)Cc1ccc(F)cc1F ZINC000025071156 944545684 /nfs/dbraw/zinc/54/56/84/944545684.db2.gz ODPZIYWTDGKQII-UHFFFAOYSA-N 1 1 363.364 3.642 20 5 FHBDMO C[C@@H](CNC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)[N@H+]1CCCC[C@H]1C ZINC000426031533 944694194 /nfs/dbraw/zinc/69/41/94/944694194.db2.gz YHKBEMJBKAKXGS-CVEARBPZSA-N 1 1 374.485 3.532 20 5 FHBDMO C[C@H](CNC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)[N@H+]1CCCC[C@H]1C ZINC000426031535 944694616 /nfs/dbraw/zinc/69/46/16/944694616.db2.gz YHKBEMJBKAKXGS-HZPDHXFCSA-N 1 1 374.485 3.532 20 5 FHBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1csc(Br)c1 ZINC000516309718 944710627 /nfs/dbraw/zinc/71/06/27/944710627.db2.gz RRNMPPYMLBVLFA-UHFFFAOYSA-N 1 1 371.256 3.930 20 5 FHBDMO Cc1nc2ccc(C[NH+]3CCN(c4ccccc4[N+](=O)[O-])CC3)cc2s1 ZINC000426056149 944748958 /nfs/dbraw/zinc/74/89/58/944748958.db2.gz XUIZQTADLDBSAT-UHFFFAOYSA-N 1 1 368.462 3.835 20 5 FHBDMO O=C(Nc1ccccc1)[C@@H]1CCC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000506296372 944836404 /nfs/dbraw/zinc/83/64/04/944836404.db2.gz YPUVOJVLWLMADB-AHKGRUIUSA-N 1 1 365.433 3.959 20 5 FHBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](Nc2nc3sccn3c2[N+](=O)[O-])C1 ZINC000507003127 944871358 /nfs/dbraw/zinc/87/13/58/944871358.db2.gz UBRNZYHMHGXENV-JSGCOSHPSA-N 1 1 357.439 3.551 20 5 FHBDMO O=C(NC[C@@H]1CCC[N@H+]1C1CCCCC1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000437835901 944938334 /nfs/dbraw/zinc/93/83/34/944938334.db2.gz CTGXQUULDLWABF-INIZCTEOSA-N 1 1 370.453 3.603 20 5 FHBDMO C[C@@H]1C[C@H](c2cccc(F)c2)[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000543205844 944993393 /nfs/dbraw/zinc/99/33/93/944993393.db2.gz BWPOFYUYXFDODB-DKSSEZFCSA-N 1 1 374.412 3.557 20 5 FHBDMO Cc1ccccc1[C@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000507176682 945007567 /nfs/dbraw/zinc/00/75/67/945007567.db2.gz DUSHDWASSINIBW-INIZCTEOSA-N 1 1 364.405 3.943 20 5 FHBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000426506068 945015377 /nfs/dbraw/zinc/01/53/77/945015377.db2.gz BLFDOKYUGNUIKX-LBPRGKRZSA-N 1 1 373.906 3.577 20 5 FHBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000511746343 945016108 /nfs/dbraw/zinc/01/61/08/945016108.db2.gz YUEOPBBKSSYVBE-IBGZPJMESA-N 1 1 367.449 3.625 20 5 FHBDMO COc1cc(C[N@H+]2C[C@H](c3ccccc3)[C@@H]3COCC[C@H]32)ccc1[N+](=O)[O-] ZINC000511764166 945059280 /nfs/dbraw/zinc/05/92/80/945059280.db2.gz CTZRCGASKIFJDI-CEXWTWQISA-N 1 1 368.433 3.608 20 5 FHBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCCC[C@H]1c1ccc(F)cc1 ZINC000544146516 945373011 /nfs/dbraw/zinc/37/30/11/945373011.db2.gz RZVSXHZQGZKTKE-MSOLQXFVSA-N 1 1 374.412 3.701 20 5 FHBDMO CC[C@@H](C)[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)Cc1ccccc1 ZINC000507677827 945442683 /nfs/dbraw/zinc/44/26/83/945442683.db2.gz NNBKAOJJBWALHM-OAHLLOKOSA-N 1 1 371.437 3.843 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)c2ccc([N+](=O)[O-])s2)cc1 ZINC000107554078 945704011 /nfs/dbraw/zinc/70/40/11/945704011.db2.gz LQBOGWAOWYYLMU-CQSZACIVSA-N 1 1 373.478 3.961 20 5 FHBDMO CSCC[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1nnc2ccccn21 ZINC000164294727 945708867 /nfs/dbraw/zinc/70/88/67/945708867.db2.gz YDYWOJNFQQMSRB-XJKSGUPXSA-N 1 1 371.466 3.783 20 5 FHBDMO C[N@@H+](CCCc1ccccc1)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000108176653 945882768 /nfs/dbraw/zinc/88/27/68/945882768.db2.gz NGRXREWREQTWJQ-UHFFFAOYSA-N 1 1 361.829 3.751 20 5 FHBDMO C[C@@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000522873957 946040043 /nfs/dbraw/zinc/04/00/43/946040043.db2.gz ZQGDCEVHVOSHBB-CQSZACIVSA-N 1 1 373.840 3.595 20 5 FHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000522873957 946040055 /nfs/dbraw/zinc/04/00/55/946040055.db2.gz ZQGDCEVHVOSHBB-CQSZACIVSA-N 1 1 373.840 3.595 20 5 FHBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)CCOc1ccccc1Cl ZINC000520059513 946081142 /nfs/dbraw/zinc/08/11/42/946081142.db2.gz IMTVQMWBPBNMOM-UHFFFAOYSA-N 1 1 350.802 3.638 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000248742365 946096086 /nfs/dbraw/zinc/09/60/86/946096086.db2.gz DVBNHKCOUAIFHK-IAGOWNOFSA-N 1 1 359.470 3.630 20 5 FHBDMO CCn1nc(C)c([N+](=O)[O-])c1N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000248662214 946158278 /nfs/dbraw/zinc/15/82/78/946158278.db2.gz GLRKCLUCHWWECT-WMLDXEAASA-N 1 1 357.458 3.585 20 5 FHBDMO C/C(=C\C(=O)NCCCC[N@@H+]1CCC[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000785283392 946226552 /nfs/dbraw/zinc/22/65/52/946226552.db2.gz RUABKALSFNFVJK-WECAROLCSA-N 1 1 359.470 3.626 20 5 FHBDMO CCCc1[nH+]ccn1CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000432225354 946255189 /nfs/dbraw/zinc/25/51/89/946255189.db2.gz GCEGMHLDDIERCS-UHFFFAOYSA-N 1 1 371.422 3.506 20 5 FHBDMO C[C@H]1C[C@H](N(C)Cc2cc(O)ccc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000093318016 946262735 /nfs/dbraw/zinc/26/27/35/946262735.db2.gz XELLHNLKQYUGMT-QFBILLFUSA-N 1 1 369.465 3.785 20 5 FHBDMO C[C@H]1C[C@H](N(C)Cc2cc(O)ccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000093318016 946262743 /nfs/dbraw/zinc/26/27/43/946262743.db2.gz XELLHNLKQYUGMT-QFBILLFUSA-N 1 1 369.465 3.785 20 5 FHBDMO CSc1cccc(C(=O)NC[C@@H](C)[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000186485369 946395847 /nfs/dbraw/zinc/39/58/47/946395847.db2.gz BLUOLLWYMMSNGP-CQSZACIVSA-N 1 1 373.478 3.567 20 5 FHBDMO Cc1cc(Cl)c([N+](=O)[O-])cc1OC(=O)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001126120533 946397175 /nfs/dbraw/zinc/39/71/75/946397175.db2.gz FUNMFFJKIHHYEW-OAHLLOKOSA-N 1 1 374.824 3.984 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H](Cc3ccc(F)cc3)C2)c2c(c1)COCO2 ZINC000121368386 946423471 /nfs/dbraw/zinc/42/34/71/946423471.db2.gz GOKYTSAARBBCQU-OAHLLOKOSA-N 1 1 372.396 3.665 20 5 FHBDMO CN(C)c1cccc([C@H]2CCC[N@H+]2CCOc2ccccc2[N+](=O)[O-])c1 ZINC000441362462 946487830 /nfs/dbraw/zinc/48/78/30/946487830.db2.gz YUVHEYBRXZEBOF-GOSISDBHSA-N 1 1 355.438 3.877 20 5 FHBDMO CCC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1ccc(OC)cc1 ZINC000618276731 946514695 /nfs/dbraw/zinc/51/46/95/946514695.db2.gz FWRQXCWXGURXHQ-UHFFFAOYSA-N 1 1 354.410 3.892 20 5 FHBDMO CCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1ccc(OC)cc1 ZINC000618276731 946514702 /nfs/dbraw/zinc/51/47/02/946514702.db2.gz FWRQXCWXGURXHQ-UHFFFAOYSA-N 1 1 354.410 3.892 20 5 FHBDMO COc1ccc(OCC[N@H+]2C[C@@H](c3ccc(F)cc3)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC000441395903 946551675 /nfs/dbraw/zinc/55/16/75/946551675.db2.gz NYMUMGAJKCORBX-HOCLYGCPSA-N 1 1 374.412 3.999 20 5 FHBDMO COc1cc(OC)c(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)c(OC)c1 ZINC000164416355 946597507 /nfs/dbraw/zinc/59/75/07/946597507.db2.gz YKUYZOVMLZBAON-ZDUSSCGKSA-N 1 1 360.410 3.780 20 5 FHBDMO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]C1CC(N2CCCCC2)C1 ZINC000475560095 946641469 /nfs/dbraw/zinc/64/14/69/946641469.db2.gz RZYIZNPLESXDAU-ACAXCVFMSA-N 1 1 357.498 3.913 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@H]3Cc3ccccc3)n2)c1 ZINC000025938035 946905243 /nfs/dbraw/zinc/90/52/43/946905243.db2.gz CKFGGDKKEMXXHD-KRWDZBQOSA-N 1 1 364.405 3.852 20 5 FHBDMO O=[N+]([O-])c1sc(C[NH2+]Cc2cccc3c2OCC3)cc1Br ZINC000897205778 946906772 /nfs/dbraw/zinc/90/67/72/946906772.db2.gz HYDWWWCZBXMXFY-UHFFFAOYSA-N 1 1 369.240 3.644 20 5 FHBDMO Cc1cc(C(=O)N[C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc([N+](=O)[O-])c1 ZINC000487386270 946919396 /nfs/dbraw/zinc/91/93/96/946919396.db2.gz GLKKGAOOGVUPJV-SJLPKXTDSA-N 1 1 367.449 3.544 20 5 FHBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@@H]1C ZINC000475361808 946953728 /nfs/dbraw/zinc/95/37/28/946953728.db2.gz KMUAUHQSUQNRBX-DZGCQCFKSA-N 1 1 374.462 3.954 20 5 FHBDMO COCCCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1ccccc1 ZINC000444583339 947025986 /nfs/dbraw/zinc/02/59/86/947025986.db2.gz NSGOGMMMSMYPPZ-UHFFFAOYSA-N 1 1 368.437 3.900 20 5 FHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@H](Cc4ccc(F)cc4)C3)nc2c1 ZINC000444644207 947066779 /nfs/dbraw/zinc/06/67/79/947066779.db2.gz VGQDYUWPLAXIDX-CQSZACIVSA-N 1 1 354.385 3.675 20 5 FHBDMO Cc1ccccc1C[C@H]1CCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444642156 947085009 /nfs/dbraw/zinc/08/50/09/947085009.db2.gz RADZKOOVUCNFID-MRXNPFEDSA-N 1 1 350.422 3.987 20 5 FHBDMO COc1ccccc1C[C@H](C)[N@@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC000441427712 947087485 /nfs/dbraw/zinc/08/74/85/947087485.db2.gz HPQDWWNRZNLNEN-INIZCTEOSA-N 1 1 358.438 3.935 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000074448511 947170528 /nfs/dbraw/zinc/17/05/28/947170528.db2.gz JPFDSBDPKVGODD-IBGZPJMESA-N 1 1 367.449 3.640 20 5 FHBDMO COc1cc(C[N@H+]2C[C@]3(C[C@@H]4CC[C@H]3C4)OC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000440543782 947189300 /nfs/dbraw/zinc/18/93/00/947189300.db2.gz ONJLVHPPILXDBQ-IIMJZQEZSA-N 1 1 360.454 3.773 20 5 FHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(CO)(Cc3ccccc3)CC2)c(F)c1 ZINC000444781685 947194890 /nfs/dbraw/zinc/19/48/90/947194890.db2.gz HUUXTPATAJCHFK-UHFFFAOYSA-N 1 1 358.413 3.551 20 5 FHBDMO C[C@@H](CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1ccccc1 ZINC000523486509 947304275 /nfs/dbraw/zinc/30/42/75/947304275.db2.gz UEKAIPFKXXKFNR-INIZCTEOSA-N 1 1 369.465 3.509 20 5 FHBDMO COc1ccc(C[N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)cc1OC(F)F ZINC000523702138 947527913 /nfs/dbraw/zinc/52/79/13/947527913.db2.gz XJSMOKCXVQBWHZ-UHFFFAOYSA-N 1 1 366.364 3.879 20 5 FHBDMO CC(C)[C@@H]1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CCS1 ZINC000072836946 947556969 /nfs/dbraw/zinc/55/69/69/947556969.db2.gz DCSPSXDMSVBEMW-KRWDZBQOSA-N 1 1 361.467 3.866 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCCCC[N@@H+]1CCCC[C@@H]1C ZINC000093971239 947620598 /nfs/dbraw/zinc/62/05/98/947620598.db2.gz WLBYVANYVMJJKN-INIZCTEOSA-N 1 1 361.486 3.904 20 5 FHBDMO C[C@H](c1ccc2c(c1)CCC2)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000445292579 947684176 /nfs/dbraw/zinc/68/41/76/947684176.db2.gz HOVLXBFNAUDHTA-RDTXWAMCSA-N 1 1 352.438 3.726 20 5 FHBDMO Cc1ccc([C@H]2[C@H](C)CCC[N@H+]2CCn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC000536378805 947851618 /nfs/dbraw/zinc/85/16/18/947851618.db2.gz MUSQUASIQSIDTH-OXQOHEQNSA-N 1 1 355.438 3.538 20 5 FHBDMO COCc1cc([N+](=O)[O-])ccc1N1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000278867027 947866069 /nfs/dbraw/zinc/86/60/69/947866069.db2.gz NHWYSCCVMNNXGR-UHFFFAOYSA-N 1 1 370.453 3.658 20 5 FHBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C1 ZINC000536391142 947957371 /nfs/dbraw/zinc/95/73/71/947957371.db2.gz OHLXGTATJIYGHX-KRWDZBQOSA-N 1 1 366.465 3.825 20 5 FHBDMO CCOc1ccc(NC(=O)C[N@@H+](C)C(C)(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000585754366 948264780 /nfs/dbraw/zinc/26/47/80/948264780.db2.gz KDWVQMJAQGGDHH-UHFFFAOYSA-N 1 1 371.437 3.799 20 5 FHBDMO CC(=O)c1ccc(N2CCC(c3[nH+]cc4n3CCCC4)CC2)c([N+](=O)[O-])c1 ZINC000278949577 948327424 /nfs/dbraw/zinc/32/74/24/948327424.db2.gz XAOUJGIFDANDNN-UHFFFAOYSA-N 1 1 368.437 3.714 20 5 FHBDMO C[N@@H+](CCCc1ccccc1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728895832 948575925 /nfs/dbraw/zinc/57/59/25/948575925.db2.gz CEGOZXJIRFWPLB-UHFFFAOYSA-N 1 1 350.422 3.980 20 5 FHBDMO C[C@H]1CC[C@@H](c2ccccc2)[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000512165033 948602739 /nfs/dbraw/zinc/60/27/39/948602739.db2.gz KQDDACKIDOVSHM-KSSFIOAISA-N 1 1 353.422 3.667 20 5 FHBDMO CC[C@H](C)[N@@H+](C)CCNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000524045938 948813303 /nfs/dbraw/zinc/81/33/03/948813303.db2.gz MUMCAAOPSXLLQW-HNNXBMFYSA-N 1 1 370.453 3.799 20 5 FHBDMO O=C(Nc1ccc(F)c([N+](=O)[O-])c1)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000109531856 206058527 /nfs/dbraw/zinc/05/85/27/206058527.db2.gz VQGXMDZNZPMTQM-OAHLLOKOSA-N 1 1 357.385 3.585 20 5 FHBDMO CCC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H](C)C(=O)Nc1ccccc1 ZINC000109869028 206066403 /nfs/dbraw/zinc/06/64/03/206066403.db2.gz QAUGERBXIOWEIT-INIZCTEOSA-N 1 1 355.438 3.877 20 5 FHBDMO Cc1c(C[N@@H+](C)[C@H]2CCCN(c3ccccc3)C2=O)cccc1[N+](=O)[O-] ZINC000078736890 132191655 /nfs/dbraw/zinc/19/16/55/132191655.db2.gz JFWCZQIYKAJPTQ-IBGZPJMESA-N 1 1 353.422 3.531 20 5 FHBDMO Cc1c(C[N@H+](C)[C@H]2CCCN(c3ccccc3)C2=O)cccc1[N+](=O)[O-] ZINC000078736890 132191657 /nfs/dbraw/zinc/19/16/57/132191657.db2.gz JFWCZQIYKAJPTQ-IBGZPJMESA-N 1 1 353.422 3.531 20 5 FHBDMO CC[N@@H+](Cc1ccc(C(=O)NCc2cccc([N+](=O)[O-])c2C)cc1)C1CC1 ZINC000481463652 567970322 /nfs/dbraw/zinc/97/03/22/567970322.db2.gz HUVLYFWRNYOFLV-UHFFFAOYSA-N 1 1 367.449 3.818 20 5 FHBDMO O=[N+]([O-])c1sc(C[NH2+][C@H]2CCc3c2cccc3O)cc1Br ZINC000602543012 567989859 /nfs/dbraw/zinc/98/98/59/567989859.db2.gz DNEIFAANDUTDFL-LBPRGKRZSA-N 1 1 369.240 3.902 20 5 FHBDMO C[NH+](C)[C@H](CNC(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-])c1ccco1 ZINC000291080199 568013972 /nfs/dbraw/zinc/01/39/72/568013972.db2.gz GMRVBXUHRICASZ-GFCCVEGCSA-N 1 1 372.208 3.527 20 5 FHBDMO Cc1cc(CNc2ncnc3sc([N+](=O)[O-])cc32)cc(N2CCCC2)[nH+]1 ZINC000291263435 568093004 /nfs/dbraw/zinc/09/30/04/568093004.db2.gz ZGYZVZYAXOSHSG-UHFFFAOYSA-N 1 1 370.438 3.515 20 5 FHBDMO Cc1cc(N2CCC[C@@H](c3[nH]cc[nH+]3)C2)c(Br)cc1[N+](=O)[O-] ZINC000568706052 568132563 /nfs/dbraw/zinc/13/25/63/568132563.db2.gz XZAHJGORNNTSBB-LLVKDONJSA-N 1 1 365.231 3.773 20 5 FHBDMO CCOc1ccc(NC(=O)C[N@@H+](C2CC2)C2CCCCC2)c([N+](=O)[O-])c1 ZINC000603875059 568174758 /nfs/dbraw/zinc/17/47/58/568174758.db2.gz XKKNKTPLVOWKEL-UHFFFAOYSA-N 1 1 361.442 3.729 20 5 FHBDMO CC(C)(C)[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000569024351 568275066 /nfs/dbraw/zinc/27/50/66/568275066.db2.gz HDEUOAJIBGDQQK-UHFFFAOYSA-N 1 1 373.375 3.560 20 5 FHBDMO CCc1ccc([C@@H](CO)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(C)C)cc1 ZINC000541984511 568308670 /nfs/dbraw/zinc/30/86/70/568308670.db2.gz XLPQOXLSTFNJJE-LJQANCHMSA-N 1 1 358.438 3.768 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])c(N2C[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@@H]3C2)n1 ZINC000569635370 568411568 /nfs/dbraw/zinc/41/15/68/568411568.db2.gz ZXTKKOIPHFGFSW-RBUKOAKNSA-N 1 1 366.465 3.565 20 5 FHBDMO CC(=Cc1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](c2nnc(C3CC3)[nH]2)C1 ZINC000570248027 568466221 /nfs/dbraw/zinc/46/62/21/568466221.db2.gz HOEHNFIBCAIBQF-QXSWTLKVSA-N 1 1 367.453 3.873 20 5 FHBDMO CC(=Cc1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H](c2nc(C3CC3)n[nH]2)C1 ZINC000570248027 568466223 /nfs/dbraw/zinc/46/62/23/568466223.db2.gz HOEHNFIBCAIBQF-QXSWTLKVSA-N 1 1 367.453 3.873 20 5 FHBDMO CC(=Cc1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](c2nc(C3CC3)n[nH]2)C1 ZINC000570248027 568466224 /nfs/dbraw/zinc/46/62/24/568466224.db2.gz HOEHNFIBCAIBQF-QXSWTLKVSA-N 1 1 367.453 3.873 20 5 FHBDMO CCC[C@H]([NH2+]Cc1nccn1CC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000482245174 568522672 /nfs/dbraw/zinc/52/26/72/568522672.db2.gz ZOFDUPIKJHIXIZ-AWEZNQCLSA-N 1 1 356.348 3.985 20 5 FHBDMO Cc1c(C)c(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)ncc1[N+](=O)[O-] ZINC001164621037 719083029 /nfs/dbraw/zinc/08/30/29/719083029.db2.gz GLTZIUXGEJYSQZ-AZUAARDMSA-N 1 1 366.465 3.707 20 5 FHBDMO CCOc1ccc([C@H](C)[NH2+]Cc2nn(C)c3ccccc23)cc1[N+](=O)[O-] ZINC000612829285 936326155 /nfs/dbraw/zinc/32/61/55/936326155.db2.gz OCPLOEFTHWXVRQ-ZDUSSCGKSA-N 1 1 354.410 3.731 20 5 FHBDMO Cc1cc(C(=O)Nc2ccc([C@H](C)[NH+]3CCOCC3)cc2)cc([N+](=O)[O-])c1 ZINC000110720432 945065722 /nfs/dbraw/zinc/06/57/22/945065722.db2.gz IFTXDIARVHRJDG-HNNXBMFYSA-N 1 1 369.421 3.549 20 5 FHBDMO C[C@H]1CCCC[N@H+]1CCC1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000157496504 927417136 /nfs/dbraw/zinc/41/71/36/927417136.db2.gz DLPMOMWXLMVXKF-KRWDZBQOSA-N 1 1 373.497 3.640 20 5 FHBDMO CCOCCC[N@H+]1CC[C@H](N[C@@H](C)c2cccc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000248012188 937173699 /nfs/dbraw/zinc/17/36/99/937173699.db2.gz LIVYFSNAYIQICZ-IEZWGBDMSA-N 1 1 363.502 3.691 20 5 FHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@H]2CCc2ccccc2)c1 ZINC001167070767 928211408 /nfs/dbraw/zinc/21/14/08/928211408.db2.gz IUUGCTSLWDKDOG-IBGZPJMESA-N 1 1 368.433 3.979 20 5 FHBDMO CC[N@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])[C@H](C)c1cccc(O)c1 ZINC000471177624 928600827 /nfs/dbraw/zinc/60/08/27/928600827.db2.gz KSQQQEIPXNXDEN-CQSZACIVSA-N 1 1 357.410 3.630 20 5 FHBDMO CC[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])[C@H](C)c1cccc(O)c1 ZINC000471177624 928600833 /nfs/dbraw/zinc/60/08/33/928600833.db2.gz KSQQQEIPXNXDEN-CQSZACIVSA-N 1 1 357.410 3.630 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1CCC1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000157732406 928788259 /nfs/dbraw/zinc/78/82/59/928788259.db2.gz WOXZICXAJDXTPU-QGZVFWFLSA-N 1 1 373.497 3.640 20 5 FHBDMO CS[C@H]1CCCC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000134576850 929070110 /nfs/dbraw/zinc/07/01/10/929070110.db2.gz ZKWGSLHECFMAJR-DOMZBBRYSA-N 1 1 362.455 3.923 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)C[C@@H](C)c1ccccc1 ZINC000066854661 929233591 /nfs/dbraw/zinc/23/35/91/929233591.db2.gz YHUOYCPLGYPNGB-OAHLLOKOSA-N 1 1 371.437 3.668 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)C[C@H](C)c1ccccc1 ZINC000066854660 929234053 /nfs/dbraw/zinc/23/40/53/929234053.db2.gz YHUOYCPLGYPNGB-HNNXBMFYSA-N 1 1 371.437 3.668 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCc2cc(F)ccc2[C@H]1C ZINC000610003879 929774872 /nfs/dbraw/zinc/77/48/72/929774872.db2.gz LUQPIJZXKYWQAP-CQSZACIVSA-N 1 1 371.412 3.990 20 5 FHBDMO Cc1cc(C(=O)NCC[C@H](C)[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000471471642 929835865 /nfs/dbraw/zinc/83/58/65/929835865.db2.gz OPRBZHZJFADREM-INIZCTEOSA-N 1 1 355.438 3.544 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@H]([N@@H+](C)Cc2ccccc2)C1 ZINC000610317193 929870494 /nfs/dbraw/zinc/87/04/94/929870494.db2.gz PGINJEGQDIAFPV-GOSISDBHSA-N 1 1 368.437 3.641 20 5 FHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCC[C@@H]1C[C@@H](O)c1cccs1 ZINC000175845951 929953413 /nfs/dbraw/zinc/95/34/13/929953413.db2.gz ZFCUFSLJBLSGQG-GDBMZVCRSA-N 1 1 350.415 3.884 20 5 FHBDMO C[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)CC1(O)CCCCCC1 ZINC000187324159 930097136 /nfs/dbraw/zinc/09/71/36/930097136.db2.gz FDARRHJBPMGZLM-UHFFFAOYSA-N 1 1 359.426 3.767 20 5 FHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@](C)(c2ccccc2)C1 ZINC001167367140 930354065 /nfs/dbraw/zinc/35/40/65/930354065.db2.gz BSGUWVCTCXTQIT-IIBYNOLFSA-N 1 1 367.449 3.976 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@](F)(c2ccccc2)C1 ZINC000579498050 930392342 /nfs/dbraw/zinc/39/23/42/930392342.db2.gz QYJSXZYORNHLGV-HXUWFJFHSA-N 1 1 371.412 3.803 20 5 FHBDMO COc1ccc(NC(=O)C[N@H+]2CCC[C@H](C(C)(C)C)CC2)c([N+](=O)[O-])c1 ZINC001167406028 930715633 /nfs/dbraw/zinc/71/56/33/930715633.db2.gz MVUBQFBJAZPFCL-AWEZNQCLSA-N 1 1 363.458 3.690 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+](Cc3ccccc3)CC[C@@H]2C)c1 ZINC000610446419 930818371 /nfs/dbraw/zinc/81/83/71/930818371.db2.gz YKNMJNRITMVULC-KRWDZBQOSA-N 1 1 367.449 3.640 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000119262286 930992345 /nfs/dbraw/zinc/99/23/45/930992345.db2.gz UTBQZPBFHCKQJL-ZDUSSCGKSA-N 1 1 373.409 3.751 20 5 FHBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1F ZINC000127156332 931576372 /nfs/dbraw/zinc/57/63/72/931576372.db2.gz NTCCARCTQBWRFN-UHFFFAOYSA-N 1 1 369.356 3.550 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000581131982 931600739 /nfs/dbraw/zinc/60/07/39/931600739.db2.gz CZGXGPNYBLBZRB-QFBILLFUSA-N 1 1 367.449 3.544 20 5 FHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2cncc(Br)c2)C2CC2)c1 ZINC000178002598 932010476 /nfs/dbraw/zinc/01/04/76/932010476.db2.gz WDYNRBISGJPXTI-UHFFFAOYSA-N 1 1 362.227 3.917 20 5 FHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cncc(Br)c2)C2CC2)c1 ZINC000178002598 932010481 /nfs/dbraw/zinc/01/04/81/932010481.db2.gz WDYNRBISGJPXTI-UHFFFAOYSA-N 1 1 362.227 3.917 20 5 FHBDMO O=C([C@H]1CC[N@H+](C2CCCCC2)C1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000135189804 932041935 /nfs/dbraw/zinc/04/19/35/932041935.db2.gz AZSIWLKPXSSRIQ-KRWDZBQOSA-N 1 1 371.481 3.740 20 5 FHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](OCc2c(C)noc2C)C1 ZINC000581456163 932090301 /nfs/dbraw/zinc/09/03/01/932090301.db2.gz SHWNALZQUFYSCG-SZJVNEJHSA-N 1 1 371.437 3.894 20 5 FHBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000477276081 932445310 /nfs/dbraw/zinc/44/53/10/932445310.db2.gz AEESCUXTCWZWFO-BETUJISGSA-N 1 1 367.877 3.654 20 5 FHBDMO COc1ccc(NC(=O)C[N@@H+]2CCC[C@@H]2c2cccc(C)c2)c([N+](=O)[O-])c1 ZINC000055911135 932738309 /nfs/dbraw/zinc/73/83/09/932738309.db2.gz HVQXLWHMQSNNBB-GOSISDBHSA-N 1 1 369.421 3.687 20 5 FHBDMO COc1ccc(NC(=O)C[N@H+]2CCC[C@@H]2c2cccc(C)c2)c([N+](=O)[O-])c1 ZINC000055911135 932738313 /nfs/dbraw/zinc/73/83/13/932738313.db2.gz HVQXLWHMQSNNBB-GOSISDBHSA-N 1 1 369.421 3.687 20 5 FHBDMO CCc1ccc([C@@H]([NH2+]CCOCC(F)F)c2ccc([N+](=O)[O-])cc2)o1 ZINC000471763813 932827825 /nfs/dbraw/zinc/82/78/25/932827825.db2.gz XOWBROIZTDUOCV-KRWDZBQOSA-N 1 1 354.353 3.711 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000430670344 932853253 /nfs/dbraw/zinc/85/32/53/932853253.db2.gz UJWGOGGQRDSHBE-FUHWJXTLSA-N 1 1 367.449 3.686 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCSC4(CCCCC4)C3)n2)c1 ZINC000175966379 932917649 /nfs/dbraw/zinc/91/76/49/932917649.db2.gz QWPSCSRPKMAIBA-UHFFFAOYSA-N 1 1 374.466 3.897 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCSC4(CCCCC4)C3)n2)c1 ZINC000175966379 932917654 /nfs/dbraw/zinc/91/76/54/932917654.db2.gz QWPSCSRPKMAIBA-UHFFFAOYSA-N 1 1 374.466 3.897 20 5 FHBDMO CCOc1cccc(N2CC[C@H](n3c[nH+]c4c3CCCC4)C2)c1[N+](=O)[O-] ZINC000548333994 933009300 /nfs/dbraw/zinc/00/93/00/933009300.db2.gz BGXRCAKAVINKRR-AWEZNQCLSA-N 1 1 356.426 3.520 20 5 FHBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1c[nH+]ccc1-n1cc(C)cn1 ZINC000588440949 933071827 /nfs/dbraw/zinc/07/18/27/933071827.db2.gz JWTMPHGORINFIH-ZROIWOOFSA-N 1 1 363.377 3.526 20 5 FHBDMO CO[C@]1(C)C[C@H]([N@@H+](C)Cc2ccc(Br)cc2[N+](=O)[O-])C1(C)C ZINC001167490565 933076424 /nfs/dbraw/zinc/07/64/24/933076424.db2.gz DMLOYNAVVPSAIF-GOEBONIOSA-N 1 1 371.275 3.993 20 5 FHBDMO COc1ccc2oc(C[NH+]3CCN(c4cccc([N+](=O)[O-])c4)CC3)cc2c1 ZINC000510536036 933197647 /nfs/dbraw/zinc/19/76/47/933197647.db2.gz DDPFPYGYPYUSOE-UHFFFAOYSA-N 1 1 367.405 3.672 20 5 FHBDMO C[N@@H+](CCC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)C1CCCCC1 ZINC000548392097 933313382 /nfs/dbraw/zinc/31/33/82/933313382.db2.gz DSJUCYTZZLPGLO-UHFFFAOYSA-N 1 1 359.470 3.740 20 5 FHBDMO O=[N+]([O-])c1cccc(OCC[NH+]2C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C2)c1 ZINC000610604853 933514022 /nfs/dbraw/zinc/51/40/22/933514022.db2.gz PQEMNZLUYLFBRK-VXGBXAGGSA-N 1 1 372.265 3.646 20 5 FHBDMO C[NH+](C)CCC1CCN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000092380933 934030470 /nfs/dbraw/zinc/03/04/70/934030470.db2.gz ACIJPNRLSKMQRK-UHFFFAOYSA-N 1 1 374.510 3.882 20 5 FHBDMO CCn1c(SCCn2cc[nH+]c2C)nc2cc3ccccc3cc2c1=O ZINC000535761960 934346262 /nfs/dbraw/zinc/34/62/62/934346262.db2.gz KUHRGCKJDRQRHO-UHFFFAOYSA-N 1 1 364.474 3.867 20 5 FHBDMO O=[N+]([O-])c1ccn(CC[N@@H+]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)n1 ZINC000176212290 934606384 /nfs/dbraw/zinc/60/63/84/934606384.db2.gz LSNSURQSVWFQCY-CQSZACIVSA-N 1 1 355.225 3.935 20 5 FHBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)n1 ZINC000176212290 934606391 /nfs/dbraw/zinc/60/63/91/934606391.db2.gz LSNSURQSVWFQCY-CQSZACIVSA-N 1 1 355.225 3.935 20 5 FHBDMO O=[N+]([O-])c1ccc(NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000065202235 934645640 /nfs/dbraw/zinc/64/56/40/934645640.db2.gz RTEXMMFESUCOAN-MRXNPFEDSA-N 1 1 370.409 3.827 20 5 FHBDMO COc1ccc(-c2ccc(C[NH2+][C@@H](CO)c3ccsc3)o2)c([N+](=O)[O-])c1 ZINC000472066155 934934207 /nfs/dbraw/zinc/93/42/07/934934207.db2.gz QFVUXCLXUQNFFQ-INIZCTEOSA-N 1 1 374.418 3.748 20 5 FHBDMO COc1cc(C[NH2+][C@@H](C)c2cncs2)c([N+](=O)[O-])cc1OC(F)F ZINC000934203663 935005806 /nfs/dbraw/zinc/00/58/06/935005806.db2.gz YQWYMEWTRYDIQQ-QMMMGPOBSA-N 1 1 359.354 3.512 20 5 FHBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(CNC(=O)c3csc([N+](=O)[O-])c3)cc2)C1 ZINC000071958289 935093762 /nfs/dbraw/zinc/09/37/62/935093762.db2.gz VNCUZLZXNYMABJ-CQSZACIVSA-N 1 1 373.478 3.818 20 5 FHBDMO COc1ccc(C(=O)C2CC[NH+](Cc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000014324942 935201182 /nfs/dbraw/zinc/20/11/82/935201182.db2.gz GHTAPCLDEZQRNT-UHFFFAOYSA-N 1 1 354.406 3.698 20 5 FHBDMO CSc1ccc(NC(=O)[C@@H](C)[N@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000511072857 935239905 /nfs/dbraw/zinc/23/99/05/935239905.db2.gz MULHCDTYSWZUQZ-CQSZACIVSA-N 1 1 373.478 3.818 20 5 FHBDMO CSc1ccc(NC(=O)[C@@H](C)[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000511072857 935239908 /nfs/dbraw/zinc/23/99/08/935239908.db2.gz MULHCDTYSWZUQZ-CQSZACIVSA-N 1 1 373.478 3.818 20 5 FHBDMO COC(=O)c1cc2cc(C[N@@H+](C)CCc3ccccc3[N+](=O)[O-])ccc2o1 ZINC000511072656 935246325 /nfs/dbraw/zinc/24/63/25/935246325.db2.gz GQJWVYDPEQMLBN-UHFFFAOYSA-N 1 1 368.389 3.802 20 5 FHBDMO Cc1ccc(CNC(=O)Nc2cccc([N+](=O)[O-])c2C)c(N2CCCC2)[nH+]1 ZINC000611582749 935453529 /nfs/dbraw/zinc/45/35/29/935453529.db2.gz XYAFPUHVZDPSML-UHFFFAOYSA-N 1 1 369.425 3.529 20 5 FHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CC[C@H](n2cnc3c2CCCC3)C1 ZINC000432113158 945102471 /nfs/dbraw/zinc/10/24/71/945102471.db2.gz FTFUZLLFSHEHBL-ZDUSSCGKSA-N 1 1 360.845 3.771 20 5 FHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CC[C@H](n2cnc3c2CCCC3)C1 ZINC000432113158 945102475 /nfs/dbraw/zinc/10/24/75/945102475.db2.gz FTFUZLLFSHEHBL-ZDUSSCGKSA-N 1 1 360.845 3.771 20 5 FHBDMO CCOc1ccc(NC(=O)C[N@H+]2CCC[C@@H]2C2CCCC2)c([N+](=O)[O-])c1 ZINC000511108528 935601940 /nfs/dbraw/zinc/60/19/40/935601940.db2.gz HUHXEBMVLFMBFZ-QGZVFWFLSA-N 1 1 361.442 3.587 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000127569205 935627194 /nfs/dbraw/zinc/62/71/94/935627194.db2.gz XZRXWOQFKCVNHP-INIZCTEOSA-N 1 1 360.458 3.598 20 5 FHBDMO Cc1cccc(NC(=O)[C@H](C)[N@H+](C)CCc2ccccc2[N+](=O)[O-])c1C ZINC000511134821 935760303 /nfs/dbraw/zinc/76/03/03/935760303.db2.gz CEUXMUQNVOSUNX-INIZCTEOSA-N 1 1 355.438 3.713 20 5 FHBDMO Cc1cccc(NC(=O)[C@H](C)[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1C ZINC000511134821 935760306 /nfs/dbraw/zinc/76/03/06/935760306.db2.gz CEUXMUQNVOSUNX-INIZCTEOSA-N 1 1 355.438 3.713 20 5 FHBDMO CCc1ccccc1NC(=O)[C@H](C)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511137077 935770910 /nfs/dbraw/zinc/77/09/10/935770910.db2.gz BMPWQOLGDBIEIU-HNNXBMFYSA-N 1 1 355.438 3.659 20 5 FHBDMO CCc1ccccc1NC(=O)[C@H](C)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511137077 935770912 /nfs/dbraw/zinc/77/09/12/935770912.db2.gz BMPWQOLGDBIEIU-HNNXBMFYSA-N 1 1 355.438 3.659 20 5 FHBDMO C[C@@H](c1nnc(-c2cccs2)o1)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511140783 935776869 /nfs/dbraw/zinc/77/68/69/935776869.db2.gz URHGFOJRYHMFJO-LBPRGKRZSA-N 1 1 358.423 3.942 20 5 FHBDMO C[C@@H](c1nnc(-c2cccs2)o1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511140783 935776871 /nfs/dbraw/zinc/77/68/71/935776871.db2.gz URHGFOJRYHMFJO-LBPRGKRZSA-N 1 1 358.423 3.942 20 5 FHBDMO Cc1ccc(NC(=O)[C@H](C)[N@H+](C)CCc2ccccc2[N+](=O)[O-])cc1C ZINC000511142461 935784332 /nfs/dbraw/zinc/78/43/32/935784332.db2.gz OSUZCISJMPMWMZ-INIZCTEOSA-N 1 1 355.438 3.713 20 5 FHBDMO Cc1ccc(NC(=O)[C@H](C)[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1C ZINC000511142461 935784336 /nfs/dbraw/zinc/78/43/36/935784336.db2.gz OSUZCISJMPMWMZ-INIZCTEOSA-N 1 1 355.438 3.713 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H]1Cc1ccccc1 ZINC000479100367 935788395 /nfs/dbraw/zinc/78/83/95/935788395.db2.gz LEVAFSBGTVKGEB-QGZVFWFLSA-N 1 1 353.422 3.549 20 5 FHBDMO Cn1cc([C@H]([NH2+]C/C=C\c2ccccc2[N+](=O)[O-])c2ccc(F)cc2)cn1 ZINC000479411981 935837430 /nfs/dbraw/zinc/83/74/30/935837430.db2.gz BSZVXHOASMXZIO-RDBXKPKDSA-N 1 1 366.396 3.860 20 5 FHBDMO CC(C)[N@@H+](C)Cc1cccc(CNC(=O)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000110871437 945133348 /nfs/dbraw/zinc/13/33/48/945133348.db2.gz YIAUOTOOAJRIJD-UHFFFAOYSA-N 1 1 359.401 3.504 20 5 FHBDMO CCn1nc(C)c([N+](=O)[O-])c1NCC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000480078838 935959161 /nfs/dbraw/zinc/95/91/61/935959161.db2.gz BEUMPFUQLRYTOQ-YJBOKZPZSA-N 1 1 371.485 3.832 20 5 FHBDMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Br)C1CCCC1 ZINC000052908359 935959336 /nfs/dbraw/zinc/95/93/36/935959336.db2.gz QNJKIQQKCDVJCX-UHFFFAOYSA-N 1 1 370.247 3.560 20 5 FHBDMO C[N@@H+](CCNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12)C1CCCC1 ZINC000277819814 935978318 /nfs/dbraw/zinc/97/83/18/935978318.db2.gz YERAESHOURFTRL-UHFFFAOYSA-N 1 1 363.461 3.698 20 5 FHBDMO CC[C@@H]1C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC[C@H]1c1ccccc1 ZINC000472262299 936140943 /nfs/dbraw/zinc/14/09/43/936140943.db2.gz URDGWTCBDNHDDW-DNVCBOLYSA-N 1 1 367.449 3.709 20 5 FHBDMO COc1ccc(C[NH2+][C@H](C)c2nc(-c3ccncc3)cs2)cc1[N+](=O)[O-] ZINC000124116190 945153631 /nfs/dbraw/zinc/15/36/31/945153631.db2.gz RFCPQUWFSQNEDC-GFCCVEGCSA-N 1 1 370.434 3.973 20 5 FHBDMO Cc1c(C[N@H+]2CCCC[C@H]2CNC(=O)c2ccccc2)cccc1[N+](=O)[O-] ZINC000472286944 938260848 /nfs/dbraw/zinc/26/08/48/938260848.db2.gz YACOYZGYFCXZEW-IBGZPJMESA-N 1 1 367.449 3.688 20 5 FHBDMO CC(C)[N@@H+](Cc1ccco1)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000506418791 945162580 /nfs/dbraw/zinc/16/25/80/945162580.db2.gz ZSXIZTGKRZSWIR-UHFFFAOYSA-N 1 1 354.410 3.999 20 5 FHBDMO CCCCNC(=O)[C@H]1CC[C@@H](C)[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000543853326 938386239 /nfs/dbraw/zinc/38/62/39/938386239.db2.gz NIMMXZSJMJTOJO-HIFRSBDPSA-N 1 1 367.877 3.765 20 5 FHBDMO CN(CC[C@H]1CCCC[N@H+]1C)C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000437261120 945176411 /nfs/dbraw/zinc/17/64/11/945176411.db2.gz GALZNQZLOXGBMN-CQSZACIVSA-N 1 1 373.375 3.560 20 5 FHBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)c1csc([N+](=O)[O-])c1 ZINC000511810471 945180344 /nfs/dbraw/zinc/18/03/44/945180344.db2.gz XIVIEDWAQCJKPC-INIZCTEOSA-N 1 1 373.478 3.687 20 5 FHBDMO COC(=O)C(C)(C)[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000611797099 938518667 /nfs/dbraw/zinc/51/86/67/938518667.db2.gz KBBHKUADEREBEY-CYBMUJFWSA-N 1 1 354.834 3.659 20 5 FHBDMO COC(=O)C(C)(C)[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000611797099 938518668 /nfs/dbraw/zinc/51/86/68/938518668.db2.gz KBBHKUADEREBEY-CYBMUJFWSA-N 1 1 354.834 3.659 20 5 FHBDMO CC(=O)c1ccc(N2CCC(Oc3cc[nH+]cc3C)CC2)c([N+](=O)[O-])c1 ZINC000278607791 938580929 /nfs/dbraw/zinc/58/09/29/938580929.db2.gz ZXVYIEUGXBSIIJ-UHFFFAOYSA-N 1 1 355.394 3.549 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)[C@@H](C)c1ccc(C)cc1 ZINC000052907687 938654669 /nfs/dbraw/zinc/65/46/69/938654669.db2.gz YLUYITNUYBCEPZ-HNNXBMFYSA-N 1 1 371.437 3.933 20 5 FHBDMO Cc1cccc(C(=O)N[C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000289874874 938865459 /nfs/dbraw/zinc/86/54/59/938865459.db2.gz WSTGNQXYEREUDD-APWZRJJASA-N 1 1 367.449 3.544 20 5 FHBDMO Cn1ccnc1[C@H]([NH2+]CCc1ccc(F)cc1F)c1ccc([N+](=O)[O-])cc1 ZINC000573273549 938963405 /nfs/dbraw/zinc/96/34/05/938963405.db2.gz MQYAWMFQQIFACC-GOSISDBHSA-N 1 1 372.375 3.528 20 5 FHBDMO CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC)Cc1cccs1 ZINC000179177782 938983259 /nfs/dbraw/zinc/98/32/59/938983259.db2.gz ZJWNCIGPDMOLFR-UHFFFAOYSA-N 1 1 363.439 3.516 20 5 FHBDMO COc1cc(C[NH2+][C@H](C)c2cnccc2C)c([N+](=O)[O-])cc1OC(F)F ZINC000611939695 938993737 /nfs/dbraw/zinc/99/37/37/938993737.db2.gz UOUSIOGWEDEXIR-LLVKDONJSA-N 1 1 367.352 3.759 20 5 FHBDMO NC(=O)[C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1ccccc1 ZINC000102420880 939018606 /nfs/dbraw/zinc/01/86/06/939018606.db2.gz ZJFWIDOCFIXHAV-GOSISDBHSA-N 1 1 367.430 3.640 20 5 FHBDMO O=[N+]([O-])c1ncccc1N[C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000612101928 939050721 /nfs/dbraw/zinc/05/07/21/939050721.db2.gz YRCYXRUGRZHCDR-OKZBNKHCSA-N 1 1 352.438 3.702 20 5 FHBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000516772018 945227788 /nfs/dbraw/zinc/22/77/88/945227788.db2.gz NTZXGYIGEPBYCZ-UHFFFAOYSA-N 1 1 361.829 3.630 20 5 FHBDMO COC[C@H](C)[N@@H+](C)Cc1ccc(OCc2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000179373208 939126700 /nfs/dbraw/zinc/12/67/00/939126700.db2.gz LNQFQKIPFYVNBL-HNNXBMFYSA-N 1 1 374.437 3.649 20 5 FHBDMO COC[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@H](C)O1 ZINC000188371318 939214316 /nfs/dbraw/zinc/21/43/16/939214316.db2.gz OTZNAWRZRFKLFH-XJKSGUPXSA-N 1 1 362.451 3.559 20 5 FHBDMO COC[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@H](C)O1 ZINC000188371318 939214326 /nfs/dbraw/zinc/21/43/26/939214326.db2.gz OTZNAWRZRFKLFH-XJKSGUPXSA-N 1 1 362.451 3.559 20 5 FHBDMO O=C(C[N@H+]1C[C@H](c2ccccc2)[C@H]2CCC[C@@H]21)Nc1ccccc1[N+](=O)[O-] ZINC000511845871 945266507 /nfs/dbraw/zinc/26/65/07/945266507.db2.gz XUFOPIZIRRQYCI-LMMKCTJWSA-N 1 1 365.433 3.801 20 5 FHBDMO O=C1CCCN1C[C@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000179554297 939887878 /nfs/dbraw/zinc/88/78/78/939887878.db2.gz KPULKANEZZUQKM-KRWDZBQOSA-N 1 1 373.840 3.702 20 5 FHBDMO Cc1noc([C@@H]2CCC[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C2)n1 ZINC000179714288 939925592 /nfs/dbraw/zinc/92/55/92/939925592.db2.gz OAEQCLGVDWYSSI-OAHLLOKOSA-N 1 1 368.393 3.926 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@]2(C1)C(=O)Nc1ccccc12 ZINC000364436564 939940891 /nfs/dbraw/zinc/94/08/91/939940891.db2.gz YZXZWNYUCKDZCC-VBKZILBWSA-N 1 1 351.406 3.560 20 5 FHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@@]2(CCSC2)C1 ZINC000451964113 939954028 /nfs/dbraw/zinc/95/40/28/939954028.db2.gz IRGRZEIKBFHTIW-SCLBCKFNSA-N 1 1 374.466 3.925 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@@H](C)c1cccs1 ZINC000411169699 940010315 /nfs/dbraw/zinc/01/03/15/940010315.db2.gz DTFGDJPHZBEJMT-LBPRGKRZSA-N 1 1 363.439 3.687 20 5 FHBDMO Cc1ccn(C2CC[NH+](Cc3coc(-c4ccc([N+](=O)[O-])cc4)n3)CC2)n1 ZINC000365009372 940038998 /nfs/dbraw/zinc/03/89/98/940038998.db2.gz PFYHHOBWYVIKJS-UHFFFAOYSA-N 1 1 367.409 3.592 20 5 FHBDMO C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000136603789 940054138 /nfs/dbraw/zinc/05/41/38/940054138.db2.gz IPJZDEVAPSYHAW-BETUJISGSA-N 1 1 367.877 3.735 20 5 FHBDMO CC(C)[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1cccc(C(F)(F)F)c1 ZINC000472434624 940097510 /nfs/dbraw/zinc/09/75/10/940097510.db2.gz WFRAHDVXCOGPLK-UHFFFAOYSA-N 1 1 356.348 3.721 20 5 FHBDMO C[C@@H]1[C@H](CC(F)(F)F)C[C@H](C)[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411767548 940110274 /nfs/dbraw/zinc/11/02/74/940110274.db2.gz FWHQRRPQHKLVKZ-XQQFMLRXSA-N 1 1 373.375 3.975 20 5 FHBDMO Cc1ccc([C@H](C)[NH2+]Cc2cnc(Br)s2)cc1[N+](=O)[O-] ZINC000290165381 940113757 /nfs/dbraw/zinc/11/37/57/940113757.db2.gz XWRJODSTNAZQGW-VIFPVBQESA-N 1 1 356.245 3.973 20 5 FHBDMO COc1ccc(C[N@@H+]2CC3(CCOCC3)[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000411994645 940179814 /nfs/dbraw/zinc/17/98/14/940179814.db2.gz AQDJQSQRKZRSTC-FQEVSTJZSA-N 1 1 368.433 3.957 20 5 FHBDMO COc1ccc(C[N@H+]2CC3(CCOCC3)[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000411994645 940179816 /nfs/dbraw/zinc/17/98/16/940179816.db2.gz AQDJQSQRKZRSTC-FQEVSTJZSA-N 1 1 368.433 3.957 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccc(-n2cccn2)c(F)c1 ZINC000550288915 945306293 /nfs/dbraw/zinc/30/62/93/945306293.db2.gz YCHRBSHMSPOKRJ-ZDUSSCGKSA-N 1 1 370.384 3.779 20 5 FHBDMO CCOc1cccc(N2CC[C@@H]([N@@H+](C)Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000613045316 940415988 /nfs/dbraw/zinc/41/59/88/940415988.db2.gz SLKXHKVARMNSLX-QGZVFWFLSA-N 1 1 355.438 3.704 20 5 FHBDMO O=[N+]([O-])c1cccc([C@H](NC[C@@H]2CC[N@H+](C3CC3)C2)c2ccccc2)c1 ZINC000180095161 940468275 /nfs/dbraw/zinc/46/82/75/940468275.db2.gz QWLJLZDONMSOLU-HRAATJIYSA-N 1 1 351.450 3.758 20 5 FHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@](CO)(Cc2ccc(F)cc2)C1 ZINC000580798235 940487578 /nfs/dbraw/zinc/48/75/78/940487578.db2.gz YSKDRWWMIIMHJG-FOIQADDNSA-N 1 1 358.413 3.722 20 5 FHBDMO COc1cc(C[N@@H+]2CCCO[C@@H](c3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC000613379025 940650494 /nfs/dbraw/zinc/65/04/94/940650494.db2.gz VHYTWRJQRKGZKX-LJQANCHMSA-N 1 1 360.385 3.706 20 5 FHBDMO COc1cc(C[N@H+]2CCCO[C@@H](c3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC000613379025 940650495 /nfs/dbraw/zinc/65/04/95/940650495.db2.gz VHYTWRJQRKGZKX-LJQANCHMSA-N 1 1 360.385 3.706 20 5 FHBDMO C[C@]12C[N@@H+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)C[C@H]1[C@@H]1CC[C@H]2C1 ZINC000452048429 940953007 /nfs/dbraw/zinc/95/30/07/940953007.db2.gz PZMMPRKBFTVMGK-PGSNGQOISA-N 1 1 354.410 3.513 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCS[C@@H]4COCC[C@@H]43)o2)cc1 ZINC000180454529 941022819 /nfs/dbraw/zinc/02/28/19/941022819.db2.gz ZASZDWAABGYXCU-FUHWJXTLSA-N 1 1 360.435 3.561 20 5 FHBDMO CCCCNC(=O)[C@@H]1CC[C@@H](C)[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000511507693 941033678 /nfs/dbraw/zinc/03/36/78/941033678.db2.gz QXOIJGQPDCJCQZ-OWUNDVQQSA-N 1 1 359.470 3.625 20 5 FHBDMO Cc1cc(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000176579850 941062257 /nfs/dbraw/zinc/06/22/57/941062257.db2.gz NTNPXKOKJFSYJF-VQIMIIECSA-N 1 1 367.449 3.686 20 5 FHBDMO CO[C@@H]1CC[C@@H]2OCC[N@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)[C@@H]2C1 ZINC000180813673 941080552 /nfs/dbraw/zinc/08/05/52/941080552.db2.gz OQDPGHFAPPXYBZ-POAQFYNOSA-N 1 1 372.421 3.623 20 5 FHBDMO CO[C@@H]1CC[C@@H]2OCC[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)[C@@H]2C1 ZINC000180813673 941080554 /nfs/dbraw/zinc/08/05/54/941080554.db2.gz OQDPGHFAPPXYBZ-POAQFYNOSA-N 1 1 372.421 3.623 20 5 FHBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CC1(c2ccccc2)CC1 ZINC000189320403 941156101 /nfs/dbraw/zinc/15/61/01/941156101.db2.gz VYHWOSBCHGJRBL-UHFFFAOYSA-N 1 1 353.422 3.587 20 5 FHBDMO CN(C(=O)c1ccc([N+](=O)[O-])c(Cl)c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311495635 941314852 /nfs/dbraw/zinc/31/48/52/941314852.db2.gz VQJTXPATTIQGEI-MRXNPFEDSA-N 1 1 373.840 3.595 20 5 FHBDMO COc1cc(NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000311543026 941323129 /nfs/dbraw/zinc/32/31/29/941323129.db2.gz UIFXNHFOJVJIGN-KRWDZBQOSA-N 1 1 355.438 3.928 20 5 FHBDMO CCc1ccc(C(=O)N[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1[N+](=O)[O-] ZINC000181480963 941330673 /nfs/dbraw/zinc/33/06/73/941330673.db2.gz GWUZLWIVVRXCMB-YOEHRIQHSA-N 1 1 359.470 3.540 20 5 FHBDMO C[N@H+]1C[C@H]2CCN(Cc3ccc(Oc4ccc(F)cc4)c([N+](=O)[O-])c3)[C@@H]2C1 ZINC000590052835 941385806 /nfs/dbraw/zinc/38/58/06/941385806.db2.gz NMYOLGQRLBQDIB-DNVCBOLYSA-N 1 1 371.412 3.662 20 5 FHBDMO CN(C(=O)c1cccc(Cl)c1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311896325 941416188 /nfs/dbraw/zinc/41/61/88/941416188.db2.gz BMVCHQKPCSVJIL-OAHLLOKOSA-N 1 1 373.840 3.595 20 5 FHBDMO CCC[C@@]1(CO)CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000290264403 941560121 /nfs/dbraw/zinc/56/01/21/941560121.db2.gz XCTHQADPHNTYPS-GOSISDBHSA-N 1 1 361.467 3.703 20 5 FHBDMO CCN(CC)C(=O)[C@@H](c1ccccc1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000549172641 941584139 /nfs/dbraw/zinc/58/41/39/941584139.db2.gz NFTZJDWBOGROOH-HXUWFJFHSA-N 1 1 369.465 3.679 20 5 FHBDMO C[C@@H]1[C@H](NC(=O)c2cccc(Cl)c2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000311929194 941659251 /nfs/dbraw/zinc/65/92/51/941659251.db2.gz FYFDVNYPJJGVNA-CXAGYDPISA-N 1 1 373.840 3.641 20 5 FHBDMO Cc1c(NC(=O)NCC[C@@H](C)[N@@H+](C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000472767653 941721617 /nfs/dbraw/zinc/72/16/17/941721617.db2.gz WFMNVWKMQFDILM-OAHLLOKOSA-N 1 1 370.453 3.935 20 5 FHBDMO CC[C@H](Cc1ccccc1)[N@@H+](CC)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000120679275 941764523 /nfs/dbraw/zinc/76/45/23/941764523.db2.gz LCBITXOUYRDZHO-GOSISDBHSA-N 1 1 355.438 3.537 20 5 FHBDMO C[C@H]1C[C@H](c2ccccc2)[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000513227390 941798898 /nfs/dbraw/zinc/79/88/98/941798898.db2.gz BYBSRTRTCGJIOF-HNAYVOBHSA-N 1 1 353.422 3.641 20 5 FHBDMO COc1ccc(NC(=O)C[N@@H+]2C[C@@H](C)C[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000513277451 941827059 /nfs/dbraw/zinc/82/70/59/941827059.db2.gz YCHKSOCQJOHJCD-KSSFIOAISA-N 1 1 369.421 3.625 20 5 FHBDMO COc1ccc(NC(=O)C[N@H+]2C[C@@H](C)C[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000513277451 941827062 /nfs/dbraw/zinc/82/70/62/941827062.db2.gz YCHKSOCQJOHJCD-KSSFIOAISA-N 1 1 369.421 3.625 20 5 FHBDMO Cc1c(NC(=O)N2CCC[C@H]2Cn2cc[nH+]c2C(C)C)cccc1[N+](=O)[O-] ZINC000377709279 941917716 /nfs/dbraw/zinc/91/77/16/941917716.db2.gz TTZZNFAWOKWFKP-HNNXBMFYSA-N 1 1 371.441 3.920 20 5 FHBDMO COc1ccc(-c2ccc(CN(C)[C@H]3CC[N@H+](C4CC4)C3)o2)c([N+](=O)[O-])c1 ZINC000513441781 941928047 /nfs/dbraw/zinc/92/80/47/941928047.db2.gz AYUDLBLDQRXHBX-HNNXBMFYSA-N 1 1 371.437 3.532 20 5 FHBDMO COc1ccc(-c2ccc(C[N@H+](C)[C@H]3CCN(C4CC4)C3)o2)c([N+](=O)[O-])c1 ZINC000513441781 941928049 /nfs/dbraw/zinc/92/80/49/941928049.db2.gz AYUDLBLDQRXHBX-HNNXBMFYSA-N 1 1 371.437 3.532 20 5 FHBDMO COc1ccc(-c2ccc(C[N@@H+](C)[C@H]3CCN(C4CC4)C3)o2)c([N+](=O)[O-])c1 ZINC000513441781 941928053 /nfs/dbraw/zinc/92/80/53/941928053.db2.gz AYUDLBLDQRXHBX-HNNXBMFYSA-N 1 1 371.437 3.532 20 5 FHBDMO CC[N@H+](CC(=O)Nc1ccccc1OC)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000182606147 941947105 /nfs/dbraw/zinc/94/71/05/941947105.db2.gz DGFGGPYGMWJYCC-OAHLLOKOSA-N 1 1 371.437 3.933 20 5 FHBDMO CC[N@@H+](CC(=O)Nc1ccccc1OC)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000182606147 941947108 /nfs/dbraw/zinc/94/71/08/941947108.db2.gz DGFGGPYGMWJYCC-OAHLLOKOSA-N 1 1 371.437 3.933 20 5 FHBDMO COc1cc(C[N@H+]2CC[C@H](c3cccc(F)c3)C2)c([N+](=O)[O-])cc1OC ZINC000513472450 941951534 /nfs/dbraw/zinc/95/15/34/941951534.db2.gz FMSBPYDSPWHRTK-AWEZNQCLSA-N 1 1 360.385 3.741 20 5 FHBDMO C[C@@H]1CCC[N@H+]1C1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2Cl)CC1 ZINC000377870965 942044118 /nfs/dbraw/zinc/04/41/18/942044118.db2.gz XIAIKEUZPCGMDH-GFCCVEGCSA-N 1 1 366.849 3.729 20 5 FHBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)c2cc(SC)ccc2[N+](=O)[O-])c1 ZINC000501952866 942130870 /nfs/dbraw/zinc/13/08/70/942130870.db2.gz AODJDGIIHOHWEQ-UHFFFAOYSA-N 1 1 373.478 3.698 20 5 FHBDMO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000137028543 942246802 /nfs/dbraw/zinc/24/68/02/942246802.db2.gz NOMOTRFPWPOBSN-ZDUSSCGKSA-N 1 1 367.877 3.879 20 5 FHBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCCN(C(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC000366759341 942328111 /nfs/dbraw/zinc/32/81/11/942328111.db2.gz SMVIAHYJBJQMJX-SFHVURJKSA-N 1 1 367.449 3.722 20 5 FHBDMO C[N@H+]1CCC[C@@H](CNc2ncc([N+](=O)[O-])cc2F)[C@@H]1c1cccs1 ZINC000413157589 942353241 /nfs/dbraw/zinc/35/32/41/942353241.db2.gz IAIATGJJXBPDMH-XHDPSFHLSA-N 1 1 350.419 3.685 20 5 FHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](c3ncc[nH]3)C2)c(C(F)(F)F)c1 ZINC000378248612 942455526 /nfs/dbraw/zinc/45/55/26/942455526.db2.gz NNYLFOURLXIGMY-LBPRGKRZSA-N 1 1 354.332 3.716 20 5 FHBDMO C[C@@H]1C[C@@H](CO)C[N@@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000421361026 942514027 /nfs/dbraw/zinc/51/40/27/942514027.db2.gz KCDPSHXHKFNLCI-GDBMZVCRSA-N 1 1 374.412 3.977 20 5 FHBDMO C[C@@H]1C[C@H](CO)C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000421362925 942515972 /nfs/dbraw/zinc/51/59/72/942515972.db2.gz OJDUGCIMDHAVNZ-OLZOCXBDSA-N 1 1 364.829 3.959 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CCC[C@@H](CCO)CC3)cs2)c1 ZINC000421398214 942549505 /nfs/dbraw/zinc/54/95/05/942549505.db2.gz NTSBPJCADJDPMV-CQSZACIVSA-N 1 1 361.467 3.703 20 5 FHBDMO CN(C)C(C)(C)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000237079821 942554869 /nfs/dbraw/zinc/55/48/69/942554869.db2.gz MSJHLLKIWNRGDO-UHFFFAOYSA-N 1 1 351.834 3.938 20 5 FHBDMO COc1cccc([C@@H]2[C@H](Nc3ncc([N+](=O)[O-])cc3F)CC[N@H+]2C2CC2)c1 ZINC000413246424 942560826 /nfs/dbraw/zinc/56/08/26/942560826.db2.gz ZNDRTHQCHVRMNN-QZTJIDSGSA-N 1 1 372.400 3.527 20 5 FHBDMO O=[N+]([O-])c1ccc(N2CC[C@H](n3c[nH+]c4c3CCCC4)C2)c2cccnc21 ZINC000413253685 942567957 /nfs/dbraw/zinc/56/79/57/942567957.db2.gz WAPKFJCBBSFPAR-AWEZNQCLSA-N 1 1 363.421 3.670 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1nc2c(s1)C[N@H+](C(C)(C)C)CC2 ZINC000425073581 942625293 /nfs/dbraw/zinc/62/52/93/942625293.db2.gz AXNGRQKCIVZCSG-UHFFFAOYSA-N 1 1 374.466 3.769 20 5 FHBDMO CC(C)[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)Cc1cccc(F)c1 ZINC000514090276 942741450 /nfs/dbraw/zinc/74/14/50/942741450.db2.gz UOWFVFCEJJJZKV-UHFFFAOYSA-N 1 1 371.412 3.534 20 5 FHBDMO CC(C)[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)Cc1cccc(F)c1 ZINC000514090276 942741452 /nfs/dbraw/zinc/74/14/52/942741452.db2.gz UOWFVFCEJJJZKV-UHFFFAOYSA-N 1 1 371.412 3.534 20 5 FHBDMO Cc1ccccc1C[C@@H]1CCC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000514188266 942815397 /nfs/dbraw/zinc/81/53/97/942815397.db2.gz CIOTURJYIMJPIV-KRWDZBQOSA-N 1 1 353.422 3.549 20 5 FHBDMO Cc1cccc(C(=O)N2CCC[N@@H+]([C@@H](C)c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000434640019 942830820 /nfs/dbraw/zinc/83/08/20/942830820.db2.gz XRDPYGMFWMLNAZ-KRWDZBQOSA-N 1 1 367.449 3.812 20 5 FHBDMO Cc1cccc(C(=O)N2CCC[N@H+]([C@@H](C)c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000434640019 942830822 /nfs/dbraw/zinc/83/08/22/942830822.db2.gz XRDPYGMFWMLNAZ-KRWDZBQOSA-N 1 1 367.449 3.812 20 5 FHBDMO COc1ccc(NC(=O)C[N@H+]2CCC[C@H]2C2CCCCC2)c([N+](=O)[O-])c1 ZINC000514234847 942845849 /nfs/dbraw/zinc/84/58/49/942845849.db2.gz SZSPHYXJBYYSOJ-KRWDZBQOSA-N 1 1 361.442 3.587 20 5 FHBDMO C[N@@H+]1CC[C@]2(CCN(Cc3ccc(-c4ccc([N+](=O)[O-])cc4)s3)C2)C1 ZINC000430116359 942928456 /nfs/dbraw/zinc/92/84/56/942928456.db2.gz HIXUJUXKOIYELJ-IBGZPJMESA-N 1 1 357.479 3.851 20 5 FHBDMO C[N@H+]1CC[C@]2(CCN(Cc3ccc(-c4ccc([N+](=O)[O-])cc4)s3)C2)C1 ZINC000430116359 942928463 /nfs/dbraw/zinc/92/84/63/942928463.db2.gz HIXUJUXKOIYELJ-IBGZPJMESA-N 1 1 357.479 3.851 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000503405638 943165743 /nfs/dbraw/zinc/16/57/43/943165743.db2.gz KCICCFXNCYESOC-INIZCTEOSA-N 1 1 370.453 3.516 20 5 FHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cnc(CC(F)(F)F)s1 ZINC000894273701 943201089 /nfs/dbraw/zinc/20/10/89/943201089.db2.gz SSSPIIHTBDZTDS-UHFFFAOYSA-N 1 1 359.373 3.831 20 5 FHBDMO O=[N+]([O-])c1cccc(CN(Cc2ccsc2)[C@H]2CC23CC[NH2+]CC3)c1 ZINC000435430935 943409436 /nfs/dbraw/zinc/40/94/36/943409436.db2.gz GCKXMOSLBWRJSY-SFHVURJKSA-N 1 1 357.479 3.801 20 5 FHBDMO CCc1ccc([C@@H](NCCC[C@H]2CCC[NH2+]2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423490366 943535117 /nfs/dbraw/zinc/53/51/17/943535117.db2.gz XOAXGCOROPBCFH-UZLBHIALSA-N 1 1 357.454 3.961 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@@H](C)c1ccccc1Cl ZINC000008173436 943652417 /nfs/dbraw/zinc/65/24/17/943652417.db2.gz KACZBIJQIWSRKJ-NSHDSACASA-N 1 1 363.801 3.546 20 5 FHBDMO CCOc1ccc([C@H](C)N[C@@H](Cc2ccccc2)C[NH+](C)C)cc1[N+](=O)[O-] ZINC000504899063 943877057 /nfs/dbraw/zinc/87/70/57/943877057.db2.gz AEKGFAIVYCDIEL-LPHOPBHVSA-N 1 1 371.481 3.817 20 5 FHBDMO CCCN1CCC([NH2+][C@H](CC)CSc2ccccc2[N+](=O)[O-])CC1 ZINC000504900200 943877248 /nfs/dbraw/zinc/87/72/48/943877248.db2.gz SZKPHPJHPYTVAO-OAHLLOKOSA-N 1 1 351.516 3.930 20 5 FHBDMO CCOc1ccc([C@H](C)[NH2+]Cc2cc(OC)ccc2OC)cc1[N+](=O)[O-] ZINC000504928773 943925605 /nfs/dbraw/zinc/92/56/05/943925605.db2.gz DJSUINBRFWNADZ-ZDUSSCGKSA-N 1 1 360.410 3.862 20 5 FHBDMO COC[C@@H]([NH2+]Cc1ccc(Br)cc1[N+](=O)[O-])c1ccccc1 ZINC000425438107 943938489 /nfs/dbraw/zinc/93/84/89/943938489.db2.gz ANRDUVHRVGZOSU-OAHLLOKOSA-N 1 1 365.227 3.835 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+](CCO)CC3CC3)o2)c(Cl)c1 ZINC000092505790 943971807 /nfs/dbraw/zinc/97/18/07/943971807.db2.gz NMMGWMLLZMOXFR-UHFFFAOYSA-N 1 1 350.802 3.713 20 5 FHBDMO C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000312614932 943979867 /nfs/dbraw/zinc/97/98/67/943979867.db2.gz ZYYRLKLZOPDTNP-GOEBONIOSA-N 1 1 370.409 3.826 20 5 FHBDMO CCOC1CC2(C1)CC[N@H+](Cc1ccc(Br)cc1[N+](=O)[O-])C2 ZINC000425457478 943983950 /nfs/dbraw/zinc/98/39/50/943983950.db2.gz KSQFKRKHVCSNFN-UHFFFAOYSA-N 1 1 369.259 3.748 20 5 FHBDMO CCOC1CC2(C1)CC[N@@H+](Cc1ccc(Br)cc1[N+](=O)[O-])C2 ZINC000425457478 943983954 /nfs/dbraw/zinc/98/39/54/943983954.db2.gz KSQFKRKHVCSNFN-UHFFFAOYSA-N 1 1 369.259 3.748 20 5 FHBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1CCC[C@H]1C1CCOCC1 ZINC000425457045 944014637 /nfs/dbraw/zinc/01/46/37/944014637.db2.gz KOJAISOGTFLNIZ-HNNXBMFYSA-N 1 1 369.259 3.748 20 5 FHBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1CCC[C@@H]1C1CCOCC1 ZINC000425457046 944014815 /nfs/dbraw/zinc/01/48/15/944014815.db2.gz KOJAISOGTFLNIZ-OAHLLOKOSA-N 1 1 369.259 3.748 20 5 FHBDMO COc1ccc(C[N@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(F)F)cc1 ZINC000505757885 944026483 /nfs/dbraw/zinc/02/64/83/944026483.db2.gz VMNFJXXNSODNDH-UHFFFAOYSA-N 1 1 352.337 3.837 20 5 FHBDMO COc1ccc(C[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(F)F)cc1 ZINC000505757885 944026491 /nfs/dbraw/zinc/02/64/91/944026491.db2.gz VMNFJXXNSODNDH-UHFFFAOYSA-N 1 1 352.337 3.837 20 5 FHBDMO C[C@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](c2ccco2)C1 ZINC000500069612 944053121 /nfs/dbraw/zinc/05/31/21/944053121.db2.gz ISDZTBXJDGBVPP-WMLDXEAASA-N 1 1 357.410 3.990 20 5 FHBDMO C[C@@]1(c2ccccc2)CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000500142785 944156260 /nfs/dbraw/zinc/15/62/60/944156260.db2.gz WQFACZLDJIPJQM-OAQYLSRUSA-N 1 1 367.449 3.977 20 5 FHBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2c3c(ccc2[N+](=O)[O-])NCC3)C1 ZINC000436316762 944194614 /nfs/dbraw/zinc/19/46/14/944194614.db2.gz KFUOOFLZZGCGHT-GDBMZVCRSA-N 1 1 352.438 3.810 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1CCCNc1nc(C2CC2)nc(Cl)c1[N+](=O)[O-] ZINC001167752433 944363825 /nfs/dbraw/zinc/36/38/25/944363825.db2.gz VSQXUTSFZFNFII-LLVKDONJSA-N 1 1 353.854 3.592 20 5 FHBDMO CC[N@@H+](CCn1ccc([N+](=O)[O-])n1)C(c1ccccc1)c1ccccc1 ZINC000518459837 944400526 /nfs/dbraw/zinc/40/05/26/944400526.db2.gz RIYBOGAOWSNEFY-UHFFFAOYSA-N 1 1 350.422 3.903 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCC[C@@H]3[C@H](O)C(F)(F)F)o2)c1 ZINC000123719877 944413890 /nfs/dbraw/zinc/41/38/90/944413890.db2.gz NAPJIGXQRHYSSW-ZBFHGGJFSA-N 1 1 370.327 3.742 20 5 FHBDMO CCn1c(=O)c2cc3ccccc3cc2nc1SC[C@H]1CC[N@@H+](C)C1 ZINC000473781084 944444035 /nfs/dbraw/zinc/44/40/35/944444035.db2.gz MEMVIUFBWKBQGX-AWEZNQCLSA-N 1 1 353.491 3.613 20 5 FHBDMO COc1cc(C[NH2+][C@@H](c2ccccc2)C(C)(C)CO)c([N+](=O)[O-])cc1F ZINC000566648396 944465672 /nfs/dbraw/zinc/46/56/72/944465672.db2.gz SGGBZNCDQGTSMJ-SFHVURJKSA-N 1 1 362.401 3.592 20 5 FHBDMO CC(C)c1[nH+]ccn1Cc1cccc(NC(=O)c2cc([N+](=O)[O-])cn2C)c1 ZINC000516112492 944498179 /nfs/dbraw/zinc/49/81/79/944498179.db2.gz PEDNKEZOYINHJA-UHFFFAOYSA-N 1 1 367.409 3.554 20 5 FHBDMO Cc1ccc(C)n1C1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000518556661 944499337 /nfs/dbraw/zinc/49/93/37/944499337.db2.gz KREAPGJFYNDGIO-UHFFFAOYSA-N 1 1 353.426 3.727 20 5 FHBDMO CC(C)c1ccc(C(=O)NCCCC[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000439417426 944590788 /nfs/dbraw/zinc/59/07/88/944590788.db2.gz BSUVZDDKSYLPRR-INIZCTEOSA-N 1 1 361.486 3.960 20 5 FHBDMO Cc1nc(C[NH+]2CCC(CNc3c(C)cccc3[N+](=O)[O-])CC2)oc1C ZINC000110603465 944651247 /nfs/dbraw/zinc/65/12/47/944651247.db2.gz JPIXGVRSCFFJMK-UHFFFAOYSA-N 1 1 358.442 3.832 20 5 FHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@](C)(c2ccccc2)C1 ZINC000438505736 944681309 /nfs/dbraw/zinc/68/13/09/944681309.db2.gz OBMQKUJMSDZWIU-FOIQADDNSA-N 1 1 353.422 3.585 20 5 FHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@](C)(c2ccccc2)C1 ZINC000438505736 944681311 /nfs/dbraw/zinc/68/13/11/944681311.db2.gz OBMQKUJMSDZWIU-FOIQADDNSA-N 1 1 353.422 3.585 20 5 FHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+][C@H]2C[C@H](CO)c3ccccc32)c1 ZINC000364431099 944693147 /nfs/dbraw/zinc/69/31/47/944693147.db2.gz DJSKUDMKVDQKSE-WBMJQRKESA-N 1 1 364.348 3.507 20 5 FHBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000426761547 944784924 /nfs/dbraw/zinc/78/49/24/944784924.db2.gz BLFDOKYUGNUIKX-GFCCVEGCSA-N 1 1 373.906 3.577 20 5 FHBDMO CC[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1 ZINC000517980726 944904387 /nfs/dbraw/zinc/90/43/87/944904387.db2.gz VVJIWNZOPIBRDO-UHFFFAOYSA-N 1 1 371.462 3.524 20 5 FHBDMO Cc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2C[C@H](O)COc2ccccc2[N+](=O)[O-])o1 ZINC000543206897 944991755 /nfs/dbraw/zinc/99/17/55/944991755.db2.gz DXHIAHFLPXYDTR-ZVZYQTTQSA-N 1 1 374.437 3.709 20 5 FHBDMO COCC[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@@H]1CCOC1 ZINC000426505412 945008865 /nfs/dbraw/zinc/00/88/65/945008865.db2.gz WOXLMLONXCWVTG-MRXNPFEDSA-N 1 1 362.451 3.561 20 5 FHBDMO CCC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)C[C@@H]1CCCCO1 ZINC000106867039 945419417 /nfs/dbraw/zinc/41/94/17/945419417.db2.gz GBURVVLTBVMLAO-KRWDZBQOSA-N 1 1 363.458 3.513 20 5 FHBDMO COc1cccc([C@H](C)[NH+]2CCN(Cc3cccc([N+](=O)[O-])c3C)CC2)c1 ZINC000507687481 945436406 /nfs/dbraw/zinc/43/64/06/945436406.db2.gz HPXFZMTUXSKRPZ-KRWDZBQOSA-N 1 1 369.465 3.791 20 5 FHBDMO CCN(CC)C(=O)C1([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CCCCC1 ZINC000543858875 945549516 /nfs/dbraw/zinc/54/95/16/945549516.db2.gz BWBZGSZREBPHMF-UHFFFAOYSA-N 1 1 367.877 3.909 20 5 FHBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H](C)Cc1ccsc1 ZINC000187777085 945593502 /nfs/dbraw/zinc/59/35/02/945593502.db2.gz WIASZODANVEKFJ-CYBMUJFWSA-N 1 1 362.451 3.976 20 5 FHBDMO CC(=O)NCC[N@@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)Cc1ccsc1 ZINC000519655372 945604658 /nfs/dbraw/zinc/60/46/58/945604658.db2.gz VHFJQXJFZBEPHS-GDNBJRDFSA-N 1 1 373.478 3.698 20 5 FHBDMO CN(C)c1cccnc1C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000519791446 945744973 /nfs/dbraw/zinc/74/49/73/945744973.db2.gz MTSLURRSTVIKQX-UHFFFAOYSA-N 1 1 352.394 3.606 20 5 FHBDMO C[C@@H](CO)[N@@H+](C)Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000519794111 945748091 /nfs/dbraw/zinc/74/80/91/945748091.db2.gz VMQQTVHUKIEQBB-LBPRGKRZSA-N 1 1 350.802 3.853 20 5 FHBDMO COc1ccc(Cl)cc1C[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000108064519 945849331 /nfs/dbraw/zinc/84/93/31/945849331.db2.gz IJGXSHAXPNPQHQ-UHFFFAOYSA-N 1 1 350.802 3.768 20 5 FHBDMO O=C(N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000522878097 946052273 /nfs/dbraw/zinc/05/22/73/946052273.db2.gz RTWWSWUEODYKKI-QGZVFWFLSA-N 1 1 373.840 3.643 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CC[N@@H+](C)[C@H]1c1ccc(Cl)cc1 ZINC000248741949 946096147 /nfs/dbraw/zinc/09/61/47/946096147.db2.gz DNFHHLMQYQQKHP-YJBOKZPZSA-N 1 1 373.840 3.732 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CC[N@H+](C)[C@H]1c1ccc(Cl)cc1 ZINC000248741949 946096152 /nfs/dbraw/zinc/09/61/52/946096152.db2.gz DNFHHLMQYQQKHP-YJBOKZPZSA-N 1 1 373.840 3.732 20 5 FHBDMO C/C(=C\C(=O)NCCCC[N@@H+]1CCCC[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000785285260 946276391 /nfs/dbraw/zinc/27/63/91/946276391.db2.gz XKKLMSMGMBYLLQ-IWLLYFRBSA-N 1 1 359.470 3.769 20 5 FHBDMO COc1ccc(-c2ccc(CNC[C@H]3CC[N@H+](C(C)C)C3)o2)c([N+](=O)[O-])c1 ZINC000549551691 946322555 /nfs/dbraw/zinc/32/25/55/946322555.db2.gz XCMKSRSKIPEPTE-OAHLLOKOSA-N 1 1 373.453 3.683 20 5 FHBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000109530526 946323865 /nfs/dbraw/zinc/32/38/65/946323865.db2.gz SYVXTXUJWMEZFO-UHFFFAOYSA-N 1 1 356.426 3.677 20 5 FHBDMO CC[C@@H](Cc1ccc(C)cc1)[N@@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000441373791 946525036 /nfs/dbraw/zinc/52/50/36/946525036.db2.gz FKQDDZMRJSKOEA-AZUAARDMSA-N 1 1 372.465 3.596 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(C[N@@H+]2CCC[C@H]2CO)cc1 ZINC000511896000 946627557 /nfs/dbraw/zinc/62/75/57/946627557.db2.gz ZMSGBCNAXDLVCF-HNNXBMFYSA-N 1 1 362.813 3.997 20 5 FHBDMO O=C(NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)Nc1cccc([N+](=O)[O-])c1 ZINC000067529353 946674432 /nfs/dbraw/zinc/67/44/32/946674432.db2.gz UNQWHZOSLLPLAC-KRWDZBQOSA-N 1 1 368.437 3.629 20 5 FHBDMO COc1cccc([C@@H](CNCc2ccc([N+](=O)[O-])cc2Cl)[NH+](C)C)c1 ZINC000237311065 946721101 /nfs/dbraw/zinc/72/11/01/946721101.db2.gz WIUFGYXZPVHADF-GOSISDBHSA-N 1 1 363.845 3.649 20 5 FHBDMO CCc1ccc([C@H]([NH2+][C@@H](C)CC[S@@](C)=O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544380945 946770851 /nfs/dbraw/zinc/77/08/51/946770851.db2.gz VLKCSGKFLQBVIO-QDOYXITCSA-N 1 1 364.467 3.586 20 5 FHBDMO Cc1c(C[NH+]2CC(c3nc(-c4ccccc4)no3)C2)cccc1[N+](=O)[O-] ZINC000897319797 946821484 /nfs/dbraw/zinc/82/14/84/946821484.db2.gz ZYJYEKVPFTWYCE-UHFFFAOYSA-N 1 1 350.378 3.553 20 5 FHBDMO Cc1cc(N2CC[C@]3(C2)CCC[N@H+](C)C3)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549576867 946826988 /nfs/dbraw/zinc/82/69/88/946826988.db2.gz FLWKFCCSRTXPCR-MRXNPFEDSA-N 1 1 357.376 3.844 20 5 FHBDMO COc1ccc([N+](=O)[O-])c(N2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)c1 ZINC000549578147 946838558 /nfs/dbraw/zinc/83/85/58/946838558.db2.gz SEPIDSSFMZWHMJ-OAQYLSRUSA-N 1 1 367.449 3.706 20 5 FHBDMO COC(=O)[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@@H]1C ZINC000475361238 946952595 /nfs/dbraw/zinc/95/25/95/946952595.db2.gz FSHXZAHSXCTMIA-GUYCJALGSA-N 1 1 374.462 3.954 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCC[C@@]1(CO)Cc1ccccc1 ZINC000475376099 946986519 /nfs/dbraw/zinc/98/65/19/946986519.db2.gz RLZNLEHCLVWMFD-VNAOOCAESA-N 1 1 352.434 3.678 20 5 FHBDMO CC[C@@H]1CCCC[C@@H]1[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000444667133 947094709 /nfs/dbraw/zinc/09/47/09/947094709.db2.gz AVMJRXBPSITRKX-PBHICJAKSA-N 1 1 363.458 3.833 20 5 FHBDMO CC[N@@H+](CCCn1c2cc([N+](=O)[O-])ccc2oc1=O)[C@@H]1CCCC[C@H]1C ZINC000444675377 947100212 /nfs/dbraw/zinc/10/02/12/947100212.db2.gz LXEPIGKOAFYVTH-GDBMZVCRSA-N 1 1 361.442 3.793 20 5 FHBDMO Cc1ccc(C2CC[NH+](Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)cn1 ZINC000444684887 947109854 /nfs/dbraw/zinc/10/98/54/947109854.db2.gz MBTNLIMLOSFYTP-UHFFFAOYSA-N 1 1 351.410 3.554 20 5 FHBDMO Cc1cc(C)cc(C[N@@H+](C)CCC(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000444712637 947142701 /nfs/dbraw/zinc/14/27/01/947142701.db2.gz ZYNHQAISCUFSIG-UHFFFAOYSA-N 1 1 355.438 3.981 20 5 FHBDMO Cc1cc(C[N@@H+](C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)ccc1F ZINC000444744058 947179619 /nfs/dbraw/zinc/17/96/19/947179619.db2.gz NPWQCQLEKMCPLE-CQSZACIVSA-N 1 1 359.401 3.810 20 5 FHBDMO Cc1cc(C[N@H+](C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)ccc1F ZINC000444744058 947179627 /nfs/dbraw/zinc/17/96/27/947179627.db2.gz NPWQCQLEKMCPLE-CQSZACIVSA-N 1 1 359.401 3.810 20 5 FHBDMO Cc1cc(C(=O)N2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)ccc1[N+](=O)[O-] ZINC000072808646 947343165 /nfs/dbraw/zinc/34/31/65/947343165.db2.gz CDHSATUGKLBMRN-DLBZAZTESA-N 1 1 359.470 3.630 20 5 FHBDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000523669496 947478231 /nfs/dbraw/zinc/47/82/31/947478231.db2.gz AYCAHDAGVYIBMF-INIZCTEOSA-N 1 1 359.426 3.725 20 5 FHBDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000523669497 947478430 /nfs/dbraw/zinc/47/84/30/947478430.db2.gz AYCAHDAGVYIBMF-MRXNPFEDSA-N 1 1 359.426 3.725 20 5 FHBDMO Cc1ccccc1[C@@H]1C[N@H+](CCOc2cccc([N+](=O)[O-])c2)[C@@H](C)CO1 ZINC000441447937 947484996 /nfs/dbraw/zinc/48/49/96/947484996.db2.gz FIPLZFSSYGSQPV-JXFKEZNVSA-N 1 1 356.422 3.744 20 5 FHBDMO Cc1ccccc1[C@@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)[C@@H](C)CO1 ZINC000441447937 947485020 /nfs/dbraw/zinc/48/50/20/947485020.db2.gz FIPLZFSSYGSQPV-JXFKEZNVSA-N 1 1 356.422 3.744 20 5 FHBDMO CC[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@@]2(CCOC2)O1 ZINC000475624989 947611869 /nfs/dbraw/zinc/61/18/69/947611869.db2.gz LTADRPBIGRDERJ-FOIQADDNSA-N 1 1 372.421 3.625 20 5 FHBDMO Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NCC(C)(C)[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000843773364 947638211 /nfs/dbraw/zinc/63/82/11/947638211.db2.gz AOYVVDKOXUUKJV-BETUJISGSA-N 1 1 365.449 3.529 20 5 FHBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1(C)C ZINC000536363698 947769683 /nfs/dbraw/zinc/76/96/83/947769683.db2.gz QUUZHSTYCIFTSX-IAGOWNOFSA-N 1 1 359.426 3.885 20 5 FHBDMO Cc1ccccc1[C@@H]1C[N@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@@H](C)CO1 ZINC000441472388 947791819 /nfs/dbraw/zinc/79/18/19/947791819.db2.gz XKPZOYOJJCRRPD-JXFKEZNVSA-N 1 1 356.422 3.744 20 5 FHBDMO Cc1ccccc1[C@@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@@H](C)CO1 ZINC000441472388 947791830 /nfs/dbraw/zinc/79/18/30/947791830.db2.gz XKPZOYOJJCRRPD-JXFKEZNVSA-N 1 1 356.422 3.744 20 5 FHBDMO O=[N+]([O-])c1cccc2c(N3CC[C@@H]4[C@@H](CCC[N@H+]4C4CC4)C3)ccnc21 ZINC000432341330 948165438 /nfs/dbraw/zinc/16/54/38/948165438.db2.gz WGMIKDAXUBKGHF-WMLDXEAASA-N 1 1 352.438 3.596 20 5 FHBDMO COc1ccc(OCC[N@H+]2CC[C@H](c3ccccc3C)C2)c([N+](=O)[O-])c1 ZINC000441535405 948232700 /nfs/dbraw/zinc/23/27/00/948232700.db2.gz PSNUABQHXPTOIW-INIZCTEOSA-N 1 1 356.422 3.780 20 5 FHBDMO Cc1ccc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2C)c(N2CCCC2)[nH+]1 ZINC000163048781 948263550 /nfs/dbraw/zinc/26/35/50/948263550.db2.gz LRKPKJLHKNZPCE-UHFFFAOYSA-N 1 1 369.425 3.529 20 5 FHBDMO CN(c1ccccc1)c1ccc(C[N@@H+](CCO)CC2CC2)cc1[N+](=O)[O-] ZINC000512053549 948313607 /nfs/dbraw/zinc/31/36/07/948313607.db2.gz RLIUBOWFSLHXPE-UHFFFAOYSA-N 1 1 355.438 3.567 20 5 FHBDMO Cc1ccc2c(C[N@@H+](C)CCc3cccc([N+](=O)[O-])c3)ccc(O)c2n1 ZINC000574859263 948634894 /nfs/dbraw/zinc/63/48/94/948634894.db2.gz QHUBJASCAAXMIB-UHFFFAOYSA-N 1 1 351.406 3.832 20 5 FHBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C1 ZINC000090113404 948665282 /nfs/dbraw/zinc/66/52/82/948665282.db2.gz OONNBOUMTAGEIP-IAGOWNOFSA-N 1 1 352.438 3.577 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H](C)[N@@H+]1CCc2sccc2C1 ZINC000043148874 567827787 /nfs/dbraw/zinc/82/77/87/567827787.db2.gz NFJJMSKBUBLQQD-ZDUSSCGKSA-N 1 1 374.466 3.533 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H](C)[N@H+]1CCc2sccc2C1 ZINC000043148874 567827789 /nfs/dbraw/zinc/82/77/89/567827789.db2.gz NFJJMSKBUBLQQD-ZDUSSCGKSA-N 1 1 374.466 3.533 20 5 FHBDMO COc1cc(C[N@H+]2C[C@H](C)CC[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000490341112 568032435 /nfs/dbraw/zinc/03/24/35/568032435.db2.gz PCKVXQAMYRZHMU-NEPJUHHUSA-N 1 1 358.385 3.868 20 5 FHBDMO COc1cc(C[N@H+]2C[C@@H](C)CC[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000490341114 568033642 /nfs/dbraw/zinc/03/36/42/568033642.db2.gz PCKVXQAMYRZHMU-RYUDHWBXSA-N 1 1 358.385 3.868 20 5 FHBDMO CCSCC[C@H](C)[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000072901611 568056893 /nfs/dbraw/zinc/05/68/93/568056893.db2.gz OAMGYWZMMPZEII-LBPRGKRZSA-N 1 1 350.444 3.608 20 5 FHBDMO CC1=C(c2ccco2)C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000569869993 568432118 /nfs/dbraw/zinc/43/21/18/568432118.db2.gz LOHUJJYXJRNMNC-UHFFFAOYSA-N 1 1 355.394 3.696 20 5 FHBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3cscc3C(F)(F)F)nc2c1 ZINC000570092583 568458507 /nfs/dbraw/zinc/45/85/07/568458507.db2.gz AXIFUFVLHBYMHH-UHFFFAOYSA-N 1 1 356.329 3.841 20 5 FHBDMO Cc1c(C)c(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)ncc1[N+](=O)[O-] ZINC001164621038 719082761 /nfs/dbraw/zinc/08/27/61/719082761.db2.gz GLTZIUXGEJYSQZ-ICSRJNTNSA-N 1 1 366.465 3.707 20 5 FHBDMO Cc1ccnc(N2CCC[C@]3(CC[N@H+]3Cc3cccc(F)c3)C2)c1[N+](=O)[O-] ZINC001164993894 722195924 /nfs/dbraw/zinc/19/59/24/722195924.db2.gz IWCUIQWYSQVWQH-FQEVSTJZSA-N 1 1 370.428 3.682 20 5 FHBDMO Cc1cc(F)cc(C(=O)NCc2ccccc2C[N@H+](C)C(C)C)c1[N+](=O)[O-] ZINC000176753575 936342216 /nfs/dbraw/zinc/34/22/16/936342216.db2.gz XLQLFBGBELPNCS-UHFFFAOYSA-N 1 1 373.428 3.813 20 5 FHBDMO CC(=O)NCC[C@H]1CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000582992559 936349255 /nfs/dbraw/zinc/34/92/55/936349255.db2.gz GSANUKFMCFIHPQ-MRXNPFEDSA-N 1 1 371.437 3.593 20 5 FHBDMO CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1csc([N+](=O)[O-])c1 ZINC000175284331 927460622 /nfs/dbraw/zinc/46/06/22/927460622.db2.gz WVFCXWJCBDRNEA-INIZCTEOSA-N 1 1 373.478 3.641 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1CN1CC[NH+]([C@H](C)c2ccsc2)CC1 ZINC000430193547 927781122 /nfs/dbraw/zinc/78/11/22/927781122.db2.gz GPNAZDDJGPFVRX-CQSZACIVSA-N 1 1 361.467 3.544 20 5 FHBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@H+](C)[C@H]2CCCOC2)cc1OC ZINC000510077272 927791498 /nfs/dbraw/zinc/79/14/98/927791498.db2.gz BORDWRQBNTWHSO-ZBFHGGJFSA-N 1 1 366.458 3.639 20 5 FHBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+](C)[C@H]2CCCOC2)cc1OC ZINC000510077272 927791504 /nfs/dbraw/zinc/79/15/04/927791504.db2.gz BORDWRQBNTWHSO-ZBFHGGJFSA-N 1 1 366.458 3.639 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@](O)(C(F)(F)F)CC2)ccc1Cl ZINC000285605724 927875274 /nfs/dbraw/zinc/87/52/74/927875274.db2.gz PVMDYLKPKXVMDP-CYBMUJFWSA-N 1 1 352.740 3.528 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@](O)(C(F)(F)F)CC2)ccc1Cl ZINC000285605724 927875290 /nfs/dbraw/zinc/87/52/90/927875290.db2.gz PVMDYLKPKXVMDP-CYBMUJFWSA-N 1 1 352.740 3.528 20 5 FHBDMO COC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1)c1cccc(Cl)c1 ZINC000583170023 937201626 /nfs/dbraw/zinc/20/16/26/937201626.db2.gz IGNLORPVHYTDGS-OAHLLOKOSA-N 1 1 350.802 3.734 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(Oc2ccc(C)cc2)CC1 ZINC000430206503 928025901 /nfs/dbraw/zinc/02/59/01/928025901.db2.gz WIWWGMARSKRTFG-UHFFFAOYSA-N 1 1 356.422 3.955 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(Nc2cccc(C)c2)CC1 ZINC000430206532 928026302 /nfs/dbraw/zinc/02/63/02/928026302.db2.gz WLMMUCZOJXBGKU-UHFFFAOYSA-N 1 1 355.438 3.988 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]1c1cccc2c1OCCO2 ZINC000430212811 928169460 /nfs/dbraw/zinc/16/94/60/928169460.db2.gz QAOVLVMIBAFLGV-QGZVFWFLSA-N 1 1 370.405 3.712 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1c1cccc2c1OCCO2 ZINC000430212811 928169486 /nfs/dbraw/zinc/16/94/86/928169486.db2.gz QAOVLVMIBAFLGV-QGZVFWFLSA-N 1 1 370.405 3.712 20 5 FHBDMO Cc1ccc([C@H]2CCCC[N@H+]2C[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC000610215322 928171638 /nfs/dbraw/zinc/17/16/38/928171638.db2.gz ZJWGXJGTPVTHGY-PZJWPPBQSA-N 1 1 370.449 3.870 20 5 FHBDMO CCOc1ccc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2OC)cc1OC ZINC000430215428 928188800 /nfs/dbraw/zinc/18/88/00/928188800.db2.gz GZGXUBCLKGIVAE-ZDUSSCGKSA-N 1 1 360.410 3.862 20 5 FHBDMO COc1ccc([C@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2OC)c(OC)c1 ZINC000430217048 928227857 /nfs/dbraw/zinc/22/78/57/928227857.db2.gz GFOJLZUVBMQLCJ-GOSISDBHSA-N 1 1 372.421 3.958 20 5 FHBDMO COc1ccc([C@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2OC)c(OC)c1 ZINC000430217048 928227870 /nfs/dbraw/zinc/22/78/70/928227870.db2.gz GFOJLZUVBMQLCJ-GOSISDBHSA-N 1 1 372.421 3.958 20 5 FHBDMO C[C@H]1C[C@@H](CCNC(=O)c2ccc([N+](=O)[O-])s2)C[N@H+]1Cc1ccccc1 ZINC000510097869 928232495 /nfs/dbraw/zinc/23/24/95/928232495.db2.gz IQDNTKPJRIILMN-GOEBONIOSA-N 1 1 373.478 3.687 20 5 FHBDMO COc1cc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc(OC)c1OC ZINC000127056118 928456688 /nfs/dbraw/zinc/45/66/88/928456688.db2.gz ROMIFWLKMPAOSB-UHFFFAOYSA-N 1 1 372.421 3.785 20 5 FHBDMO COc1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc(OC)c1OC ZINC000127056118 928456699 /nfs/dbraw/zinc/45/66/99/928456699.db2.gz ROMIFWLKMPAOSB-UHFFFAOYSA-N 1 1 372.421 3.785 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCc2cc(F)c(OC)cc21 ZINC000509426608 928894571 /nfs/dbraw/zinc/89/45/71/928894571.db2.gz SXPBRDAUZHWCQG-QGZVFWFLSA-N 1 1 360.385 3.918 20 5 FHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H](c2ccncn2)C1 ZINC001167100851 929377273 /nfs/dbraw/zinc/37/72/73/929377273.db2.gz OMBLZRWYIDLZTL-HNNXBMFYSA-N 1 1 356.426 3.552 20 5 FHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](c2ccncn2)C1 ZINC001167100851 929377279 /nfs/dbraw/zinc/37/72/79/929377279.db2.gz OMBLZRWYIDLZTL-HNNXBMFYSA-N 1 1 356.426 3.552 20 5 FHBDMO C[C@H](c1ccc(NC(=O)Nc2cccc([N+](=O)[O-])c2)cc1)[NH+]1CCOCC1 ZINC000109846625 929700329 /nfs/dbraw/zinc/70/03/29/929700329.db2.gz QFHAJFOIBSRYCZ-CQSZACIVSA-N 1 1 370.409 3.632 20 5 FHBDMO Cc1ccccc1[C@@H]1CCC[N@@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000165462275 929856037 /nfs/dbraw/zinc/85/60/37/929856037.db2.gz YOGPMWNWASFHEF-KRWDZBQOSA-N 1 1 353.422 3.987 20 5 FHBDMO Cc1ccccc1[C@@H]1CCC[N@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000165462275 929856045 /nfs/dbraw/zinc/85/60/45/929856045.db2.gz YOGPMWNWASFHEF-KRWDZBQOSA-N 1 1 353.422 3.987 20 5 FHBDMO CC(C)[N@@H+](C)CCCNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275742149 930089626 /nfs/dbraw/zinc/08/96/26/930089626.db2.gz XIIKUBABACSNCL-UHFFFAOYSA-N 1 1 351.450 3.554 20 5 FHBDMO Cc1cc(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000536370131 930479871 /nfs/dbraw/zinc/47/98/71/930479871.db2.gz JKKJPKQHTFZVEQ-SJLPKXTDSA-N 1 1 373.840 3.732 20 5 FHBDMO Cc1cc(C(=O)N[C@@H]2CC[N@H+](C)[C@@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000536370131 930479874 /nfs/dbraw/zinc/47/98/74/930479874.db2.gz JKKJPKQHTFZVEQ-SJLPKXTDSA-N 1 1 373.840 3.732 20 5 FHBDMO COc1ccccc1[C@H]1CC[N@@H+](Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000121218765 930698495 /nfs/dbraw/zinc/69/84/95/930698495.db2.gz UVQUEKJFFJMTEV-HNNXBMFYSA-N 1 1 366.421 3.709 20 5 FHBDMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC001167434215 931139847 /nfs/dbraw/zinc/13/98/47/931139847.db2.gz SQXMKFXKBGSAOM-XUJVJEKNSA-N 1 1 351.834 3.840 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCC[C@@H]([C@@H]4CCOC4)C3)cs2)c1 ZINC000537694100 931209540 /nfs/dbraw/zinc/20/95/40/931209540.db2.gz XACVTISYLLOPDS-HZPDHXFCSA-N 1 1 373.478 3.967 20 5 FHBDMO C[C@](CO)([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1cccc(C(F)(F)F)c1 ZINC000610476371 931540805 /nfs/dbraw/zinc/54/08/05/931540805.db2.gz AZOUFKAQAHFOBP-MRXNPFEDSA-N 1 1 372.318 3.750 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1CCC1CCN(C(=O)c2csc([N+](=O)[O-])c2)CC1 ZINC000177964886 931798677 /nfs/dbraw/zinc/79/86/77/931798677.db2.gz AVAZMHRDKWHTDW-CQSZACIVSA-N 1 1 365.499 3.773 20 5 FHBDMO COc1cc(F)c([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])c(F)c2)cc1OC ZINC000276295364 932147579 /nfs/dbraw/zinc/14/75/79/932147579.db2.gz IUJANRZQQXXFQO-JTQLQIEISA-N 1 1 352.337 3.741 20 5 FHBDMO COc1ccc([C@@H]2CCC[N@H+]2CCOc2ccccc2[N+](=O)[O-])cc1OC ZINC000051284035 932893342 /nfs/dbraw/zinc/89/33/42/932893342.db2.gz YMQKVERBOBOEGU-INIZCTEOSA-N 1 1 372.421 3.828 20 5 FHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H](O)c1ccc(F)c(F)c1 ZINC000051287067 932959345 /nfs/dbraw/zinc/95/93/45/932959345.db2.gz XGUNLJCBTMJJQM-MRXNPFEDSA-N 1 1 356.756 3.692 20 5 FHBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H](O)c1ccc(F)c(F)c1 ZINC000051287067 932959347 /nfs/dbraw/zinc/95/93/47/932959347.db2.gz XGUNLJCBTMJJQM-MRXNPFEDSA-N 1 1 356.756 3.692 20 5 FHBDMO Cn1nccc1C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000510624188 933313503 /nfs/dbraw/zinc/31/35/03/933313503.db2.gz GNLDKSUZLVXUMC-YHWZYXNKSA-N 1 1 362.380 3.517 20 5 FHBDMO Cn1nccc1C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000510624188 933313514 /nfs/dbraw/zinc/31/35/14/933313514.db2.gz GNLDKSUZLVXUMC-YHWZYXNKSA-N 1 1 362.380 3.517 20 5 FHBDMO O=[N+]([O-])c1ccc2oc(C[NH2+]C3(c4ccc(F)cc4)CCOCC3)nc2c1 ZINC000610582004 933325335 /nfs/dbraw/zinc/32/53/35/933325335.db2.gz GIUNRXGEUWQIRU-UHFFFAOYSA-N 1 1 371.368 3.671 20 5 FHBDMO COc1cc(C[N@H+]2CC(C)=C[C@H](C)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000430882219 933354538 /nfs/dbraw/zinc/35/45/38/933354538.db2.gz IPSVRRIWLMRQSM-NSHDSACASA-N 1 1 374.359 3.943 20 5 FHBDMO COc1cc(C[N@@H+]2CC(C)=C[C@H](C)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000430882219 933354547 /nfs/dbraw/zinc/35/45/47/933354547.db2.gz IPSVRRIWLMRQSM-NSHDSACASA-N 1 1 374.359 3.943 20 5 FHBDMO O=[N+]([O-])c1cc(F)c(C[NH2+][C@@H]2CCO[C@H]2c2ccc(F)c(F)c2)c(F)c1 ZINC000510793446 933731390 /nfs/dbraw/zinc/73/13/90/933731390.db2.gz AFILTMRZAAMPKZ-SJORKVTESA-N 1 1 370.302 3.771 20 5 FHBDMO CC[C@@H]1CN(C)c2ccccc2C[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610676596 933737904 /nfs/dbraw/zinc/73/79/04/933737904.db2.gz ALHUDZGYYWYNHH-OAHLLOKOSA-N 1 1 366.421 3.967 20 5 FHBDMO CC[C@@H]1CN(C)c2ccccc2C[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610676596 933737908 /nfs/dbraw/zinc/73/79/08/933737908.db2.gz ALHUDZGYYWYNHH-OAHLLOKOSA-N 1 1 366.421 3.967 20 5 FHBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000247527488 934089107 /nfs/dbraw/zinc/08/91/07/934089107.db2.gz XERCSTCSPFFCAU-GJZGRUSLSA-N 1 1 374.510 3.928 20 5 FHBDMO C[N@H+]1CCC[C@@H](NC(=O)c2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)C1 ZINC000610859165 934533526 /nfs/dbraw/zinc/53/35/26/934533526.db2.gz FYDWAPJAKDGBGS-OAHLLOKOSA-N 1 1 371.462 3.570 20 5 FHBDMO Cc1nc(-c2ccccc2)sc1[C@@H](C)[N@@H+](C)CCn1cc([N+](=O)[O-])cn1 ZINC000119454879 934815441 /nfs/dbraw/zinc/81/54/41/934815441.db2.gz OKDITBLLZCSIKI-CQSZACIVSA-N 1 1 371.466 3.916 20 5 FHBDMO Cc1c(CN2C[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@@H]3C2)cccc1[N+](=O)[O-] ZINC000380853489 934939208 /nfs/dbraw/zinc/93/92/08/934939208.db2.gz CXMVGKZTZZCPDC-LEWJYISDSA-N 1 1 365.477 3.857 20 5 FHBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C12CCCCC2 ZINC001167539099 935151346 /nfs/dbraw/zinc/15/13/46/935151346.db2.gz IUHPBQRTNYQEAQ-GUDVDZBRSA-N 1 1 362.470 3.688 20 5 FHBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)C12CCCCC2 ZINC001167539102 935151550 /nfs/dbraw/zinc/15/15/50/935151550.db2.gz IUHPBQRTNYQEAQ-IPMKNSEASA-N 1 1 362.470 3.688 20 5 FHBDMO C[C@H](C(=O)Nc1ccc(Cl)cc1)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511105786 935582461 /nfs/dbraw/zinc/58/24/61/935582461.db2.gz KITCVKUXWHASGC-CYBMUJFWSA-N 1 1 361.829 3.750 20 5 FHBDMO C[C@H](C(=O)Nc1ccc(Cl)cc1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511105786 935582463 /nfs/dbraw/zinc/58/24/63/935582463.db2.gz KITCVKUXWHASGC-CYBMUJFWSA-N 1 1 361.829 3.750 20 5 FHBDMO O=C(c1cc2ccccc2c2cccnc12)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000684845802 935604698 /nfs/dbraw/zinc/60/46/98/935604698.db2.gz UVYSQBASXGBMCP-UXHICEINSA-N 1 1 363.436 3.646 20 5 FHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H](O)Cc1ccc2ccccc2c1 ZINC000511123314 935699192 /nfs/dbraw/zinc/69/91/92/935699192.db2.gz IINIVMLHUWCBAO-NRFANRHFSA-N 1 1 364.445 3.826 20 5 FHBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[S@](=O)C1 ZINC000277599694 935704088 /nfs/dbraw/zinc/70/40/88/935704088.db2.gz VNUNYYQFMIYSFM-OZAJXLCCSA-N 1 1 364.492 3.524 20 5 FHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[S@](=O)C1 ZINC000277599694 935704092 /nfs/dbraw/zinc/70/40/92/935704092.db2.gz VNUNYYQFMIYSFM-OZAJXLCCSA-N 1 1 364.492 3.524 20 5 FHBDMO CC(C)C[N@H+]1Cc2cccc(NC(=O)Cc3ccccc3[N+](=O)[O-])c2C1 ZINC000158317046 935713791 /nfs/dbraw/zinc/71/37/91/935713791.db2.gz GQIUKEDKGJNXKK-UHFFFAOYSA-N 1 1 353.422 3.748 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCCCC[N@@H+]1CCC[C@@H](C)C1 ZINC000127714893 935753731 /nfs/dbraw/zinc/75/37/31/935753731.db2.gz KXNKRVJOFVGOLZ-CQSZACIVSA-N 1 1 362.474 3.845 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H]1Cc1ccccc1 ZINC000479118378 935797454 /nfs/dbraw/zinc/79/74/54/935797454.db2.gz DRYXZFFKORLQGB-QGZVFWFLSA-N 1 1 353.422 3.549 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000479189710 935816459 /nfs/dbraw/zinc/81/64/59/935816459.db2.gz GJNALCJOZXVRAL-MRXNPFEDSA-N 1 1 367.449 3.899 20 5 FHBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@H](O)Cc1ccc3ccccc3c1)C2 ZINC000548751925 935955598 /nfs/dbraw/zinc/95/55/98/935955598.db2.gz HHJUPVKKCZPEOQ-HXUWFJFHSA-N 1 1 362.429 3.710 20 5 FHBDMO Cn1cc[nH+]c1C[C@@H](Nc1ncnc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000611708870 935959378 /nfs/dbraw/zinc/95/93/78/935959378.db2.gz RUACTOUTQIIREM-GOSISDBHSA-N 1 1 374.404 3.667 20 5 FHBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2ncnc3ccc([N+](=O)[O-])cc32)C1 ZINC000611709351 936033522 /nfs/dbraw/zinc/03/35/22/936033522.db2.gz PLNJUMQHRJNUBS-GDBMZVCRSA-N 1 1 363.421 3.785 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000194495713 936078384 /nfs/dbraw/zinc/07/83/84/936078384.db2.gz QLLDPPKEKZZREK-GOSISDBHSA-N 1 1 367.449 3.688 20 5 FHBDMO Cc1[nH+]ccn1CCCCNc1ccc(Br)cc1[N+](=O)[O-] ZINC000078336105 936112028 /nfs/dbraw/zinc/11/20/28/936112028.db2.gz NADNBLPFMANOCI-UHFFFAOYSA-N 1 1 353.220 3.755 20 5 FHBDMO Cc1ccc(C[N@@H+]2CC[C@H](CN(C)Cc3ccccc3[N+](=O)[O-])C2)s1 ZINC000582931546 936302738 /nfs/dbraw/zinc/30/27/38/936302738.db2.gz YIPHLEAVGAHIED-MRXNPFEDSA-N 1 1 359.495 3.919 20 5 FHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[NH+]2CCC(c3c[nH]cn3)CC2)c1 ZINC000583681424 938356559 /nfs/dbraw/zinc/35/65/59/938356559.db2.gz KACXLOZMTLLLIC-UHFFFAOYSA-N 1 1 354.332 3.716 20 5 FHBDMO C[C@H](NC(=O)N[C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000458638185 938359532 /nfs/dbraw/zinc/35/95/32/938359532.db2.gz SVNRFKGNYGMUOA-YQQAZPJKSA-N 1 1 374.485 3.608 20 5 FHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](Cc2ccccc2)[C@@H]1C ZINC000472308466 938491106 /nfs/dbraw/zinc/49/11/06/938491106.db2.gz AABVJPZXPLEQOH-LZLYRXPVSA-N 1 1 367.449 3.875 20 5 FHBDMO COC(=O)C(C)(C)[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000611797100 938518678 /nfs/dbraw/zinc/51/86/78/938518678.db2.gz KBBHKUADEREBEY-ZDUSSCGKSA-N 1 1 354.834 3.659 20 5 FHBDMO COC(=O)C(C)(C)[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000611797100 938518680 /nfs/dbraw/zinc/51/86/80/938518680.db2.gz KBBHKUADEREBEY-ZDUSSCGKSA-N 1 1 354.834 3.659 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000278703102 938670301 /nfs/dbraw/zinc/67/03/01/938670301.db2.gz JSPMZFFHTMREAY-LBPRGKRZSA-N 1 1 359.348 3.506 20 5 FHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC=C(c4ccc(O)cc4)CC3)nc2c1 ZINC000083132616 938815434 /nfs/dbraw/zinc/81/54/34/938815434.db2.gz KKJITAOEQQFJNC-UHFFFAOYSA-N 1 1 351.362 3.731 20 5 FHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC=C(c4ccc(O)cc4)CC3)nc2c1 ZINC000083132616 938815437 /nfs/dbraw/zinc/81/54/37/938815437.db2.gz KKJITAOEQQFJNC-UHFFFAOYSA-N 1 1 351.362 3.731 20 5 FHBDMO CC(=O)c1ccc(NCCc2[nH+]ccn2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000024203461 938844428 /nfs/dbraw/zinc/84/44/28/938844428.db2.gz GNMSOESJUJOUJP-UHFFFAOYSA-N 1 1 364.405 3.697 20 5 FHBDMO C[C@@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000511294231 938991776 /nfs/dbraw/zinc/99/17/76/938991776.db2.gz QNCNZNKKYUVMKH-ZIAGYGMSSA-N 1 1 371.437 3.724 20 5 FHBDMO COc1ccc(-c2ccc(C[NH2+]C3CCN(C4CC4)CC3)o2)c([N+](=O)[O-])c1 ZINC000102420454 939018598 /nfs/dbraw/zinc/01/85/98/939018598.db2.gz QBPZILPOYGARAG-UHFFFAOYSA-N 1 1 371.437 3.580 20 5 FHBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000507464970 945253445 /nfs/dbraw/zinc/25/34/45/945253445.db2.gz DBIDSOFITGYWFV-CYBMUJFWSA-N 1 1 359.426 3.581 20 5 FHBDMO Cc1cccc(C(=O)Nc2ccc([C@@H](C)[NH+]3CCOCC3)cc2)c1[N+](=O)[O-] ZINC000106405425 945271520 /nfs/dbraw/zinc/27/15/20/945271520.db2.gz DMJCJHPMFGVKLG-OAHLLOKOSA-N 1 1 369.421 3.549 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C)c1ccc(-n2cccn2)c(F)c1 ZINC000550286384 945274581 /nfs/dbraw/zinc/27/45/81/945274581.db2.gz KLMSLVGQDQSVGU-ZDUSSCGKSA-N 1 1 370.384 3.779 20 5 FHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@H](Cn3cnc4ccccc43)C2)c1 ZINC000614236026 939902215 /nfs/dbraw/zinc/90/22/15/939902215.db2.gz WTSSTROLHSFMPJ-QGZVFWFLSA-N 1 1 350.422 3.857 20 5 FHBDMO Cc1noc([C@H]2CCC[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C2)n1 ZINC000179714302 939926309 /nfs/dbraw/zinc/92/63/09/939926309.db2.gz OAEQCLGVDWYSSI-HNNXBMFYSA-N 1 1 368.393 3.926 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@]2(C1)C(=O)Nc1ccccc12 ZINC000364436565 939941013 /nfs/dbraw/zinc/94/10/13/939941013.db2.gz YZXZWNYUCKDZCC-VLIAUNLRSA-N 1 1 351.406 3.560 20 5 FHBDMO O=C(Nc1ccccc1)C1CC[NH+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000047541417 945288277 /nfs/dbraw/zinc/28/82/77/945288277.db2.gz NPOHVDCLFJQWGV-UHFFFAOYSA-N 1 1 357.385 3.585 20 5 FHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000411491652 940053805 /nfs/dbraw/zinc/05/38/05/940053805.db2.gz BBBDGCZRIWHGSP-RNEXODBNSA-N 1 1 371.481 3.562 20 5 FHBDMO O=[N+]([O-])c1cnn(CC[N@H+](Cc2ccccc2)Cc2ccccc2F)c1 ZINC000472441510 940147298 /nfs/dbraw/zinc/14/72/98/940147298.db2.gz YMPVUVGAMJYQDH-UHFFFAOYSA-N 1 1 354.385 3.633 20 5 FHBDMO O=[N+]([O-])c1cnn(CC[N@@H+](Cc2ccccc2)Cc2ccccc2F)c1 ZINC000472441510 940147299 /nfs/dbraw/zinc/14/72/99/940147299.db2.gz YMPVUVGAMJYQDH-UHFFFAOYSA-N 1 1 354.385 3.633 20 5 FHBDMO C[C@@H](c1ncc(-c2ccccc2)o1)[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000376036098 940223819 /nfs/dbraw/zinc/22/38/19/940223819.db2.gz WOEODGMPXZRRBN-AWEZNQCLSA-N 1 1 367.409 3.844 20 5 FHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@](CO)(Cc2ccc(F)cc2)C1 ZINC000580798238 940487599 /nfs/dbraw/zinc/48/75/99/940487599.db2.gz YSKDRWWMIIMHJG-YWZLYKJASA-N 1 1 358.413 3.722 20 5 FHBDMO O=C1O[C@@H](C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)CN1c1ccccc1 ZINC000177999518 940503446 /nfs/dbraw/zinc/50/34/46/940503446.db2.gz ARYCQGQHRROFKN-IBGZPJMESA-N 1 1 367.405 3.585 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])c(NC[C@H]2CC[N@@H+](CCc3ccccc3)C2)n1 ZINC000581962868 940635432 /nfs/dbraw/zinc/63/54/32/940635432.db2.gz BQMFMFZLYQEQPP-GOSISDBHSA-N 1 1 354.454 3.583 20 5 FHBDMO COc1c(O)ccc(C[NH2+][C@@H](C)c2ccccc2OC(C)C)c1[N+](=O)[O-] ZINC000892600140 940901723 /nfs/dbraw/zinc/90/17/23/940901723.db2.gz PQFOJFPRSJCUQX-ZDUSSCGKSA-N 1 1 360.410 3.947 20 5 FHBDMO Cn1cccc1[C@@H]1CCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000170906073 940903551 /nfs/dbraw/zinc/90/35/51/940903551.db2.gz WFVGEUWJDLGAGG-SFHVURJKSA-N 1 1 366.421 3.968 20 5 FHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCO[C@H]([C@@H]3CCCO3)C2)s1 ZINC000180562989 941048031 /nfs/dbraw/zinc/04/80/31/941048031.db2.gz UQMZYXBWAZHTMM-ROUUACIJSA-N 1 1 374.462 3.703 20 5 FHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCO[C@H]([C@@H]3CCCO3)C2)s1 ZINC000180562989 941048035 /nfs/dbraw/zinc/04/80/35/941048035.db2.gz UQMZYXBWAZHTMM-ROUUACIJSA-N 1 1 374.462 3.703 20 5 FHBDMO CC(=O)NCC[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000564323456 941096356 /nfs/dbraw/zinc/09/63/56/941096356.db2.gz KBOLMLNXFGHHMF-MRXNPFEDSA-N 1 1 371.437 3.593 20 5 FHBDMO C[N@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C[C@H]1CCCC[C@@H]1O ZINC000181099129 941108749 /nfs/dbraw/zinc/10/87/49/941108749.db2.gz ZNJYXJVWLCGWMK-PBHICJAKSA-N 1 1 361.467 3.701 20 5 FHBDMO C[C@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccc(N2CCOC2=O)cc1 ZINC000181274324 941118558 /nfs/dbraw/zinc/11/85/58/941118558.db2.gz MTTGVOKOSZODGH-LBPRGKRZSA-N 1 1 359.357 3.541 20 5 FHBDMO C[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc(N2CCOC2=O)cc1 ZINC000181287707 941120325 /nfs/dbraw/zinc/12/03/25/941120325.db2.gz BDFWDAOEBISFEX-LBPRGKRZSA-N 1 1 359.357 3.541 20 5 FHBDMO COc1cc(Br)ccc1C[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000189186863 941151154 /nfs/dbraw/zinc/15/11/54/941151154.db2.gz QKPUFMRGBRGJLW-UHFFFAOYSA-N 1 1 357.229 3.717 20 5 FHBDMO C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)CC1(c2ccccc2)CC1 ZINC000189325097 941156271 /nfs/dbraw/zinc/15/62/71/941156271.db2.gz ODDAIRVHWCKHRC-UHFFFAOYSA-N 1 1 364.405 3.808 20 5 FHBDMO C[C@@H](NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000181455704 941288508 /nfs/dbraw/zinc/28/85/08/941288508.db2.gz IYPMSRBLOHOCFS-OLZOCXBDSA-N 1 1 365.861 3.631 20 5 FHBDMO CC[N@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)Cc1occc1C ZINC000414555763 941378440 /nfs/dbraw/zinc/37/84/40/941378440.db2.gz XCWJCRAMZIKFEN-UHFFFAOYSA-N 1 1 354.410 3.919 20 5 FHBDMO CC(C)Oc1cccc(C[N@H+](C)[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000120656986 941724855 /nfs/dbraw/zinc/72/48/55/941724855.db2.gz RPVZGRHIJOCGFX-HNNXBMFYSA-N 1 1 371.437 3.841 20 5 FHBDMO CC(C)Oc1cccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000120656986 941724858 /nfs/dbraw/zinc/72/48/58/941724858.db2.gz RPVZGRHIJOCGFX-HNNXBMFYSA-N 1 1 371.437 3.841 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@H](C)C[C@H]1c1ccccc1 ZINC000513233528 941790541 /nfs/dbraw/zinc/79/05/41/941790541.db2.gz YPHSHKNPZDKDCX-KDOFPFPSSA-N 1 1 353.422 3.925 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@H](C)C[C@H]1c1ccccc1 ZINC000513233528 941790544 /nfs/dbraw/zinc/79/05/44/941790544.db2.gz YPHSHKNPZDKDCX-KDOFPFPSSA-N 1 1 353.422 3.925 20 5 FHBDMO C[C@@H]1C[C@@H](c2ccccc2)[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000513227927 941798062 /nfs/dbraw/zinc/79/80/62/941798062.db2.gz GCJYSBJXAKLWDX-QRWLVFNGSA-N 1 1 365.433 3.567 20 5 FHBDMO C[C@@H]1C[C@H](c2ccccc2)[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000513227389 941798918 /nfs/dbraw/zinc/79/89/18/941798918.db2.gz BYBSRTRTCGJIOF-DNVCBOLYSA-N 1 1 353.422 3.641 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@H](C)C[C@H]1c1ccccc1 ZINC000513257434 941821169 /nfs/dbraw/zinc/82/11/69/941821169.db2.gz QTHFMJNGIHPREW-KDOFPFPSSA-N 1 1 369.421 3.625 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H](C)C[C@H]1c1ccccc1 ZINC000513257434 941821171 /nfs/dbraw/zinc/82/11/71/941821171.db2.gz QTHFMJNGIHPREW-KDOFPFPSSA-N 1 1 369.421 3.625 20 5 FHBDMO C[C@@H]1C[C@H](c2ccccc2)[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000513272576 941825149 /nfs/dbraw/zinc/82/51/49/941825149.db2.gz RKIDHVOLXQOYOJ-DNVCBOLYSA-N 1 1 365.433 3.567 20 5 FHBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+](Cc2ccccc2)CC2CCC2)c1 ZINC000513490042 941960537 /nfs/dbraw/zinc/96/05/37/941960537.db2.gz LCSWQBYMLXPBGO-HXUWFJFHSA-N 1 1 370.449 3.637 20 5 FHBDMO Cc1c(NC(=O)NC[C@@H]2CC[N@H+](C)[C@H]2c2cccs2)cccc1[N+](=O)[O-] ZINC000377772866 941981211 /nfs/dbraw/zinc/98/12/11/941981211.db2.gz QNLGXDZECLWOHJ-SUMWQHHRSA-N 1 1 374.466 3.779 20 5 FHBDMO C[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F)[N@H+]1CCCC[C@H]1C ZINC000549365743 942060371 /nfs/dbraw/zinc/06/03/71/942060371.db2.gz CCVFDRAJUWRFKD-VXGBXAGGSA-N 1 1 373.375 3.606 20 5 FHBDMO CCS(=O)(=O)c1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)s1 ZINC000279990199 942084775 /nfs/dbraw/zinc/08/47/75/942084775.db2.gz FGJFEPFRVQYQGX-GFCCVEGCSA-N 1 1 368.480 3.609 20 5 FHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420955297 942274499 /nfs/dbraw/zinc/27/44/99/942274499.db2.gz WEWXKOZEMIEEIP-NEPJUHHUSA-N 1 1 359.348 3.586 20 5 FHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420955297 942274500 /nfs/dbraw/zinc/27/45/00/942274500.db2.gz WEWXKOZEMIEEIP-NEPJUHHUSA-N 1 1 359.348 3.586 20 5 FHBDMO O=C(CC[N@@H+](Cc1ccco1)C1CCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000501116068 942316444 /nfs/dbraw/zinc/31/64/44/942316444.db2.gz IKTWUBDTYUVBFP-UHFFFAOYSA-N 1 1 357.410 3.961 20 5 FHBDMO COc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(OC)c([N+](=O)[O-])c2)cc1OC ZINC000051283950 942344195 /nfs/dbraw/zinc/34/41/95/942344195.db2.gz HOOIHGQULIMFLG-MRXNPFEDSA-N 1 1 372.421 3.958 20 5 FHBDMO COc1ccc([C@H]2CCC[N@H+]2Cc2ccc(OC)c([N+](=O)[O-])c2)cc1OC ZINC000051283950 942344199 /nfs/dbraw/zinc/34/41/99/942344199.db2.gz HOOIHGQULIMFLG-MRXNPFEDSA-N 1 1 372.421 3.958 20 5 FHBDMO C[C@@H]1C[C@@H](N(C)c2ncc([N+](=O)[O-])cc2F)CC[N@H+]1Cc1ccccc1 ZINC000413153667 942352223 /nfs/dbraw/zinc/35/22/23/942352223.db2.gz HUWJUKVEAKEMKX-ZBFHGGJFSA-N 1 1 358.417 3.618 20 5 FHBDMO Cc1ccc(C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)c(-c2cnn(C)c2)c1 ZINC000549401502 942405926 /nfs/dbraw/zinc/40/59/26/942405926.db2.gz KADHRROFKOSJHL-UHFFFAOYSA-N 1 1 362.433 3.862 20 5 FHBDMO CC(C)[N@H+]1CCCN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000505289575 942449746 /nfs/dbraw/zinc/44/97/46/942449746.db2.gz KDHWCVHZEJCJKJ-UHFFFAOYSA-N 1 1 360.483 3.634 20 5 FHBDMO C[N@@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])cc2F)[C@@H]1c1ccc(Cl)cc1 ZINC000413200735 942473465 /nfs/dbraw/zinc/47/34/65/942473465.db2.gz FICWALRATIJNFV-GJZGRUSLSA-N 1 1 350.781 3.640 20 5 FHBDMO C[N@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])cc2F)[C@@H]1c1ccc(Cl)cc1 ZINC000413200735 942473466 /nfs/dbraw/zinc/47/34/66/942473466.db2.gz FICWALRATIJNFV-GJZGRUSLSA-N 1 1 350.781 3.640 20 5 FHBDMO C[C@@H]1C[C@@H](CO)C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000421362923 942516330 /nfs/dbraw/zinc/51/63/30/942516330.db2.gz OJDUGCIMDHAVNZ-CHWSQXEVSA-N 1 1 364.829 3.959 20 5 FHBDMO COc1ccc(C[N@@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)cc1 ZINC000104661791 942565840 /nfs/dbraw/zinc/56/58/40/942565840.db2.gz QQQIMLFLIKKPEI-UHFFFAOYSA-N 1 1 367.405 3.933 20 5 FHBDMO CC(C)(C)[N@H+]1CCc2nc(NC(=O)c3ccc([N+](=O)[O-])s3)sc2C1 ZINC000425075954 942632656 /nfs/dbraw/zinc/63/26/56/942632656.db2.gz FHTWXVMOHUBMSZ-UHFFFAOYSA-N 1 1 366.468 3.522 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C(=O)Nc2nc3c(s2)C[N@H+](C(C)(C)C)CC3)c1 ZINC000425077569 942650134 /nfs/dbraw/zinc/65/01/34/942650134.db2.gz IPBWUIXYUNNMMJ-UHFFFAOYSA-N 1 1 374.466 3.769 20 5 FHBDMO CC(C)(C)[N@H+]1CCc2nc(NC(=O)c3csc([N+](=O)[O-])c3)sc2C1 ZINC000425079535 942650919 /nfs/dbraw/zinc/65/09/19/942650919.db2.gz LYXHYRCZMARDHT-UHFFFAOYSA-N 1 1 366.468 3.522 20 5 FHBDMO Cc1ccc([C@H]2CC[N@H+]([C@@H](C)C(=O)Nc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000541389612 942697593 /nfs/dbraw/zinc/69/75/93/942697593.db2.gz RNWMDVFYPRLOSL-RDJZCZTQSA-N 1 1 353.422 3.720 20 5 FHBDMO CCc1ccc([C@H]2CN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3)CC[NH2+]2)cc1 ZINC000505469208 942863233 /nfs/dbraw/zinc/86/32/33/942863233.db2.gz NTRUPXYRKWCEHP-GOSISDBHSA-N 1 1 373.840 3.597 20 5 FHBDMO CCc1ccc([C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3Cl)CC[NH2+]2)cc1 ZINC000505483774 942890370 /nfs/dbraw/zinc/89/03/70/942890370.db2.gz MBLSICSDVXPVJT-SFHVURJKSA-N 1 1 373.840 3.597 20 5 FHBDMO O=[N+]([O-])c1ccc2[nH]c(NC[C@H]3CCC[N@@H+](Cc4ccccc4)C3)nc2c1 ZINC000312233389 942893567 /nfs/dbraw/zinc/89/35/67/942893567.db2.gz AWBUBIVXIJWJBN-MRXNPFEDSA-N 1 1 365.437 3.795 20 5 FHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+](Cc1ccccc1)C[C@H]1CCCO1 ZINC000505559554 943029584 /nfs/dbraw/zinc/02/95/84/943029584.db2.gz LGFLHXOIDRKPHO-GOSISDBHSA-N 1 1 356.422 3.655 20 5 FHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](c2ccccc2)[C@@H]1C ZINC000434895769 943033939 /nfs/dbraw/zinc/03/39/39/943033939.db2.gz NBGOYQORBFCDCA-UXLLHSPISA-N 1 1 353.422 3.800 20 5 FHBDMO C[C@H](c1cccc(Nc2ncc(Cl)cc2[N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000434945712 943066787 /nfs/dbraw/zinc/06/67/87/943066787.db2.gz FPKAARYKMUOLID-GFCCVEGCSA-N 1 1 362.817 3.780 20 5 FHBDMO COCC[N@@H+](C)CC[C@H](Nc1ccc(F)cc1[N+](=O)[O-])c1ccccc1 ZINC000505577197 943068817 /nfs/dbraw/zinc/06/88/17/943068817.db2.gz RPWXIPMJHFVYJN-KRWDZBQOSA-N 1 1 361.417 3.855 20 5 FHBDMO Cc1c(NC(=O)N2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000416740639 943074071 /nfs/dbraw/zinc/07/40/71/943074071.db2.gz UVCPCVIXGFLEEZ-OAHLLOKOSA-N 1 1 368.437 3.641 20 5 FHBDMO Cc1c(NC(=O)N2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000416740639 943074077 /nfs/dbraw/zinc/07/40/77/943074077.db2.gz UVCPCVIXGFLEEZ-OAHLLOKOSA-N 1 1 368.437 3.641 20 5 FHBDMO O=[N+]([O-])c1cccc2c1ccn2C[C@@H]1C[N@@H+](Cc2ccccc2)CCCO1 ZINC000514635228 943167020 /nfs/dbraw/zinc/16/70/20/943167020.db2.gz NENOWJUAICTHQJ-SFHVURJKSA-N 1 1 365.433 3.841 20 5 FHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cncc(Br)c2)c(Cl)c1 ZINC000183807443 943218643 /nfs/dbraw/zinc/21/86/43/943218643.db2.gz JPIPMMMRJUGABR-UHFFFAOYSA-N 1 1 356.607 3.696 20 5 FHBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3ccco3)CC2)cc1C(F)(F)F ZINC000514705734 943235101 /nfs/dbraw/zinc/23/51/01/943235101.db2.gz NSFOLHYZBBCBSD-UHFFFAOYSA-N 1 1 355.316 3.529 20 5 FHBDMO C[NH2+]CCC1CCN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000435381623 943369490 /nfs/dbraw/zinc/36/94/90/943369490.db2.gz XBIQMFFLIJSANU-UHFFFAOYSA-N 1 1 360.483 3.540 20 5 FHBDMO COc1c(C)cc(C[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1C ZINC000110288574 943453284 /nfs/dbraw/zinc/45/32/84/943453284.db2.gz NVRDWDKJWIHPIQ-UHFFFAOYSA-N 1 1 371.437 3.681 20 5 FHBDMO CC(C)(CNC(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2ccccc2C1 ZINC000504737036 943763026 /nfs/dbraw/zinc/76/30/26/943763026.db2.gz HXJPOVWDXCDUJQ-UHFFFAOYSA-N 1 1 368.437 3.553 20 5 FHBDMO COc1ccc(C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)c(OC)n1 ZINC000516896956 943813379 /nfs/dbraw/zinc/81/33/79/943813379.db2.gz USFAEPJNDHCINL-MRXNPFEDSA-N 1 1 357.410 3.519 20 5 FHBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1CC[C@H](C2CCOCC2)C1 ZINC000425423374 943884645 /nfs/dbraw/zinc/88/46/45/943884645.db2.gz QQCQCUVJTVXDCQ-ZDUSSCGKSA-N 1 1 369.259 3.606 20 5 FHBDMO C[C@@H](NC(=O)NC[C@H]1CCC[N@H+]1C1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000437637341 944004441 /nfs/dbraw/zinc/00/44/41/944004441.db2.gz VHJVWOCNTPETQW-DNVCBOLYSA-N 1 1 374.485 3.752 20 5 FHBDMO COc1ccc([C@@H](C)[N@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000506101273 944023714 /nfs/dbraw/zinc/02/37/14/944023714.db2.gz CNXYVOKKBPDSII-CYBMUJFWSA-N 1 1 368.393 3.846 20 5 FHBDMO COc1ccc([C@@H](C)[N@@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000506101273 944023726 /nfs/dbraw/zinc/02/37/26/944023726.db2.gz CNXYVOKKBPDSII-CYBMUJFWSA-N 1 1 368.393 3.846 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@H](Cc2ccccc2)C1 ZINC000436126752 944039815 /nfs/dbraw/zinc/03/98/15/944039815.db2.gz KDJSPFNCVMFDFX-GOSISDBHSA-N 1 1 367.449 3.796 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@H](Cc2ccccc2)C1 ZINC000436126752 944039826 /nfs/dbraw/zinc/03/98/26/944039826.db2.gz KDJSPFNCVMFDFX-GOSISDBHSA-N 1 1 367.449 3.796 20 5 FHBDMO O=C(CC[N@H+]1CCC[C@H](Cc2ccccc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000500103008 944099499 /nfs/dbraw/zinc/09/94/99/944099499.db2.gz GXWGAZWDWDAGGS-GOSISDBHSA-N 1 1 367.449 3.878 20 5 FHBDMO CC[C@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])c1nnc2n1CCCCC2 ZINC000517245744 944138288 /nfs/dbraw/zinc/13/82/88/944138288.db2.gz AJHVUWNNHZYEBY-HOTGVXAUSA-N 1 1 355.442 3.641 20 5 FHBDMO COc1cc(C[N@@H+](Cc2cccc(O)c2)CC2CC2)c([N+](=O)[O-])cc1F ZINC000184215038 944277904 /nfs/dbraw/zinc/27/79/04/944277904.db2.gz ZLMNYBNFUKFBCI-UHFFFAOYSA-N 1 1 360.385 3.860 20 5 FHBDMO COc1cc(C[N@H+](Cc2cccc(O)c2)CC2CC2)c([N+](=O)[O-])cc1F ZINC000184215038 944277912 /nfs/dbraw/zinc/27/79/12/944277912.db2.gz ZLMNYBNFUKFBCI-UHFFFAOYSA-N 1 1 360.385 3.860 20 5 FHBDMO COc1cc(N2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)ccc1[N+](=O)[O-] ZINC000517410755 944279398 /nfs/dbraw/zinc/27/93/98/944279398.db2.gz XIQRVIOBRRPNBF-NRFANRHFSA-N 1 1 367.449 3.706 20 5 FHBDMO COc1cc(C[N@@H+](CCCO)[C@@H]2CCc3ccccc32)c([N+](=O)[O-])cc1F ZINC000184231449 944288552 /nfs/dbraw/zinc/28/85/52/944288552.db2.gz ULYCEXXUGYGBHR-GOSISDBHSA-N 1 1 374.412 3.614 20 5 FHBDMO CN(C(=O)C[N@@H+]1CCC[C@@H]1/C=C\c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000505825149 944330823 /nfs/dbraw/zinc/33/08/23/944330823.db2.gz KGFKFIKRCDUBNY-ZBTAVZRMSA-N 1 1 365.433 3.735 20 5 FHBDMO CN(C(=O)C[N@H+]1CCC[C@@H]1/C=C\c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000505825149 944330829 /nfs/dbraw/zinc/33/08/29/944330829.db2.gz KGFKFIKRCDUBNY-ZBTAVZRMSA-N 1 1 365.433 3.735 20 5 FHBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000126508022 944334681 /nfs/dbraw/zinc/33/46/81/944334681.db2.gz DEZDBAYOTVWJPA-OKILXGFUSA-N 1 1 367.877 3.736 20 5 FHBDMO C[C@H](NC(=O)[C@@H](c1cccc(Cl)c1)[NH+](C)C)c1cccc([N+](=O)[O-])c1 ZINC000518443809 944381442 /nfs/dbraw/zinc/38/14/42/944381442.db2.gz SDVIFEVQONEKIO-YVEFUNNKSA-N 1 1 361.829 3.728 20 5 FHBDMO CCOc1c(Cl)cccc1C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000425958572 944410822 /nfs/dbraw/zinc/41/08/22/944410822.db2.gz OCTUHIICDVJJKL-UHFFFAOYSA-N 1 1 364.833 3.681 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](c2ccccc2F)C1 ZINC000550208985 944425596 /nfs/dbraw/zinc/42/55/96/944425596.db2.gz DWNSGKFOVYBJPZ-HNNXBMFYSA-N 1 1 371.412 3.860 20 5 FHBDMO CSC[C@H]1CCC[N@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000312695646 944449289 /nfs/dbraw/zinc/44/92/89/944449289.db2.gz NCNYFWHGPCPTHK-LBPRGKRZSA-N 1 1 359.289 3.932 20 5 FHBDMO CSC[C@H]1CCC[N@@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000312695646 944449291 /nfs/dbraw/zinc/44/92/91/944449291.db2.gz NCNYFWHGPCPTHK-LBPRGKRZSA-N 1 1 359.289 3.932 20 5 FHBDMO CC[C@@](C)(O)C[N@@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1OC ZINC000439258997 944475654 /nfs/dbraw/zinc/47/56/54/944475654.db2.gz MCGVFPIJCOKFFV-HXUWFJFHSA-N 1 1 358.438 3.767 20 5 FHBDMO CCC[C@@H](NC(=O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000516094319 944492800 /nfs/dbraw/zinc/49/28/00/944492800.db2.gz XWWKECWNCPJUJN-HXUWFJFHSA-N 1 1 369.465 3.727 20 5 FHBDMO CCC[C@@H](NC(=O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000516094319 944492805 /nfs/dbraw/zinc/49/28/05/944492805.db2.gz XWWKECWNCPJUJN-HXUWFJFHSA-N 1 1 369.465 3.727 20 5 FHBDMO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000517675909 944504108 /nfs/dbraw/zinc/50/41/08/944504108.db2.gz LGCNHLJQMDCXLP-AWEZNQCLSA-N 1 1 372.469 3.707 20 5 FHBDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000517675910 944504118 /nfs/dbraw/zinc/50/41/18/944504118.db2.gz LGCNHLJQMDCXLP-CQSZACIVSA-N 1 1 372.469 3.707 20 5 FHBDMO C[C@@H]1C[C@H](c2ccccc2)CC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000439330337 944542869 /nfs/dbraw/zinc/54/28/69/944542869.db2.gz ZHLDDXRXZOTXOQ-QRQLOZEOSA-N 1 1 370.449 3.603 20 5 FHBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C[C@@H](C)C1 ZINC000516190646 944579721 /nfs/dbraw/zinc/57/97/21/944579721.db2.gz BZIKNDVROHFMCM-PBFPGSCMSA-N 1 1 371.403 3.776 20 5 FHBDMO O=c1[nH]ccc2c1C[N@@H+](Cc1ccc(-c3cccc([N+](=O)[O-])c3)o1)CC2 ZINC000426371901 944582523 /nfs/dbraw/zinc/58/25/23/944582523.db2.gz NDUMNMASDNIZJG-UHFFFAOYSA-N 1 1 351.362 3.514 20 5 FHBDMO C[C@@H](C[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccccc1 ZINC000066854544 944634047 /nfs/dbraw/zinc/63/40/47/944634047.db2.gz CPCGKSFNBDOMDN-AWEZNQCLSA-N 1 1 352.394 3.880 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccncc1OCC(F)F ZINC000519580987 944667105 /nfs/dbraw/zinc/66/71/05/944667105.db2.gz CSSULSRAESHTJY-GFCCVEGCSA-N 1 1 351.353 3.793 20 5 FHBDMO COc1cccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CCC(O)CC2)c1 ZINC000102176362 944675130 /nfs/dbraw/zinc/67/51/30/944675130.db2.gz AZQYSVFZKAVMPD-UHFFFAOYSA-N 1 1 370.449 3.909 20 5 FHBDMO C[C@@H]([NH2+]Cc1ccc(OCC(F)(F)F)nc1)c1ccccc1[N+](=O)[O-] ZINC000516304444 944706427 /nfs/dbraw/zinc/70/64/27/944706427.db2.gz DDBBAOUIUZTRGL-LLVKDONJSA-N 1 1 355.316 3.782 20 5 FHBDMO CN(Cc1ccc([N+](=O)[O-])cc1F)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000383074037 944707813 /nfs/dbraw/zinc/70/78/13/944707813.db2.gz ZQFIUFVMOZBAFT-QGZVFWFLSA-N 1 1 357.429 3.688 20 5 FHBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](Nc2nc3sccn3c2[N+](=O)[O-])C1 ZINC000507003129 944871346 /nfs/dbraw/zinc/87/13/46/944871346.db2.gz UBRNZYHMHGXENV-OCCSQVGLSA-N 1 1 357.439 3.551 20 5 FHBDMO Cc1ccccc1[C@H]1CC[N@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC000507203060 945027956 /nfs/dbraw/zinc/02/79/56/945027956.db2.gz IPQAOQRXNSCKQM-INIZCTEOSA-N 1 1 353.422 3.640 20 5 FHBDMO Cc1ccccc1[C@H]1CC[N@@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC000507203060 945027965 /nfs/dbraw/zinc/02/79/65/945027965.db2.gz IPQAOQRXNSCKQM-INIZCTEOSA-N 1 1 353.422 3.640 20 5 FHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000507685643 945449645 /nfs/dbraw/zinc/44/96/45/945449645.db2.gz DIXXVTUYCGMBIX-SJORKVTESA-N 1 1 367.232 3.992 20 5 FHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000507685643 945449649 /nfs/dbraw/zinc/44/96/49/945449649.db2.gz DIXXVTUYCGMBIX-SJORKVTESA-N 1 1 367.232 3.992 20 5 FHBDMO C[C@H](O)[C@@H]1CC[N@@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000507706888 945479749 /nfs/dbraw/zinc/47/97/49/945479749.db2.gz ZXTWIPIRONIZAH-DOTOQJQBSA-N 1 1 355.438 3.565 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](Cc1ccc(F)cc1)CC1CC1 ZINC000444159032 946000784 /nfs/dbraw/zinc/00/07/84/946000784.db2.gz KMXLPSQTJXVPOV-UHFFFAOYSA-N 1 1 371.412 3.893 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000487354433 946096264 /nfs/dbraw/zinc/09/62/64/946096264.db2.gz MEHHIFSZBVSROT-WMZOPIPTSA-N 1 1 367.449 3.544 20 5 FHBDMO CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000045789960 946154395 /nfs/dbraw/zinc/15/43/95/946154395.db2.gz KRTQKPUXKGIFSJ-UHFFFAOYSA-N 1 1 356.426 3.757 20 5 FHBDMO CCn1nc(C)c([N+](=O)[O-])c1N[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000248662216 946160897 /nfs/dbraw/zinc/16/08/97/946160897.db2.gz GLRKCLUCHWWECT-YOEHRIQHSA-N 1 1 357.458 3.585 20 5 FHBDMO CCC[C@H](C)NC(=O)[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000783555349 946253425 /nfs/dbraw/zinc/25/34/25/946253425.db2.gz PGELJIMXVZXIPT-ZFWWWQNUSA-N 1 1 367.877 3.765 20 5 FHBDMO CCC[C@H](C)NC(=O)[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000783555349 946253433 /nfs/dbraw/zinc/25/34/33/946253433.db2.gz PGELJIMXVZXIPT-ZFWWWQNUSA-N 1 1 367.877 3.765 20 5 FHBDMO C/C(=C/C(=O)NCCCC[N@@H+]1CCCC[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000785284475 946266876 /nfs/dbraw/zinc/26/68/76/946266876.db2.gz XKKLMSMGMBYLLQ-FUYCXPICSA-N 1 1 359.470 3.769 20 5 FHBDMO CN(C)c1cccc([C@@H]2CCC[N@H+]2CCOc2ccccc2[N+](=O)[O-])c1 ZINC000441362466 946487988 /nfs/dbraw/zinc/48/79/88/946487988.db2.gz YUVHEYBRXZEBOF-SFHVURJKSA-N 1 1 355.438 3.877 20 5 FHBDMO C[N@@H+](CCCNC(=O)c1cc(Cl)ccc1[N+](=O)[O-])Cc1ccccc1 ZINC000067509823 946515172 /nfs/dbraw/zinc/51/51/72/946515172.db2.gz GJVPILRRPUVKEW-UHFFFAOYSA-N 1 1 361.829 3.500 20 5 FHBDMO Cc1cc(C(=O)N[C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000487386682 946563703 /nfs/dbraw/zinc/56/37/03/946563703.db2.gz HDOGKKOBVISNMI-VQIMIIECSA-N 1 1 367.449 3.544 20 5 FHBDMO CC(C)[C@H]([NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)c1cnn(C)c1 ZINC000897081114 946570950 /nfs/dbraw/zinc/57/09/50/946570950.db2.gz KDTDYVHOQSIGCP-LBPRGKRZSA-N 1 1 373.276 3.639 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](CO)c1ccccc1OC(F)(F)F ZINC000475563852 946656011 /nfs/dbraw/zinc/65/60/11/946656011.db2.gz WQAZFODMRHNTFR-HNNXBMFYSA-N 1 1 370.327 3.625 20 5 FHBDMO Cc1ccc(C[NH2+][C@H](CO)c2ccccc2OC(F)(F)F)cc1[N+](=O)[O-] ZINC000475566902 946679452 /nfs/dbraw/zinc/67/94/52/946679452.db2.gz JGHDJEFKGKIXQL-CQSZACIVSA-N 1 1 370.327 3.625 20 5 FHBDMO C[C@@H]1OCC[C@]12C[N@@H+](Cc1ccc(-c3ccccc3[N+](=O)[O-])s1)CCO2 ZINC000475290047 946829241 /nfs/dbraw/zinc/82/92/41/946829241.db2.gz DZDOLGIFHGLJRA-LIRRHRJNSA-N 1 1 374.462 3.703 20 5 FHBDMO CN(C(=O)c1cc(Cl)cc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475314304 946873849 /nfs/dbraw/zinc/87/38/49/946873849.db2.gz SSANQFAQMWUNFJ-QGZVFWFLSA-N 1 1 373.840 3.595 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C/CN1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000475336233 946902817 /nfs/dbraw/zinc/90/28/17/946902817.db2.gz UCSJJSDZQDZMEZ-YHWHNIOJSA-N 1 1 363.461 3.672 20 5 FHBDMO COC(=O)[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@H]1C ZINC000475361809 946954200 /nfs/dbraw/zinc/95/42/00/946954200.db2.gz KMUAUHQSUQNRBX-HIFRSBDPSA-N 1 1 374.462 3.954 20 5 FHBDMO CCCC[N@@H+](C)CC1CCN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)CC1 ZINC000112918475 946992465 /nfs/dbraw/zinc/99/24/65/946992465.db2.gz QPDWBLPSRKKNAU-UHFFFAOYSA-N 1 1 372.469 3.660 20 5 FHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@H]3Cc3ccc(F)cc3)nc2c1 ZINC000444595985 947020274 /nfs/dbraw/zinc/02/02/74/947020274.db2.gz KOFGXMQKHLAEAA-HNNXBMFYSA-N 1 1 354.385 3.817 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N(C)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000074446258 947067648 /nfs/dbraw/zinc/06/76/48/947067648.db2.gz DZCINNLKZWNAHI-IBGZPJMESA-N 1 1 367.449 3.640 20 5 FHBDMO COCCc1cc[nH+]c(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000508503589 947082570 /nfs/dbraw/zinc/08/25/70/947082570.db2.gz IOKWSNUKFPYELU-UHFFFAOYSA-N 1 1 370.434 3.914 20 5 FHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CCC[C@H](Nc4ccccc4)C3)nc2c1 ZINC000444664683 947090929 /nfs/dbraw/zinc/09/09/29/947090929.db2.gz OHSBPTSEPWTYFU-HNNXBMFYSA-N 1 1 351.410 3.548 20 5 FHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@H](Nc4ccccc4)C3)nc2c1 ZINC000444664683 947090940 /nfs/dbraw/zinc/09/09/40/947090940.db2.gz OHSBPTSEPWTYFU-HNNXBMFYSA-N 1 1 351.410 3.548 20 5 FHBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+](C)CC2(c3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000444670278 947095536 /nfs/dbraw/zinc/09/55/36/947095536.db2.gz GKYJOTZBXOAXRL-MRXNPFEDSA-N 1 1 367.449 3.894 20 5 FHBDMO CC[N@@H+](CCCn1c2cc([N+](=O)[O-])ccc2oc1=O)[C@@H]1CCCC[C@@H]1C ZINC000444675378 947100045 /nfs/dbraw/zinc/10/00/45/947100045.db2.gz LXEPIGKOAFYVTH-GOEBONIOSA-N 1 1 361.442 3.793 20 5 FHBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1OC ZINC000444682937 947107360 /nfs/dbraw/zinc/10/73/60/947107360.db2.gz CAKPFQCKXRSSRO-GFCCVEGCSA-N 1 1 370.409 3.729 20 5 FHBDMO COc1cccc(C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@H]2CCCO2)c1 ZINC000523701868 947528329 /nfs/dbraw/zinc/52/83/29/947528329.db2.gz WXILTCGYJUNOPE-OAQYLSRUSA-N 1 1 370.449 3.827 20 5 FHBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000072837533 947568811 /nfs/dbraw/zinc/56/88/11/947568811.db2.gz ATLOIUSFRUUKAD-GDBMZVCRSA-N 1 1 365.499 3.838 20 5 FHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](CCCc1nc(-c3ccccc3)no1)CC2 ZINC000088606970 947585758 /nfs/dbraw/zinc/58/57/58/947585758.db2.gz HLYMTIQIAITLRO-UHFFFAOYSA-N 1 1 364.405 3.636 20 5 FHBDMO Cc1cc(C(=O)N2C[C@@H](C)[N@@H+](Cc3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000500441177 947804076 /nfs/dbraw/zinc/80/40/76/947804076.db2.gz XOQSSTCLYBLGGQ-SJORKVTESA-N 1 1 367.449 3.638 20 5 FHBDMO Cc1cc(C(=O)N2C[C@@H](C)[N@H+](Cc3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000500441177 947804082 /nfs/dbraw/zinc/80/40/82/947804082.db2.gz XOQSSTCLYBLGGQ-SJORKVTESA-N 1 1 367.449 3.638 20 5 FHBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3ccco3)CC2)nc1-c1ccccc1 ZINC000536391311 947957682 /nfs/dbraw/zinc/95/76/82/947957682.db2.gz ULIZOSXPQFBZDS-UHFFFAOYSA-N 1 1 364.405 3.572 20 5 FHBDMO COc1ccc(-c2ccc(C[NH2+][C@H](C)Cc3cc(C)[nH]n3)o2)c([N+](=O)[O-])c1 ZINC000136788231 947995082 /nfs/dbraw/zinc/99/50/82/947995082.db2.gz ZSWHZPGXBNPPFO-GFCCVEGCSA-N 1 1 370.409 3.616 20 5 FHBDMO O=[N+]([O-])c1cccc2c(N3CC[NH+](Cc4cccc(F)c4)CC3)ccnc21 ZINC000432328981 948091589 /nfs/dbraw/zinc/09/15/89/948091589.db2.gz NEBPQIXSBNDIMI-UHFFFAOYSA-N 1 1 366.396 3.604 20 5 FHBDMO Cc1cccc(N2CCC(Nc3ccnc4c3cccc4[N+](=O)[O-])CC2)[nH+]1 ZINC000432330847 948115165 /nfs/dbraw/zinc/11/51/65/948115165.db2.gz GKKKKYLDETWMIP-UHFFFAOYSA-N 1 1 363.421 3.927 20 5 FHBDMO O=[N+]([O-])c1ccc(CNC2CC[NH+](CCC(F)(F)F)CC2)c(Cl)c1 ZINC000184667579 948120408 /nfs/dbraw/zinc/12/04/08/948120408.db2.gz GSZVXFWLZXZYJG-UHFFFAOYSA-N 1 1 365.783 3.755 20 5 FHBDMO CCOc1ccc([C@H](C)[NH2+]CCc2ccc3cn[nH]c3c2)cc1[N+](=O)[O-] ZINC000585765587 948276687 /nfs/dbraw/zinc/27/66/87/948276687.db2.gz XJJLRCNQVMBNNT-ZDUSSCGKSA-N 1 1 354.410 3.763 20 5 FHBDMO NC(=O)c1ccc(C[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C2CC2)cc1 ZINC000520645694 948489240 /nfs/dbraw/zinc/48/92/40/948489240.db2.gz SZZSELMBOWIXBW-UHFFFAOYSA-N 1 1 359.813 3.512 20 5 FHBDMO NC(=O)c1ccc(C[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C2CC2)cc1 ZINC000520645694 948489247 /nfs/dbraw/zinc/48/92/47/948489247.db2.gz SZZSELMBOWIXBW-UHFFFAOYSA-N 1 1 359.813 3.512 20 5 FHBDMO CN(C)CC[C@@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C(C)(C)C ZINC000126019470 948714539 /nfs/dbraw/zinc/71/45/39/948714539.db2.gz HYJPAKHNOXYRPJ-LJQANCHMSA-N 1 1 362.518 3.520 20 5 FHBDMO CCC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)CC(=O)Nc1ccccc1C ZINC000051452266 567958729 /nfs/dbraw/zinc/95/87/29/567958729.db2.gz RRFZGGMSTMGTGZ-UHFFFAOYSA-N 1 1 355.438 3.796 20 5 FHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH+]1CCC(c2ccon2)CC1 ZINC000602717913 568014846 /nfs/dbraw/zinc/01/48/46/568014846.db2.gz KFKYRQITXBMQRR-UHFFFAOYSA-N 1 1 355.316 3.981 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@H](c1ccncc1)C1(CO)CCC1 ZINC000602899872 568015073 /nfs/dbraw/zinc/01/50/73/568015073.db2.gz BJHMKYKBCPKHMG-QGZVFWFLSA-N 1 1 361.829 3.637 20 5 FHBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@H](O)Cc1ccccc1 ZINC000568306279 568018177 /nfs/dbraw/zinc/01/81/77/568018177.db2.gz XOKKKODHVOEGFX-QGZVFWFLSA-N 1 1 366.417 3.890 20 5 FHBDMO CCSCC[C@H](C)[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000072900601 568056849 /nfs/dbraw/zinc/05/68/49/568056849.db2.gz UVQBKAOVLFWGPB-AWEZNQCLSA-N 1 1 353.488 3.695 20 5 FHBDMO COc1ccc(C[N@H+]2CCC[C@]3(C2)OCc2ccccc23)cc1[N+](=O)[O-] ZINC000481725576 568098404 /nfs/dbraw/zinc/09/84/04/568098404.db2.gz KSTKHAFSFFMFQJ-HXUWFJFHSA-N 1 1 354.406 3.625 20 5 FHBDMO Cc1cc(C(=O)NC[C@H](c2ccccc2Cl)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000008262428 568285054 /nfs/dbraw/zinc/28/50/54/568285054.db2.gz YSJPOEQIJYUAIU-QGZVFWFLSA-N 1 1 361.829 3.589 20 5 FHBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3cscc3C(F)(F)F)CC2)n1 ZINC000569057609 568293547 /nfs/dbraw/zinc/29/35/47/568293547.db2.gz CEDXZHCMSXAAFJ-UHFFFAOYSA-N 1 1 360.361 3.709 20 5 FHBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+](C)C2CCOCC2)cc1OC ZINC000541986187 568302402 /nfs/dbraw/zinc/30/24/02/568302402.db2.gz JDKJUNOSNSAQHM-CQSZACIVSA-N 1 1 366.458 3.639 20 5 FHBDMO COc1ccccc1[C@H](CO)[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000569908211 568435754 /nfs/dbraw/zinc/43/57/54/568435754.db2.gz SLRKULOYJYWWDY-MSOLQXFVSA-N 1 1 356.422 3.649 20 5 FHBDMO CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)Cc1cccs1 ZINC000007613784 568539793 /nfs/dbraw/zinc/53/97/93/568539793.db2.gz QKBWEHHJWBQWLE-UHFFFAOYSA-N 1 1 353.831 3.770 20 5 FHBDMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)Cc1cccs1 ZINC000007613784 568539795 /nfs/dbraw/zinc/53/97/95/568539795.db2.gz QKBWEHHJWBQWLE-UHFFFAOYSA-N 1 1 353.831 3.770 20 5 FHBDMO CC(C)c1ccc(C[N@@H+](C)Cc2cccc(-c3nn[nH]n3)c2)cc1[N+](=O)[O-] ZINC000824347574 608520578 /nfs/dbraw/zinc/52/05/78/608520578.db2.gz DUPHCXBVVLPWER-UHFFFAOYSA-N 1 1 366.425 3.530 20 5 FHBDMO C/C(=C/C(=O)OC[C@@H]1CCC[N@H+]1Cc1ccco1)c1ccc([N+](=O)[O-])cc1 ZINC000784900960 927240177 /nfs/dbraw/zinc/24/01/77/927240177.db2.gz DSUFEFWXCQQNPD-NZHZHZHDSA-N 1 1 370.405 3.799 20 5 FHBDMO CCOCCC[N@@H+]1CC[C@H](N[C@@H](CC)c2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000247983786 937151294 /nfs/dbraw/zinc/15/12/94/937151294.db2.gz IPUZUDQHXJDZIU-UXPWSPDFSA-N 1 1 363.502 3.773 20 5 FHBDMO CCOCCC[N@H+]1CC[C@H](N[C@@H](CC)c2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000247983786 937151296 /nfs/dbraw/zinc/15/12/96/937151296.db2.gz IPUZUDQHXJDZIU-UXPWSPDFSA-N 1 1 363.502 3.773 20 5 FHBDMO CCOCCCN1CC[C@H]([NH2+][C@@H](CC)c2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000247983786 937151297 /nfs/dbraw/zinc/15/12/97/937151297.db2.gz IPUZUDQHXJDZIU-UXPWSPDFSA-N 1 1 363.502 3.773 20 5 FHBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)CCCCc1ccccc1 ZINC001167053846 927504403 /nfs/dbraw/zinc/50/44/03/927504403.db2.gz CGIBHYQPOQKJJK-INIZCTEOSA-N 1 1 355.438 3.877 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1CCC1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000157507877 927771741 /nfs/dbraw/zinc/77/17/41/927771741.db2.gz MSTFRLKPVNFHQZ-MRXNPFEDSA-N 1 1 359.470 3.712 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C)c1cccc(N2CCCC2=O)c1 ZINC000430193634 927781433 /nfs/dbraw/zinc/78/14/33/927781433.db2.gz GVVCCBAEGUFILR-AWEZNQCLSA-N 1 1 369.421 3.581 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]1CC(=O)c1cccs1 ZINC000430206809 928062313 /nfs/dbraw/zinc/06/23/13/928062313.db2.gz LFRKGHRKMYIJFQ-CQSZACIVSA-N 1 1 360.435 3.902 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1CC(=O)c1cccs1 ZINC000430206809 928062332 /nfs/dbraw/zinc/06/23/32/928062332.db2.gz LFRKGHRKMYIJFQ-CQSZACIVSA-N 1 1 360.435 3.902 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](CCCO)[C@H]1CCCc2ccccc21 ZINC000430211292 928130657 /nfs/dbraw/zinc/13/06/57/928130657.db2.gz XMVAKLVRXJYKLP-FQEVSTJZSA-N 1 1 370.449 3.865 20 5 FHBDMO COc1ccc(OC)c([C@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2OC)c1 ZINC000430212545 928141117 /nfs/dbraw/zinc/14/11/17/928141117.db2.gz OBFWLYAFQHJJQR-GOSISDBHSA-N 1 1 372.421 3.958 20 5 FHBDMO COc1ccc(OC)c([C@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2OC)c1 ZINC000430212545 928141122 /nfs/dbraw/zinc/14/11/22/928141122.db2.gz OBFWLYAFQHJJQR-GOSISDBHSA-N 1 1 372.421 3.958 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC2(C1)CCCCC2 ZINC000610216170 928173551 /nfs/dbraw/zinc/17/35/51/928173551.db2.gz VCMQFNDEAZCAGA-UHFFFAOYSA-N 1 1 361.442 3.588 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1ccccc1N1CCCC1 ZINC000430214249 928182104 /nfs/dbraw/zinc/18/21/04/928182104.db2.gz YBYXVIKWPVMXBS-UHFFFAOYSA-N 1 1 355.438 3.836 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1ccccc1N1CCCC1 ZINC000430214249 928182110 /nfs/dbraw/zinc/18/21/10/928182110.db2.gz YBYXVIKWPVMXBS-UHFFFAOYSA-N 1 1 355.438 3.836 20 5 FHBDMO O=C(c1cccc(Cl)c1[N+](=O)[O-])N1C[C@H]2CCC[N@H+]2Cc2ccccc21 ZINC000175756633 928320191 /nfs/dbraw/zinc/32/01/91/928320191.db2.gz QQPKLPBKDDSFIU-CQSZACIVSA-N 1 1 371.824 3.873 20 5 FHBDMO COc1cc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc2c1OCCO2 ZINC000126980177 928361473 /nfs/dbraw/zinc/36/14/73/928361473.db2.gz FEODFJOVOSQZQI-UHFFFAOYSA-N 1 1 370.405 3.539 20 5 FHBDMO COc1cc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc2c1OCCO2 ZINC000126980177 928361486 /nfs/dbraw/zinc/36/14/86/928361486.db2.gz FEODFJOVOSQZQI-UHFFFAOYSA-N 1 1 370.405 3.539 20 5 FHBDMO Cc1nc2ccccc2n1C[C@@H]1CCC[N@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000535965293 937247612 /nfs/dbraw/zinc/24/76/12/937247612.db2.gz YMAMLHYAJUWKLE-HNNXBMFYSA-N 1 1 356.451 3.979 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+]C1(C(F)F)CCCCC1 ZINC000510128372 928851207 /nfs/dbraw/zinc/85/12/07/928851207.db2.gz RXPRDFPQLUYTFD-UHFFFAOYSA-N 1 1 355.385 3.789 20 5 FHBDMO COc1cc(C[N@H+]2CC(C)=C[C@@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000430261648 928853792 /nfs/dbraw/zinc/85/37/92/928853792.db2.gz JXUBOZKQGYFHOU-LLVKDONJSA-N 1 1 356.369 3.645 20 5 FHBDMO COc1cc(C[N@@H+]2CC(C)=C[C@@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000430261648 928853801 /nfs/dbraw/zinc/85/38/01/928853801.db2.gz JXUBOZKQGYFHOU-LLVKDONJSA-N 1 1 356.369 3.645 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](CC(F)F)CC1CCC1 ZINC000535614584 928975377 /nfs/dbraw/zinc/97/53/77/928975377.db2.gz CHRMMHNUPPOFMA-UHFFFAOYSA-N 1 1 355.385 3.599 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](CC(F)F)CC1CCC1 ZINC000535614584 928975385 /nfs/dbraw/zinc/97/53/85/928975385.db2.gz CHRMMHNUPPOFMA-UHFFFAOYSA-N 1 1 355.385 3.599 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1CNc1cccc([C@H](C)[NH+]2CCOCC2)c1 ZINC000609221126 929086425 /nfs/dbraw/zinc/08/64/25/929086425.db2.gz XEMQIDOAGOCHGY-HNNXBMFYSA-N 1 1 371.437 3.609 20 5 FHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](C(=O)N(C)c2ccccc2)C1 ZINC000430294686 929355600 /nfs/dbraw/zinc/35/56/00/929355600.db2.gz BLFKUKXVPKGCQL-HOTGVXAUSA-N 1 1 353.422 3.641 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](C(=O)N(C)c2ccccc2)C1 ZINC000430301018 929546586 /nfs/dbraw/zinc/54/65/86/929546586.db2.gz PNOPZOWHSMIXRL-IRXDYDNUSA-N 1 1 367.449 3.949 20 5 FHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+](CCO)[C@@H]3CCCc4ccccc43)nc2c1 ZINC000083172249 929635181 /nfs/dbraw/zinc/63/51/81/929635181.db2.gz XWSKQWFAEKWRMX-GOSISDBHSA-N 1 1 367.405 3.608 20 5 FHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccc(Oc2cnccn2)cc1 ZINC000579977606 929741037 /nfs/dbraw/zinc/74/10/37/929741037.db2.gz JPXOKYOHPXKBNK-UHFFFAOYSA-N 1 1 364.405 3.852 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1C[C@H](O)c1cccs1 ZINC000175833461 929843017 /nfs/dbraw/zinc/84/30/17/929843017.db2.gz OUEYXTLQKNLQAR-HOCLYGCPSA-N 1 1 362.451 3.753 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@H](n2cnc3c2CCCC3)C1 ZINC000548010743 929937385 /nfs/dbraw/zinc/93/73/85/929937385.db2.gz ZLMXMRYKPIIJSA-NVXWUHKLSA-N 1 1 354.454 3.987 20 5 FHBDMO C[C@@H]1CCC[C@@H](C)[NH+]1CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC001167337637 929993759 /nfs/dbraw/zinc/99/37/59/929993759.db2.gz VCKMQOODHUPGPS-CHWSQXEVSA-N 1 1 374.466 3.920 20 5 FHBDMO C[C@@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000303538063 930379891 /nfs/dbraw/zinc/37/98/91/930379891.db2.gz TVSKGSHTUZFTMP-CQSZACIVSA-N 1 1 373.840 3.595 20 5 FHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000303538063 930379899 /nfs/dbraw/zinc/37/98/99/930379899.db2.gz TVSKGSHTUZFTMP-CQSZACIVSA-N 1 1 373.840 3.595 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1CN[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379654502 930497680 /nfs/dbraw/zinc/49/76/80/930497680.db2.gz IRFPXDDDBBKQJM-QFBILLFUSA-N 1 1 369.465 3.746 20 5 FHBDMO C[N@H+]1CCC[C@H](CNC(=O)c2ccc([N+](=O)[O-])s2)[C@H]1c1cccs1 ZINC000247260458 930531825 /nfs/dbraw/zinc/53/18/25/930531825.db2.gz FAVJKJHUWOJBBI-ABAIWWIYSA-N 1 1 365.480 3.531 20 5 FHBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[N@H+](C)C[C@H]1c1ccccc1 ZINC000580645820 930960502 /nfs/dbraw/zinc/96/05/02/930960502.db2.gz BDZJZFSQFZOVNV-IBGZPJMESA-N 1 1 368.437 3.678 20 5 FHBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[N@@H+](C)C[C@H]1c1ccccc1 ZINC000580645820 930960511 /nfs/dbraw/zinc/96/05/11/930960511.db2.gz BDZJZFSQFZOVNV-IBGZPJMESA-N 1 1 368.437 3.678 20 5 FHBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)CCN1Cc1c(F)cccc1[N+](=O)[O-] ZINC000610451900 931018207 /nfs/dbraw/zinc/01/82/07/931018207.db2.gz MIRKFRUFWVOAGO-MRXNPFEDSA-N 1 1 357.429 3.830 20 5 FHBDMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC001167434213 931140143 /nfs/dbraw/zinc/14/01/43/931140143.db2.gz SQXMKFXKBGSAOM-LALPHHSUSA-N 1 1 351.834 3.840 20 5 FHBDMO CCOc1cc(N2CC[C@@H]([N@@H+](C)Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000610515860 932333209 /nfs/dbraw/zinc/33/32/09/932333209.db2.gz CJGNYHCEGAZSFF-GOSISDBHSA-N 1 1 355.438 3.704 20 5 FHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@](O)(C(F)(F)F)CC2)c(Cl)c1 ZINC000285406720 932560560 /nfs/dbraw/zinc/56/05/60/932560560.db2.gz CVNPXKPSUQOCOE-CYBMUJFWSA-N 1 1 352.740 3.528 20 5 FHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@](O)(C(F)(F)F)CC2)c(Cl)c1 ZINC000285406720 932560563 /nfs/dbraw/zinc/56/05/63/932560563.db2.gz CVNPXKPSUQOCOE-CYBMUJFWSA-N 1 1 352.740 3.528 20 5 FHBDMO C[C@H]1CCCC[N@H+]1CCC1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000157460740 932565751 /nfs/dbraw/zinc/56/57/51/932565751.db2.gz FOFZZSBZLKEZIG-INIZCTEOSA-N 1 1 359.470 3.712 20 5 FHBDMO COc1ccc(C[N@@H+](C)Cc2ccc(OC(F)F)cc2)cc1[N+](=O)[O-] ZINC000051212582 932612548 /nfs/dbraw/zinc/61/25/48/932612548.db2.gz OGLSZQJGRVWBEK-UHFFFAOYSA-N 1 1 352.337 3.837 20 5 FHBDMO Cc1sc(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000430654455 932614604 /nfs/dbraw/zinc/61/46/04/932614604.db2.gz RTIMHEDBONVMBG-CZUORRHYSA-N 1 1 373.478 3.748 20 5 FHBDMO C[N@H+]1CCC[C@H](CNC(=O)c2csc([N+](=O)[O-])c2)[C@H]1c1cccs1 ZINC000247417980 932955466 /nfs/dbraw/zinc/95/54/66/932955466.db2.gz NSYJPQLMDXVSIR-ABAIWWIYSA-N 1 1 365.480 3.531 20 5 FHBDMO Cn1cc([C@H]([NH2+]C/C=C/c2ccccc2[N+](=O)[O-])c2ccc(F)cc2)cn1 ZINC000187512093 932966464 /nfs/dbraw/zinc/96/64/64/932966464.db2.gz BSZVXHOASMXZIO-PEAOBZDDSA-N 1 1 366.396 3.860 20 5 FHBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCCCC[N@@H+]1CCC[C@H](C)C1 ZINC000588444424 933100871 /nfs/dbraw/zinc/10/08/71/933100871.db2.gz AQGSKBADWOZUGL-GDGUIRGDSA-N 1 1 359.470 3.626 20 5 FHBDMO Cc1cccc(C)c1C[N@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000933768632 933492465 /nfs/dbraw/zinc/49/24/65/933492465.db2.gz PJKDPTFIABVXGV-UHFFFAOYSA-N 1 1 352.394 3.894 20 5 FHBDMO Cc1cccc(C)c1C[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000933768632 933492466 /nfs/dbraw/zinc/49/24/66/933492466.db2.gz PJKDPTFIABVXGV-UHFFFAOYSA-N 1 1 352.394 3.894 20 5 FHBDMO Cc1ccc([C@@H](C)NC(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)cc1[N+](=O)[O-] ZINC000610644920 933595627 /nfs/dbraw/zinc/59/56/27/933595627.db2.gz PPYMPZKXBGWZMF-NXHRZFHOSA-N 1 1 374.485 3.621 20 5 FHBDMO Cc1cc(Cl)cc(C)c1C[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000535785570 934374553 /nfs/dbraw/zinc/37/45/53/934374553.db2.gz XWCIVQIZKCHCGC-UHFFFAOYSA-N 1 1 360.845 3.582 20 5 FHBDMO Cc1ncc2c(n1)CC[N@@H+](Cc1ccc(-c3ccc([N+](=O)[O-])cc3)s1)C2 ZINC000535790155 934381591 /nfs/dbraw/zinc/38/15/91/934381591.db2.gz PWQGEPFIMPJSTK-UHFFFAOYSA-N 1 1 366.446 3.980 20 5 FHBDMO Cc1ncc2c(n1)CC[N@H+](Cc1ccc(-c3ccc([N+](=O)[O-])cc3)s1)C2 ZINC000535790155 934381602 /nfs/dbraw/zinc/38/16/02/934381602.db2.gz PWQGEPFIMPJSTK-UHFFFAOYSA-N 1 1 366.446 3.980 20 5 FHBDMO CC[C@H]1C[N@@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)C[C@H]1O ZINC000535810286 934418643 /nfs/dbraw/zinc/41/86/43/934418643.db2.gz BOOOBWONVHBRJP-OXJNMPFZSA-N 1 1 355.438 3.565 20 5 FHBDMO C[N@H+]1CCC[C@H](NC(=O)c2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)C1 ZINC000610859164 934533274 /nfs/dbraw/zinc/53/32/74/934533274.db2.gz FYDWAPJAKDGBGS-HNNXBMFYSA-N 1 1 371.462 3.570 20 5 FHBDMO Cn1cc[nH+]c1C[C@H](Nc1ncc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000610929468 934626487 /nfs/dbraw/zinc/62/64/87/934626487.db2.gz LSBPEOCBHOOTER-AWEZNQCLSA-N 1 1 357.801 3.773 20 5 FHBDMO COc1ccc([C@@H]2CCC[N@@H+]2Cc2cc3c(cc2[N+](=O)[O-])OCCO3)cc1 ZINC000610931005 934632641 /nfs/dbraw/zinc/63/26/41/934632641.db2.gz BHCUMEGKRDTJTI-KRWDZBQOSA-N 1 1 370.405 3.712 20 5 FHBDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2cc3c(cc2[N+](=O)[O-])OCCO3)cc1 ZINC000610931005 934632642 /nfs/dbraw/zinc/63/26/42/934632642.db2.gz BHCUMEGKRDTJTI-KRWDZBQOSA-N 1 1 370.405 3.712 20 5 FHBDMO Cn1ccnc1[C@H]([NH2+]CC(C)(C)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000611560353 934823199 /nfs/dbraw/zinc/82/31/99/934823199.db2.gz WJNMIPRSXDQMOV-LJQANCHMSA-N 1 1 364.449 3.985 20 5 FHBDMO COc1ccc(OC)c(C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000065533728 934963731 /nfs/dbraw/zinc/96/37/31/934963731.db2.gz ZLSQADNYXHPIMK-UHFFFAOYSA-N 1 1 372.421 3.655 20 5 FHBDMO C[C@@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1 ZINC000119684113 935036554 /nfs/dbraw/zinc/03/65/54/935036554.db2.gz PFXLPZLDVZOHGJ-SNVBAGLBSA-N 1 1 367.327 3.563 20 5 FHBDMO CCO[C@@H]1C[C@H]([N@@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C12CCCCC2 ZINC001167539093 935151337 /nfs/dbraw/zinc/15/13/37/935151337.db2.gz IUHPBQRTNYQEAQ-CEXWTWQISA-N 1 1 362.470 3.688 20 5 FHBDMO COc1cc(C[N@H+]2CC[C@@H]3CCC[C@@H]32)c([N+](=O)[O-])cc1OCC(F)F ZINC000426525990 945080890 /nfs/dbraw/zinc/08/08/90/945080890.db2.gz SYTSXBMVNQLWHP-AAEUAGOBSA-N 1 1 356.369 3.622 20 5 FHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+](Cc1cccs1)C[C@H]1CCCO1 ZINC000051429998 935247009 /nfs/dbraw/zinc/24/70/09/935247009.db2.gz RPVQNCPHUOULBY-OAHLLOKOSA-N 1 1 362.451 3.716 20 5 FHBDMO C[N@@H+](CCCc1nc(-c2ccccc2)no1)CCc1ccccc1[N+](=O)[O-] ZINC000511080982 935309649 /nfs/dbraw/zinc/30/96/49/935309649.db2.gz KZNYCNCAMUZOSB-UHFFFAOYSA-N 1 1 366.421 3.752 20 5 FHBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000119888194 935319152 /nfs/dbraw/zinc/31/91/52/935319152.db2.gz WWQUECQTORUVCV-IPELMVKDSA-N 1 1 371.437 3.538 20 5 FHBDMO C[C@H](C(=O)NCc1cccs1)[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451545181 935437794 /nfs/dbraw/zinc/43/77/94/935437794.db2.gz GWRCUIWOBAKJTE-GDBMZVCRSA-N 1 1 373.478 3.541 20 5 FHBDMO C[C@H](C(=O)NCc1cccs1)[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451545181 935437796 /nfs/dbraw/zinc/43/77/96/935437796.db2.gz GWRCUIWOBAKJTE-GDBMZVCRSA-N 1 1 373.478 3.541 20 5 FHBDMO C[C@H](NCc1ccc([N+](=O)[O-])cc1F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381711595 935544367 /nfs/dbraw/zinc/54/43/67/935544367.db2.gz JIBHNNDYKMFFCG-YJBOKZPZSA-N 1 1 357.429 3.734 20 5 FHBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@@H](c3cccc(C(F)(F)F)c3)C2)n1 ZINC000511103242 935574273 /nfs/dbraw/zinc/57/42/73/935574273.db2.gz BTXGPUBOXOVGKN-CQSZACIVSA-N 1 1 368.359 3.690 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCCC[N@H+](C)Cc1ccccc1 ZINC000127527192 935607120 /nfs/dbraw/zinc/60/71/20/935607120.db2.gz VMQQLTNHRUVBHA-UHFFFAOYSA-N 1 1 370.453 3.855 20 5 FHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccn(-c2ccc(F)cc2F)n1 ZINC000511111999 935624695 /nfs/dbraw/zinc/62/46/95/935624695.db2.gz XHKYEJNSGUCZBW-UHFFFAOYSA-N 1 1 372.375 3.733 20 5 FHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccn(-c2ccc(F)cc2F)n1 ZINC000511111999 935624698 /nfs/dbraw/zinc/62/46/98/935624698.db2.gz XHKYEJNSGUCZBW-UHFFFAOYSA-N 1 1 372.375 3.733 20 5 FHBDMO C[C@H](CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)[N@H+]1CCCC[C@@H]1C ZINC000478562593 935646028 /nfs/dbraw/zinc/64/60/28/935646028.db2.gz PJNGRHXKPICJBV-QWHCGFSZSA-N 1 1 361.467 3.802 20 5 FHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1nc(-c2ccc(Cl)cc2)no1 ZINC000511124614 935693844 /nfs/dbraw/zinc/69/38/44/935693844.db2.gz SWXCWPSQQUNIBD-UHFFFAOYSA-N 1 1 372.812 3.973 20 5 FHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1nc(-c2ccc(Cl)cc2)no1 ZINC000511124614 935693847 /nfs/dbraw/zinc/69/38/47/935693847.db2.gz SWXCWPSQQUNIBD-UHFFFAOYSA-N 1 1 372.812 3.973 20 5 FHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H](O)Cc1ccc2ccccc2c1 ZINC000511123315 935698897 /nfs/dbraw/zinc/69/88/97/935698897.db2.gz IINIVMLHUWCBAO-OAQYLSRUSA-N 1 1 364.445 3.826 20 5 FHBDMO CCn1cnnc1C[NH2+][C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000158342978 935744706 /nfs/dbraw/zinc/74/47/06/935744706.db2.gz PHBLYUNLTCHNIN-LBPRGKRZSA-N 1 1 357.439 3.786 20 5 FHBDMO CSc1ccccc1NC(=O)[C@H](C)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511141982 935778365 /nfs/dbraw/zinc/77/83/65/935778365.db2.gz XYKZJHWGOYDKFU-AWEZNQCLSA-N 1 1 373.478 3.818 20 5 FHBDMO CSc1ccccc1NC(=O)[C@H](C)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511141982 935778368 /nfs/dbraw/zinc/77/83/68/935778368.db2.gz XYKZJHWGOYDKFU-AWEZNQCLSA-N 1 1 373.478 3.818 20 5 FHBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000511790406 945130889 /nfs/dbraw/zinc/13/08/89/945130889.db2.gz YSMYZWZZOCUWTB-IBGZPJMESA-N 1 1 367.449 3.625 20 5 FHBDMO COc1ccc(OCC[N@H+]2CC[C@@H](c3ccccc3)[C@H]2C)c([N+](=O)[O-])c1 ZINC001167599142 935943179 /nfs/dbraw/zinc/94/31/79/935943179.db2.gz PMGROUILCMNQGY-CRAIPNDOSA-N 1 1 356.422 3.860 20 5 FHBDMO CC[C@H](C)[N@@H+](C)CCNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000277801269 935960560 /nfs/dbraw/zinc/96/05/60/935960560.db2.gz WHTFALAZNJIKHQ-AWEZNQCLSA-N 1 1 351.450 3.554 20 5 FHBDMO COc1cccc([N+](=O)[O-])c1NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000516682651 945137633 /nfs/dbraw/zinc/13/76/33/945137633.db2.gz BGGJCZLCCPNLLS-KRWDZBQOSA-N 1 1 355.438 3.580 20 5 FHBDMO C[C@H](Cc1cccs1)[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC001167609094 936050330 /nfs/dbraw/zinc/05/03/30/936050330.db2.gz SAEXVEPQNPCMJK-GFCCVEGCSA-N 1 1 365.430 3.687 20 5 FHBDMO COc1ccc(C[NH2+][C@@H](C)c2nc(-c3ccncc3)cs2)cc1[N+](=O)[O-] ZINC000124115935 945153502 /nfs/dbraw/zinc/15/35/02/945153502.db2.gz RFCPQUWFSQNEDC-LBPRGKRZSA-N 1 1 370.434 3.973 20 5 FHBDMO O=[N+]([O-])c1ccc(CN2CC[NH+](Cc3cccs3)CC2)c(Cl)c1 ZINC000611772979 938285909 /nfs/dbraw/zinc/28/59/09/938285909.db2.gz FTEUSPRVMKHFEI-UHFFFAOYSA-N 1 1 351.859 3.628 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H](CNC(=O)C(C)(C)C)C1 ZINC000245529131 938302842 /nfs/dbraw/zinc/30/28/42/938302842.db2.gz QYKRCNSOVZTPNQ-HOTGVXAUSA-N 1 1 361.486 3.839 20 5 FHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@H](c3nc4ccccc4o3)C2)c1 ZINC000052611788 938435598 /nfs/dbraw/zinc/43/55/98/938435598.db2.gz JHZQKTYZKNZCHQ-HNNXBMFYSA-N 1 1 367.405 3.994 20 5 FHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@@H](c3nc4ccccc4o3)C2)c1 ZINC000052611787 938436166 /nfs/dbraw/zinc/43/61/66/938436166.db2.gz JHZQKTYZKNZCHQ-OAHLLOKOSA-N 1 1 367.405 3.994 20 5 FHBDMO C[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1csc2ccccc12 ZINC000052805473 938605169 /nfs/dbraw/zinc/60/51/69/938605169.db2.gz CCBJHFWYXNVZHU-UHFFFAOYSA-N 1 1 355.419 3.880 20 5 FHBDMO C[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1csc2ccccc12 ZINC000052805473 938605171 /nfs/dbraw/zinc/60/51/71/938605171.db2.gz CCBJHFWYXNVZHU-UHFFFAOYSA-N 1 1 355.419 3.880 20 5 FHBDMO CC[C@@H](c1cccc(OC)c1)[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000584315394 938683669 /nfs/dbraw/zinc/68/36/69/938683669.db2.gz WQGRWKRZCIYFOV-IBGZPJMESA-N 1 1 371.437 3.933 20 5 FHBDMO CC[C@@H](c1cccc(OC)c1)[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000584315394 938683671 /nfs/dbraw/zinc/68/36/71/938683671.db2.gz WQGRWKRZCIYFOV-IBGZPJMESA-N 1 1 371.437 3.933 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H](Cc2ccccc2)[C@@H]1C ZINC000472341977 939001175 /nfs/dbraw/zinc/00/11/75/939001175.db2.gz IBFIPHMORVLIFN-FUHWJXTLSA-N 1 1 367.449 3.795 20 5 FHBDMO CSc1cccc(C(=O)NCCCC[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-] ZINC000188060112 939017436 /nfs/dbraw/zinc/01/74/36/939017436.db2.gz BHXOZUOEUGVYHQ-AWEZNQCLSA-N 1 1 365.499 3.559 20 5 FHBDMO O=[N+]([O-])c1ncccc1N[C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000612101929 939050588 /nfs/dbraw/zinc/05/05/88/939050588.db2.gz YRCYXRUGRZHCDR-RCCFBDPRSA-N 1 1 352.438 3.702 20 5 FHBDMO COc1ccc(-c2ccc(CN[C@H](C)C[NH+]3CCCCC3)o2)c([N+](=O)[O-])c1 ZINC000518268724 945274226 /nfs/dbraw/zinc/27/42/26/945274226.db2.gz SHPXZGSXQLMZJV-OAHLLOKOSA-N 1 1 373.453 3.827 20 5 FHBDMO Cc1cccc([C@@H]2CCC[N@H+]2C[C@@H](O)COc2ccccc2[N+](=O)[O-])c1C ZINC000544143119 945277291 /nfs/dbraw/zinc/27/72/91/945277291.db2.gz YCKHOPOAJSKMAI-MJGOQNOKSA-N 1 1 370.449 3.788 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1C[C@H](O)c1ccco1 ZINC000177129677 939943163 /nfs/dbraw/zinc/94/31/63/939943163.db2.gz WKTWZWSSMFEGEZ-RDJZCZTQSA-N 1 1 360.410 3.675 20 5 FHBDMO CC[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@H](C)c1ccc(F)cc1 ZINC000053088526 939962819 /nfs/dbraw/zinc/96/28/19/939962819.db2.gz NSPGKMATUHSSQO-CQSZACIVSA-N 1 1 359.401 3.780 20 5 FHBDMO CC[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@H](C)c1ccc(F)cc1 ZINC000053088526 939962822 /nfs/dbraw/zinc/96/28/22/939962822.db2.gz NSPGKMATUHSSQO-CQSZACIVSA-N 1 1 359.401 3.780 20 5 FHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2ccccc2)C[C@@H](O)c2ccco2)c1 ZINC000177151439 939965006 /nfs/dbraw/zinc/96/50/06/939965006.db2.gz URPXJMKTIVGEAF-LJQANCHMSA-N 1 1 352.390 3.924 20 5 FHBDMO C[C@@](O)(C1CC[NH+](C/C=C\c2ccccc2[N+](=O)[O-])CC1)C(F)(F)F ZINC000545244331 940028254 /nfs/dbraw/zinc/02/82/54/940028254.db2.gz NMHAXTXCVYVCFK-DQOPKJQZSA-N 1 1 358.360 3.633 20 5 FHBDMO CCc1ccc([C@H](C)NC(=O)C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000548935342 940104145 /nfs/dbraw/zinc/10/41/45/940104145.db2.gz JJLHBXLEMQMQEZ-INIZCTEOSA-N 1 1 369.465 3.509 20 5 FHBDMO CCc1ccc([C@H](C)NC(=O)C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000548935342 940104148 /nfs/dbraw/zinc/10/41/48/940104148.db2.gz JJLHBXLEMQMQEZ-INIZCTEOSA-N 1 1 369.465 3.509 20 5 FHBDMO CC(C)[C@@H](CNCc1csc([N+](=O)[O-])c1)[N@@H+]1CCc2ccccc2C1 ZINC000236701671 940163296 /nfs/dbraw/zinc/16/32/96/940163296.db2.gz GBTPPYFIJCHUKK-GOSISDBHSA-N 1 1 359.495 3.829 20 5 FHBDMO CC(C)[C@@H](CNCc1csc([N+](=O)[O-])c1)[N@H+]1CCc2ccccc2C1 ZINC000236701671 940163298 /nfs/dbraw/zinc/16/32/98/940163298.db2.gz GBTPPYFIJCHUKK-GOSISDBHSA-N 1 1 359.495 3.829 20 5 FHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@]2(C1)CC(=O)c1ccccc1O2 ZINC000411984791 940173316 /nfs/dbraw/zinc/17/33/16/940173316.db2.gz NFFSGKGRNMXNFI-XOBRGWDASA-N 1 1 352.390 3.766 20 5 FHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@]2(C1)CC(=O)c1ccccc1O2 ZINC000411984791 940173318 /nfs/dbraw/zinc/17/33/18/940173318.db2.gz NFFSGKGRNMXNFI-XOBRGWDASA-N 1 1 352.390 3.766 20 5 FHBDMO CC(C)(C)[N@H+](CC(=O)Nc1ccc(F)cc1)Cc1cccc([N+](=O)[O-])c1 ZINC000506789626 945317708 /nfs/dbraw/zinc/31/77/08/945317708.db2.gz IKJOHIWEJPMGGK-UHFFFAOYSA-N 1 1 359.401 3.973 20 5 FHBDMO CC(C)(C)[N@@H+](CC(=O)Nc1ccc(F)cc1)Cc1cccc([N+](=O)[O-])c1 ZINC000506789626 945317715 /nfs/dbraw/zinc/31/77/15/945317715.db2.gz IKJOHIWEJPMGGK-UHFFFAOYSA-N 1 1 359.401 3.973 20 5 FHBDMO O=[N+]([O-])c1cccc([C@@H](NC[C@H]2CC[N@H+](C3CC3)C2)c2ccccc2)c1 ZINC000180095175 940468285 /nfs/dbraw/zinc/46/82/85/940468285.db2.gz QWLJLZDONMSOLU-IERDGZPVSA-N 1 1 351.450 3.758 20 5 FHBDMO Cc1ccc(Sc2ccc(C[N@@H+](CC(N)=O)C(C)C)cc2[N+](=O)[O-])cc1 ZINC000506790966 945329799 /nfs/dbraw/zinc/32/97/99/945329799.db2.gz VOTQGQXTYIGPDS-UHFFFAOYSA-N 1 1 373.478 3.750 20 5 FHBDMO Cc1ccc(Sc2ccc(C[N@H+](CC(N)=O)C(C)C)cc2[N+](=O)[O-])cc1 ZINC000506790966 945329806 /nfs/dbraw/zinc/32/98/06/945329806.db2.gz VOTQGQXTYIGPDS-UHFFFAOYSA-N 1 1 373.478 3.750 20 5 FHBDMO CC[C@@H]1CCC[N@H+]1Cc1cc(OC)c(OCC(F)(F)F)cc1[N+](=O)[O-] ZINC000511479152 940593620 /nfs/dbraw/zinc/59/36/20/940593620.db2.gz PXYOFXMLKVOYBN-GFCCVEGCSA-N 1 1 362.348 3.919 20 5 FHBDMO COc1cc(C[N@@H+]2CC3(CCOCC3)[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000412015865 940691965 /nfs/dbraw/zinc/69/19/65/940691965.db2.gz UILNKANSFWLGRB-HXUWFJFHSA-N 1 1 368.433 3.957 20 5 FHBDMO COc1cc(C[N@H+]2CC3(CCOCC3)[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000412015865 940691970 /nfs/dbraw/zinc/69/19/70/940691970.db2.gz UILNKANSFWLGRB-HXUWFJFHSA-N 1 1 368.433 3.957 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCN(c2nccc(C(C)C)n2)CC1 ZINC000613498662 940787271 /nfs/dbraw/zinc/78/72/71/940787271.db2.gz RTSUWNDIFNCHSZ-MRXNPFEDSA-N 1 1 369.469 3.700 20 5 FHBDMO CCC[C@H]([NH2+]Cc1ccccc1S(C)(=O)=O)c1cccc([N+](=O)[O-])c1 ZINC000414229121 940800967 /nfs/dbraw/zinc/80/09/67/940800967.db2.gz FBQYQUUZMMRNGS-KRWDZBQOSA-N 1 1 362.451 3.629 20 5 FHBDMO CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000180220554 940829121 /nfs/dbraw/zinc/82/91/21/940829121.db2.gz CSYSNZMEOHVXBX-KGLIPLIRSA-N 1 1 365.499 3.650 20 5 FHBDMO C[C@@H]([NH2+]CC(=O)Nc1nc(-c2ccco2)cs1)c1cccc([N+](=O)[O-])c1 ZINC000180433537 941014382 /nfs/dbraw/zinc/01/43/82/941014382.db2.gz YFLARMCGZIGUQZ-LLVKDONJSA-N 1 1 372.406 3.601 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCO[C@@H]([C@@H]4CCCO4)C3)s2)cc1 ZINC000180560506 941048104 /nfs/dbraw/zinc/04/81/04/941048104.db2.gz PEBJPJWBMVFBRH-ZWKOTPCHSA-N 1 1 374.462 3.703 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCO[C@@H]([C@@H]4CCCO4)C3)s2)cc1 ZINC000180560506 941048106 /nfs/dbraw/zinc/04/81/06/941048106.db2.gz PEBJPJWBMVFBRH-ZWKOTPCHSA-N 1 1 374.462 3.703 20 5 FHBDMO CC(=O)c1cc(N2CCC[C@H](c3[nH+]cc4n3CCCC4)C2)ccc1[N+](=O)[O-] ZINC000376474982 941067006 /nfs/dbraw/zinc/06/70/06/941067006.db2.gz QIBIQEOTUKJFDP-HNNXBMFYSA-N 1 1 368.437 3.714 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@H](c2nncn2C2CC2)C1 ZINC000180860642 941086051 /nfs/dbraw/zinc/08/60/51/941086051.db2.gz YUMBVHGDHMABRT-ZDUSSCGKSA-N 1 1 361.833 3.554 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@H](c2nncn2C2CC2)C1 ZINC000180860642 941086053 /nfs/dbraw/zinc/08/60/53/941086053.db2.gz YUMBVHGDHMABRT-ZDUSSCGKSA-N 1 1 361.833 3.554 20 5 FHBDMO Cc1nc(C[NH+]2CCC(CNc3nc(C)cc(C)c3[N+](=O)[O-])CC2)oc1C ZINC000541005685 941101373 /nfs/dbraw/zinc/10/13/73/941101373.db2.gz ZKVYCDHRFUAORE-UHFFFAOYSA-N 1 1 373.457 3.536 20 5 FHBDMO CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000181380882 941141135 /nfs/dbraw/zinc/14/11/35/941141135.db2.gz ZSVQCXRPESHXJX-CQSZACIVSA-N 1 1 365.499 3.509 20 5 FHBDMO O=C(N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000311251125 941151622 /nfs/dbraw/zinc/15/16/22/941151622.db2.gz PDPQELFAEFPTIJ-OAHLLOKOSA-N 1 1 373.840 3.643 20 5 FHBDMO COc1cccc(NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000311405452 941281396 /nfs/dbraw/zinc/28/13/96/941281396.db2.gz WEMFAKGPZAINAA-KRWDZBQOSA-N 1 1 355.438 3.928 20 5 FHBDMO COC(=O)C[C@](C)([NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1)c1ccncc1 ZINC000190020863 941346548 /nfs/dbraw/zinc/34/65/48/941346548.db2.gz LIVWPYCXOWBKNR-FQEVSTJZSA-N 1 1 371.437 3.681 20 5 FHBDMO [NH3+][C@@H]1CC[C@@H]2CN(Cc3ccc(-c4ccc([N+](=O)[O-])cc4Cl)o3)C[C@H]12 ZINC000414675502 941433706 /nfs/dbraw/zinc/43/37/06/941433706.db2.gz TXSQTWOMSHIKSG-XQAQDONZSA-N 1 1 361.829 3.677 20 5 FHBDMO COc1c(O)ccc(C[NH2+]Cc2ccccc2C(F)(F)F)c1[N+](=O)[O-] ZINC000892740695 941505854 /nfs/dbraw/zinc/50/58/54/941505854.db2.gz LMHWZUMTMDKWEI-UHFFFAOYSA-N 1 1 356.300 3.618 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(CN3CCCC[C@@H]3[C@H]3CC[NH2+]C3)o2)cc1 ZINC000415036619 941552911 /nfs/dbraw/zinc/55/29/11/941552911.db2.gz FPYALCNMILFWHJ-QFBILLFUSA-N 1 1 355.438 3.819 20 5 FHBDMO CC1=C(c2ccco2)C[N@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000549162248 941560574 /nfs/dbraw/zinc/56/05/74/941560574.db2.gz OLVRYFFSJVFEOY-AWEZNQCLSA-N 1 1 355.394 3.694 20 5 FHBDMO CC1=C(c2ccco2)C[N@@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000549162248 941560576 /nfs/dbraw/zinc/56/05/76/941560576.db2.gz OLVRYFFSJVFEOY-AWEZNQCLSA-N 1 1 355.394 3.694 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2ccc(CN3CCCC[C@@H]3[C@H]3CC[NH2+]C3)o2)c1 ZINC000415057757 941570610 /nfs/dbraw/zinc/57/06/10/941570610.db2.gz URVPNIATTPQHPE-QFBILLFUSA-N 1 1 355.438 3.819 20 5 FHBDMO CC(C)[N@@H+](C)CCNCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000236652386 941592824 /nfs/dbraw/zinc/59/28/24/941592824.db2.gz MCBAMMJGAVYOEI-UHFFFAOYSA-N 1 1 361.417 3.956 20 5 FHBDMO CC(C)N(C)CC[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000236652386 941592830 /nfs/dbraw/zinc/59/28/30/941592830.db2.gz MCBAMMJGAVYOEI-UHFFFAOYSA-N 1 1 361.417 3.956 20 5 FHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(c2nc3ccccc3cc2[N+](=O)[O-])C1 ZINC000473521431 941743846 /nfs/dbraw/zinc/74/38/46/941743846.db2.gz OVGAQXSBOOAPIU-UXLLHSPISA-N 1 1 354.454 3.985 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@H](C)C[C@@H]1c1ccccc1 ZINC000513261188 941814082 /nfs/dbraw/zinc/81/40/82/941814082.db2.gz MCTCQNMHQWPKJF-AUUYWEPGSA-N 1 1 353.422 3.925 20 5 FHBDMO COc1ccccc1O[C@@H]1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000513361367 941869450 /nfs/dbraw/zinc/86/94/50/941869450.db2.gz JNSFQIXHMFTEKZ-GOSISDBHSA-N 1 1 372.421 3.526 20 5 FHBDMO COc1ccccc1O[C@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000513386810 941884710 /nfs/dbraw/zinc/88/47/10/941884710.db2.gz QQFOGZUFFQRNEA-INIZCTEOSA-N 1 1 372.421 3.526 20 5 FHBDMO CC(C)[C@@H](C)[N@@H+](C)CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000433782230 941888303 /nfs/dbraw/zinc/88/83/03/941888303.db2.gz HRLRDQGVJRBHEU-GFCCVEGCSA-N 1 1 362.455 3.633 20 5 FHBDMO Cc1cccc(NC2CCN(C(=O)Nc3cccc([N+](=O)[O-])c3C)CC2)[nH+]1 ZINC000377713482 941919533 /nfs/dbraw/zinc/91/95/33/941919533.db2.gz XSCZZEGCZFMABK-UHFFFAOYSA-N 1 1 369.425 3.715 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)Cc1ccccc1N1CCOCC1 ZINC000182618891 941947742 /nfs/dbraw/zinc/94/77/42/941947742.db2.gz QOHLBEJDFYZGGE-KRWDZBQOSA-N 1 1 369.465 3.933 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H](c3cccc(F)c3)C2)c2c(c1)COCO2 ZINC000513461201 941948876 /nfs/dbraw/zinc/94/88/76/941948876.db2.gz KSFSNQUAIDEDQF-AWEZNQCLSA-N 1 1 358.369 3.590 20 5 FHBDMO C[N@@H+](Cc1ccccc1)C1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000513548070 942007041 /nfs/dbraw/zinc/00/70/41/942007041.db2.gz IJQUHVMIJQANFH-UHFFFAOYSA-N 1 1 374.828 3.596 20 5 FHBDMO Cc1cccc(CC[NH2+][C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)c1 ZINC000513654027 942057561 /nfs/dbraw/zinc/05/75/61/942057561.db2.gz GVRKVEXBTFNQIW-LJQANCHMSA-N 1 1 350.422 3.558 20 5 FHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@H](Oc4cccc(F)c4)C3)nc2c1 ZINC000183381398 942151960 /nfs/dbraw/zinc/15/19/60/942151960.db2.gz LRXBQQGRXUXTMD-HNNXBMFYSA-N 1 1 357.341 3.528 20 5 FHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@H](Oc4cccc(F)c4)C3)nc2c1 ZINC000183381398 942151965 /nfs/dbraw/zinc/15/19/65/942151965.db2.gz LRXBQQGRXUXTMD-HNNXBMFYSA-N 1 1 357.341 3.528 20 5 FHBDMO COc1cc(C[N@@H+]2CCC[C@H](CC(F)(F)F)C2)c([N+](=O)[O-])cc1F ZINC000420940515 942265841 /nfs/dbraw/zinc/26/58/41/942265841.db2.gz DJYGKVXLFGQHPF-SNVBAGLBSA-N 1 1 350.312 3.907 20 5 FHBDMO COc1cc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)c([N+](=O)[O-])cc1F ZINC000420940515 942265842 /nfs/dbraw/zinc/26/58/42/942265842.db2.gz DJYGKVXLFGQHPF-SNVBAGLBSA-N 1 1 350.312 3.907 20 5 FHBDMO O=C(CC[N@H+]1CCC[C@@H](CC(F)(F)F)C1)Nc1ccccc1[N+](=O)[O-] ZINC000420957456 942276356 /nfs/dbraw/zinc/27/63/56/942276356.db2.gz ZOBSUSPVUIHYSM-LBPRGKRZSA-N 1 1 359.348 3.588 20 5 FHBDMO CN(C)[C@H](C[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)C1CC1 ZINC000237029826 942314573 /nfs/dbraw/zinc/31/45/73/942314573.db2.gz OELUVVCDIFFNMK-LJQANCHMSA-N 1 1 373.428 3.956 20 5 FHBDMO CC[C@@H](NC(=O)N1CCC([N@H+]2CCC[C@H]2C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000366440046 942346351 /nfs/dbraw/zinc/34/63/51/942346351.db2.gz UBBQBIXIRMBKMY-DNVCBOLYSA-N 1 1 374.485 3.704 20 5 FHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](c3ccncn3)C2)c(C(F)(F)F)c1 ZINC000378222415 942416880 /nfs/dbraw/zinc/41/68/80/942416880.db2.gz WEMYYCAKWMZXNM-ZDUSSCGKSA-N 1 1 366.343 3.783 20 5 FHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](c3ccncn3)C2)c(C(F)(F)F)c1 ZINC000378222415 942416884 /nfs/dbraw/zinc/41/68/84/942416884.db2.gz WEMYYCAKWMZXNM-ZDUSSCGKSA-N 1 1 366.343 3.783 20 5 FHBDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000502443422 942455573 /nfs/dbraw/zinc/45/55/73/942455573.db2.gz GKGBELWPAATWBB-CQSZACIVSA-N 1 1 353.850 3.633 20 5 FHBDMO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C1(c2noc(C(F)F)n2)CCC1 ZINC000366536441 942550427 /nfs/dbraw/zinc/55/04/27/942550427.db2.gz QVUJVXLRCKDCSY-NSHDSACASA-N 1 1 366.368 3.906 20 5 FHBDMO COc1cccc([C@@H]2[C@@H](Nc3ncc([N+](=O)[O-])cc3F)CC[N@H+]2C2CC2)c1 ZINC000413246426 942560983 /nfs/dbraw/zinc/56/09/83/942560983.db2.gz ZNDRTHQCHVRMNN-ZWKOTPCHSA-N 1 1 372.400 3.527 20 5 FHBDMO O=[N+]([O-])c1ccc2ncnc(N[C@H]3CCC[N@@H+](Cc4ccccc4)C3)c2c1 ZINC000312139533 942625369 /nfs/dbraw/zinc/62/53/69/942625369.db2.gz TXJXGCZYIIPSJI-INIZCTEOSA-N 1 1 363.421 3.615 20 5 FHBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000501758452 942661627 /nfs/dbraw/zinc/66/16/27/942661627.db2.gz YFKMFJZVKTXITG-BETUJISGSA-N 1 1 368.865 3.738 20 5 FHBDMO Cc1cc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)cn2cc[nH+]c12 ZINC000502751584 942717453 /nfs/dbraw/zinc/71/74/53/942717453.db2.gz BBCSRDUJHQXPIT-UHFFFAOYSA-N 1 1 356.357 3.606 20 5 FHBDMO Cc1ccc([C@@H]2CC[N@@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000541391914 942758526 /nfs/dbraw/zinc/75/85/26/942758526.db2.gz DDJFNUNSITUFBF-QGZVFWFLSA-N 1 1 353.422 3.721 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000421740735 942780989 /nfs/dbraw/zinc/78/09/89/942780989.db2.gz LOJCYKHZCIWRIK-UHFFFAOYSA-N 1 1 367.449 3.560 20 5 FHBDMO Cc1cc(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cn2cc[nH+]c12 ZINC000502830119 942783248 /nfs/dbraw/zinc/78/32/48/942783248.db2.gz KPNOVWWXBOCROY-GFCCVEGCSA-N 1 1 356.407 3.670 20 5 FHBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)c2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000421746123 942793349 /nfs/dbraw/zinc/79/33/49/942793349.db2.gz AMKBSSFEUMEJRI-UHFFFAOYSA-N 1 1 355.438 3.593 20 5 FHBDMO Cc1ccc([C@]2(C)CC[N@H+](CC(=O)N(C)c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000434747004 942937744 /nfs/dbraw/zinc/93/77/44/942937744.db2.gz NSYBFJNVMRGYGS-OAQYLSRUSA-N 1 1 367.449 3.530 20 5 FHBDMO CCN(CC)c1ncc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000183799396 943185859 /nfs/dbraw/zinc/18/58/59/943185859.db2.gz WUCNJPITAYXZLE-UHFFFAOYSA-N 1 1 354.863 3.841 20 5 FHBDMO O=[N+]([O-])c1cccc(F)c1CN1CCC[N@@H+](Cc2ccc(F)cc2)CC1 ZINC000505615260 943194289 /nfs/dbraw/zinc/19/42/89/943194289.db2.gz RWYFMMSFLZVPTH-UHFFFAOYSA-N 1 1 361.392 3.581 20 5 FHBDMO COc1cccc(C[N@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000505627969 943237099 /nfs/dbraw/zinc/23/70/99/943237099.db2.gz BWAMBCNQFQLCOI-UHFFFAOYSA-N 1 1 352.337 3.837 20 5 FHBDMO COc1cccc(C[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000505627969 943237107 /nfs/dbraw/zinc/23/71/07/943237107.db2.gz BWAMBCNQFQLCOI-UHFFFAOYSA-N 1 1 352.337 3.837 20 5 FHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCc3c(Br)cccc3C2)cc1 ZINC000503561940 943249435 /nfs/dbraw/zinc/24/94/35/943249435.db2.gz HDYFTGZGRVUIPD-UHFFFAOYSA-N 1 1 361.239 3.958 20 5 FHBDMO CCOC(=O)[C@H]1CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000435234966 943271916 /nfs/dbraw/zinc/27/19/16/943271916.db2.gz BPORYYRMFIMZIU-HNNXBMFYSA-N 1 1 358.394 3.630 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000425368363 943381411 /nfs/dbraw/zinc/38/14/11/943381411.db2.gz FBFYKSIWRQTHME-LJQANCHMSA-N 1 1 360.454 3.775 20 5 FHBDMO CCC[N@@H+](C)C[C@@H]1CCN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000549466344 943406476 /nfs/dbraw/zinc/40/64/76/943406476.db2.gz BTKKMPJLHOWQPY-ZDUSSCGKSA-N 1 1 359.392 3.777 20 5 FHBDMO C[C@H](N[C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000423144750 943406678 /nfs/dbraw/zinc/40/66/78/943406678.db2.gz HVJJMIKVMFFNCZ-QMIHWGKISA-N 1 1 353.422 3.501 20 5 FHBDMO C[C@H](N[C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000423144749 943406702 /nfs/dbraw/zinc/40/67/02/943406702.db2.gz HVJJMIKVMFFNCZ-DCPHZVHLSA-N 1 1 353.422 3.501 20 5 FHBDMO COc1cccc([C@@H]2C[C@@H](C)C[N@@H+]2CC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000544118556 943473842 /nfs/dbraw/zinc/47/38/42/943473842.db2.gz YBKQFBGBJXCCEM-KUHUBIRLSA-N 1 1 369.421 3.625 20 5 FHBDMO COc1cccc([C@@H]2C[C@@H](C)C[N@H+]2CC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000544118556 943473848 /nfs/dbraw/zinc/47/38/48/943473848.db2.gz YBKQFBGBJXCCEM-KUHUBIRLSA-N 1 1 369.421 3.625 20 5 FHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H](NCC1([NH+]3CCCC3)CCOCC1)CCCC2 ZINC000417301381 943495131 /nfs/dbraw/zinc/49/51/31/943495131.db2.gz BJQURLCCXYELDK-HXUWFJFHSA-N 1 1 373.497 3.597 20 5 FHBDMO CCc1ccc([C@@H](NCCC[C@@H]2CCC[NH2+]2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423490363 943534842 /nfs/dbraw/zinc/53/48/42/943534842.db2.gz XOAXGCOROPBCFH-JXFKEZNVSA-N 1 1 357.454 3.961 20 5 FHBDMO CCOc1ccc([C@@H](C)[NH2+]C[C@@H](N)c2ccccc2CC)cc1[N+](=O)[O-] ZINC000423513086 943542115 /nfs/dbraw/zinc/54/21/15/943542115.db2.gz VAZADTYVRRBQMQ-RDTXWAMCSA-N 1 1 357.454 3.907 20 5 FHBDMO CC(C)Oc1ccc([C@@H](CNCc2csc([N+](=O)[O-])c2)[NH+](C)C)cc1 ZINC000515250260 943586036 /nfs/dbraw/zinc/58/60/36/943586036.db2.gz XTBMDCWJAUYQIP-QGZVFWFLSA-N 1 1 363.483 3.836 20 5 FHBDMO CC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1ccc(OC)c(OC)c1 ZINC000504763694 943787901 /nfs/dbraw/zinc/78/79/01/943787901.db2.gz XLSCZYICWHQIKR-UHFFFAOYSA-N 1 1 360.410 3.513 20 5 FHBDMO COc1ccc(C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)c(OC)n1 ZINC000516896955 943813503 /nfs/dbraw/zinc/81/35/03/943813503.db2.gz USFAEPJNDHCINL-INIZCTEOSA-N 1 1 357.410 3.519 20 5 FHBDMO C[C@H]1CCC[N@@H+](Cc2ccccc2CNC(=O)c2csc([N+](=O)[O-])c2)C1 ZINC000515426521 943871042 /nfs/dbraw/zinc/87/10/42/943871042.db2.gz GNERBWRRPSTGJC-AWEZNQCLSA-N 1 1 373.478 3.818 20 5 FHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)C12CC3CC(CC(C3)C1)C2 ZINC000517042836 943944919 /nfs/dbraw/zinc/94/49/19/943944919.db2.gz DWNJPKOIKXQPFX-UHFFFAOYSA-N 1 1 356.466 3.855 20 5 FHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)C12CC3CC(CC(C3)C1)C2 ZINC000517042836 943944923 /nfs/dbraw/zinc/94/49/23/943944923.db2.gz DWNJPKOIKXQPFX-UHFFFAOYSA-N 1 1 356.466 3.855 20 5 FHBDMO CSC[C@H]1CCC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425450873 943965092 /nfs/dbraw/zinc/96/50/92/943965092.db2.gz WFCJDDUBFLSPEL-NSHDSACASA-N 1 1 359.289 3.932 20 5 FHBDMO CSC[C@H]1CCC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425450873 943965096 /nfs/dbraw/zinc/96/50/96/943965096.db2.gz WFCJDDUBFLSPEL-NSHDSACASA-N 1 1 359.289 3.932 20 5 FHBDMO CCO[C@@H]1CC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C[C@H]1C ZINC000425492136 944111399 /nfs/dbraw/zinc/11/13/99/944111399.db2.gz MVVFCPBCZXGOCK-IAQYHMDHSA-N 1 1 357.248 3.604 20 5 FHBDMO CCO[C@@H]1CC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C[C@H]1C ZINC000425492136 944111406 /nfs/dbraw/zinc/11/14/06/944111406.db2.gz MVVFCPBCZXGOCK-IAQYHMDHSA-N 1 1 357.248 3.604 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](Oc3ccccc3)C2)c2c(c1)COCO2 ZINC000418100341 944154256 /nfs/dbraw/zinc/15/42/56/944154256.db2.gz PEJWLHBXIPUGOT-LJQANCHMSA-N 1 1 370.405 3.505 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](Oc3ccccc3)C2)c2c(c1)COCO2 ZINC000418100341 944154263 /nfs/dbraw/zinc/15/42/63/944154263.db2.gz PEJWLHBXIPUGOT-LJQANCHMSA-N 1 1 370.405 3.505 20 5 FHBDMO C[N@H+]1CCCN(C(=O)c2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)CC1 ZINC000425917742 944159800 /nfs/dbraw/zinc/15/98/00/944159800.db2.gz GWWSYADPXXHIKQ-UHFFFAOYSA-N 1 1 371.462 3.524 20 5 FHBDMO CN(C/C=C/c1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000506482497 944332588 /nfs/dbraw/zinc/33/25/88/944332588.db2.gz TVHHDXYCVYMAON-WUTDNEBXSA-N 1 1 351.450 3.814 20 5 FHBDMO C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@@H]1CCN(Cc2ccccc2)C1 ZINC000506482497 944332598 /nfs/dbraw/zinc/33/25/98/944332598.db2.gz TVHHDXYCVYMAON-WUTDNEBXSA-N 1 1 351.450 3.814 20 5 FHBDMO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@@H]1CCN(Cc2ccccc2)C1 ZINC000506482497 944332608 /nfs/dbraw/zinc/33/26/08/944332608.db2.gz TVHHDXYCVYMAON-WUTDNEBXSA-N 1 1 351.450 3.814 20 5 FHBDMO CNC(=O)CC[C@H]1CCCC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000515918636 944342904 /nfs/dbraw/zinc/34/29/04/944342904.db2.gz MRBKKVQTWPAFCW-MRXNPFEDSA-N 1 1 371.437 3.736 20 5 FHBDMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)NC[C@H]1CCC[N@H+]1C1CCCCC1 ZINC000438138146 944363338 /nfs/dbraw/zinc/36/33/38/944363338.db2.gz IYYJYQSLHOZOBX-GOSISDBHSA-N 1 1 374.485 3.533 20 5 FHBDMO C[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000518474002 944413815 /nfs/dbraw/zinc/41/38/15/944413815.db2.gz QZVGDWRBCGVSRC-IRXDYDNUSA-N 1 1 367.232 3.992 20 5 FHBDMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000518474002 944413819 /nfs/dbraw/zinc/41/38/19/944413819.db2.gz QZVGDWRBCGVSRC-IRXDYDNUSA-N 1 1 367.232 3.992 20 5 FHBDMO C[C@H]1[C@@H](CO)CC[N@H+]1Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000425993012 944557815 /nfs/dbraw/zinc/55/78/15/944557815.db2.gz JDNBEOJUGHGDJQ-DOTOQJQBSA-N 1 1 355.438 3.565 20 5 FHBDMO C[C@H]1[C@H](CO)CC[N@H+]1Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000425998163 944586164 /nfs/dbraw/zinc/58/61/64/944586164.db2.gz GHKNJJONXJKSRJ-ZFWWWQNUSA-N 1 1 360.385 3.729 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)C[C@@H](C)c1ccccc1 ZINC000066854659 944641395 /nfs/dbraw/zinc/64/13/95/944641395.db2.gz MLQCEIFUMUHMEG-OAHLLOKOSA-N 1 1 371.437 3.668 20 5 FHBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@](C)(c2ccccc2)C1 ZINC000438505743 944683096 /nfs/dbraw/zinc/68/30/96/944683096.db2.gz OBMQKUJMSDZWIU-YWZLYKJASA-N 1 1 353.422 3.585 20 5 FHBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@](C)(c2ccccc2)C1 ZINC000438505743 944683101 /nfs/dbraw/zinc/68/31/01/944683101.db2.gz OBMQKUJMSDZWIU-YWZLYKJASA-N 1 1 353.422 3.585 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@](C)(c2ccccc2)C1 ZINC000438498696 944694728 /nfs/dbraw/zinc/69/47/28/944694728.db2.gz FVFGJFBIQSNDGL-OAQYLSRUSA-N 1 1 367.449 3.895 20 5 FHBDMO O=C(NC[C@@H]1CCC[N@H+]1C1CCCCC1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000437845838 945035190 /nfs/dbraw/zinc/03/51/90/945035190.db2.gz KKTDRCPEGLPMFJ-KRWDZBQOSA-N 1 1 371.437 3.868 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H](C)C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000443973374 945390592 /nfs/dbraw/zinc/39/05/92/945390592.db2.gz ZOVWATBJJMKYEE-VNHYZAJKSA-N 1 1 362.474 3.700 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])c(N[C@H]2CC[N@@H+](C)[C@H]2c2ccc(F)c(F)c2)n1 ZINC000543789741 945414608 /nfs/dbraw/zinc/41/46/08/945414608.db2.gz BSHKWASTANCLJU-RDJZCZTQSA-N 1 1 362.380 3.742 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])c(N[C@H]2CC[N@H+](C)[C@H]2c2ccc(F)c(F)c2)n1 ZINC000543789741 945414614 /nfs/dbraw/zinc/41/46/14/945414614.db2.gz BSHKWASTANCLJU-RDJZCZTQSA-N 1 1 362.380 3.742 20 5 FHBDMO CCC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C[C@H]1CCCCO1 ZINC000106867400 945419088 /nfs/dbraw/zinc/41/90/88/945419088.db2.gz VZGUKCKZNVMVRE-QGZVFWFLSA-N 1 1 363.458 3.513 20 5 FHBDMO C[N@@H+](Cc1cc([O-])ccc1[N+](=O)[O-])[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000519749611 945715783 /nfs/dbraw/zinc/71/57/83/945715783.db2.gz XJLXQNVITAPNQQ-LPHOPBHVSA-N 1 1 360.385 3.792 20 5 FHBDMO C[C@@H]([NH2+]Cc1nccn1CCc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000164297950 945726414 /nfs/dbraw/zinc/72/64/14/945726414.db2.gz HJPMBEAJVVCNSZ-MRXNPFEDSA-N 1 1 350.422 3.885 20 5 FHBDMO CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ncc(C)cc1[N+](=O)[O-] ZINC000439693200 945881386 /nfs/dbraw/zinc/88/13/86/945881386.db2.gz LYUHTHHAEKRXAS-GOSISDBHSA-N 1 1 354.454 3.647 20 5 FHBDMO C[C@H](NC(=O)NCCCC[N@H+]1CCCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000108466243 945980826 /nfs/dbraw/zinc/98/08/26/945980826.db2.gz SGACSPOMGUEWKX-HOTGVXAUSA-N 1 1 362.474 3.610 20 5 FHBDMO CCOc1ccc(NC(=O)C[N@H+]2[C@H](C)C[C@@H]3CCCC[C@H]32)c([N+](=O)[O-])c1 ZINC000444240756 946117003 /nfs/dbraw/zinc/11/70/03/946117003.db2.gz DGGAWPPBKJCSDC-JKIFEVAISA-N 1 1 361.442 3.585 20 5 FHBDMO Cc1cc(C(=O)NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000109305845 946227028 /nfs/dbraw/zinc/22/70/28/946227028.db2.gz SEZZOJHRDGPDMG-GOSISDBHSA-N 1 1 367.449 3.545 20 5 FHBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@](C)(c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000438502356 946374791 /nfs/dbraw/zinc/37/47/91/946374791.db2.gz VZRGSXSQYBQZNK-KKSFZXQISA-N 1 1 367.449 3.894 20 5 FHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@H](COCc3ccccc3)C2)cc1 ZINC000441328008 946458142 /nfs/dbraw/zinc/45/81/42/946458142.db2.gz AOZXAHGTBLDIEL-IBGZPJMESA-N 1 1 370.449 3.902 20 5 FHBDMO CN(C)c1cccc([C@@H]2CCC[N@H+]2CCOc2cccc([N+](=O)[O-])c2)c1 ZINC000441356416 946474635 /nfs/dbraw/zinc/47/46/35/946474635.db2.gz PTYZXYVANJOBLA-FQEVSTJZSA-N 1 1 355.438 3.877 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H](C)[N@@H+](C)Cc1ccccc1 ZINC000111700562 946513602 /nfs/dbraw/zinc/51/36/02/946513602.db2.gz QFXVUOMAHXPLOA-HNNXBMFYSA-N 1 1 356.426 3.545 20 5 FHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+](CCO)[C@@H]2CCCSC2)o1 ZINC000475510255 946522970 /nfs/dbraw/zinc/52/29/70/946522970.db2.gz NDVCTOAEKWFCCL-CQSZACIVSA-N 1 1 362.451 3.545 20 5 FHBDMO COc1ccc(OCC[N@@H+](C)[C@@H](C)Cc2ccccc2OC)c([N+](=O)[O-])c1 ZINC000441408509 946563095 /nfs/dbraw/zinc/56/30/95/946563095.db2.gz XKSYECGTYGYNHA-HNNXBMFYSA-N 1 1 374.437 3.554 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1Cc2ccccc2C2(CC2)C1 ZINC000186231441 946637506 /nfs/dbraw/zinc/63/75/06/946637506.db2.gz UHNQFHIZNLMJSV-UHFFFAOYSA-N 1 1 365.433 3.779 20 5 FHBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000475557667 946640005 /nfs/dbraw/zinc/64/00/05/946640005.db2.gz AQBLCSMUPLDUPM-INIZCTEOSA-N 1 1 362.474 3.701 20 5 FHBDMO CCS[C@H]1CCCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000112090127 946658202 /nfs/dbraw/zinc/65/82/02/946658202.db2.gz ZJJCMLRPTQVCPL-INIZCTEOSA-N 1 1 352.456 3.569 20 5 FHBDMO CCSc1cccc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000473148827 946712541 /nfs/dbraw/zinc/71/25/41/946712541.db2.gz RIYAYZXSYCXBDH-HNNXBMFYSA-N 1 1 358.467 3.788 20 5 FHBDMO C[C@H]([NH2+][C@@H](c1cnn(C)c1)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000186639450 946768281 /nfs/dbraw/zinc/76/82/81/946768281.db2.gz CBHHWXXEPLYFDR-ORAYPTAESA-N 1 1 354.385 3.908 20 5 FHBDMO COc1ccccc1[C@@H]1CC[N@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1 ZINC000093593310 946795484 /nfs/dbraw/zinc/79/54/84/946795484.db2.gz UQZZBLQBJZKHLR-CQSZACIVSA-N 1 1 372.421 3.610 20 5 FHBDMO CN(C(=O)c1c(Cl)cccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475315905 946878342 /nfs/dbraw/zinc/87/83/42/946878342.db2.gz YJOOJAJKYQHXFC-OAHLLOKOSA-N 1 1 373.840 3.595 20 5 FHBDMO Cc1c(C(=O)NC[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)cccc1[N+](=O)[O-] ZINC000129765667 946909224 /nfs/dbraw/zinc/90/92/24/946909224.db2.gz KODLQUZKRXPLOA-KDOFPFPSSA-N 1 1 373.478 3.778 20 5 FHBDMO Cn1nc(C2CC2)cc1C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000897223987 946954339 /nfs/dbraw/zinc/95/43/39/946954339.db2.gz DHHIWFUAOYVSSF-UHFFFAOYSA-N 1 1 355.225 3.802 20 5 FHBDMO CC(C)c1ccc(C[N@@H+](C)C[C@H](O)COCc2ccccc2)cc1[N+](=O)[O-] ZINC000511959228 947171056 /nfs/dbraw/zinc/17/10/56/947171056.db2.gz XZMODKCMHNAZJW-IBGZPJMESA-N 1 1 372.465 3.728 20 5 FHBDMO C[C@@H](c1ccccc1Cl)[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248373052 947230901 /nfs/dbraw/zinc/23/09/01/947230901.db2.gz FXBRHKKUBRXHOS-UONOGXRCSA-N 1 1 364.829 3.681 20 5 FHBDMO Cc1ccc(C[N@@H+](CCO)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)o1 ZINC000475619705 947430806 /nfs/dbraw/zinc/43/08/06/947430806.db2.gz MOFMDTVGQSKJNF-UHFFFAOYSA-N 1 1 356.378 3.751 20 5 FHBDMO Cc1ccc(C[N@H+](CCO)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)o1 ZINC000475619705 947430800 /nfs/dbraw/zinc/43/08/00/947430800.db2.gz MOFMDTVGQSKJNF-UHFFFAOYSA-N 1 1 356.378 3.751 20 5 FHBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000072837845 947570194 /nfs/dbraw/zinc/57/01/94/947570194.db2.gz FWTLPJGRGMSPPV-ZBFHGGJFSA-N 1 1 365.499 3.838 20 5 FHBDMO C[C@@H]1[C@@H](NC(=O)c2cccc(Cl)c2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000311929196 948032680 /nfs/dbraw/zinc/03/26/80/948032680.db2.gz FYFDVNYPJJGVNA-DYVFJYSZSA-N 1 1 373.840 3.641 20 5 FHBDMO Cc1ccc(N2CCC(Nc3ccnc4c3cccc4[N+](=O)[O-])CC2)[nH+]c1 ZINC000432329195 948088850 /nfs/dbraw/zinc/08/88/50/948088850.db2.gz ZDEIDFVKRUGJHW-UHFFFAOYSA-N 1 1 363.421 3.927 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@@H]1CCc2ccccc21 ZINC000109095073 206044762 /nfs/dbraw/zinc/04/47/62/206044762.db2.gz VAYVCOOURPUPOI-LJQANCHMSA-N 1 1 353.422 3.851 20 5 FHBDMO CC[C@H](C[N@@H+](CC)Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000481688623 568088807 /nfs/dbraw/zinc/08/88/07/568088807.db2.gz LPJMAWBLEMHOSO-OAHLLOKOSA-N 1 1 355.438 3.709 20 5 FHBDMO C[C@H]1CCC[N@@H+](Cc2ccccc2CNC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000481766063 568119601 /nfs/dbraw/zinc/11/96/01/568119601.db2.gz AEOJBYLEOJAUOE-INIZCTEOSA-N 1 1 367.449 3.757 20 5 FHBDMO CC(C)[N@H+](CC(=O)N[C@@H]1CCC[C@@H](C)[C@H]1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000604411542 568272185 /nfs/dbraw/zinc/27/21/85/568272185.db2.gz HNCGMOULNALHPG-GPMSIDNRSA-N 1 1 361.486 3.746 20 5 FHBDMO CC(C)[N@@H+](CC(=O)N[C@@H]1CCC[C@@H](C)[C@H]1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000604411542 568272186 /nfs/dbraw/zinc/27/21/86/568272186.db2.gz HNCGMOULNALHPG-GPMSIDNRSA-N 1 1 361.486 3.746 20 5 FHBDMO COC(=O)[C@@H](C)C[N@@H+](Cc1ccccc1)Cc1cccc([N+](=O)[O-])c1C ZINC000604540786 568309540 /nfs/dbraw/zinc/30/95/40/568309540.db2.gz RAPLMNBOKIMYPZ-HNNXBMFYSA-N 1 1 356.422 3.715 20 5 FHBDMO COc1cc(C[N@@H+]2CC[C@H](C(F)(F)F)C2(C)C)c([N+](=O)[O-])cc1F ZINC000330990750 568476993 /nfs/dbraw/zinc/47/69/93/568476993.db2.gz SFVOYWPUZOJQAT-ZDUSSCGKSA-N 1 1 350.312 3.905 20 5 FHBDMO COc1cc(C[N@H+]2CC[C@H](C(F)(F)F)C2(C)C)c([N+](=O)[O-])cc1F ZINC000330990750 568476994 /nfs/dbraw/zinc/47/69/94/568476994.db2.gz SFVOYWPUZOJQAT-ZDUSSCGKSA-N 1 1 350.312 3.905 20 5 FHBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N(C)CCC[N@@H+](C)Cc1ccco1 ZINC000482243806 568522313 /nfs/dbraw/zinc/52/23/13/568522313.db2.gz RCLQVALJHMKTNF-UHFFFAOYSA-N 1 1 374.441 3.790 20 5 FHBDMO CC(C)[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC1 ZINC000049657047 568553029 /nfs/dbraw/zinc/55/30/29/568553029.db2.gz PODAZFZSQGBKIU-UHFFFAOYSA-N 1 1 369.421 3.553 20 5 FHBDMO Cc1[nH+]ccn1-c1ccc(CNc2ncc(Cl)cc2[N+](=O)[O-])cc1F ZINC000153620396 936328311 /nfs/dbraw/zinc/32/83/11/936328311.db2.gz FTCGNAQDXZCAFH-UHFFFAOYSA-N 1 1 361.764 3.889 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000079556589 937133400 /nfs/dbraw/zinc/13/34/00/937133400.db2.gz DSKJYRQMZDZCEX-AEFFLSMTSA-N 1 1 367.449 3.686 20 5 FHBDMO C/C(=C\C(=O)OC[C@@H]1CCC[N@H+]1Cc1ccco1)c1ccc([N+](=O)[O-])cc1 ZINC000784900962 927239722 /nfs/dbraw/zinc/23/97/22/927239722.db2.gz DSUFEFWXCQQNPD-XOVFHRFOSA-N 1 1 370.405 3.799 20 5 FHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@@](O)(C(F)(F)F)CC1 ZINC000285626311 927977433 /nfs/dbraw/zinc/97/74/33/927977433.db2.gz QXLQCYUMOVFTNF-ZDUSSCGKSA-N 1 1 352.740 3.528 20 5 FHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@@](O)(C(F)(F)F)CC1 ZINC000285626311 927977461 /nfs/dbraw/zinc/97/74/61/927977461.db2.gz QXLQCYUMOVFTNF-ZDUSSCGKSA-N 1 1 352.740 3.528 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1CN[C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000430203836 928002452 /nfs/dbraw/zinc/00/24/52/928002452.db2.gz JJGUYZPJHUEQEO-UZLBHIALSA-N 1 1 369.465 3.604 20 5 FHBDMO Cc1ccccc1[C@@H]1C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)CCO1 ZINC000610217918 928218494 /nfs/dbraw/zinc/21/84/94/928218494.db2.gz XXDQAGFSLULXGG-FQEVSTJZSA-N 1 1 356.422 3.746 20 5 FHBDMO Cc1ccccc1[C@@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CCO1 ZINC000610217918 928218523 /nfs/dbraw/zinc/21/85/23/928218523.db2.gz XXDQAGFSLULXGG-FQEVSTJZSA-N 1 1 356.422 3.746 20 5 FHBDMO C[C@H]1CCCC[N@H+]1CCC1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000157732551 928799221 /nfs/dbraw/zinc/79/92/21/928799221.db2.gz WOXZICXAJDXTPU-KRWDZBQOSA-N 1 1 373.497 3.640 20 5 FHBDMO CNC(=O)C[NH2+]Cc1ccc(Oc2ccc(C(C)(C)C)cc2)c([N+](=O)[O-])c1 ZINC000579981448 929746121 /nfs/dbraw/zinc/74/61/21/929746121.db2.gz PDPHTTQGKCJESV-UHFFFAOYSA-N 1 1 371.437 3.520 20 5 FHBDMO O=C(c1ccc(F)cc1)[C@H]1CCC[N@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000610004475 929775053 /nfs/dbraw/zinc/77/50/53/929775053.db2.gz LQVDJYZIYALUFQ-INIZCTEOSA-N 1 1 372.396 3.708 20 5 FHBDMO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275676340 929834499 /nfs/dbraw/zinc/83/44/99/929834499.db2.gz BTYXXPYWCKLNBV-JLTOFOAXSA-N 1 1 363.461 3.506 20 5 FHBDMO Cc1cc(C)cc(NC(=O)[C@H](C)[N@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000560984017 930266931 /nfs/dbraw/zinc/26/69/31/930266931.db2.gz OIPTYSOJCXPLCN-INIZCTEOSA-N 1 1 355.438 3.713 20 5 FHBDMO Cc1cc(C)cc(NC(=O)[C@H](C)[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000560984017 930266937 /nfs/dbraw/zinc/26/69/37/930266937.db2.gz OIPTYSOJCXPLCN-INIZCTEOSA-N 1 1 355.438 3.713 20 5 FHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCCN(C(=O)CC2CCCC2)CC1 ZINC000610390867 930308060 /nfs/dbraw/zinc/30/80/60/930308060.db2.gz JKFXLNFDFRUEIZ-INIZCTEOSA-N 1 1 359.470 3.770 20 5 FHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCN(C(=O)CC2CCCC2)CC1 ZINC000610390867 930308072 /nfs/dbraw/zinc/30/80/72/930308072.db2.gz JKFXLNFDFRUEIZ-INIZCTEOSA-N 1 1 359.470 3.770 20 5 FHBDMO C[C@H](c1ccccc1)[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)CC1CCC1 ZINC000536378184 930481482 /nfs/dbraw/zinc/48/14/82/930481482.db2.gz MUEUGFMHGMBNGN-MRXNPFEDSA-N 1 1 355.438 3.620 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000247259498 930533469 /nfs/dbraw/zinc/53/34/69/930533469.db2.gz DXZDRMUGYPQHPQ-RDTXWAMCSA-N 1 1 373.478 3.778 20 5 FHBDMO O=[N+]([O-])c1ccc([C@@H](NC[C@H]2CCCC[N@@H+]2C2CC2)C(F)(F)F)cc1 ZINC000579601983 930597625 /nfs/dbraw/zinc/59/76/25/930597625.db2.gz KLUZSWDSUBKVMD-HZPDHXFCSA-N 1 1 357.376 3.805 20 5 FHBDMO O=[N+]([O-])c1ccc([C@@H](NC[C@H]2CCCC[N@H+]2C2CC2)C(F)(F)F)cc1 ZINC000579601983 930597632 /nfs/dbraw/zinc/59/76/32/930597632.db2.gz KLUZSWDSUBKVMD-HZPDHXFCSA-N 1 1 357.376 3.805 20 5 FHBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCCN1CCOc1cccc([N+](=O)[O-])c1 ZINC000610133933 930782735 /nfs/dbraw/zinc/78/27/35/930782735.db2.gz QQGRCTMEVKXWPT-SFHVURJKSA-N 1 1 369.465 3.570 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](Cc2ccccc2)CC[C@@H]1C ZINC000610445635 930809239 /nfs/dbraw/zinc/80/92/39/930809239.db2.gz ACNNFWDRIUABBI-KRWDZBQOSA-N 1 1 367.449 3.640 20 5 FHBDMO C[N@@H+](CCCNC(=O)C1CCC1)[C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000432816081 930862105 /nfs/dbraw/zinc/86/21/05/930862105.db2.gz MTPOFTVDFCUPJI-HKUYNNGSSA-N 1 1 373.497 3.544 20 5 FHBDMO COc1ccc(NC(=O)[C@@H](C)[N@H+]2CCC[C@@H](C(C)C)CC2)c([N+](=O)[O-])c1 ZINC001167424390 930941116 /nfs/dbraw/zinc/94/11/16/930941116.db2.gz HZOOFHALJXFVFX-HUUCEWRRSA-N 1 1 363.458 3.689 20 5 FHBDMO COc1cc(C[N@@H+](CCc2ccc(F)cc2)C2CC2)c([N+](=O)[O-])cc1OC ZINC000537635972 931067204 /nfs/dbraw/zinc/06/72/04/931067204.db2.gz LYRHLIULOGDSAV-UHFFFAOYSA-N 1 1 374.412 3.958 20 5 FHBDMO CC(C)[N@H+]1CCC[C@@H](NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C1 ZINC000275986354 931183015 /nfs/dbraw/zinc/18/30/15/931183015.db2.gz PNUCNZGCMXXYMH-MRXNPFEDSA-N 1 1 363.461 3.696 20 5 FHBDMO Cc1cc(N2CC[C@@H](c3[nH+]ccn3C)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000580821434 931198419 /nfs/dbraw/zinc/19/84/19/931198419.db2.gz ANLAFMDQOVQFIG-LLVKDONJSA-N 1 1 354.332 3.649 20 5 FHBDMO O=C([C@@H]1CC[N@H+](C2CCCCC2)C1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000126114010 931398380 /nfs/dbraw/zinc/39/83/80/931398380.db2.gz WGKLTCQHOOQNOM-QGZVFWFLSA-N 1 1 371.481 3.740 20 5 FHBDMO Cc1cc(N(C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c(Br)cc1[N+](=O)[O-] ZINC000581267600 931756040 /nfs/dbraw/zinc/75/60/40/931756040.db2.gz BLWJNTMITXBZKQ-FUNVUKJBSA-N 1 1 368.275 3.727 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H]1c1cccc(F)c1 ZINC000610505422 932016214 /nfs/dbraw/zinc/01/62/14/932016214.db2.gz KXKFEGSBFHRRCN-GOSISDBHSA-N 1 1 357.385 3.818 20 5 FHBDMO Cc1c(C[N@H+]2CCC[C@H](CNC(=O)c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000178051094 932223397 /nfs/dbraw/zinc/22/33/97/932223397.db2.gz NXLIBKFVYBMKLP-QGZVFWFLSA-N 1 1 367.449 3.545 20 5 FHBDMO Cc1sc(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000430654456 932614747 /nfs/dbraw/zinc/61/47/47/932614747.db2.gz RTIMHEDBONVMBG-XJKSGUPXSA-N 1 1 373.478 3.748 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H]1c1cccc(C)c1 ZINC000055911162 932737817 /nfs/dbraw/zinc/73/78/17/932737817.db2.gz NRZPMLLJKWMLCQ-SFHVURJKSA-N 1 1 369.421 3.687 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H]1c1cccc(C)c1 ZINC000055911162 932737824 /nfs/dbraw/zinc/73/78/24/932737824.db2.gz NRZPMLLJKWMLCQ-SFHVURJKSA-N 1 1 369.421 3.687 20 5 FHBDMO Cc1c(C[N@@H+]2CC[C@@H](NC(=O)OC(C)(C)C)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000134645130 932762056 /nfs/dbraw/zinc/76/20/56/932762056.db2.gz SVXCQFBBVAXVJQ-XJKSGUPXSA-N 1 1 363.458 3.781 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C/CN1CC[NH+](C/C=C\c2ccccc2)CC1 ZINC000033324102 933068581 /nfs/dbraw/zinc/06/85/81/933068581.db2.gz NRGYNZQRBTVEKK-KMJJTFSOSA-N 1 1 363.461 3.939 20 5 FHBDMO CO[C@]1(C)C[C@@H]([N@@H+](C)Cc2ccc(Br)cc2[N+](=O)[O-])C1(C)C ZINC001167490564 933076215 /nfs/dbraw/zinc/07/62/15/933076215.db2.gz DMLOYNAVVPSAIF-GDBMZVCRSA-N 1 1 371.275 3.993 20 5 FHBDMO Cn1nccc1[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000510628308 933320806 /nfs/dbraw/zinc/32/08/06/933320806.db2.gz HJLLOXJGHPZPCN-HNNXBMFYSA-N 1 1 366.421 3.968 20 5 FHBDMO C[C@@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)[N@@H+]1CCC[C@@H](C)C1 ZINC000610655867 933658967 /nfs/dbraw/zinc/65/89/67/933658967.db2.gz VWUAOZQHJJUGGR-OLZOCXBDSA-N 1 1 374.466 3.777 20 5 FHBDMO C[C@@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)[N@H+]1CCC[C@@H](C)C1 ZINC000610655867 933658975 /nfs/dbraw/zinc/65/89/75/933658975.db2.gz VWUAOZQHJJUGGR-OLZOCXBDSA-N 1 1 374.466 3.777 20 5 FHBDMO O=[N+]([O-])c1cc(F)c(C[NH2+][C@H]2CCO[C@@H]2c2ccc(F)c(F)c2)c(F)c1 ZINC000510793438 933731260 /nfs/dbraw/zinc/73/12/60/933731260.db2.gz AFILTMRZAAMPKZ-DLBZAZTESA-N 1 1 370.302 3.771 20 5 FHBDMO CCOc1cc(C[N@H+]2CCC[C@@H](c3nncn3C(C)C)C2)ccc1[N+](=O)[O-] ZINC000276919209 933979382 /nfs/dbraw/zinc/97/93/82/933979382.db2.gz OWBQPBHXTPSPHZ-MRXNPFEDSA-N 1 1 373.457 3.546 20 5 FHBDMO Cc1cnc(N2CCC3(CC[N@@H+](Cc4ccccc4)C3)CC2)c([N+](=O)[O-])c1 ZINC000535692371 934286046 /nfs/dbraw/zinc/28/60/46/934286046.db2.gz BTMJECUBNXITMW-UHFFFAOYSA-N 1 1 366.465 3.791 20 5 FHBDMO C[N@H+]1CCC[C@H]2CN(Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)CC[C@H]21 ZINC000535806325 934412507 /nfs/dbraw/zinc/41/25/07/934412507.db2.gz QQLHUSWLNNSLRM-MAUKXSAKSA-N 1 1 355.438 3.771 20 5 FHBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)CCN1c1ncc(Cl)cc1[N+](=O)[O-] ZINC000610929658 934626306 /nfs/dbraw/zinc/62/63/06/934626306.db2.gz BSNQCGFOYWDDRC-AWEZNQCLSA-N 1 1 360.845 3.744 20 5 FHBDMO CC(C)CO[C@H]1CC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000091964115 934807794 /nfs/dbraw/zinc/80/77/94/934807794.db2.gz PBVIYCBHBGSMPQ-KRWDZBQOSA-N 1 1 361.467 3.965 20 5 FHBDMO CC(C)CO[C@H]1CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000091964115 934807798 /nfs/dbraw/zinc/80/77/98/934807798.db2.gz PBVIYCBHBGSMPQ-KRWDZBQOSA-N 1 1 361.467 3.965 20 5 FHBDMO COC1CC[NH+](C(C)(C)CNCc2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000538414989 934846730 /nfs/dbraw/zinc/84/67/30/934846730.db2.gz WICGGKQMFGGHRF-UHFFFAOYSA-N 1 1 363.502 3.697 20 5 FHBDMO COc1cc(OC)cc(OCCC[N@H+](C)Cc2csc([N+](=O)[O-])c2)c1 ZINC000084865823 935226901 /nfs/dbraw/zinc/22/69/01/935226901.db2.gz HHTQIADDQZAHRL-UHFFFAOYSA-N 1 1 366.439 3.574 20 5 FHBDMO COc1cc(OC)cc(OCCC[N@@H+](C)Cc2csc([N+](=O)[O-])c2)c1 ZINC000084865823 935226907 /nfs/dbraw/zinc/22/69/07/935226907.db2.gz HHTQIADDQZAHRL-UHFFFAOYSA-N 1 1 366.439 3.574 20 5 FHBDMO COc1cc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])ccc1OC(F)F ZINC000511075183 935286621 /nfs/dbraw/zinc/28/66/21/935286621.db2.gz QOEOCEJLBDTPTM-UHFFFAOYSA-N 1 1 366.364 3.879 20 5 FHBDMO COc1cccc(OC)c1C[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000511781662 945094276 /nfs/dbraw/zinc/09/42/76/945094276.db2.gz QZXFWZDCUNMXSG-UHFFFAOYSA-N 1 1 370.327 3.921 20 5 FHBDMO COc1c(C)c[nH+]c(CN(C)Cc2c(F)cc([N+](=O)[O-])cc2F)c1C ZINC000451370904 935368009 /nfs/dbraw/zinc/36/80/09/935368009.db2.gz CSCXXHLNTAFKJU-UHFFFAOYSA-N 1 1 351.353 3.525 20 5 FHBDMO CC(C)CO[C@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000120056668 935509232 /nfs/dbraw/zinc/50/92/32/935509232.db2.gz LCPYIZYGYUCCHJ-KRWDZBQOSA-N 1 1 359.426 3.539 20 5 FHBDMO Cn1c(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])nc2cc(Cl)ccc21 ZINC000582370445 935581753 /nfs/dbraw/zinc/58/17/53/935581753.db2.gz PXASZUCEXGXBHI-AWEZNQCLSA-N 1 1 356.813 3.912 20 5 FHBDMO O=C(c1cc2ccccc2c2cccnc12)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000684845806 935604561 /nfs/dbraw/zinc/60/45/61/935604561.db2.gz UVYSQBASXGBMCP-WOJBJXKFSA-N 1 1 363.436 3.646 20 5 FHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cncn1Cc1ccccc1 ZINC000511143899 935784546 /nfs/dbraw/zinc/78/45/46/935784546.db2.gz RGBPXIGZTNGCKB-UHFFFAOYSA-N 1 1 350.422 3.514 20 5 FHBDMO C[C@H]([NH2+][C@H](CO)c1ccccc1OC(F)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000479511253 935847685 /nfs/dbraw/zinc/84/76/85/935847685.db2.gz IJCFECHCWCCGGO-XHDPSFHLSA-N 1 1 370.327 3.878 20 5 FHBDMO CCn1ncnc1C[NH2+][C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000479522860 935852462 /nfs/dbraw/zinc/85/24/62/935852462.db2.gz DBNSTENCMANUDS-GFCCVEGCSA-N 1 1 357.439 3.786 20 5 FHBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@@H](C)Cc1ccsc1 ZINC000187777063 935961726 /nfs/dbraw/zinc/96/17/26/935961726.db2.gz WIASZODANVEKFJ-ZDUSSCGKSA-N 1 1 362.451 3.976 20 5 FHBDMO CCOC(=O)CC[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000611792893 936050149 /nfs/dbraw/zinc/05/01/49/936050149.db2.gz VGXZQMPUTSWXQD-ZDUSSCGKSA-N 1 1 354.834 3.804 20 5 FHBDMO COc1ccc(C[N@H+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])cc1C ZINC000092787105 936238557 /nfs/dbraw/zinc/23/85/57/936238557.db2.gz DRDDKVMARFDPPU-UHFFFAOYSA-N 1 1 360.410 3.561 20 5 FHBDMO COc1ccc(C[N@@H+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])cc1C ZINC000092787105 936238559 /nfs/dbraw/zinc/23/85/59/936238559.db2.gz DRDDKVMARFDPPU-UHFFFAOYSA-N 1 1 360.410 3.561 20 5 FHBDMO COc1ccc(C[N@H+]2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)cc1[N+](=O)[O-] ZINC000511798330 945156775 /nfs/dbraw/zinc/15/67/75/945156775.db2.gz SAPFUESCHKBZPN-QRVBRYPASA-N 1 1 368.433 3.608 20 5 FHBDMO Cc1c(C[N@H+]2CCCC[C@@H]2CNC(=O)c2ccccc2)cccc1[N+](=O)[O-] ZINC000472286945 938260909 /nfs/dbraw/zinc/26/09/09/938260909.db2.gz YACOYZGYFCXZEW-LJQANCHMSA-N 1 1 367.449 3.688 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCS[C@H]2CCCC[C@H]21 ZINC000246117140 938336783 /nfs/dbraw/zinc/33/67/83/938336783.db2.gz KUIIYTSRTHVXAH-SJORKVTESA-N 1 1 363.483 3.592 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1c2sccc2OC(C)(C)[C@@H]1O ZINC000583680810 938358778 /nfs/dbraw/zinc/35/87/78/938358778.db2.gz PWHGBDSEHDYLMO-XNJJOIOASA-N 1 1 362.451 3.889 20 5 FHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](Cc2ccccc2)[C@@H]1C ZINC000472308465 938491028 /nfs/dbraw/zinc/49/10/28/938491028.db2.gz AABVJPZXPLEQOH-JZXOWHBKSA-N 1 1 367.449 3.875 20 5 FHBDMO COc1cc(N2CCC(c3[nH+]cc4n3CCCC4)CC2)c(F)cc1[N+](=O)[O-] ZINC000278581323 938555438 /nfs/dbraw/zinc/55/54/38/938555438.db2.gz CRKNNIPSSFBKQA-UHFFFAOYSA-N 1 1 374.416 3.659 20 5 FHBDMO COc1cc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)ccc1OC(C)C ZINC000278674063 938638179 /nfs/dbraw/zinc/63/81/79/938638179.db2.gz LTHZQPPKYOLYQY-UHFFFAOYSA-N 1 1 370.409 3.557 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000278703076 938670397 /nfs/dbraw/zinc/67/03/97/938670397.db2.gz JSPMZFFHTMREAY-GFCCVEGCSA-N 1 1 359.348 3.506 20 5 FHBDMO C[N@H+]1CCC[C@@H](CNCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000108428710 945206197 /nfs/dbraw/zinc/20/61/97/945206197.db2.gz IBDCOFDZXWUZGN-INIZCTEOSA-N 1 1 373.428 3.958 20 5 FHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000289878495 938863428 /nfs/dbraw/zinc/86/34/28/938863428.db2.gz RGPVJKGSTLEVJS-WDEREUQCSA-N 1 1 352.341 3.683 20 5 FHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000289878495 938863431 /nfs/dbraw/zinc/86/34/31/938863431.db2.gz RGPVJKGSTLEVJS-WDEREUQCSA-N 1 1 352.341 3.683 20 5 FHBDMO CS[C@H]1CCCC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000092063983 945212170 /nfs/dbraw/zinc/21/21/70/945212170.db2.gz DCQZFVDBMKXQGU-KRWDZBQOSA-N 1 1 360.483 3.713 20 5 FHBDMO CC[C@@H](OC(=O)[C@]1(F)CC[N@H+](C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC001267375065 938914379 /nfs/dbraw/zinc/91/43/79/938914379.db2.gz ZOBMADSBPKBHSK-QAPCUYQASA-N 1 1 352.406 3.802 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)CCCCc1ccccc1 ZINC000053079136 938965456 /nfs/dbraw/zinc/96/54/56/938965456.db2.gz KOLIIWSYNFNEMC-UHFFFAOYSA-N 1 1 355.438 3.796 20 5 FHBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@H](CC(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000278781143 938994919 /nfs/dbraw/zinc/99/49/19/938994919.db2.gz NOZWZAULEFEUJS-NWDGAFQWSA-N 1 1 359.348 3.505 20 5 FHBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@H](CC(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000278781143 938994920 /nfs/dbraw/zinc/99/49/20/938994920.db2.gz NOZWZAULEFEUJS-NWDGAFQWSA-N 1 1 359.348 3.505 20 5 FHBDMO O=[N+]([O-])c1cc2ccccc2nc1N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000480588792 938997524 /nfs/dbraw/zinc/99/75/24/938997524.db2.gz KOLMXIREHZIBBM-KDURUIRLSA-N 1 1 374.444 3.711 20 5 FHBDMO COCOc1ccc(OC)cc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000179320495 939084586 /nfs/dbraw/zinc/08/45/86/939084586.db2.gz TYGRKGMGNABLMK-UHFFFAOYSA-N 1 1 374.437 3.997 20 5 FHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@@H](Cn3cnc4ccccc43)C2)cc1 ZINC000614235837 939902440 /nfs/dbraw/zinc/90/24/40/939902440.db2.gz KDUPXRAAWAEMKP-GOSISDBHSA-N 1 1 364.449 3.899 20 5 FHBDMO O=[N+]([O-])c1cnn([C@@H]2CCC[N@H+](Cc3cccn3Cc3cccs3)C2)c1 ZINC000364343584 939921669 /nfs/dbraw/zinc/92/16/69/939921669.db2.gz WXXSTXIELOLBJQ-MRXNPFEDSA-N 1 1 371.466 3.540 20 5 FHBDMO O=[N+]([O-])c1cnn([C@@H]2CCC[N@@H+](Cc3cccn3Cc3cccs3)C2)c1 ZINC000364343584 939921673 /nfs/dbraw/zinc/92/16/73/939921673.db2.gz WXXSTXIELOLBJQ-MRXNPFEDSA-N 1 1 371.466 3.540 20 5 FHBDMO C[N@@H+](CCCNC(=O)c1ccc([N+](=O)[O-])c(Cl)c1)Cc1ccccc1 ZINC000310558217 939929734 /nfs/dbraw/zinc/92/97/34/939929734.db2.gz SQKASELMDDEOKK-UHFFFAOYSA-N 1 1 361.829 3.500 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2nc(C[NH2+][C@H](CCCO)c3ccccc3)co2)cc1 ZINC000179753602 939931377 /nfs/dbraw/zinc/93/13/77/939931377.db2.gz MPSIIAIAKXNOSP-LJQANCHMSA-N 1 1 367.405 3.853 20 5 FHBDMO CCC[N@@H+](C[C@@H]1CCCCO1)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000411370486 940036619 /nfs/dbraw/zinc/03/66/19/940036619.db2.gz UIZZMGTUBWMRRS-HOTGVXAUSA-N 1 1 363.458 3.511 20 5 FHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)[C@H]1CCN(c2ccccc2Cl)C1=O ZINC000548934540 940094770 /nfs/dbraw/zinc/09/47/70/940094770.db2.gz JALYXQDSMMGYQP-SFHVURJKSA-N 1 1 373.840 3.528 20 5 FHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)[C@H]1CCN(c2ccccc2Cl)C1=O ZINC000548934540 940094773 /nfs/dbraw/zinc/09/47/73/940094773.db2.gz JALYXQDSMMGYQP-SFHVURJKSA-N 1 1 373.840 3.528 20 5 FHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC2(CCOCC2)[C@@H]1c1ccccc1 ZINC000411994881 940179736 /nfs/dbraw/zinc/17/97/36/940179736.db2.gz BKIGTWFVSJNUOB-FQEVSTJZSA-N 1 1 368.433 3.827 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@H]1CC[N@H+](C)[C@@H]1c1ccccc1 ZINC000180008692 940221335 /nfs/dbraw/zinc/22/13/35/940221335.db2.gz GIKYQGIKDCERCE-FXAWDEMLSA-N 1 1 367.449 3.695 20 5 FHBDMO C[N@@H+](CCn1cc(-c2cccc([N+](=O)[O-])c2)cn1)Cc1ccc(F)cc1 ZINC000612999303 940383213 /nfs/dbraw/zinc/38/32/13/940383213.db2.gz XBXLCWNSVSBUSV-UHFFFAOYSA-N 1 1 354.385 3.729 20 5 FHBDMO CC(=O)c1cc(N[C@@H]2CC[N@@H+](Cc3ccccn3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000376177162 940422895 /nfs/dbraw/zinc/42/28/95/940422895.db2.gz ZZMPTIRSBROWJR-IFXJQAMLSA-N 1 1 368.437 3.515 20 5 FHBDMO CC(=O)c1cc(N[C@@H]2CC[N@H+](Cc3ccccn3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000376177162 940422896 /nfs/dbraw/zinc/42/28/96/940422896.db2.gz ZZMPTIRSBROWJR-IFXJQAMLSA-N 1 1 368.437 3.515 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@H](c2ccccc2)[C@H](C)C1 ZINC000581343104 940499826 /nfs/dbraw/zinc/49/98/26/940499826.db2.gz YWZIZDPBHDKXGM-SJLPKXTDSA-N 1 1 367.449 3.967 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@H](c2ccccc2)[C@H](C)C1 ZINC000581343104 940499827 /nfs/dbraw/zinc/49/98/27/940499827.db2.gz YWZIZDPBHDKXGM-SJLPKXTDSA-N 1 1 367.449 3.967 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCN(c2ccccc2)CC1 ZINC000511482448 940608175 /nfs/dbraw/zinc/60/81/75/940608175.db2.gz PHYJSWOONANQDK-UHFFFAOYSA-N 1 1 355.438 3.706 20 5 FHBDMO CCN(C(=O)c1cc(C)cc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000186313133 940980844 /nfs/dbraw/zinc/98/08/44/940980844.db2.gz WMNHTOHOWMLEQB-LJQANCHMSA-N 1 1 367.449 3.640 20 5 FHBDMO Cc1cc(C[C@H](C)[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)n[nH]1 ZINC000180963931 941097940 /nfs/dbraw/zinc/09/79/40/941097940.db2.gz BVZWTHIRVUKKME-VBKZILBWSA-N 1 1 350.422 3.937 20 5 FHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)Nc1cccc2ccccc21 ZINC000549153734 941540142 /nfs/dbraw/zinc/54/01/42/941540142.db2.gz ODMHQVXTPNZGLW-UHFFFAOYSA-N 1 1 363.417 3.861 20 5 FHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)Nc1cccc2ccccc21 ZINC000549153734 941540144 /nfs/dbraw/zinc/54/01/44/941540144.db2.gz ODMHQVXTPNZGLW-UHFFFAOYSA-N 1 1 363.417 3.861 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2ccc(CN3CCCC[C@H]3[C@H]3CC[NH2+]C3)o2)c1 ZINC000415057754 941570683 /nfs/dbraw/zinc/57/06/83/941570683.db2.gz URVPNIATTPQHPE-LPHOPBHVSA-N 1 1 355.438 3.819 20 5 FHBDMO C[C@@H]1[C@H](NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CC[N@H+]1Cc1ccccc1 ZINC000311925121 941651936 /nfs/dbraw/zinc/65/19/36/941651936.db2.gz FLDQYKRKBXMKBC-CXAGYDPISA-N 1 1 373.840 3.641 20 5 FHBDMO C[N@H+](CC(=O)NC(C)(C)C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000120671531 941760039 /nfs/dbraw/zinc/76/00/39/941760039.db2.gz MSGAGGYUFBPIJX-UHFFFAOYSA-N 1 1 361.467 3.670 20 5 FHBDMO C[N@@H+](CC(=O)NC(C)(C)C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000120671531 941760041 /nfs/dbraw/zinc/76/00/41/941760041.db2.gz MSGAGGYUFBPIJX-UHFFFAOYSA-N 1 1 361.467 3.670 20 5 FHBDMO CN(C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)[C@H]1CCC[N@@H+](C)C1 ZINC000151156672 941764319 /nfs/dbraw/zinc/76/43/19/941764319.db2.gz RZZVCHOATCGUHW-INIZCTEOSA-N 1 1 369.421 3.553 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@@H](C)C[C@H]1c1ccccc1 ZINC000513261191 941814094 /nfs/dbraw/zinc/81/40/94/941814094.db2.gz MCTCQNMHQWPKJF-LIRRHRJNSA-N 1 1 353.422 3.925 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@H](C)C[C@@H]1c1ccccc1 ZINC000513257437 941821231 /nfs/dbraw/zinc/82/12/31/941821231.db2.gz QTHFMJNGIHPREW-RDTXWAMCSA-N 1 1 369.421 3.625 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H](C)C[C@@H]1c1ccccc1 ZINC000513257437 941821235 /nfs/dbraw/zinc/82/12/35/941821235.db2.gz QTHFMJNGIHPREW-RDTXWAMCSA-N 1 1 369.421 3.625 20 5 FHBDMO C[C@H](c1ccco1)[N@@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)C1CC1 ZINC000119269690 941875535 /nfs/dbraw/zinc/87/55/35/941875535.db2.gz WGIKVJXXPLKBLH-CYBMUJFWSA-N 1 1 371.393 3.711 20 5 FHBDMO Cc1ccccc1CN(C)C(=O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000513392898 941888486 /nfs/dbraw/zinc/88/84/86/941888486.db2.gz ZLXPTLKPEHRUHC-UHFFFAOYSA-N 1 1 369.465 3.772 20 5 FHBDMO Cc1ccccc1CN(C)C(=O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000513392898 941888489 /nfs/dbraw/zinc/88/84/89/941888489.db2.gz ZLXPTLKPEHRUHC-UHFFFAOYSA-N 1 1 369.465 3.772 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCN([C@@H](C)c2cccnc2)CC1 ZINC000182807562 941970059 /nfs/dbraw/zinc/97/00/59/941970059.db2.gz YOJBYJLPGUSXRF-IRXDYDNUSA-N 1 1 354.454 3.738 20 5 FHBDMO C[C@@H](C[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000513684656 942074987 /nfs/dbraw/zinc/07/49/87/942074987.db2.gz UAARNEOPDKESJI-LIRRHRJNSA-N 1 1 368.412 3.950 20 5 FHBDMO O=[N+]([O-])c1cc2ccccc2nc1N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000473535359 942169745 /nfs/dbraw/zinc/16/97/45/942169745.db2.gz XSKDHLCCVXVXOG-MAUKXSAKSA-N 1 1 352.438 3.596 20 5 FHBDMO COc1ccc(C[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1C ZINC000103145444 942223897 /nfs/dbraw/zinc/22/38/97/942223897.db2.gz WCJZTBPMHIOECU-UHFFFAOYSA-N 1 1 371.437 3.681 20 5 FHBDMO O=[N+]([O-])c1cc(C[NH2+][C@H](CC(F)F)c2ccccc2)c2c(c1)COCO2 ZINC000420987203 942283283 /nfs/dbraw/zinc/28/32/83/942283283.db2.gz ONIAVLITTVEHNS-MRXNPFEDSA-N 1 1 364.348 3.947 20 5 FHBDMO CC(C)[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@H](C)c1ccsc1 ZINC000421005480 942298596 /nfs/dbraw/zinc/29/85/96/942298596.db2.gz JIQLGEYOGRMLHL-ZBFHGGJFSA-N 1 1 364.467 3.868 20 5 FHBDMO COCC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000501162804 942332323 /nfs/dbraw/zinc/33/23/23/942332323.db2.gz KMVXVKZZIMZPOI-INIZCTEOSA-N 1 1 371.437 3.633 20 5 FHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H](O)c1ccc(F)c(F)c1 ZINC000051287065 942344167 /nfs/dbraw/zinc/34/41/67/942344167.db2.gz XGUNLJCBTMJJQM-INIZCTEOSA-N 1 1 356.756 3.692 20 5 FHBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H](O)c1ccc(F)c(F)c1 ZINC000051287065 942344170 /nfs/dbraw/zinc/34/41/70/942344170.db2.gz XGUNLJCBTMJJQM-INIZCTEOSA-N 1 1 356.756 3.692 20 5 FHBDMO Cc1ccc(C[N@H+]2CCC[C@H](c3ncc4n3CCCC4)C2)cc1[N+](=O)[O-] ZINC000502319725 942351815 /nfs/dbraw/zinc/35/18/15/942351815.db2.gz KECVIKJVBSEGNY-KRWDZBQOSA-N 1 1 354.454 3.816 20 5 FHBDMO O=[N+]([O-])c1ccc(N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c2cccnc21 ZINC000413199956 942472213 /nfs/dbraw/zinc/47/22/13/942472213.db2.gz JTKMKTVQBCDUCK-PBHICJAKSA-N 1 1 352.438 3.596 20 5 FHBDMO C[C@H]1C[C@H](CO)C[N@@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000421361028 942513823 /nfs/dbraw/zinc/51/38/23/942513823.db2.gz KCDPSHXHKFNLCI-HOCLYGCPSA-N 1 1 374.412 3.977 20 5 FHBDMO Cn1ccnc1[C@H]([NH2+]C[C@H]1CC12CCSCC2)c1cccc([N+](=O)[O-])c1 ZINC000421375364 942526569 /nfs/dbraw/zinc/52/65/69/942526569.db2.gz IMHQIFUOUCTJCP-NVXWUHKLSA-N 1 1 372.494 3.541 20 5 FHBDMO CC[N@@H+](CCNc1ncc([N+](=O)[O-])cc1C(F)(F)F)CCC(F)(F)F ZINC000413259719 942570212 /nfs/dbraw/zinc/57/02/12/942570212.db2.gz IOLBPAMEOAPUOR-UHFFFAOYSA-N 1 1 374.285 3.695 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@H](N4CCCCC4)C3)o2)cc1 ZINC000513718215 942574554 /nfs/dbraw/zinc/57/45/54/942574554.db2.gz WSPODJUTUFVHAH-SFHVURJKSA-N 1 1 355.438 3.915 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@H](N4CCCCC4)C3)o2)cc1 ZINC000513718215 942574561 /nfs/dbraw/zinc/57/45/61/942574561.db2.gz WSPODJUTUFVHAH-SFHVURJKSA-N 1 1 355.438 3.915 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@H](c1ccco1)[NH+]1CCCCC1 ZINC000421462864 942583200 /nfs/dbraw/zinc/58/32/00/942583200.db2.gz YWPDLHZRLZJTPQ-GOSISDBHSA-N 1 1 371.437 3.762 20 5 FHBDMO O=[N+]([O-])c1ccc2ncnc(N[C@@H]3CCC[N@@H+](Cc4ccccc4)C3)c2c1 ZINC000312139534 942626438 /nfs/dbraw/zinc/62/64/38/942626438.db2.gz TXJXGCZYIIPSJI-MRXNPFEDSA-N 1 1 363.421 3.615 20 5 FHBDMO COc1ccc(NC(=O)C[N@H+]2CCC[C@@H]2C2CCCCC2)c([N+](=O)[O-])c1 ZINC000514234848 942846248 /nfs/dbraw/zinc/84/62/48/942846248.db2.gz SZSPHYXJBYYSOJ-QGZVFWFLSA-N 1 1 361.442 3.587 20 5 FHBDMO Cc1cccc([C@@H]2CCC[N@@H+]2CC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1 ZINC000434707982 942873691 /nfs/dbraw/zinc/87/36/91/942873691.db2.gz BCDJDAVLLALDCF-IBGZPJMESA-N 1 1 353.422 3.987 20 5 FHBDMO Cc1cccc([C@@H]2CCC[N@H+]2CC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1 ZINC000434707982 942873697 /nfs/dbraw/zinc/87/36/97/942873697.db2.gz BCDJDAVLLALDCF-IBGZPJMESA-N 1 1 353.422 3.987 20 5 FHBDMO CCc1ccc([C@H]2CN(C(=O)c3ccc(CC)c([N+](=O)[O-])c3)CC[NH2+]2)cc1 ZINC000505483575 942889899 /nfs/dbraw/zinc/88/98/99/942889899.db2.gz KEWHPVTZGSMIHG-LJQANCHMSA-N 1 1 367.449 3.506 20 5 FHBDMO Cc1ccc([C@]2(C)CC[N@H+](CC(=O)Nc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000434750127 942940702 /nfs/dbraw/zinc/94/07/02/942940702.db2.gz YBVJIPOHWOBLJH-HXUWFJFHSA-N 1 1 353.422 3.505 20 5 FHBDMO Cc1ccc([C@]2(C)CC[N@@H+](CC(=O)Nc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000434750127 942940707 /nfs/dbraw/zinc/94/07/07/942940707.db2.gz YBVJIPOHWOBLJH-HXUWFJFHSA-N 1 1 353.422 3.505 20 5 FHBDMO Cc1ccccc1C[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000434831081 942983711 /nfs/dbraw/zinc/98/37/11/942983711.db2.gz WDJRHFKAGZQEQU-UHFFFAOYSA-N 1 1 353.422 3.815 20 5 FHBDMO Cc1ccccc1C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000434831081 942983717 /nfs/dbraw/zinc/98/37/17/942983717.db2.gz WDJRHFKAGZQEQU-UHFFFAOYSA-N 1 1 353.422 3.815 20 5 FHBDMO COCC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@H](C)c1ccccc1 ZINC000434894987 943032432 /nfs/dbraw/zinc/03/24/32/943032432.db2.gz JYRYLXIKEFCPPD-MRXNPFEDSA-N 1 1 371.437 3.551 20 5 FHBDMO COCC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@H](C)c1ccccc1 ZINC000434894987 943032435 /nfs/dbraw/zinc/03/24/35/943032435.db2.gz JYRYLXIKEFCPPD-MRXNPFEDSA-N 1 1 371.437 3.551 20 5 FHBDMO COc1cc(C[NH2+]Cc2c(C)oc3ccccc32)c([N+](=O)[O-])cc1OC ZINC000183921184 943100604 /nfs/dbraw/zinc/10/06/04/943100604.db2.gz ZZAVBBJOXSZQON-UHFFFAOYSA-N 1 1 356.378 3.956 20 5 FHBDMO CC(C)[N@@H+](C)CC1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000048053069 943126987 /nfs/dbraw/zinc/12/69/87/943126987.db2.gz HNDRYZBIRBPOQA-UHFFFAOYSA-N 1 1 368.865 3.832 20 5 FHBDMO COc1c(C)cc(C[N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])cc1C ZINC000110287771 943398293 /nfs/dbraw/zinc/39/82/93/943398293.db2.gz JIAKXZWPHAEPEN-UHFFFAOYSA-N 1 1 371.437 3.681 20 5 FHBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ncnn1-c1ccccc1)CCCC2 ZINC000417333872 943522017 /nfs/dbraw/zinc/52/20/17/943522017.db2.gz QOGAUAUAJBNQSN-IBGZPJMESA-N 1 1 363.421 3.733 20 5 FHBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)c1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1 ZINC000515184416 943540503 /nfs/dbraw/zinc/54/05/03/943540503.db2.gz MBLVAIIJEQZNPP-BBRMVZONSA-N 1 1 358.417 3.572 20 5 FHBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@@H+]1CCC[C@]2(CCCOC2)C1 ZINC000425411986 943836197 /nfs/dbraw/zinc/83/61/97/943836197.db2.gz BLJJGPOWLNYKKU-INIZCTEOSA-N 1 1 369.259 3.750 20 5 FHBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1CCC[C@]2(CCCOC2)C1 ZINC000425411986 943836201 /nfs/dbraw/zinc/83/62/01/943836201.db2.gz BLJJGPOWLNYKKU-INIZCTEOSA-N 1 1 369.259 3.750 20 5 FHBDMO C[C@@H]1CCC[N@@H+](Cc2ccccc2CNC(=O)c2csc([N+](=O)[O-])c2)C1 ZINC000515426522 943870858 /nfs/dbraw/zinc/87/08/58/943870858.db2.gz GNERBWRRPSTGJC-CQSZACIVSA-N 1 1 373.478 3.818 20 5 FHBDMO COC[C@H]1CCCC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425430828 943890381 /nfs/dbraw/zinc/89/03/81/943890381.db2.gz GPCWNKJFJMJLPS-LBPRGKRZSA-N 1 1 357.248 3.606 20 5 FHBDMO C[C@@H](NC(=O)NC[C@@H]1CCC[N@H+]1C1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000437637340 944004636 /nfs/dbraw/zinc/00/46/36/944004636.db2.gz VHJVWOCNTPETQW-BEFAXECRSA-N 1 1 374.485 3.752 20 5 FHBDMO COc1cc([C@H](C)[NH2+]Cc2ccc(Br)cc2[N+](=O)[O-])ccn1 ZINC000425460270 944006780 /nfs/dbraw/zinc/00/67/80/944006780.db2.gz RCBGLILSSLKJAO-JTQLQIEISA-N 1 1 366.215 3.612 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)CCOc1ccc(Cl)cc1 ZINC000014926880 944079310 /nfs/dbraw/zinc/07/93/10/944079310.db2.gz WEJGWRDYBAKKQY-UHFFFAOYSA-N 1 1 350.802 3.768 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CCOc1ccc(Cl)cc1 ZINC000014926880 944079317 /nfs/dbraw/zinc/07/93/17/944079317.db2.gz WEJGWRDYBAKKQY-UHFFFAOYSA-N 1 1 350.802 3.768 20 5 FHBDMO COc1cc(C[N@@H+](C)C[C@H](C)OC)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000517263107 944142568 /nfs/dbraw/zinc/14/25/68/944142568.db2.gz VINSKJOFYOEGSZ-HNNXBMFYSA-N 1 1 374.437 3.649 20 5 FHBDMO COc1cc(C[N@H+](C)C[C@H](C)OC)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000517263107 944142575 /nfs/dbraw/zinc/14/25/75/944142575.db2.gz VINSKJOFYOEGSZ-HNNXBMFYSA-N 1 1 374.437 3.649 20 5 FHBDMO COc1ccc(CN2CCC[N@@H+](CC3CCCCC3)CC2)cc1[N+](=O)[O-] ZINC000515744065 944164941 /nfs/dbraw/zinc/16/49/41/944164941.db2.gz ZETUQDLQFUMJJT-UHFFFAOYSA-N 1 1 361.486 3.691 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@H]1CCC[N@H+]1C1CCCCC1 ZINC000436376803 944246136 /nfs/dbraw/zinc/24/61/36/944246136.db2.gz DAKLJHOASHYYPJ-QGZVFWFLSA-N 1 1 360.458 3.822 20 5 FHBDMO COc1cc(N2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)ccc1[N+](=O)[O-] ZINC000517410757 944279064 /nfs/dbraw/zinc/27/90/64/944279064.db2.gz XIQRVIOBRRPNBF-OAQYLSRUSA-N 1 1 367.449 3.706 20 5 FHBDMO C[C@H]1CCCC[N@H+]1CCCNc1ccc(-c2cccc([N+](=O)[O-])c2)nn1 ZINC001167751821 944347761 /nfs/dbraw/zinc/34/77/61/944347761.db2.gz NYRGUZXLJULABJ-HNNXBMFYSA-N 1 1 355.442 3.728 20 5 FHBDMO O=[N+]([O-])c1cc(CN[C@H]2CC[N@@H+](C3CC3)C2)ccc1Oc1ccc(F)cc1 ZINC000517545127 944393141 /nfs/dbraw/zinc/39/31/41/944393141.db2.gz CWHBCOUVLNUPNY-INIZCTEOSA-N 1 1 371.412 3.853 20 5 FHBDMO O=[N+]([O-])c1cc(CN[C@H]2CC[N@H+](C3CC3)C2)ccc1Oc1ccc(F)cc1 ZINC000517545127 944393149 /nfs/dbraw/zinc/39/31/49/944393149.db2.gz CWHBCOUVLNUPNY-INIZCTEOSA-N 1 1 371.412 3.853 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2nnc(C[NH2+][C@@H]3CCCC[C@@H]3C(F)(F)F)o2)cc1 ZINC000516058418 944460068 /nfs/dbraw/zinc/46/00/68/944460068.db2.gz AMAQRHQSSJYLEU-QWHCGFSZSA-N 1 1 370.331 3.856 20 5 FHBDMO O=[N+]([O-])c1ccc2c(ccnc2N2CC[NH+](Cc3ccsc3)CC2)c1 ZINC000584570748 944507015 /nfs/dbraw/zinc/50/70/15/944507015.db2.gz ANEBVHBKFNMTCU-UHFFFAOYSA-N 1 1 354.435 3.527 20 5 FHBDMO COc1ccc(Br)cc1C[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000015296689 944522836 /nfs/dbraw/zinc/52/28/36/944522836.db2.gz AUSBSEZTFVFHFV-UHFFFAOYSA-N 1 1 365.227 3.998 20 5 FHBDMO COc1ccc(Br)cc1C[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000015296689 944522842 /nfs/dbraw/zinc/52/28/42/944522842.db2.gz AUSBSEZTFVFHFV-UHFFFAOYSA-N 1 1 365.227 3.998 20 5 FHBDMO COc1cc(C[N@H+](Cc2ccccc2)[C@@H](C)CCO)c([N+](=O)[O-])cc1F ZINC000184296064 944532777 /nfs/dbraw/zinc/53/27/77/944532777.db2.gz LWRPGIXQJFDGQV-AWEZNQCLSA-N 1 1 362.401 3.516 20 5 FHBDMO COc1cc(C[N@@H+](Cc2ccccc2)[C@@H](C)CCO)c([N+](=O)[O-])cc1F ZINC000184296064 944532778 /nfs/dbraw/zinc/53/27/78/944532778.db2.gz LWRPGIXQJFDGQV-AWEZNQCLSA-N 1 1 362.401 3.516 20 5 FHBDMO C[C@@H]1C[C@@H](c2ccccc2)CC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000439333699 944544311 /nfs/dbraw/zinc/54/43/11/944544311.db2.gz WGCCDSLQFYTIRV-KPFFTGBYSA-N 1 1 370.449 3.603 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+](CCO)Cc3ccccc3)o2)cc1 ZINC000505867931 944550164 /nfs/dbraw/zinc/55/01/64/944550164.db2.gz JIINXSYBUGOQHN-UHFFFAOYSA-N 1 1 352.390 3.849 20 5 FHBDMO C[C@@H]1[C@H](CO)CC[N@H+]1Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000425993015 944557726 /nfs/dbraw/zinc/55/77/26/944557726.db2.gz JDNBEOJUGHGDJQ-WBVHZDCISA-N 1 1 355.438 3.565 20 5 FHBDMO Cc1ccc(C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C(C)C)s1 ZINC000516308292 944710125 /nfs/dbraw/zinc/71/01/25/944710125.db2.gz ZWYWRRJPQQDITP-INIZCTEOSA-N 1 1 364.467 3.615 20 5 FHBDMO C[C@H](CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)[N@H+]1CCC[C@H](C)C1 ZINC000506259771 944711493 /nfs/dbraw/zinc/71/14/93/944711493.db2.gz NLMPPJOUOJEGFP-QWHCGFSZSA-N 1 1 361.467 3.660 20 5 FHBDMO C[N@@H+](CCCn1c2cc([N+](=O)[O-])ccc2oc1=O)C1CCC(C)(C)CC1 ZINC000438506840 944715965 /nfs/dbraw/zinc/71/59/65/944715965.db2.gz UHLPVGJFBLZZAV-UHFFFAOYSA-N 1 1 361.442 3.793 20 5 FHBDMO CN(CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC[C@@H]1CCCC[N@H+]1C ZINC000072758971 944740525 /nfs/dbraw/zinc/74/05/25/944740525.db2.gz FBWXPGZUILUDIB-KRWDZBQOSA-N 1 1 372.469 3.599 20 5 FHBDMO CCOc1cccc(NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000388535086 944798219 /nfs/dbraw/zinc/79/82/19/944798219.db2.gz PINDLUSTXUJZAK-QGZVFWFLSA-N 1 1 355.438 3.928 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)[N@@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000500424130 944857162 /nfs/dbraw/zinc/85/71/62/944857162.db2.gz MIXSDCMVRMXSQM-IAGOWNOFSA-N 1 1 367.449 3.638 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)[N@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000500424130 944857176 /nfs/dbraw/zinc/85/71/76/944857176.db2.gz MIXSDCMVRMXSQM-IAGOWNOFSA-N 1 1 367.449 3.638 20 5 FHBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000437839597 944955357 /nfs/dbraw/zinc/95/53/57/944955357.db2.gz UZSWBAXAFLOTTN-RDJZCZTQSA-N 1 1 353.422 3.547 20 5 FHBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000437839597 944955364 /nfs/dbraw/zinc/95/53/64/944955364.db2.gz UZSWBAXAFLOTTN-RDJZCZTQSA-N 1 1 353.422 3.547 20 5 FHBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000511741475 944979145 /nfs/dbraw/zinc/97/91/45/944979145.db2.gz JCAXBPDBVNUQHR-INIZCTEOSA-N 1 1 373.478 3.687 20 5 FHBDMO COc1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc2c1OCCO2 ZINC000507173176 945022045 /nfs/dbraw/zinc/02/20/45/945022045.db2.gz LAJXJPKYALTCLL-UHFFFAOYSA-N 1 1 372.421 3.785 20 5 FHBDMO Cc1ccccc1[C@@H]1CC[N@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC000507203061 945028301 /nfs/dbraw/zinc/02/83/01/945028301.db2.gz IPQAOQRXNSCKQM-MRXNPFEDSA-N 1 1 353.422 3.640 20 5 FHBDMO Cc1ccccc1[C@@H]1CC[N@@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC000507203061 945028312 /nfs/dbraw/zinc/02/83/12/945028312.db2.gz IPQAOQRXNSCKQM-MRXNPFEDSA-N 1 1 353.422 3.640 20 5 FHBDMO COc1ccc(C[N@H+](C)[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000015440701 945469242 /nfs/dbraw/zinc/46/92/42/945469242.db2.gz SXZMIXXCTYISPG-ZDUSSCGKSA-N 1 1 368.393 3.846 20 5 FHBDMO COc1ccc(C[N@@H+](C)[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000015440701 945469249 /nfs/dbraw/zinc/46/92/49/945469249.db2.gz SXZMIXXCTYISPG-ZDUSSCGKSA-N 1 1 368.393 3.846 20 5 FHBDMO CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000729479935 945667063 /nfs/dbraw/zinc/66/70/63/945667063.db2.gz JINNMFYFSOQMPU-QGZVFWFLSA-N 1 1 363.458 3.816 20 5 FHBDMO CSc1ccc([N+](=O)[O-])c(C(=O)NCCCC[N@H+]2CCCC[C@H]2C)c1 ZINC000107602194 945735102 /nfs/dbraw/zinc/73/51/02/945735102.db2.gz LZPVKOPYOUIEEV-CQSZACIVSA-N 1 1 365.499 3.701 20 5 FHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CC[C@@H](COC(F)F)C2)c1 ZINC000550097543 945833067 /nfs/dbraw/zinc/83/30/67/945833067.db2.gz RSEPGPRTCXTMKC-SECBINFHSA-N 1 1 354.275 3.675 20 5 FHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@@H](COC(F)F)C2)c1 ZINC000550097543 945833071 /nfs/dbraw/zinc/83/30/71/945833071.db2.gz RSEPGPRTCXTMKC-SECBINFHSA-N 1 1 354.275 3.675 20 5 FHBDMO O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC[NH+](C2CCCC2)CC1 ZINC000045084208 945930204 /nfs/dbraw/zinc/93/02/04/945930204.db2.gz GIXSYQFKTVKQGC-UHFFFAOYSA-N 1 1 359.451 3.510 20 5 FHBDMO COc1cc(C[N@@H+]2CCC[C@@H](c3nccs3)C2)c([N+](=O)[O-])cc1F ZINC000184193566 945954652 /nfs/dbraw/zinc/95/46/52/945954652.db2.gz ZLNWSOPDRGKEGA-LLVKDONJSA-N 1 1 351.403 3.579 20 5 FHBDMO COc1cc(C[N@H+]2CCC[C@@H](c3nccs3)C2)c([N+](=O)[O-])cc1F ZINC000184193566 945954661 /nfs/dbraw/zinc/95/46/61/945954661.db2.gz ZLNWSOPDRGKEGA-LLVKDONJSA-N 1 1 351.403 3.579 20 5 FHBDMO CC[NH+](CC)[C@@H](C(=O)OCc1ccc([N+](=O)[O-])c(F)c1)c1ccccc1 ZINC000783586793 946040888 /nfs/dbraw/zinc/04/08/88/946040888.db2.gz MXYYOMZVDAGOSY-GOSISDBHSA-N 1 1 360.385 3.860 20 5 FHBDMO Cc1ccc(C[C@@H](C)[N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000444226960 946094632 /nfs/dbraw/zinc/09/46/32/946094632.db2.gz PTBFHGLANXTLGW-MRXNPFEDSA-N 1 1 355.438 3.713 20 5 FHBDMO C[C@@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)c1nnc2n1CCC2 ZINC000237435743 946552216 /nfs/dbraw/zinc/55/22/16/946552216.db2.gz KUIHAABWTVWKLT-GFCCVEGCSA-N 1 1 369.450 3.712 20 5 FHBDMO COc1ccc(OCC[N@H+]2C[C@@H](c3ccccc3)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC000441400625 946556878 /nfs/dbraw/zinc/55/68/78/946556878.db2.gz WWSNLTVYHAGFNT-RDJZCZTQSA-N 1 1 356.422 3.860 20 5 FHBDMO Cn1cnc([N+](=O)[O-])c1C[NH+]1CCC(c2cccc3ccccc32)CC1 ZINC000475526490 946597890 /nfs/dbraw/zinc/59/78/90/946597890.db2.gz FPHGWJDDSXTDPN-UHFFFAOYSA-N 1 1 350.422 3.861 20 5 FHBDMO CC[N@H+]1C[C@H](C)N(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[C@@H]1C ZINC000475194481 946677429 /nfs/dbraw/zinc/67/74/29/946677429.db2.gz QPACKDCEPGXPRS-QWRGUYRKSA-N 1 1 374.363 3.560 20 5 FHBDMO CCC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@H](C)C(=O)Nc1ccccc1 ZINC001168073169 946712402 /nfs/dbraw/zinc/71/24/02/946712402.db2.gz IDMUPZAKZSLBSU-MRXNPFEDSA-N 1 1 371.437 3.713 20 5 FHBDMO O=C(NC1CC1)[C@@H]1CCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000121450245 946744299 /nfs/dbraw/zinc/74/42/99/946744299.db2.gz LWSHVICCDJNXKG-KRWDZBQOSA-N 1 1 371.462 3.566 20 5 FHBDMO CC(C)(C)C[N@@H+](CCCO)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000112600101 946917591 /nfs/dbraw/zinc/91/75/91/946917591.db2.gz LBJSEIJIPPGYEL-UHFFFAOYSA-N 1 1 361.442 3.523 20 5 FHBDMO COC(=O)[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@H]1C ZINC000475361236 946952709 /nfs/dbraw/zinc/95/27/09/946952709.db2.gz FSHXZAHSXCTMIA-DYVFJYSZSA-N 1 1 374.462 3.954 20 5 FHBDMO CC[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C1CC1 ZINC000523200373 946985319 /nfs/dbraw/zinc/98/53/19/946985319.db2.gz VIBRBMHINHHWHA-UHFFFAOYSA-N 1 1 369.421 3.601 20 5 FHBDMO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248373562 947223111 /nfs/dbraw/zinc/22/31/11/947223111.db2.gz JSOZAGAAAMYIFK-XJKSGUPXSA-N 1 1 364.829 3.681 20 5 FHBDMO Cc1ccc(C)c([C@H](C)[N@@H+](C)C[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000523438730 947268492 /nfs/dbraw/zinc/26/84/92/947268492.db2.gz NOURIPQRZBVXRG-FUHWJXTLSA-N 1 1 358.438 3.644 20 5 FHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000523531472 947340377 /nfs/dbraw/zinc/34/03/77/947340377.db2.gz DTFVYHXIJKAAFJ-FCEWJHQRSA-N 1 1 373.497 3.736 20 5 FHBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000072838451 947570225 /nfs/dbraw/zinc/57/02/25/947570225.db2.gz LSBYVGKCKREIAS-HUUCEWRRSA-N 1 1 362.455 3.751 20 5 FHBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000072837919 947570375 /nfs/dbraw/zinc/57/03/75/947570375.db2.gz SIKSWPLBCHTDJV-CHWSQXEVSA-N 1 1 371.890 3.793 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](Cc1cccnc1)C(C)C ZINC000125741786 947590862 /nfs/dbraw/zinc/59/08/62/947590862.db2.gz POWZYXJIRPFEDF-UHFFFAOYSA-N 1 1 356.426 3.537 20 5 FHBDMO Cc1ccc([C@@H]2[C@@H](C)CCC[N@H+]2CCn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC000536378791 947851099 /nfs/dbraw/zinc/85/10/99/947851099.db2.gz MUSQUASIQSIDTH-JXFKEZNVSA-N 1 1 355.438 3.538 20 5 FHBDMO CC[N@H+]1CCC[C@@H]1CNc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000015164199 947853649 /nfs/dbraw/zinc/85/36/49/947853649.db2.gz AQRVMMRBEBMYSX-QGZVFWFLSA-N 1 1 353.422 3.722 20 5 FHBDMO C[C@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])c1nc(C(F)(F)F)cs1 ZINC000278940093 948311557 /nfs/dbraw/zinc/31/15/57/948311557.db2.gz NJFNXKOIKMWQCH-VIFPVBQESA-N 1 1 361.345 3.800 20 5 FHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H](O)c1ccccc1Br ZINC000179001125 948565568 /nfs/dbraw/zinc/56/55/68/948565568.db2.gz RSIXAJYQQUXGAF-MRXNPFEDSA-N 1 1 365.227 3.523 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2cnn(C[NH+]3CCC(OC4CCCC4)CC3)c2)cc1 ZINC000728900479 948777530 /nfs/dbraw/zinc/77/75/30/948777530.db2.gz JYDYSHMLAVZXPK-UHFFFAOYSA-N 1 1 370.453 3.839 20 5 FHBDMO CC[C@@H](C)[N@@H+](C)CCNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000524045939 948812215 /nfs/dbraw/zinc/81/22/15/948812215.db2.gz MUMCAAOPSXLLQW-OAHLLOKOSA-N 1 1 370.453 3.799 20 5 FHBDMO CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)Cc1ccc(OC)cc1 ZINC000109103808 206046303 /nfs/dbraw/zinc/04/63/03/206046303.db2.gz LFFFHEBYJHPPOK-UHFFFAOYSA-N 1 1 371.437 3.763 20 5 FHBDMO Cn1ccnc1[C@H]([NH2+][C@H]1C[C@@H]1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000568660949 568113097 /nfs/dbraw/zinc/11/30/97/568113097.db2.gz ZALFKGOGCOWKCQ-YSIASYRMSA-N 1 1 362.433 3.639 20 5 FHBDMO CC[C@H](Cc1ccccc1)[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000128723180 568220318 /nfs/dbraw/zinc/22/03/18/568220318.db2.gz UKOJBHLLZIDETK-GOSISDBHSA-N 1 1 356.422 3.914 20 5 FHBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCCC[C@H]1c1ccccc1 ZINC000569298012 568344322 /nfs/dbraw/zinc/34/43/22/568344322.db2.gz NWHFQAFVSPINJL-ROUUACIJSA-N 1 1 356.422 3.562 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])c(N2C[C@H]3CC[N@@H+](Cc4ccccc4)C[C@@H]3C2)n1 ZINC000569635371 568411592 /nfs/dbraw/zinc/41/15/92/568411592.db2.gz ZXTKKOIPHFGFSW-RTBURBONSA-N 1 1 366.465 3.565 20 5 FHBDMO CC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@@H](C)c1ccc(-c2nn[nH]n2)cc1 ZINC000825434861 608550219 /nfs/dbraw/zinc/55/02/19/608550219.db2.gz HXKGUZMOTRSUFV-AWEZNQCLSA-N 1 1 366.425 3.666 20 5 FHBDMO Cc1cc(C(=O)Nc2ccc([C@@H](C)[NH+]3CCOCC3)cc2)cc([N+](=O)[O-])c1 ZINC000110720429 945065448 /nfs/dbraw/zinc/06/54/48/945065448.db2.gz IFTXDIARVHRJDG-OAHLLOKOSA-N 1 1 369.421 3.549 20 5 FHBDMO CC[N@@H+](Cc1ccc(C(=O)Nc2ccc([N+](=O)[O-])c(C)n2)cc1)C1CC1 ZINC000133632596 927153580 /nfs/dbraw/zinc/15/35/80/927153580.db2.gz DPZYKWPKBFGYQP-UHFFFAOYSA-N 1 1 354.410 3.535 20 5 FHBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCC(c2ccsc2)CC1 ZINC000186913749 927573969 /nfs/dbraw/zinc/57/39/69/927573969.db2.gz QTMCRGXGRHMHPA-ZDUSSCGKSA-N 1 1 359.451 3.863 20 5 FHBDMO C[N@H+](Cc1cc(Br)cs1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136944353 927721191 /nfs/dbraw/zinc/72/11/91/927721191.db2.gz AFJRWEVKQNRMMZ-CQSZACIVSA-N 1 1 371.256 3.584 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CCC[C@@H]3c3ccncc3)co2)cc1 ZINC000154041007 928011509 /nfs/dbraw/zinc/01/15/09/928011509.db2.gz NZLWDTKSCMEDMT-GOSISDBHSA-N 1 1 350.378 3.982 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@@H]3c3ccncc3)co2)cc1 ZINC000154041007 928011524 /nfs/dbraw/zinc/01/15/24/928011524.db2.gz NZLWDTKSCMEDMT-GOSISDBHSA-N 1 1 350.378 3.982 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCCCC[N@@H+]1CCCC[C@@H]1C ZINC000120309501 928050163 /nfs/dbraw/zinc/05/01/63/928050163.db2.gz NEIXJKYDIHKUQJ-INIZCTEOSA-N 1 1 362.474 3.988 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000430210616 928100681 /nfs/dbraw/zinc/10/06/81/928100681.db2.gz FAJHBEPGUOOGTD-KRWDZBQOSA-N 1 1 370.405 3.712 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000430210616 928100690 /nfs/dbraw/zinc/10/06/90/928100690.db2.gz FAJHBEPGUOOGTD-KRWDZBQOSA-N 1 1 370.405 3.712 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H]1c1cccc2c1OCCO2 ZINC000430212810 928169072 /nfs/dbraw/zinc/16/90/72/928169072.db2.gz QAOVLVMIBAFLGV-KRWDZBQOSA-N 1 1 370.405 3.712 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]1c1cccc2c1OCCO2 ZINC000430212810 928169077 /nfs/dbraw/zinc/16/90/77/928169077.db2.gz QAOVLVMIBAFLGV-KRWDZBQOSA-N 1 1 370.405 3.712 20 5 FHBDMO CC(C)(C)OC1CC[NH+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000120614502 929107700 /nfs/dbraw/zinc/10/77/00/929107700.db2.gz BHBHEXLVLDLFSR-UHFFFAOYSA-N 1 1 358.442 3.695 20 5 FHBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+](C)C[C@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000066854077 929216500 /nfs/dbraw/zinc/21/65/00/929216500.db2.gz GZGVUSADDFLELD-GJZGRUSLSA-N 1 1 371.437 3.666 20 5 FHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C(=O)N(C)c2ccccc2)C1 ZINC000430296405 929398464 /nfs/dbraw/zinc/39/84/64/929398464.db2.gz JBTIHIORUVJLNY-NVXWUHKLSA-N 1 1 353.422 3.641 20 5 FHBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000610296826 929714626 /nfs/dbraw/zinc/71/46/26/929714626.db2.gz KXTKAZUOTAMNPR-MRXNPFEDSA-N 1 1 373.840 3.595 20 5 FHBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000610297347 929718697 /nfs/dbraw/zinc/71/86/97/929718697.db2.gz NDTQFIYUIXBVSR-INIZCTEOSA-N 1 1 373.840 3.595 20 5 FHBDMO COc1ccc(CN[C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000312594193 929799641 /nfs/dbraw/zinc/79/96/41/929799641.db2.gz XIDUNLDAZIYWRW-APWZRJJASA-N 1 1 369.465 3.604 20 5 FHBDMO COc1ccc(CN[C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000312594193 929799654 /nfs/dbraw/zinc/79/96/54/929799654.db2.gz XIDUNLDAZIYWRW-APWZRJJASA-N 1 1 369.465 3.604 20 5 FHBDMO CCC1(CC)[C@H]([NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C[C@H]1OC ZINC000560543736 929883583 /nfs/dbraw/zinc/88/35/83/929883583.db2.gz LUFSTBVHPQDSNA-KURKYZTESA-N 1 1 372.469 3.601 20 5 FHBDMO Cc1cc(C)n(-c2ccc(C[N@@H+]3CCc4c(cccc4[N+](=O)[O-])C3)cc2)n1 ZINC000536000886 937371127 /nfs/dbraw/zinc/37/11/27/937371127.db2.gz SBVQRYFACSRABX-UHFFFAOYSA-N 1 1 362.433 3.956 20 5 FHBDMO Cc1cc(C)n(-c2ccc(C[N@H+]3CCc4c(cccc4[N+](=O)[O-])C3)cc2)n1 ZINC000536000886 937371131 /nfs/dbraw/zinc/37/11/31/937371131.db2.gz SBVQRYFACSRABX-UHFFFAOYSA-N 1 1 362.433 3.956 20 5 FHBDMO C[C@H]1C[C@H](N(C)C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CC[N@H+]1C ZINC000275754775 930155822 /nfs/dbraw/zinc/15/58/22/930155822.db2.gz JQQYDDBAJCRGHN-GOEBONIOSA-N 1 1 363.461 3.648 20 5 FHBDMO C[C@H]1C[C@@H](N(C)C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CC[N@H+]1C ZINC000275754783 930156062 /nfs/dbraw/zinc/15/60/62/930156062.db2.gz JQQYDDBAJCRGHN-HOCLYGCPSA-N 1 1 363.461 3.648 20 5 FHBDMO CC[N@@H+](c1ccc(Nc2ccc(C(=O)NC)cc2[N+](=O)[O-])cc1)C(C)C ZINC000064904562 930227847 /nfs/dbraw/zinc/22/78/47/930227847.db2.gz OLZILHKVDWKIKT-UHFFFAOYSA-N 1 1 356.426 3.933 20 5 FHBDMO CC[N@H+](c1ccc(Nc2ccc(C(=O)NC)cc2[N+](=O)[O-])cc1)C(C)C ZINC000064904562 930227856 /nfs/dbraw/zinc/22/78/56/930227856.db2.gz OLZILHKVDWKIKT-UHFFFAOYSA-N 1 1 356.426 3.933 20 5 FHBDMO COc1cccc([C@@H](C)[NH+]2CCN(Cc3ccc(F)cc3[N+](=O)[O-])CC2)c1 ZINC001167360844 930313930 /nfs/dbraw/zinc/31/39/30/930313930.db2.gz SIKSDTZTCGKZBK-OAHLLOKOSA-N 1 1 373.428 3.621 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@](F)(c2ccccc2)C1 ZINC000579498049 930392298 /nfs/dbraw/zinc/39/22/98/930392298.db2.gz QYJSXZYORNHLGV-FQEVSTJZSA-N 1 1 371.412 3.803 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(OCc2ccc(F)cc2)CC1 ZINC000118962711 930475708 /nfs/dbraw/zinc/47/57/08/930475708.db2.gz SSYGKDZIDSGIKK-UHFFFAOYSA-N 1 1 374.412 3.924 20 5 FHBDMO COc1ccc(OCC[N@H+]2CCC[C@H]2Cc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC001167387153 930591374 /nfs/dbraw/zinc/59/13/74/930591374.db2.gz OSYMVVBPNBQFFP-SFHVURJKSA-N 1 1 370.449 3.998 20 5 FHBDMO CCc1ccc(C(=O)N2CC[C@@H]([N@@H+](C)Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000610437732 930604408 /nfs/dbraw/zinc/60/44/08/930604408.db2.gz LGKHXMJWDAOPCC-LJQANCHMSA-N 1 1 367.449 3.504 20 5 FHBDMO Cc1ccnc(-c2n[nH]c([C@@H](C)[NH2+][C@H](C)c3cc([N+](=O)[O-])ccc3C)n2)c1 ZINC000580511419 930785395 /nfs/dbraw/zinc/78/53/95/930785395.db2.gz FHNNORMDPQEDDD-ZIAGYGMSSA-N 1 1 366.425 3.804 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]([C@H](C)c1ccco1)C1CC1 ZINC000119262399 930992047 /nfs/dbraw/zinc/99/20/47/930992047.db2.gz UTBQZPBFHCKQJL-CYBMUJFWSA-N 1 1 373.409 3.751 20 5 FHBDMO CC(=O)c1ccc([N+](=O)[O-])cc1N1CC[C@@H](C)[N@H+](Cc2ccccc2)CC1 ZINC000580706800 931035912 /nfs/dbraw/zinc/03/59/12/931035912.db2.gz QOJDTBYMXUJWOZ-MRXNPFEDSA-N 1 1 367.449 3.898 20 5 FHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+](CCCO)Cc2ccccn2)o1 ZINC000581217660 931690582 /nfs/dbraw/zinc/69/05/82/931690582.db2.gz HCYZYLCRFCFVCE-UHFFFAOYSA-N 1 1 367.405 3.634 20 5 FHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+](CCCO)Cc2ccccn2)o1 ZINC000581217660 931690586 /nfs/dbraw/zinc/69/05/86/931690586.db2.gz HCYZYLCRFCFVCE-UHFFFAOYSA-N 1 1 367.405 3.634 20 5 FHBDMO Cc1ccc(NC(=O)N2CC[C@@H]([N@@H+](C)Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000610316913 931956366 /nfs/dbraw/zinc/95/63/66/931956366.db2.gz JNDJQBLCEDVODE-GOSISDBHSA-N 1 1 368.437 3.641 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H]1c1cccc(F)c1 ZINC000610505243 932014636 /nfs/dbraw/zinc/01/46/36/932014636.db2.gz DFVKIPBUGDFNBC-GOSISDBHSA-N 1 1 357.385 3.818 20 5 FHBDMO Cc1c(NC(=O)CC[N@H+](C)[C@@H](C)Cc2ccc(O)cc2)cccc1[N+](=O)[O-] ZINC000119396813 932198952 /nfs/dbraw/zinc/19/89/52/932198952.db2.gz WALYTCWCUQEKDM-AWEZNQCLSA-N 1 1 371.437 3.500 20 5 FHBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000477286958 932453185 /nfs/dbraw/zinc/45/31/85/932453185.db2.gz LYVXHQJWZZNNGT-MRXNPFEDSA-N 1 1 373.840 3.561 20 5 FHBDMO Cc1cc(C(=O)NC[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)cc([N+](=O)[O-])c1 ZINC000247365341 932610185 /nfs/dbraw/zinc/61/01/85/932610185.db2.gz KKAVDOAIWJXWTH-KBXCAEBGSA-N 1 1 373.478 3.778 20 5 FHBDMO Cc1c(C(=O)NC[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)cccc1[N+](=O)[O-] ZINC000247367678 932611084 /nfs/dbraw/zinc/61/10/84/932611084.db2.gz KODLQUZKRXPLOA-KBXCAEBGSA-N 1 1 373.478 3.778 20 5 FHBDMO COc1ccc(NC(=O)C[N@@H+]2CCC[C@H]2c2cccc(C)c2)c([N+](=O)[O-])c1 ZINC000055911134 932737154 /nfs/dbraw/zinc/73/71/54/932737154.db2.gz HVQXLWHMQSNNBB-SFHVURJKSA-N 1 1 369.421 3.687 20 5 FHBDMO COc1ccc(NC(=O)C[N@H+]2CCC[C@H]2c2cccc(C)c2)c([N+](=O)[O-])c1 ZINC000055911134 932737159 /nfs/dbraw/zinc/73/71/59/932737159.db2.gz HVQXLWHMQSNNBB-SFHVURJKSA-N 1 1 369.421 3.687 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C\CN1CC[NH+](C/C=C/c2ccccc2)CC1 ZINC000033324103 933068820 /nfs/dbraw/zinc/06/88/20/933068820.db2.gz NRGYNZQRBTVEKK-NGSBCVAZSA-N 1 1 363.461 3.939 20 5 FHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@H](C)O[C@]2(CCO[C@H](C)C2)C1 ZINC000430780865 933233237 /nfs/dbraw/zinc/23/32/37/933233237.db2.gz PPTJTRAFSDEPFE-QPXHVOONSA-N 1 1 360.454 3.657 20 5 FHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1C[C@H](C)O[C@]2(CCO[C@H](C)C2)C1 ZINC000430780865 933233244 /nfs/dbraw/zinc/23/32/44/933233244.db2.gz PPTJTRAFSDEPFE-QPXHVOONSA-N 1 1 360.454 3.657 20 5 FHBDMO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCO[C@]3(CCc4ccccc43)C2)cc1 ZINC000510640208 933335671 /nfs/dbraw/zinc/33/56/71/933335671.db2.gz ZGZACYQWEHXZGH-OAQYLSRUSA-N 1 1 368.433 3.538 20 5 FHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCO[C@]3(CCc4ccccc43)C2)cc1 ZINC000510640208 933335680 /nfs/dbraw/zinc/33/56/80/933335680.db2.gz ZGZACYQWEHXZGH-OAQYLSRUSA-N 1 1 368.433 3.538 20 5 FHBDMO Cc1cccc(C(=O)NC[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)c1[N+](=O)[O-] ZINC000247511392 934011886 /nfs/dbraw/zinc/01/18/86/934011886.db2.gz VSBRCUNWKOPXMR-KBXCAEBGSA-N 1 1 373.478 3.778 20 5 FHBDMO Cc1cc(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cc([N+](=O)[O-])c1 ZINC000176114210 934147689 /nfs/dbraw/zinc/14/76/89/934147689.db2.gz SJSOPILYDBZWNP-APWZRJJASA-N 1 1 367.449 3.686 20 5 FHBDMO C[N@H+]1CCC[C@@H]2CN(Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)CC[C@@H]21 ZINC000535806326 934412627 /nfs/dbraw/zinc/41/26/27/934412627.db2.gz QQLHUSWLNNSLRM-QAPCUYQASA-N 1 1 355.438 3.771 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@H+](Cc2ccc(F)cc2)C2CCOCC2)cs1 ZINC000277044818 934465514 /nfs/dbraw/zinc/46/55/14/934465514.db2.gz OCZXJAKSLURMRR-UHFFFAOYSA-N 1 1 350.415 3.977 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@@H+](Cc2ccc(F)cc2)C2CCOCC2)cs1 ZINC000277044818 934465519 /nfs/dbraw/zinc/46/55/19/934465519.db2.gz OCZXJAKSLURMRR-UHFFFAOYSA-N 1 1 350.415 3.977 20 5 FHBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1ccccc1N1CCCC1 ZINC000065222875 934731923 /nfs/dbraw/zinc/73/19/23/934731923.db2.gz VVCDUIAGGJDLHQ-UHFFFAOYSA-N 1 1 355.438 3.706 20 5 FHBDMO CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@@H]1CCC[N@@H+](C)C1 ZINC000538570934 934869074 /nfs/dbraw/zinc/86/90/74/934869074.db2.gz IOTKEVFGZCFUJL-OAHLLOKOSA-N 1 1 365.499 3.653 20 5 FHBDMO Cc1cnc(CC[N@H+](C)[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)s1 ZINC000157420704 935071759 /nfs/dbraw/zinc/07/17/59/935071759.db2.gz IYTCBANEGNALIN-GFCCVEGCSA-N 1 1 373.438 3.645 20 5 FHBDMO CCC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C[C@H]1COc2ccccc2O1 ZINC000071969813 935129860 /nfs/dbraw/zinc/12/98/60/935129860.db2.gz SQEIGOMBZRTDNT-SFHVURJKSA-N 1 1 356.422 3.689 20 5 FHBDMO Cc1cccc(-c2noc(C[N@H+](C)CCc3ccccc3[N+](=O)[O-])n2)c1 ZINC000511059517 935174896 /nfs/dbraw/zinc/17/48/96/935174896.db2.gz MVMJDNPMYUQPIW-UHFFFAOYSA-N 1 1 352.394 3.628 20 5 FHBDMO Cc1cccc(-c2noc(C[N@@H+](C)CCc3ccccc3[N+](=O)[O-])n2)c1 ZINC000511059517 935174897 /nfs/dbraw/zinc/17/48/97/935174897.db2.gz MVMJDNPMYUQPIW-UHFFFAOYSA-N 1 1 352.394 3.628 20 5 FHBDMO O=[N+]([O-])c1ccc2nc(N3CC[C@@H](n4c[nH+]c5c4CCCC5)C3)ccc2c1 ZINC000548662134 935202486 /nfs/dbraw/zinc/20/24/86/935202486.db2.gz RLYNXDCFIGMHFL-MRXNPFEDSA-N 1 1 363.421 3.670 20 5 FHBDMO CCc1ccc([C@H](C)NC(=O)C[N@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000511065057 935212519 /nfs/dbraw/zinc/21/25/19/935212519.db2.gz NCWCGVISIWUPRR-INIZCTEOSA-N 1 1 369.465 3.509 20 5 FHBDMO CCc1ccc([C@H](C)NC(=O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000511065057 935212523 /nfs/dbraw/zinc/21/25/23/935212523.db2.gz NCWCGVISIWUPRR-INIZCTEOSA-N 1 1 369.465 3.509 20 5 FHBDMO Cc1ccccc1[C@H](C)NC(=O)[C@@H](C)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511074602 935266370 /nfs/dbraw/zinc/26/63/70/935266370.db2.gz VRDXLHVVONXUPK-DLBZAZTESA-N 1 1 369.465 3.643 20 5 FHBDMO Cc1ccccc1[C@H](C)NC(=O)[C@@H](C)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511074602 935266375 /nfs/dbraw/zinc/26/63/75/935266375.db2.gz VRDXLHVVONXUPK-DLBZAZTESA-N 1 1 369.465 3.643 20 5 FHBDMO CCc1[nH+]ccn1C[C@H]1CCCN1c1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000540035711 935346743 /nfs/dbraw/zinc/34/67/43/935346743.db2.gz SGKSPJFYJBWBRO-CYBMUJFWSA-N 1 1 366.368 3.624 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21 ZINC000511785139 945110960 /nfs/dbraw/zinc/11/09/60/945110960.db2.gz IYROCCUZXZUGIR-VAMGGRTRSA-N 1 1 368.433 3.608 20 5 FHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CC[C@H](OCCCc2ccccc2)C1 ZINC001167568374 935594350 /nfs/dbraw/zinc/59/43/50/935594350.db2.gz QVQBIFASXPHFDJ-IBGZPJMESA-N 1 1 358.413 3.958 20 5 FHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CC[C@H](OCCCc2ccccc2)C1 ZINC001167568374 935594353 /nfs/dbraw/zinc/59/43/53/935594353.db2.gz QVQBIFASXPHFDJ-IBGZPJMESA-N 1 1 358.413 3.958 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000158562610 935635204 /nfs/dbraw/zinc/63/52/04/935635204.db2.gz LJTUCBOGWHJXFE-QAPCUYQASA-N 1 1 372.469 3.692 20 5 FHBDMO CCn1c2ccc(F)cc2nc1C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511127369 935724209 /nfs/dbraw/zinc/72/42/09/935724209.db2.gz VGSJXMJXGAKAFG-UHFFFAOYSA-N 1 1 356.401 3.778 20 5 FHBDMO CCn1c2ccc(F)cc2nc1C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511127369 935724210 /nfs/dbraw/zinc/72/42/10/935724210.db2.gz VGSJXMJXGAKAFG-UHFFFAOYSA-N 1 1 356.401 3.778 20 5 FHBDMO CCc1ccc([C@@H]([NH2+]CCN2CC=CCC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000479539231 935855966 /nfs/dbraw/zinc/85/59/66/935855966.db2.gz GINDZVWYPPIRLA-FQEVSTJZSA-N 1 1 355.438 3.691 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(c2ncnc3ccc([N+](=O)[O-])cc32)C1 ZINC000611707499 935948990 /nfs/dbraw/zinc/94/89/90/935948990.db2.gz NOZJBGQAKMMFRM-HZPDHXFCSA-N 1 1 369.469 3.629 20 5 FHBDMO CC[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@H](C)Cc1ccsc1 ZINC000187781625 935966084 /nfs/dbraw/zinc/96/60/84/935966084.db2.gz XUHCITRESHNXMX-CQSZACIVSA-N 1 1 361.467 3.856 20 5 FHBDMO CC[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@@H](C)Cc1ccsc1 ZINC000187781603 935967771 /nfs/dbraw/zinc/96/77/71/935967771.db2.gz XUHCITRESHNXMX-AWEZNQCLSA-N 1 1 361.467 3.856 20 5 FHBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(c2ncnc3ccc([N+](=O)[O-])cc32)C1 ZINC000611707502 936032525 /nfs/dbraw/zinc/03/25/25/936032525.db2.gz NOZJBGQAKMMFRM-JKSUJKDBSA-N 1 1 369.469 3.629 20 5 FHBDMO CC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000472255097 936077061 /nfs/dbraw/zinc/07/70/61/936077061.db2.gz HJUSHMOEPHDDOT-LBPRGKRZSA-N 1 1 356.348 3.893 20 5 FHBDMO C[N@H+](Cc1cc2ccccc2o1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000472293563 938305731 /nfs/dbraw/zinc/30/57/31/938305731.db2.gz KTYQZKABJLNNQA-SFHVURJKSA-N 1 1 365.389 3.578 20 5 FHBDMO C[N@@H+](Cc1cc2ccccc2o1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000472293563 938305733 /nfs/dbraw/zinc/30/57/33/938305733.db2.gz KTYQZKABJLNNQA-SFHVURJKSA-N 1 1 365.389 3.578 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C1CC1)C1CCCCC1 ZINC000052664757 938470537 /nfs/dbraw/zinc/47/05/37/938470537.db2.gz ABRIDIFTFSIWAJ-UHFFFAOYSA-N 1 1 361.442 3.729 20 5 FHBDMO C[C@H](C1CCCCC1)[N@@H+](C)CCCn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000584006354 938536759 /nfs/dbraw/zinc/53/67/59/938536759.db2.gz UDKIHTGHZDFPKK-CQSZACIVSA-N 1 1 361.442 3.793 20 5 FHBDMO Cc1c(NC(=O)[C@H](C)[N@@H+](C)CCCc2ccccc2)cccc1[N+](=O)[O-] ZINC000052802823 938594444 /nfs/dbraw/zinc/59/44/44/938594444.db2.gz WOFIWXNNOXVGJJ-INIZCTEOSA-N 1 1 355.438 3.795 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)CCCc1ccccc1 ZINC000052802805 938595727 /nfs/dbraw/zinc/59/57/27/938595727.db2.gz VESYUAPKQIULRP-UHFFFAOYSA-N 1 1 355.438 3.796 20 5 FHBDMO Cc1c(NC(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000584191554 938636963 /nfs/dbraw/zinc/63/69/63/938636963.db2.gz MICLLDJMCXUWRS-CRAIPNDOSA-N 1 1 368.437 3.688 20 5 FHBDMO Cc1noc(C)c1[C@H](C)[NH2+]Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000162199817 938796052 /nfs/dbraw/zinc/79/60/52/938796052.db2.gz JGFCXFMFPBCMLN-QMMMGPOBSA-N 1 1 354.204 3.813 20 5 FHBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000065675113 938858416 /nfs/dbraw/zinc/85/84/16/938858416.db2.gz FIXVXNAPHWIHPL-QWHCGFSZSA-N 1 1 361.467 3.660 20 5 FHBDMO COc1ccc(C[N@H+]2CCCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@H]2O)cc1[N+](=O)[O-] ZINC000573263485 938908649 /nfs/dbraw/zinc/90/86/49/938908649.db2.gz UQGUQHWZQKPEQV-ITQYTPKQSA-N 1 1 362.470 3.755 20 5 FHBDMO CC(C)c1ccc(C[NH+]2CCC([C@@H](O)C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000093766534 938929993 /nfs/dbraw/zinc/92/99/93/938929993.db2.gz MTZYISUZKHKUEL-MRXNPFEDSA-N 1 1 360.376 3.853 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CCN(c4ccccn4)CC3)o2)cc1 ZINC000158885672 938964090 /nfs/dbraw/zinc/96/40/90/938964090.db2.gz YVNABGKAXHFVTH-UHFFFAOYSA-N 1 1 364.405 3.572 20 5 FHBDMO Cc1cccc(NCc2cc(I)cc([N+](=O)[O-])c2)[nH+]1 ZINC000514977067 938972974 /nfs/dbraw/zinc/97/29/74/938972974.db2.gz RROXAEFUETVRBQ-UHFFFAOYSA-N 1 1 369.162 3.515 20 5 FHBDMO CC[N@@H+](CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])Cc1cccs1 ZINC000179176298 938983289 /nfs/dbraw/zinc/98/32/89/938983289.db2.gz IBJXUKKAMSEGGW-UHFFFAOYSA-N 1 1 363.439 3.516 20 5 FHBDMO COc1cc(C[NH2+][C@@H](C)c2cnccc2C)c([N+](=O)[O-])cc1OC(F)F ZINC000611939700 938993694 /nfs/dbraw/zinc/99/36/94/938993694.db2.gz UOUSIOGWEDEXIR-NSHDSACASA-N 1 1 367.352 3.759 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@H](Cc2ccccc2)[C@@H]1C ZINC000472341979 939001193 /nfs/dbraw/zinc/00/11/93/939001193.db2.gz IBFIPHMORVLIFN-WMZOPIPTSA-N 1 1 367.449 3.795 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@H](C4OCCO4)C3)s2)cc1 ZINC000179367162 939096797 /nfs/dbraw/zinc/09/67/97/939096797.db2.gz VGNVNOCTQAAUNB-HNNXBMFYSA-N 1 1 374.462 3.908 20 5 FHBDMO Cc1cccc([C@H]2CCC[N@H+]2C[C@H](O)COc2ccccc2[N+](=O)[O-])c1C ZINC000544143120 945277553 /nfs/dbraw/zinc/27/75/53/945277553.db2.gz YCKHOPOAJSKMAI-PKOBYXMFSA-N 1 1 370.449 3.788 20 5 FHBDMO Cc1noc([C@@H]2CCC[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2)n1 ZINC000179712346 939924643 /nfs/dbraw/zinc/92/46/43/939924643.db2.gz SOYNYNGOXJXHHZ-OAHLLOKOSA-N 1 1 368.393 3.926 20 5 FHBDMO COc1c(O)ccc(C[NH2+][C@H](C)c2ccccc2OC(F)F)c1[N+](=O)[O-] ZINC000892500000 940102543 /nfs/dbraw/zinc/10/25/43/940102543.db2.gz DGGTUTLBYQDZBM-SNVBAGLBSA-N 1 1 368.336 3.761 20 5 FHBDMO O=C(C[N@@H+]1CCSC2(CCC2)CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000411871594 940149277 /nfs/dbraw/zinc/14/92/77/940149277.db2.gz RWKBVECVHVILGD-UHFFFAOYSA-N 1 1 369.874 3.548 20 5 FHBDMO O=C(C[N@H+]1CCSC2(CCC2)CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000411871594 940149280 /nfs/dbraw/zinc/14/92/80/940149280.db2.gz RWKBVECVHVILGD-UHFFFAOYSA-N 1 1 369.874 3.548 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1CC[N@H+](C)[C@H]1c1cccs1 ZINC000365479508 940172269 /nfs/dbraw/zinc/17/22/69/940172269.db2.gz DQKHCFHJCJFVCI-CXAGYDPISA-N 1 1 374.466 3.779 20 5 FHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@H](c3ncc[nH]3)C2)o1 ZINC000092072452 940316344 /nfs/dbraw/zinc/31/63/44/940316344.db2.gz LHNQWTNZUQYISD-AWEZNQCLSA-N 1 1 352.394 3.958 20 5 FHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@@H](CC2CC2)C1 ZINC000580336091 940473189 /nfs/dbraw/zinc/47/31/89/940473189.db2.gz XPBFGMJTPFNYLR-YPMHNXCESA-N 1 1 351.834 3.697 20 5 FHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@@H](CC2CC2)C1 ZINC000580336091 940473191 /nfs/dbraw/zinc/47/31/91/940473191.db2.gz XPBFGMJTPFNYLR-YPMHNXCESA-N 1 1 351.834 3.697 20 5 FHBDMO Cn1nccc1C1=CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000580483425 940476518 /nfs/dbraw/zinc/47/65/18/940476518.db2.gz DJYSQKBKNUSDOI-UHFFFAOYSA-N 1 1 364.405 3.878 20 5 FHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@](CO)(Cc2ccc(F)cc2)C1 ZINC000580798236 940487546 /nfs/dbraw/zinc/48/75/46/940487546.db2.gz YSKDRWWMIIMHJG-MGPUTAFESA-N 1 1 358.413 3.722 20 5 FHBDMO CC(C)[C@@H](C)NC(=O)C1CC[NH+](Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000163513629 940499907 /nfs/dbraw/zinc/49/99/07/940499907.db2.gz ROLBSBQLWDMLQY-CYBMUJFWSA-N 1 1 367.877 3.621 20 5 FHBDMO COc1c(O)ccc(C[NH2+]Cc2ccc(F)cc2C(F)(F)F)c1[N+](=O)[O-] ZINC000892576481 940824998 /nfs/dbraw/zinc/82/49/98/940824998.db2.gz DSOPTQRPHSSAGD-UHFFFAOYSA-N 1 1 374.290 3.757 20 5 FHBDMO CCN(C(=O)c1ccc([N+](=O)[O-])c(C)c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000186328621 940977794 /nfs/dbraw/zinc/97/77/94/940977794.db2.gz YQOAZGJTQMBPQG-IBGZPJMESA-N 1 1 367.449 3.640 20 5 FHBDMO Cc1cc(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cc([N+](=O)[O-])c1 ZINC000176114192 940992057 /nfs/dbraw/zinc/99/20/57/940992057.db2.gz SJSOPILYDBZWNP-VQIMIIECSA-N 1 1 367.449 3.686 20 5 FHBDMO CCCCNC(=O)[C@@H]1CC[C@H](C)[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000511507692 941033942 /nfs/dbraw/zinc/03/39/42/941033942.db2.gz QXOIJGQPDCJCQZ-NKAACUPNSA-N 1 1 359.470 3.625 20 5 FHBDMO COCCO[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000188814435 941095746 /nfs/dbraw/zinc/09/57/46/941095746.db2.gz XAWAHTXJBRUITO-AWEZNQCLSA-N 1 1 362.451 3.561 20 5 FHBDMO COCCO[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000188814657 941095795 /nfs/dbraw/zinc/09/57/95/941095795.db2.gz RXSGOWIRVLSMKZ-MRXNPFEDSA-N 1 1 362.451 3.561 20 5 FHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]Cc2cnc3n2CCCC3)o1 ZINC000376716531 941388364 /nfs/dbraw/zinc/38/83/64/941388364.db2.gz NQBCBGGQKAPFLX-UHFFFAOYSA-N 1 1 352.394 3.677 20 5 FHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[C@@H]1O ZINC000190054762 941722670 /nfs/dbraw/zinc/72/26/70/941722670.db2.gz ZTCPBZKGERDIOX-BZNIZROVSA-N 1 1 350.802 3.711 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H](C)C[C@@H]1c1ccccc1 ZINC000513275778 941826098 /nfs/dbraw/zinc/82/60/98/941826098.db2.gz KCCOKIHWRSJJKU-AUUYWEPGSA-N 1 1 353.422 3.925 20 5 FHBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH+]1CCC(OC[C@H]2CCCCO2)CC1 ZINC000119301029 941877621 /nfs/dbraw/zinc/87/76/21/941877621.db2.gz MJJJXCQQZSNGHD-OAHLLOKOSA-N 1 1 368.861 3.798 20 5 FHBDMO CC(C)[C@H](C)[N@@H+](C)CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000433782232 941888817 /nfs/dbraw/zinc/88/88/17/941888817.db2.gz HRLRDQGVJRBHEU-LBPRGKRZSA-N 1 1 362.455 3.633 20 5 FHBDMO CC[C@H]([NH2+]Cc1ccc(O)c(OC)c1[N+](=O)[O-])c1cc(F)ccc1F ZINC000893019865 941895066 /nfs/dbraw/zinc/89/50/66/941895066.db2.gz UBSSVWQUQNQNQV-AWEZNQCLSA-N 1 1 352.337 3.828 20 5 FHBDMO COc1cc(C[N@H+]2CC[C@@H](c3cccc(F)c3)C2)c([N+](=O)[O-])cc1OC ZINC000513472451 941951741 /nfs/dbraw/zinc/95/17/41/941951741.db2.gz FMSBPYDSPWHRTK-CQSZACIVSA-N 1 1 360.385 3.741 20 5 FHBDMO C[C@@H]1C[C@@H](CC[NH2+]Cc2ccccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000513488479 941959828 /nfs/dbraw/zinc/95/98/28/941959828.db2.gz VTZATUYMNGZQGU-IEBWSBKVSA-N 1 1 353.466 3.985 20 5 FHBDMO C[C@@H](Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182817237 941971879 /nfs/dbraw/zinc/97/18/79/941971879.db2.gz MTLCLZHGEVLJCV-HIFRSBDPSA-N 1 1 372.469 3.544 20 5 FHBDMO COc1cc(C[N@@H+](C)C[C@@H]2CC=CCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000544107057 942037836 /nfs/dbraw/zinc/03/78/36/942037836.db2.gz BRYZVQWWEAPYES-GFCCVEGCSA-N 1 1 356.369 3.993 20 5 FHBDMO C/C(=C/c1ccccc1)C[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000501871810 942090851 /nfs/dbraw/zinc/09/08/51/942090851.db2.gz GSODVLRJODLXKJ-PEZBUJJGSA-N 1 1 353.422 3.959 20 5 FHBDMO Cc1c(C[NH2+][C@@H](C)c2ccc(Br)cn2)cccc1[N+](=O)[O-] ZINC000280272527 942147401 /nfs/dbraw/zinc/14/74/01/942147401.db2.gz XZFVDYBIVGRARD-NSHDSACASA-N 1 1 350.216 3.912 20 5 FHBDMO Cn1ccnc1[C@@H]([NH2+][C@H]1C[C@H](c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000280618606 942214739 /nfs/dbraw/zinc/21/47/39/942214739.db2.gz FJZMFJNTECXLHU-BJLQDIEVSA-N 1 1 362.433 3.954 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@@H](C)[N@@H+](C)Cc1ccccc1 ZINC000085637639 942333213 /nfs/dbraw/zinc/33/32/13/942333213.db2.gz YQZVPIHJDSRWQE-OAHLLOKOSA-N 1 1 370.453 3.854 20 5 FHBDMO O=C(C[N@@H+]1CCC[C@@H]1Cc1ccccc1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000025439717 942342637 /nfs/dbraw/zinc/34/26/37/942342637.db2.gz QGBHGDKUXBRZFZ-OAHLLOKOSA-N 1 1 373.840 3.894 20 5 FHBDMO O=C(C[N@H+]1CCC[C@@H]1Cc1ccccc1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000025439717 942342640 /nfs/dbraw/zinc/34/26/40/942342640.db2.gz QGBHGDKUXBRZFZ-OAHLLOKOSA-N 1 1 373.840 3.894 20 5 FHBDMO O=[N+]([O-])c1ccc2ccnc(N3CC[C@@H]4[C@H](CCC[N@H+]4C4CC4)C3)c2c1 ZINC000413199106 942457623 /nfs/dbraw/zinc/45/76/23/942457623.db2.gz IRTKPKAKPFSSCB-DNVCBOLYSA-N 1 1 352.438 3.596 20 5 FHBDMO Cc1cc([NH+]2CCCC2)ccc1N[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000052774372 942506285 /nfs/dbraw/zinc/50/62/85/942506285.db2.gz BJBQPHPTYKMKNC-OAHLLOKOSA-N 1 1 368.437 3.943 20 5 FHBDMO Cn1cc(C[N@@H+](C)C2CC(OC(C)(C)C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000421375578 942525692 /nfs/dbraw/zinc/52/56/92/942525692.db2.gz QMXUVKFAQAISQB-UHFFFAOYSA-N 1 1 372.469 3.773 20 5 FHBDMO CC(C)([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCC1CCCCC1 ZINC000502718954 942681269 /nfs/dbraw/zinc/68/12/69/942681269.db2.gz UPLOSYHMHPKJBA-UHFFFAOYSA-N 1 1 367.877 3.813 20 5 FHBDMO Cc1cc(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])cn2cc[nH+]c12 ZINC000502749980 942716458 /nfs/dbraw/zinc/71/64/58/942716458.db2.gz VNIRKXYEYCTVHR-UHFFFAOYSA-N 1 1 364.283 3.822 20 5 FHBDMO Cn1c2ccccc2cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1=O ZINC000584568150 942809824 /nfs/dbraw/zinc/80/98/24/942809824.db2.gz AATKYERCCBYMCW-UHFFFAOYSA-N 1 1 363.417 3.611 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC[C@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000421770958 942814291 /nfs/dbraw/zinc/81/42/91/942814291.db2.gz LDFSHFZDLGRBKQ-ZWKOTPCHSA-N 1 1 373.497 3.938 20 5 FHBDMO O=[N+]([O-])c1cccc([C@H](N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c2ccccc2)c1 ZINC000378494347 942827138 /nfs/dbraw/zinc/82/71/38/942827138.db2.gz KXJUKPAXOZSNRW-SFHLNBCPSA-N 1 1 351.450 3.901 20 5 FHBDMO COc1ccc(NC(=O)C[N@H+](C)Cc2ccc(C(C)C)cc2)c([N+](=O)[O-])c1 ZINC000016588139 942880266 /nfs/dbraw/zinc/88/02/66/942880266.db2.gz PFSCFSASJJBLAO-UHFFFAOYSA-N 1 1 371.437 3.797 20 5 FHBDMO COc1ccc(NC(=O)C[N@@H+](C)Cc2ccc(C(C)C)cc2)c([N+](=O)[O-])c1 ZINC000016588139 942880270 /nfs/dbraw/zinc/88/02/70/942880270.db2.gz PFSCFSASJJBLAO-UHFFFAOYSA-N 1 1 371.437 3.797 20 5 FHBDMO C[N@H+]1CC[C@@]2(CCN(Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)C2)C1 ZINC000430114277 942927178 /nfs/dbraw/zinc/92/71/78/942927178.db2.gz CASZZYYLDLPXPG-LJQANCHMSA-N 1 1 357.479 3.851 20 5 FHBDMO CN1CC[C@@]2(CC[N@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)C2)C1 ZINC000430114277 942927197 /nfs/dbraw/zinc/92/71/97/942927197.db2.gz CASZZYYLDLPXPG-LJQANCHMSA-N 1 1 357.479 3.851 20 5 FHBDMO CN1CC[C@@]2(CC[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)C2)C1 ZINC000430114277 942927201 /nfs/dbraw/zinc/92/72/01/942927201.db2.gz CASZZYYLDLPXPG-LJQANCHMSA-N 1 1 357.479 3.851 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2nc(CNC[C@@H]3CCCC[N@H+]3C3CC3)cs2)c1 ZINC000434782730 942961667 /nfs/dbraw/zinc/96/16/67/942961667.db2.gz DNKHFCZPYJOEQX-SFHVURJKSA-N 1 1 372.494 3.825 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]C[C@@H]3CCCCN3C3CC3)cs2)c1 ZINC000434782730 942961671 /nfs/dbraw/zinc/96/16/71/942961671.db2.gz DNKHFCZPYJOEQX-SFHVURJKSA-N 1 1 372.494 3.825 20 5 FHBDMO O=[N+]([O-])c1cccc(OCC[N@H+](Cc2ccccc2)C[C@@H]2CCCO2)c1 ZINC000505552604 943009316 /nfs/dbraw/zinc/00/93/16/943009316.db2.gz BLVKDXCBRBMSDF-FQEVSTJZSA-N 1 1 356.422 3.655 20 5 FHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+](Cc1ccccc1)C[C@@H]1CCCO1 ZINC000505559555 943029927 /nfs/dbraw/zinc/02/99/27/943029927.db2.gz LGFLHXOIDRKPHO-SFHVURJKSA-N 1 1 356.422 3.655 20 5 FHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](c2ccccc2)[C@H]1C ZINC000434895767 943034126 /nfs/dbraw/zinc/03/41/26/943034126.db2.gz NBGOYQORBFCDCA-BFYDXBDKSA-N 1 1 353.422 3.800 20 5 FHBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000503401475 943163584 /nfs/dbraw/zinc/16/35/84/943163584.db2.gz CKRQPCNFKYHUQA-ZIAGYGMSSA-N 1 1 365.499 3.652 20 5 FHBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000503401473 943163777 /nfs/dbraw/zinc/16/37/77/943163777.db2.gz CKRQPCNFKYHUQA-KGLIPLIRSA-N 1 1 365.499 3.652 20 5 FHBDMO C[C@]1(CNC(=O)c2ccc(F)cc2[N+](=O)[O-])CCC[N@H+]1Cc1ccccc1 ZINC000162331790 943333368 /nfs/dbraw/zinc/33/33/68/943333368.db2.gz JRGGNQMZCNPODC-HXUWFJFHSA-N 1 1 371.412 3.518 20 5 FHBDMO CC[C@H]1C[C@@H](C)C[N@H+]1CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000467208880 943478803 /nfs/dbraw/zinc/47/88/03/943478803.db2.gz VGAUTCRMPMPBDD-OCCSQVGLSA-N 1 1 374.466 3.777 20 5 FHBDMO CCOc1ccc([C@H](C)[NH2+]C[C@@H](N)c2ccccc2CC)cc1[N+](=O)[O-] ZINC000423513083 943542185 /nfs/dbraw/zinc/54/21/85/943542185.db2.gz VAZADTYVRRBQMQ-KBXCAEBGSA-N 1 1 357.454 3.907 20 5 FHBDMO CS(=O)(=O)c1ccccc1C[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417385925 943563294 /nfs/dbraw/zinc/56/32/94/943563294.db2.gz YDXPLKYSTLTMNQ-SFHVURJKSA-N 1 1 374.462 3.556 20 5 FHBDMO C[C@H]([N@@H+](C)CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)C1(C)CC1 ZINC000437524210 943903680 /nfs/dbraw/zinc/90/36/80/943903680.db2.gz MHDADYJOICDVQM-LBPRGKRZSA-N 1 1 374.466 3.777 20 5 FHBDMO Cc1cnn([C@@H]2CC[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C2)c1 ZINC000584501902 943927101 /nfs/dbraw/zinc/92/71/01/943927101.db2.gz ZZVIBOCSSKMMJE-QGZVFWFLSA-N 1 1 352.394 3.807 20 5 FHBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC000425444417 943953247 /nfs/dbraw/zinc/95/32/47/943953247.db2.gz NOUKWSQAGZTQKY-HIFRSBDPSA-N 1 1 355.232 3.501 20 5 FHBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC000425444417 943953251 /nfs/dbraw/zinc/95/32/51/943953251.db2.gz NOUKWSQAGZTQKY-HIFRSBDPSA-N 1 1 355.232 3.501 20 5 FHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2C[C@H](c3ccccc3)[C@@H]3COCC[C@@H]32)cc1 ZINC000511645230 943990907 /nfs/dbraw/zinc/99/09/07/943990907.db2.gz FXOAJAGLMSSOBW-HKBOAZHASA-N 1 1 352.434 3.642 20 5 FHBDMO C[C@@H]1[C@H](c2ccccc2)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500093946 944084701 /nfs/dbraw/zinc/08/47/01/944084701.db2.gz SWXAIUKYWYEQFH-NVXWUHKLSA-N 1 1 353.422 3.801 20 5 FHBDMO COC[C@@H]1CCC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000425495241 944119904 /nfs/dbraw/zinc/11/99/04/944119904.db2.gz SEZBEUMHOLZCBD-GFCCVEGCSA-N 1 1 357.248 3.606 20 5 FHBDMO COC[C@@H]1CCC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000425495241 944119909 /nfs/dbraw/zinc/11/99/09/944119909.db2.gz SEZBEUMHOLZCBD-GFCCVEGCSA-N 1 1 357.248 3.606 20 5 FHBDMO CN(C)C(=O)c1ccccc1C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000418072982 944123097 /nfs/dbraw/zinc/12/30/97/944123097.db2.gz LREOQDMNJLMFMR-QGZVFWFLSA-N 1 1 367.449 3.676 20 5 FHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(c2cc(C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000436303065 944186849 /nfs/dbraw/zinc/18/68/49/944186849.db2.gz BMIVTCZPVVSILL-FRRDWIJNSA-N 1 1 372.391 3.850 20 5 FHBDMO CSCC[C@H]([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)c1nnc2ccccn21 ZINC000123240416 944309273 /nfs/dbraw/zinc/30/92/73/944309273.db2.gz SULPNPYNOMUGIM-HNNXBMFYSA-N 1 1 371.466 3.530 20 5 FHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CCCCCOc3ccccc3)C2)nc1 ZINC000438099680 944340412 /nfs/dbraw/zinc/34/04/12/944340412.db2.gz XIJZTHDGWFBGHM-QGZVFWFLSA-N 1 1 370.453 3.725 20 5 FHBDMO O=C(CC1CCCC1)N1CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000506499133 944387886 /nfs/dbraw/zinc/38/78/86/944387886.db2.gz JMNQLOXXSZWWJB-BJMVGYQFSA-N 1 1 371.481 3.723 20 5 FHBDMO O=C(CC1CCCC1)N1CCC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000506499133 944387894 /nfs/dbraw/zinc/38/78/94/944387894.db2.gz JMNQLOXXSZWWJB-BJMVGYQFSA-N 1 1 371.481 3.723 20 5 FHBDMO O=[N+]([O-])c1c(NCC[N@H+]2CCc3sccc3C2)ccc2ncccc21 ZINC000053580049 944395724 /nfs/dbraw/zinc/39/57/24/944395724.db2.gz VGXRNCSOWGKGLP-UHFFFAOYSA-N 1 1 354.435 3.675 20 5 FHBDMO C[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000518474003 944413653 /nfs/dbraw/zinc/41/36/53/944413653.db2.gz QZVGDWRBCGVSRC-SJORKVTESA-N 1 1 367.232 3.992 20 5 FHBDMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000518474003 944413656 /nfs/dbraw/zinc/41/36/56/944413656.db2.gz QZVGDWRBCGVSRC-SJORKVTESA-N 1 1 367.232 3.992 20 5 FHBDMO CC(C)c1ccccc1OC[C@@H](O)C[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000046835981 944455931 /nfs/dbraw/zinc/45/59/31/944455931.db2.gz JAEXDSXYKGEENZ-KRWDZBQOSA-N 1 1 358.438 3.590 20 5 FHBDMO CC(C)c1ccccc1OC[C@@H](O)C[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000046835981 944455934 /nfs/dbraw/zinc/45/59/34/944455934.db2.gz JAEXDSXYKGEENZ-KRWDZBQOSA-N 1 1 358.438 3.590 20 5 FHBDMO Cc1cc(NC(=O)N[C@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000473789234 944468787 /nfs/dbraw/zinc/46/87/87/944468787.db2.gz RTDBPIHMKOOCLY-QAPCUYQASA-N 1 1 368.437 3.860 20 5 FHBDMO CCC[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC1 ZINC000517738582 944550043 /nfs/dbraw/zinc/55/00/43/944550043.db2.gz UJNWJOOCLUKHRG-UHFFFAOYSA-N 1 1 369.421 3.555 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](COc2ccccc2)C1 ZINC000505874720 944573125 /nfs/dbraw/zinc/57/31/25/944573125.db2.gz MWIGICGPZAMVIN-MRXNPFEDSA-N 1 1 356.422 3.894 20 5 FHBDMO O=c1[nH]ccc2c1C[N@@H+](Cc1ccc(-c3ccccc3[N+](=O)[O-])o1)CC2 ZINC000426372273 944582289 /nfs/dbraw/zinc/58/22/89/944582289.db2.gz NWZRMVZJNVGMCE-UHFFFAOYSA-N 1 1 351.362 3.514 20 5 FHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@@H]1CCCc2ccccc21 ZINC000015291595 944593084 /nfs/dbraw/zinc/59/30/84/944593084.db2.gz YUWUVQMTORNETA-LJQANCHMSA-N 1 1 354.406 3.971 20 5 FHBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000518761159 944709855 /nfs/dbraw/zinc/70/98/55/944709855.db2.gz WWHQUNMCQLOJSH-GASCZTMLSA-N 1 1 373.453 3.829 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](C)[N@@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000500424131 944856683 /nfs/dbraw/zinc/85/66/83/944856683.db2.gz MIXSDCMVRMXSQM-IRXDYDNUSA-N 1 1 367.449 3.638 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](C)[N@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000500424131 944856690 /nfs/dbraw/zinc/85/66/90/944856690.db2.gz MIXSDCMVRMXSQM-IRXDYDNUSA-N 1 1 367.449 3.638 20 5 FHBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@@H+](C)C1CCCC1 ZINC000506314989 944902215 /nfs/dbraw/zinc/90/22/15/944902215.db2.gz NYTSKBBARNXRLZ-UHFFFAOYSA-N 1 1 365.499 3.701 20 5 FHBDMO Cc1ccccc1[C@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000507165301 944997891 /nfs/dbraw/zinc/99/78/91/944997891.db2.gz PASMAHIMJWNCAT-INIZCTEOSA-N 1 1 353.422 3.721 20 5 FHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1c[nH]nc1-c1ccccc1F ZINC000516602953 945046993 /nfs/dbraw/zinc/04/69/93/945046993.db2.gz HFAMKKSRYQQRAF-UHFFFAOYSA-N 1 1 354.385 3.799 20 5 FHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21 ZINC000511762753 945051902 /nfs/dbraw/zinc/05/19/02/945051902.db2.gz OITFDMSKMRHOTP-AYBZRNKSSA-N 1 1 356.397 3.738 20 5 FHBDMO Cc1c(NC(=O)CC[N@H+]2CCCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000106887499 945425644 /nfs/dbraw/zinc/42/56/44/945425644.db2.gz OSNQIKYYHCELGT-UHFFFAOYSA-N 1 1 353.422 3.680 20 5 FHBDMO CC[C@@H](C)[N@@H+](CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000507680331 945444794 /nfs/dbraw/zinc/44/47/94/945444794.db2.gz ZMIVZKQCRNQVFI-OAHLLOKOSA-N 1 1 371.437 3.843 20 5 FHBDMO C[C@@H](O)[C@H]1CC[N@@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000507697629 945461429 /nfs/dbraw/zinc/46/14/29/945461429.db2.gz KMDIKMHVPJBVEZ-HIFRSBDPSA-N 1 1 360.385 3.729 20 5 FHBDMO O=C(NC[C@@H]1CCC[N@H+]1C1CCCCC1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000280940618 945470344 /nfs/dbraw/zinc/47/03/44/945470344.db2.gz JFROTLXRAWQYGX-AWEZNQCLSA-N 1 1 365.861 3.775 20 5 FHBDMO C[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C1CCCCC1 ZINC000438052502 945487637 /nfs/dbraw/zinc/48/76/37/945487637.db2.gz TZQQCBCEHYNDRU-UHFFFAOYSA-N 1 1 373.375 3.608 20 5 FHBDMO O=[N+]([O-])c1ccc(Br)cc1NCCc1cn2c([nH+]1)CCCC2 ZINC000302681012 945533119 /nfs/dbraw/zinc/53/31/19/945533119.db2.gz RVDNSODLMJSRMX-UHFFFAOYSA-N 1 1 365.231 3.545 20 5 FHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+](CCCO)Cc2ccccc2)c1 ZINC000093102240 945581555 /nfs/dbraw/zinc/58/15/55/945581555.db2.gz ZAZXEENLRLBYQA-UHFFFAOYSA-N 1 1 366.364 3.581 20 5 FHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+](CCCO)Cc2ccccc2)c1 ZINC000093102240 945581561 /nfs/dbraw/zinc/58/15/61/945581561.db2.gz ZAZXEENLRLBYQA-UHFFFAOYSA-N 1 1 366.364 3.581 20 5 FHBDMO Cc1cc(N2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549524981 945605053 /nfs/dbraw/zinc/60/50/53/945605053.db2.gz OYFYHCVGWNQEHN-OCCSQVGLSA-N 1 1 357.376 3.843 20 5 FHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@H](c3cc[nH]n3)C2)o1 ZINC000121220501 945720925 /nfs/dbraw/zinc/72/09/25/945720925.db2.gz PFTPICUULJBUFC-AWEZNQCLSA-N 1 1 352.394 3.958 20 5 FHBDMO CC(=O)c1ccc(N2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)c([N+](=O)[O-])c1 ZINC000281864024 945892430 /nfs/dbraw/zinc/89/24/30/945892430.db2.gz KJPNNEISBUGHHF-MRXNPFEDSA-N 1 1 368.437 3.714 20 5 FHBDMO Cc1ccccc1OCCC[N@@H+](C)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000108255921 945909287 /nfs/dbraw/zinc/90/92/87/945909287.db2.gz ASSPELJSLZOAGK-INIZCTEOSA-N 1 1 371.437 3.631 20 5 FHBDMO Cc1ccccc1OCCC[N@H+](C)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000108255921 945909293 /nfs/dbraw/zinc/90/92/93/945909293.db2.gz ASSPELJSLZOAGK-INIZCTEOSA-N 1 1 371.437 3.631 20 5 FHBDMO COc1ccc(Br)c(C[NH2+]Cc2cccc([N+](=O)[O-])c2)c1 ZINC000111158677 945926238 /nfs/dbraw/zinc/92/62/38/945926238.db2.gz FAWWSUWNSANATK-UHFFFAOYSA-N 1 1 351.200 3.656 20 5 FHBDMO COc1cc(C[N@@H+]2CCC[C@H](c3nccs3)C2)c([N+](=O)[O-])cc1F ZINC000184193546 945954326 /nfs/dbraw/zinc/95/43/26/945954326.db2.gz ZLNWSOPDRGKEGA-NSHDSACASA-N 1 1 351.403 3.579 20 5 FHBDMO COc1cc(C[N@H+]2CCC[C@H](c3nccs3)C2)c([N+](=O)[O-])cc1F ZINC000184193546 945954336 /nfs/dbraw/zinc/95/43/36/945954336.db2.gz ZLNWSOPDRGKEGA-NSHDSACASA-N 1 1 351.403 3.579 20 5 FHBDMO CC[NH+](CC)[C@H](C(=O)OCc1ccc([N+](=O)[O-])c(F)c1)c1ccccc1 ZINC000783586794 946040699 /nfs/dbraw/zinc/04/06/99/946040699.db2.gz MXYYOMZVDAGOSY-SFHVURJKSA-N 1 1 360.385 3.860 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000248742370 946096785 /nfs/dbraw/zinc/09/67/85/946096785.db2.gz DVBNHKCOUAIFHK-SJORKVTESA-N 1 1 359.470 3.630 20 5 FHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](C[C@@H]3CCC4(CCCCCC4)O3)C2)nc1 ZINC001167778383 946096841 /nfs/dbraw/zinc/09/68/41/946096841.db2.gz FLCIWFUAHVYBEA-AEFFLSMTSA-N 1 1 374.485 3.748 20 5 FHBDMO Cc1ccccc1C[NH+]1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CC1 ZINC000609873370 946178659 /nfs/dbraw/zinc/17/86/59/946178659.db2.gz GQDZEULRQGTQTI-UHFFFAOYSA-N 1 1 373.840 3.515 20 5 FHBDMO C/C(=C/C(=O)NCCCC[N@@H+]1CCC[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000785283388 946226400 /nfs/dbraw/zinc/22/64/00/946226400.db2.gz RUABKALSFNFVJK-DXFLKOCDSA-N 1 1 359.470 3.626 20 5 FHBDMO C[C@@H]1C[N@@H+]2CCCC[C@H]2CN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000408182665 946301475 /nfs/dbraw/zinc/30/14/75/946301475.db2.gz LIIKEDAYXZGWRK-DOMZBBRYSA-N 1 1 359.451 3.508 20 5 FHBDMO C[C@@H]1C[N@H+]2CCCC[C@H]2CN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000408182665 946301484 /nfs/dbraw/zinc/30/14/84/946301484.db2.gz LIIKEDAYXZGWRK-DOMZBBRYSA-N 1 1 359.451 3.508 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H](Cc3ccc(F)cc3)C2)c2c(c1)COCO2 ZINC000121368220 946427483 /nfs/dbraw/zinc/42/74/83/946427483.db2.gz GOKYTSAARBBCQU-HNNXBMFYSA-N 1 1 372.396 3.665 20 5 FHBDMO COc1ccc(OCC[N@@H+](CCc2ccc(F)cc2)C2CC2)c([N+](=O)[O-])c1 ZINC000441383348 946506564 /nfs/dbraw/zinc/50/65/64/946506564.db2.gz OTPVLKOMIWDHHY-UHFFFAOYSA-N 1 1 374.412 3.828 20 5 FHBDMO COc1ccc(OCC[N@H+]2C[C@@H](c3ccc(F)cc3)C[C@H]2C)c([N+](=O)[O-])c1 ZINC000441395904 946551662 /nfs/dbraw/zinc/55/16/62/946551662.db2.gz NYMUMGAJKCORBX-ZBFHGGJFSA-N 1 1 374.412 3.999 20 5 FHBDMO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]C1CC(N2CCCCC2)C1 ZINC000475560096 946641246 /nfs/dbraw/zinc/64/12/46/946641246.db2.gz RZYIZNPLESXDAU-CMTQZCSUSA-N 1 1 357.498 3.913 20 5 FHBDMO C[C@@H]([NH2+][C@H](c1cnn(C)c1)c1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000186647518 946780950 /nfs/dbraw/zinc/78/09/50/946780950.db2.gz GZWUPFUERLATHP-YJYMSZOUSA-N 1 1 354.385 3.908 20 5 FHBDMO CN(C(=O)c1c(Cl)cccc1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475315904 946878676 /nfs/dbraw/zinc/87/86/76/946878676.db2.gz YJOOJAJKYQHXFC-HNNXBMFYSA-N 1 1 373.840 3.595 20 5 FHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@@H](Cc4ccccc4)C3)nc2c1 ZINC000444602550 947029649 /nfs/dbraw/zinc/02/96/49/947029649.db2.gz KJASWTOZKNASNC-INIZCTEOSA-N 1 1 350.422 3.926 20 5 FHBDMO COc1c(C)cc(C[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1C ZINC000444617486 947044594 /nfs/dbraw/zinc/04/45/94/947044594.db2.gz FCYAXWQRLSRGJA-UHFFFAOYSA-N 1 1 354.410 3.729 20 5 FHBDMO COc1c(C)cc(C[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1C ZINC000444617486 947044584 /nfs/dbraw/zinc/04/45/84/947044584.db2.gz FCYAXWQRLSRGJA-UHFFFAOYSA-N 1 1 354.410 3.729 20 5 FHBDMO C[C@@H]1C[C@@H](c2ccc(F)cc2)C[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000121491438 947141276 /nfs/dbraw/zinc/14/12/76/947141276.db2.gz QPXBQDMTZUEKOS-UKRRQHHQSA-N 1 1 372.396 3.978 20 5 FHBDMO Cc1[nH+]ccn1-c1ccc([C@H](C)NC(=O)c2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000150779961 947341464 /nfs/dbraw/zinc/34/14/64/947341464.db2.gz LYMMPHMAAPUZTL-LBPRGKRZSA-N 1 1 368.368 3.719 20 5 FHBDMO Cc1ccc(C(=O)N2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)cc1[N+](=O)[O-] ZINC000072810798 947350131 /nfs/dbraw/zinc/35/01/31/947350131.db2.gz OFNSBWBQFYUOET-IRXDYDNUSA-N 1 1 359.470 3.630 20 5 FHBDMO CC(C)CCSc1ccc(C(=O)NCC[N@@H+](C)C(C)C)cc1[N+](=O)[O-] ZINC000523623603 947452776 /nfs/dbraw/zinc/45/27/76/947452776.db2.gz PCFLXSDKEMMTKQ-UHFFFAOYSA-N 1 1 367.515 3.803 20 5 FHBDMO Cn1cnc([N+](=O)[O-])c1NCC1([N@@H+](C)Cc2ccccc2)CCCCC1 ZINC000714228321 947454706 /nfs/dbraw/zinc/45/47/06/947454706.db2.gz KGROXJDGVHJGTO-UHFFFAOYSA-N 1 1 357.458 3.575 20 5 FHBDMO CC(=O)c1cc(NC2CCN(c3ccc(C)c[nH+]3)CC2)ccc1[N+](=O)[O-] ZINC000367726648 947517075 /nfs/dbraw/zinc/51/70/75/947517075.db2.gz DABOOMWPHDISNR-UHFFFAOYSA-N 1 1 354.410 3.582 20 5 FHBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000072837530 947568909 /nfs/dbraw/zinc/56/89/09/947568909.db2.gz ATLOIUSFRUUKAD-GOEBONIOSA-N 1 1 365.499 3.838 20 5 FHBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C1 ZINC000536391153 947957445 /nfs/dbraw/zinc/95/74/45/947957445.db2.gz OHLXGTATJIYGHX-QGZVFWFLSA-N 1 1 366.465 3.825 20 5 FHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(c2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000432348784 948186466 /nfs/dbraw/zinc/18/64/66/948186466.db2.gz SZIMECPLVGWZRF-OWCLPIDISA-N 1 1 354.454 3.985 20 5 FHBDMO COc1cc(N2CCC(c3[nH+]cc4n3CCCC4)CC2)ccc1[N+](=O)[O-] ZINC000279058569 948445179 /nfs/dbraw/zinc/44/51/79/948445179.db2.gz KSBONVHPUCUAOZ-UHFFFAOYSA-N 1 1 356.426 3.520 20 5 FHBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000120403296 948493175 /nfs/dbraw/zinc/49/31/75/948493175.db2.gz KOVURFDMBLZMFX-GASCZTMLSA-N 1 1 372.469 3.564 20 5 FHBDMO CC(C)[C@@]1(CO)CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000550433268 948614742 /nfs/dbraw/zinc/61/47/42/948614742.db2.gz HCKONCATVKHDFR-INIZCTEOSA-N 1 1 360.376 3.844 20 5 FHBDMO CC(C)[C@@]1(CO)CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000550433268 948614746 /nfs/dbraw/zinc/61/47/46/948614746.db2.gz HCKONCATVKHDFR-INIZCTEOSA-N 1 1 360.376 3.844 20 5 FHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@H](Cc3nccn3C)C2)cc1[N+](=O)[O-] ZINC000182088632 948632900 /nfs/dbraw/zinc/63/29/00/948632900.db2.gz SUMLCFRDLJJIJS-MRXNPFEDSA-N 1 1 356.470 3.906 20 5 FHBDMO COc1ccc([C@@H]2CCC[N@H+]2CCc2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000108081888 206028329 /nfs/dbraw/zinc/02/83/29/206028329.db2.gz CQSMCKALSXHMSD-IBGZPJMESA-N 1 1 356.422 3.992 20 5 FHBDMO CC[C@H]1[C@@H](C)CC[N@H+]1CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000481375838 567863033 /nfs/dbraw/zinc/86/30/33/567863033.db2.gz QUMGOQBMUGOXPB-LRDDRELGSA-N 1 1 374.466 3.777 20 5 FHBDMO Cn1cc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c(C(F)F)n1 ZINC000291020910 567963686 /nfs/dbraw/zinc/96/36/86/567963686.db2.gz GWUBKPVTATUBAB-UHFFFAOYSA-N 1 1 364.274 3.575 20 5 FHBDMO CCn1nc(C)c(C[NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)c1C ZINC000602531078 567988299 /nfs/dbraw/zinc/98/82/99/567988299.db2.gz HSEPIZWFRVURDL-UHFFFAOYSA-N 1 1 373.276 3.542 20 5 FHBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])[C@H](C)C1 ZINC000291237316 568084907 /nfs/dbraw/zinc/08/49/07/568084907.db2.gz APLDQUXLDWCIIM-QMTHXVAHSA-N 1 1 374.268 3.704 20 5 FHBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000568921888 568252495 /nfs/dbraw/zinc/25/24/95/568252495.db2.gz ORSRYEYAVSFUSW-HOCLYGCPSA-N 1 1 374.485 3.932 20 5 FHBDMO CN(CC[N@@H+](C)C1CCCCC1)C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000569325018 568383366 /nfs/dbraw/zinc/38/33/66/568383366.db2.gz IZFFTHVCRVMDLR-UHFFFAOYSA-N 1 1 353.850 3.585 20 5 FHBDMO COc1ccc(-c2ccc(C[N@@H+](C)[C@H](CO)CC(C)C)o2)c([N+](=O)[O-])c1 ZINC000570008897 568449443 /nfs/dbraw/zinc/44/94/43/568449443.db2.gz JXSMKXKNJBXBGU-AWEZNQCLSA-N 1 1 362.426 3.702 20 5 FHBDMO CC[C@@H](c1cccc(OC)c1)[N@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000570192493 568460234 /nfs/dbraw/zinc/46/02/34/568460234.db2.gz SNJLKGAGKYPSBV-KRWDZBQOSA-N 1 1 371.437 3.933 20 5 FHBDMO CC[C@@H](c1cccc(OC)c1)[N@@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000570192493 568460235 /nfs/dbraw/zinc/46/02/35/568460235.db2.gz SNJLKGAGKYPSBV-KRWDZBQOSA-N 1 1 371.437 3.933 20 5 FHBDMO CC(=Cc1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1 ZINC000570248025 568466252 /nfs/dbraw/zinc/46/62/52/568466252.db2.gz HOEHNFIBCAIBQF-OOXMNIKJSA-N 1 1 367.453 3.873 20 5 FHBDMO CC(=Cc1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1 ZINC000570248025 568466253 /nfs/dbraw/zinc/46/62/53/568466253.db2.gz HOEHNFIBCAIBQF-OOXMNIKJSA-N 1 1 367.453 3.873 20 5 FHBDMO CC(=Cc1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1 ZINC000570248025 568466254 /nfs/dbraw/zinc/46/62/54/568466254.db2.gz HOEHNFIBCAIBQF-OOXMNIKJSA-N 1 1 367.453 3.873 20 5 FHBDMO COc1ccc(C[NH2+][C@@H](C)c2ncc(-c3ccccc3)n2C)cc1[N+](=O)[O-] ZINC000453084758 568515449 /nfs/dbraw/zinc/51/54/49/568515449.db2.gz NRROYIPTLSIEKF-AWEZNQCLSA-N 1 1 366.421 3.855 20 5 FHBDMO O=[N+]([O-])c1cnc(Cl)cc1N1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001164618555 719062993 /nfs/dbraw/zinc/06/29/93/719062993.db2.gz BBIANLPRMBMXRS-YJBOKZPZSA-N 1 1 372.856 3.744 20 5 FHBDMO O=[N+]([O-])c1cnc(Cl)cc1N1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001164618552 719063022 /nfs/dbraw/zinc/06/30/22/719063022.db2.gz BBIANLPRMBMXRS-CRAIPNDOSA-N 1 1 372.856 3.744 20 5 FHBDMO C[C@H](O)C[N@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000535805024 927599965 /nfs/dbraw/zinc/59/99/65/927599965.db2.gz PYLQXRVTTREODO-ZDUSSCGKSA-N 1 1 366.364 3.579 20 5 FHBDMO C[C@H](O)C[N@@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000535805024 927599969 /nfs/dbraw/zinc/59/99/69/927599969.db2.gz PYLQXRVTTREODO-ZDUSSCGKSA-N 1 1 366.364 3.579 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](CC(=O)OC(C)C)c1ccccc1 ZINC000430209428 928088070 /nfs/dbraw/zinc/08/80/70/928088070.db2.gz XUNKOSOWYCOJKL-GOSISDBHSA-N 1 1 372.421 3.776 20 5 FHBDMO C[C@@H]1C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@@H](c2ccc(F)cc2)O1 ZINC000610217629 928222215 /nfs/dbraw/zinc/22/22/15/928222215.db2.gz QUFLTCKGPOTFCY-QRWLVFNGSA-N 1 1 374.412 3.965 20 5 FHBDMO C[C@@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@@H](c2ccc(F)cc2)O1 ZINC000610217629 928222219 /nfs/dbraw/zinc/22/22/19/928222219.db2.gz QUFLTCKGPOTFCY-QRWLVFNGSA-N 1 1 374.412 3.965 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1cc(OC)c(OC)cc1C ZINC000430230293 928333892 /nfs/dbraw/zinc/33/38/92/928333892.db2.gz XTTHADPXQBMAEM-UHFFFAOYSA-N 1 1 360.410 3.561 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1cc(OC)c(OC)cc1C ZINC000430230293 928333908 /nfs/dbraw/zinc/33/39/08/928333908.db2.gz XTTHADPXQBMAEM-UHFFFAOYSA-N 1 1 360.410 3.561 20 5 FHBDMO C[C@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000097592203 928379975 /nfs/dbraw/zinc/37/99/75/928379975.db2.gz DJMKNMFHMKDZBA-AWEZNQCLSA-N 1 1 373.840 3.595 20 5 FHBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000097592203 928379983 /nfs/dbraw/zinc/37/99/83/928379983.db2.gz DJMKNMFHMKDZBA-AWEZNQCLSA-N 1 1 373.840 3.595 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000430235792 928384033 /nfs/dbraw/zinc/38/40/33/928384033.db2.gz ZUFIRIPSRITTEB-UHFFFAOYSA-N 1 1 364.405 3.769 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000430235792 928384045 /nfs/dbraw/zinc/38/40/45/928384045.db2.gz ZUFIRIPSRITTEB-UHFFFAOYSA-N 1 1 364.405 3.769 20 5 FHBDMO O=[N+]([O-])c1ccc2oc(C[NH2+]C3(c4ccccc4)CCOCC3)nc2c1 ZINC000083172559 929638309 /nfs/dbraw/zinc/63/83/09/929638309.db2.gz VSNGVMIILMBKEL-UHFFFAOYSA-N 1 1 353.378 3.532 20 5 FHBDMO Cc1ccc(C(=O)NCC[C@@H](C)[N@@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000471450700 929686813 /nfs/dbraw/zinc/68/68/13/929686813.db2.gz IAAUUKSIYIFLCJ-MRXNPFEDSA-N 1 1 355.438 3.544 20 5 FHBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000610296332 929714640 /nfs/dbraw/zinc/71/46/40/929714640.db2.gz AJCIOWRZARMCHN-QGZVFWFLSA-N 1 1 373.840 3.595 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](n2cnc3c2CCCC3)C1 ZINC000548010744 929937592 /nfs/dbraw/zinc/93/75/92/929937592.db2.gz ZLMXMRYKPIIJSA-RDJZCZTQSA-N 1 1 354.454 3.987 20 5 FHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCC[C@H]1C[C@@H](O)c1cccs1 ZINC000175845917 929953198 /nfs/dbraw/zinc/95/31/98/929953198.db2.gz ZFCUFSLJBLSGQG-GOEBONIOSA-N 1 1 350.415 3.884 20 5 FHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](CCc1ccc(Cl)cc1)CC1CC1 ZINC001167378037 930483372 /nfs/dbraw/zinc/48/33/72/930483372.db2.gz ZGOGDSYNSAJBBC-UHFFFAOYSA-N 1 1 362.861 3.708 20 5 FHBDMO COc1ccccc1[C@@H]1CC[N@@H+](Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000121218929 930698866 /nfs/dbraw/zinc/69/88/66/930698866.db2.gz UVQUEKJFFJMTEV-OAHLLOKOSA-N 1 1 366.421 3.709 20 5 FHBDMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CCC[C@H](C(C)C)CC2)c([N+](=O)[O-])c1 ZINC001167424389 930941082 /nfs/dbraw/zinc/94/10/82/930941082.db2.gz HZOOFHALJXFVFX-GJZGRUSLSA-N 1 1 363.458 3.689 20 5 FHBDMO C[C@H](Nc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000312973115 931074861 /nfs/dbraw/zinc/07/48/61/931074861.db2.gz KQTWZENKQROESQ-HOCLYGCPSA-N 1 1 365.437 3.794 20 5 FHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(C(=O)c2ccc(O)cc2)CC1 ZINC000610389813 932009827 /nfs/dbraw/zinc/00/98/27/932009827.db2.gz YGWPCVCEIOJFDI-AWEZNQCLSA-N 1 1 354.406 3.956 20 5 FHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@@](O)(C(F)(F)F)CC2)c1 ZINC000285476092 932586192 /nfs/dbraw/zinc/58/61/92/932586192.db2.gz HVWZVHMSZMWJCN-ZDUSSCGKSA-N 1 1 352.740 3.528 20 5 FHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@@](O)(C(F)(F)F)CC2)c1 ZINC000285476092 932586195 /nfs/dbraw/zinc/58/61/95/932586195.db2.gz HVWZVHMSZMWJCN-ZDUSSCGKSA-N 1 1 352.740 3.528 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000247372805 932800354 /nfs/dbraw/zinc/80/03/54/932800354.db2.gz KYEKPQLJRBBRKE-KBXCAEBGSA-N 1 1 373.478 3.778 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](c1cnn(C)c1)c1ccc(F)cc1 ZINC000187512492 932966317 /nfs/dbraw/zinc/96/63/17/932966317.db2.gz YVTVEWRNKSSPJH-LJQANCHMSA-N 1 1 354.385 3.655 20 5 FHBDMO C[C@@H]1C[C@@H](O)C[N@H+]1Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000471803361 932974490 /nfs/dbraw/zinc/97/44/90/932974490.db2.gz GUHWYHCHUYCQOV-TZMCWYRMSA-N 1 1 362.813 3.996 20 5 FHBDMO C[C@@H]([NH2+][C@H](C)c1ncnn1C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000276709305 933009833 /nfs/dbraw/zinc/00/98/33/933009833.db2.gz WMILFGDCMQDGFB-VXGBXAGGSA-N 1 1 357.439 3.864 20 5 FHBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000588441940 933073939 /nfs/dbraw/zinc/07/39/39/933073939.db2.gz OEFBQTSTGCXREQ-XRMNKTDYSA-N 1 1 371.481 3.767 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCc2c(cnn2-c2ccccc2)C1 ZINC000510517824 933182790 /nfs/dbraw/zinc/18/27/90/933182790.db2.gz LRHWCJNYPSEKKR-SOFGYWHQSA-N 1 1 360.417 3.852 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](OCCCc2ccccc2)C1 ZINC000430942999 933455665 /nfs/dbraw/zinc/45/56/65/933455665.db2.gz NUPASIHHSGGNKI-FQEVSTJZSA-N 1 1 370.449 3.827 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](OCCCc2ccccc2)C1 ZINC000430942999 933455674 /nfs/dbraw/zinc/45/56/74/933455674.db2.gz NUPASIHHSGGNKI-FQEVSTJZSA-N 1 1 370.449 3.827 20 5 FHBDMO O=[N+]([O-])c1cccc(OCC[NH+]2C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)c1 ZINC000610604851 933514586 /nfs/dbraw/zinc/51/45/86/933514586.db2.gz PQEMNZLUYLFBRK-RYUDHWBXSA-N 1 1 372.265 3.646 20 5 FHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@H]1c1nc2ccccc2s1 ZINC000610782691 934179290 /nfs/dbraw/zinc/17/92/90/934179290.db2.gz LNWIIEVVFPRRCJ-AWEZNQCLSA-N 1 1 357.439 3.547 20 5 FHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H]1c1nc2ccccc2s1 ZINC000610782691 934179292 /nfs/dbraw/zinc/17/92/92/934179292.db2.gz LNWIIEVVFPRRCJ-AWEZNQCLSA-N 1 1 357.439 3.547 20 5 FHBDMO Cn1cc(C[N@H+]2CCC[C@H]2c2ccccn2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000535780767 934369022 /nfs/dbraw/zinc/36/90/22/934369022.db2.gz PJVDAAYEXKAXNX-IBGZPJMESA-N 1 1 363.421 3.727 20 5 FHBDMO CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NCC[C@@H]1CCC[N@@H+](C)C1 ZINC000458212033 934381304 /nfs/dbraw/zinc/38/13/04/934381304.db2.gz LPEWTRXDBUBDBG-AWEZNQCLSA-N 1 1 365.499 3.557 20 5 FHBDMO COc1cc(C[N@@H+](C)[C@H](C)C2CC2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000158064215 934418601 /nfs/dbraw/zinc/41/86/01/934418601.db2.gz ZVYCTSKXAACVEX-SNVBAGLBSA-N 1 1 362.348 3.775 20 5 FHBDMO COc1ccccc1C[N@H+](CCn1ccc([N+](=O)[O-])n1)Cc1cccs1 ZINC000176194076 934596314 /nfs/dbraw/zinc/59/63/14/934596314.db2.gz NUBHIJDHWCITHJ-UHFFFAOYSA-N 1 1 372.450 3.564 20 5 FHBDMO COc1ccccc1C[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1cccs1 ZINC000176194076 934596320 /nfs/dbraw/zinc/59/63/20/934596320.db2.gz NUBHIJDHWCITHJ-UHFFFAOYSA-N 1 1 372.450 3.564 20 5 FHBDMO O=[N+]([O-])c1ccn(CC[N@@H+]2CCc3sccc3[C@H]2c2cccs2)n1 ZINC000176198158 934597369 /nfs/dbraw/zinc/59/73/69/934597369.db2.gz NBMFXZILDGOJJS-INIZCTEOSA-N 1 1 360.464 3.562 20 5 FHBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCc3sccc3[C@H]2c2cccs2)n1 ZINC000176198158 934597375 /nfs/dbraw/zinc/59/73/75/934597375.db2.gz NBMFXZILDGOJJS-INIZCTEOSA-N 1 1 360.464 3.562 20 5 FHBDMO Cc1ccccc1C[N@H+]1CCCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1 ZINC000610928958 934626410 /nfs/dbraw/zinc/62/64/10/934626410.db2.gz WDNVDSIUYXXGIH-UHFFFAOYSA-N 1 1 360.845 3.664 20 5 FHBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1csc(Br)c1 ZINC000065536673 934961464 /nfs/dbraw/zinc/96/14/64/934961464.db2.gz UFAHHPCXNDKZCR-UHFFFAOYSA-N 1 1 371.256 3.930 20 5 FHBDMO C[C@@H](CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[N@H+]1CCCC[C@H]1C ZINC000437151490 945071251 /nfs/dbraw/zinc/07/12/51/945071251.db2.gz GOXASQLLTOWSQT-NEPJUHHUSA-N 1 1 373.375 3.606 20 5 FHBDMO CCc1ccc([C@@H](C)NC(=O)C[N@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000511065059 935212591 /nfs/dbraw/zinc/21/25/91/935212591.db2.gz NCWCGVISIWUPRR-MRXNPFEDSA-N 1 1 369.465 3.509 20 5 FHBDMO CCc1ccc([C@@H](C)NC(=O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000511065059 935212596 /nfs/dbraw/zinc/21/25/96/935212596.db2.gz NCWCGVISIWUPRR-MRXNPFEDSA-N 1 1 369.465 3.509 20 5 FHBDMO Cc1cc(OC[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)c(F)cc1[N+](=O)[O-] ZINC000582091359 935241164 /nfs/dbraw/zinc/24/11/64/935241164.db2.gz OBBVHQFYOGZOQC-QGZVFWFLSA-N 1 1 374.412 3.712 20 5 FHBDMO CC(C)c1ccccc1OC[C@@H](O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511073659 935250588 /nfs/dbraw/zinc/25/05/88/935250588.db2.gz PZDQPECXKXNTFV-SFHVURJKSA-N 1 1 372.465 3.632 20 5 FHBDMO Cc1ccccc1[C@@H](C)NC(=O)[C@@H](C)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511074608 935266352 /nfs/dbraw/zinc/26/63/52/935266352.db2.gz VRDXLHVVONXUPK-IAGOWNOFSA-N 1 1 369.465 3.643 20 5 FHBDMO Cc1ccccc1[C@@H](C)NC(=O)[C@@H](C)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511074608 935266357 /nfs/dbraw/zinc/26/63/57/935266357.db2.gz VRDXLHVVONXUPK-IAGOWNOFSA-N 1 1 369.465 3.643 20 5 FHBDMO CC(C)CNC(=O)c1cccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511075161 935270951 /nfs/dbraw/zinc/27/09/51/935270951.db2.gz YNIPFLBPWXQUMF-UHFFFAOYSA-N 1 1 369.465 3.655 20 5 FHBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000119887877 935318977 /nfs/dbraw/zinc/31/89/77/935318977.db2.gz WWQUECQTORUVCV-LZQZEXGQSA-N 1 1 371.437 3.538 20 5 FHBDMO CSc1ccccc1NC(=O)CC[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511088078 935370783 /nfs/dbraw/zinc/37/07/83/935370783.db2.gz AASLKSYWDWAVJO-UHFFFAOYSA-N 1 1 373.478 3.820 20 5 FHBDMO CC(C)CO[C@@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000120056517 935509812 /nfs/dbraw/zinc/50/98/12/935509812.db2.gz LCPYIZYGYUCCHJ-QGZVFWFLSA-N 1 1 359.426 3.539 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCCN2c3ccccc3C[C@@H]2C1 ZINC000582388740 935612588 /nfs/dbraw/zinc/61/25/88/935612588.db2.gz AEXBZUYUZHECIE-QGZVFWFLSA-N 1 1 357.841 3.885 20 5 FHBDMO CN(CCC[N@@H+](C)Cc1ccco1)c1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000516672424 945115793 /nfs/dbraw/zinc/11/57/93/945115793.db2.gz QHIMNZLRKATXBU-UHFFFAOYSA-N 1 1 372.347 3.560 20 5 FHBDMO COC(=O)c1ccc(F)c(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000511117417 935667958 /nfs/dbraw/zinc/66/79/58/935667958.db2.gz VNJQKVKYXRIZJQ-UHFFFAOYSA-N 1 1 360.385 3.931 20 5 FHBDMO COC(=O)c1ccc(F)c(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000511117417 935667960 /nfs/dbraw/zinc/66/79/60/935667960.db2.gz VNJQKVKYXRIZJQ-UHFFFAOYSA-N 1 1 360.385 3.931 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC=C(c2ccco2)C1 ZINC000511119208 935678515 /nfs/dbraw/zinc/67/85/15/935678515.db2.gz DAGXGMFIYBXARM-UHFFFAOYSA-N 1 1 355.394 3.614 20 5 FHBDMO CCc1cccc(CC)c1NC(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511122490 935689177 /nfs/dbraw/zinc/68/91/77/935689177.db2.gz NPJWDSPSECCMMF-UHFFFAOYSA-N 1 1 369.465 3.833 20 5 FHBDMO CCc1cccc(CC)c1NC(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511122490 935689179 /nfs/dbraw/zinc/68/91/79/935689179.db2.gz NPJWDSPSECCMMF-UHFFFAOYSA-N 1 1 369.465 3.833 20 5 FHBDMO CC(C)c1ccccc1NC(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511126156 935713256 /nfs/dbraw/zinc/71/32/56/935713256.db2.gz XORHHGARPOYCID-UHFFFAOYSA-N 1 1 355.438 3.831 20 5 FHBDMO CC(C)c1ccccc1NC(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511126156 935713261 /nfs/dbraw/zinc/71/32/61/935713261.db2.gz XORHHGARPOYCID-UHFFFAOYSA-N 1 1 355.438 3.831 20 5 FHBDMO COC(=O)c1ccc(Cl)c(C[N@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511141322 935781719 /nfs/dbraw/zinc/78/17/19/935781719.db2.gz VOEOTENHVHBOLI-UHFFFAOYSA-N 1 1 362.813 3.709 20 5 FHBDMO COC(=O)c1ccc(Cl)c(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511141322 935781721 /nfs/dbraw/zinc/78/17/21/935781721.db2.gz VOEOTENHVHBOLI-UHFFFAOYSA-N 1 1 362.813 3.709 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)NCc1cccc(C[N@H+](C)C(C)C)c1 ZINC000110872071 945133140 /nfs/dbraw/zinc/13/31/40/945133140.db2.gz UKTUMNFUNMLKKQ-UHFFFAOYSA-N 1 1 355.438 3.673 20 5 FHBDMO C[N@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1nccn1Cc1ccccc1 ZINC000075915122 936017274 /nfs/dbraw/zinc/01/72/74/936017274.db2.gz CMDMXGDDAIHKBF-UHFFFAOYSA-N 1 1 350.422 3.514 20 5 FHBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1nccn1Cc1ccccc1 ZINC000075915122 936017277 /nfs/dbraw/zinc/01/72/77/936017277.db2.gz CMDMXGDDAIHKBF-UHFFFAOYSA-N 1 1 350.422 3.514 20 5 FHBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2ncnc3ccc([N+](=O)[O-])cc32)C1 ZINC000611709380 936033498 /nfs/dbraw/zinc/03/34/98/936033498.db2.gz PLNJUMQHRJNUBS-GOEBONIOSA-N 1 1 363.421 3.785 20 5 FHBDMO CCn1c(C)nc([N+](=O)[O-])c1NCC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000582747008 936071676 /nfs/dbraw/zinc/07/16/76/936071676.db2.gz ZQTXPXJYHILSSX-QAPCUYQASA-N 1 1 371.485 3.832 20 5 FHBDMO Cc1[nH+]ccn1CCCCNc1cc(C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000078336409 936112654 /nfs/dbraw/zinc/11/26/54/936112654.db2.gz FGUMQTGXTFKMLW-UHFFFAOYSA-N 1 1 366.425 3.757 20 5 FHBDMO CCOc1cc(C[N@H+]2CC[C@H]2Cc2ccc(OC)cc2)ccc1[N+](=O)[O-] ZINC001167636448 936273963 /nfs/dbraw/zinc/27/39/63/936273963.db2.gz SVMCEUOTZSPJET-KRWDZBQOSA-N 1 1 356.422 3.819 20 5 FHBDMO Cc1ccc(OC[C@@H]2C[N@@H+](Cc3ccccc3)CCCO2)cc1[N+](=O)[O-] ZINC000583721598 938375913 /nfs/dbraw/zinc/37/59/13/938375913.db2.gz GNHILKOVQPDIEA-IBGZPJMESA-N 1 1 356.422 3.573 20 5 FHBDMO O=[N+]([O-])c1ccc(N2C[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)c2ncccc12 ZINC000480576867 938996263 /nfs/dbraw/zinc/99/62/63/938996263.db2.gz GXPVHVFBVWSHRR-HDICACEKSA-N 1 1 374.444 3.711 20 5 FHBDMO COC(=O)c1ccccc1CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000480585922 938997039 /nfs/dbraw/zinc/99/70/39/938997039.db2.gz ZZNRLLASMDUBIM-UHFFFAOYSA-N 1 1 354.406 3.589 20 5 FHBDMO CC(C)c1ccc(C(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1[N+](=O)[O-] ZINC000188127254 939018620 /nfs/dbraw/zinc/01/86/20/939018620.db2.gz VZVKLWKJAPIGTD-APWZRJJASA-N 1 1 371.481 3.807 20 5 FHBDMO C[N@H+](Cc1ccc(OC[C@@H]2CCCO2)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000179315931 939080229 /nfs/dbraw/zinc/08/02/29/939080229.db2.gz PWWUPYOQBDNKAV-IBGZPJMESA-N 1 1 356.422 3.785 20 5 FHBDMO C[N@@H+](Cc1ccc(OC[C@@H]2CCCO2)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000179315931 939080233 /nfs/dbraw/zinc/08/02/33/939080233.db2.gz PWWUPYOQBDNKAV-IBGZPJMESA-N 1 1 356.422 3.785 20 5 FHBDMO COc1cc(C[N@@H+]2CCC=C(C)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000437345063 945273384 /nfs/dbraw/zinc/27/33/84/945273384.db2.gz OBLIASSPIDSHGO-UHFFFAOYSA-N 1 1 360.332 3.697 20 5 FHBDMO COc1cc(C[N@H+]2CCC=C(C)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000437345063 945273392 /nfs/dbraw/zinc/27/33/92/945273392.db2.gz OBLIASSPIDSHGO-UHFFFAOYSA-N 1 1 360.332 3.697 20 5 FHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](Cn3cnc4ccccc43)C2)cc1 ZINC000614235975 939902416 /nfs/dbraw/zinc/90/24/16/939902416.db2.gz SXNRLCVXUQHXGA-KRWDZBQOSA-N 1 1 350.422 3.857 20 5 FHBDMO CCCOc1ccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1OC ZINC000278791875 940005296 /nfs/dbraw/zinc/00/52/96/940005296.db2.gz WQWCRXCQNWYKMS-UHFFFAOYSA-N 1 1 370.409 3.558 20 5 FHBDMO Cc1nc(C)c([C@@H](C)[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)s1 ZINC000411282500 940027552 /nfs/dbraw/zinc/02/75/52/940027552.db2.gz UZYLJCKTSRVQFR-GFCCVEGCSA-N 1 1 362.455 3.690 20 5 FHBDMO O=[N+]([O-])c1cnn(CC[N@@H+](Cc2ccc(Cl)c(Cl)c2)C2CC2)c1 ZINC000472429006 940068619 /nfs/dbraw/zinc/06/86/19/940068619.db2.gz VORZTVHPRPVHHC-UHFFFAOYSA-N 1 1 355.225 3.763 20 5 FHBDMO O=[N+]([O-])c1cnc2c(c1)C[N@@H+](Cc1cc(Cl)ccc1OC(F)F)CC2 ZINC000612468181 940083422 /nfs/dbraw/zinc/08/34/22/940083422.db2.gz GNUCOFXWFCUVSZ-UHFFFAOYSA-N 1 1 369.755 3.803 20 5 FHBDMO O=[N+]([O-])c1cnc2c(c1)C[N@H+](Cc1cc(Cl)ccc1OC(F)F)CC2 ZINC000612468181 940083431 /nfs/dbraw/zinc/08/34/31/940083431.db2.gz GNUCOFXWFCUVSZ-UHFFFAOYSA-N 1 1 369.755 3.803 20 5 FHBDMO Cc1ccc(-c2noc(C[N@H+](C)CCc3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000548936378 940110051 /nfs/dbraw/zinc/11/00/51/940110051.db2.gz QPLLUDHVZKAMPT-UHFFFAOYSA-N 1 1 352.394 3.628 20 5 FHBDMO Cc1ccc(-c2noc(C[N@@H+](C)CCc3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000548936378 940110054 /nfs/dbraw/zinc/11/00/54/940110054.db2.gz QPLLUDHVZKAMPT-UHFFFAOYSA-N 1 1 352.394 3.628 20 5 FHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@@H](O)C[C@@H]1c1ccccc1 ZINC000411947170 940161333 /nfs/dbraw/zinc/16/13/33/940161333.db2.gz OUZNTNHMCKIUKG-RBUKOAKNSA-N 1 1 356.422 3.690 20 5 FHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H](O)C[C@@H]1c1ccccc1 ZINC000411947170 940161334 /nfs/dbraw/zinc/16/13/34/940161334.db2.gz OUZNTNHMCKIUKG-RBUKOAKNSA-N 1 1 356.422 3.690 20 5 FHBDMO C[C@H](c1nc(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)no1)c1ccc([N+](=O)[O-])cc1F ZINC000612954628 940358366 /nfs/dbraw/zinc/35/83/66/940358366.db2.gz LWJPDURPTUTYMR-WODVXLOZSA-N 1 1 360.389 3.609 20 5 FHBDMO Cc1cc(OC[C@@H]2C[N@@H+](Cc3ccccc3)CCCO2)c(F)cc1[N+](=O)[O-] ZINC000582091358 940652485 /nfs/dbraw/zinc/65/24/85/940652485.db2.gz OBBVHQFYOGZOQC-KRWDZBQOSA-N 1 1 374.412 3.712 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)CCC1CCCCC1 ZINC000507587594 945343910 /nfs/dbraw/zinc/34/39/10/945343910.db2.gz SIGPOMXFWQFGEV-UHFFFAOYSA-N 1 1 363.458 3.834 20 5 FHBDMO COc1cccc([C@H]2C[C@H]([N@@H+](C)Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)c1 ZINC000452025362 940819380 /nfs/dbraw/zinc/81/93/80/940819380.db2.gz ZRWNHGYTCUOKPL-KOMQPUFPSA-N 1 1 366.421 3.858 20 5 FHBDMO Cc1ccc(C[N@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1C ZINC000452040357 940959629 /nfs/dbraw/zinc/95/96/29/940959629.db2.gz JQKLZDFDORXWSF-UHFFFAOYSA-N 1 1 352.394 3.894 20 5 FHBDMO Cc1ccc(C[N@@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1C ZINC000452040357 940959631 /nfs/dbraw/zinc/95/96/31/940959631.db2.gz JQKLZDFDORXWSF-UHFFFAOYSA-N 1 1 352.394 3.894 20 5 FHBDMO COCCO[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000188814677 941095694 /nfs/dbraw/zinc/09/56/94/941095694.db2.gz RXSGOWIRVLSMKZ-INIZCTEOSA-N 1 1 362.451 3.561 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@@H](c2ccccc2)C[C@@H]1C ZINC000115554247 941137305 /nfs/dbraw/zinc/13/73/05/941137305.db2.gz SOYXAMNVLKQUHN-RDJZCZTQSA-N 1 1 353.422 3.720 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@@H](c2ccccc2)C[C@@H]1C ZINC000115554247 941137306 /nfs/dbraw/zinc/13/73/06/941137306.db2.gz SOYXAMNVLKQUHN-RDJZCZTQSA-N 1 1 353.422 3.720 20 5 FHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](Cc1ccco1)Cc1cccc(C)c1 ZINC001167709188 941156003 /nfs/dbraw/zinc/15/60/03/941156003.db2.gz UMGYNNUGXHOIHW-UHFFFAOYSA-N 1 1 354.410 3.704 20 5 FHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](Cc1ccco1)Cc1cccc(C)c1 ZINC001167709188 941156005 /nfs/dbraw/zinc/15/60/05/941156005.db2.gz UMGYNNUGXHOIHW-UHFFFAOYSA-N 1 1 354.410 3.704 20 5 FHBDMO Cn1cc(C[N@H+]2CCSC3(CCC3)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000414479239 941328475 /nfs/dbraw/zinc/32/84/75/941328475.db2.gz RMHBSIAMXZTHLI-UHFFFAOYSA-N 1 1 372.494 3.857 20 5 FHBDMO CC(C)[C@@H]1[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC12CCOCC2 ZINC000414521686 941371450 /nfs/dbraw/zinc/37/14/50/941371450.db2.gz FGSCNQBLCNCPDO-INIZCTEOSA-N 1 1 370.396 3.833 20 5 FHBDMO CC(C)[C@@H]1[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC12CCOCC2 ZINC000414521686 941371453 /nfs/dbraw/zinc/37/14/53/941371453.db2.gz FGSCNQBLCNCPDO-INIZCTEOSA-N 1 1 370.396 3.833 20 5 FHBDMO COc1cc(N[C@H](C)C[N@@H+](C)Cc2ccccc2)c([N+](=O)[O-])cc1OC ZINC000311852226 941404294 /nfs/dbraw/zinc/40/42/94/941404294.db2.gz WBKADAAKEIMQON-CQSZACIVSA-N 1 1 359.426 3.544 20 5 FHBDMO C[C@@H]1[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CC[N@H+]1Cc1ccccc1 ZINC000311925124 941651828 /nfs/dbraw/zinc/65/18/28/941651828.db2.gz FLDQYKRKBXMKBC-DYVFJYSZSA-N 1 1 373.840 3.641 20 5 FHBDMO C[C@H]1C[C@@H](c2ccccc2)[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000513227928 941798427 /nfs/dbraw/zinc/79/84/27/941798427.db2.gz GCJYSBJXAKLWDX-YWZLYKJASA-N 1 1 365.433 3.567 20 5 FHBDMO C[C@H](CCNC(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1 ZINC000472798930 941812441 /nfs/dbraw/zinc/81/24/41/941812441.db2.gz XQTPMPXRCGMNJS-OAHLLOKOSA-N 1 1 356.426 3.627 20 5 FHBDMO CO[C@@H](C)C[N@H+](C)[C@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000513261805 941814790 /nfs/dbraw/zinc/81/47/90/941814790.db2.gz POCKKXRNSVBWOG-KXBFYZLASA-N 1 1 371.437 3.550 20 5 FHBDMO CO[C@@H](C)C[N@@H+](C)[C@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000513261805 941814794 /nfs/dbraw/zinc/81/47/94/941814794.db2.gz POCKKXRNSVBWOG-KXBFYZLASA-N 1 1 371.437 3.550 20 5 FHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCCN(C(=O)c2ccccc2)CC1 ZINC000433722013 941855299 /nfs/dbraw/zinc/85/52/99/941855299.db2.gz APUWUIKBBJWCLV-INIZCTEOSA-N 1 1 353.422 3.504 20 5 FHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCN(C(=O)c2ccccc2)CC1 ZINC000433722013 941855301 /nfs/dbraw/zinc/85/53/01/941855301.db2.gz APUWUIKBBJWCLV-INIZCTEOSA-N 1 1 353.422 3.504 20 5 FHBDMO CC(C)[N@H+](CC(=O)N1c2ccccc2C[C@@H]1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000513391482 941888044 /nfs/dbraw/zinc/88/80/44/941888044.db2.gz CLDAGPWSTUWXPD-INIZCTEOSA-N 1 1 367.449 3.783 20 5 FHBDMO CC(C)[N@@H+](CC(=O)N1c2ccccc2C[C@@H]1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000513391482 941888052 /nfs/dbraw/zinc/88/80/52/941888052.db2.gz CLDAGPWSTUWXPD-INIZCTEOSA-N 1 1 367.449 3.783 20 5 FHBDMO O=[N+]([O-])c1cc2ccccc2nc1N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000473528017 941941300 /nfs/dbraw/zinc/94/13/00/941941300.db2.gz LQFGCSDSILYYEV-UHFFFAOYSA-N 1 1 362.433 3.855 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCN([C@H](C)c2cccnc2)CC1 ZINC000182807582 941970137 /nfs/dbraw/zinc/97/01/37/941970137.db2.gz YOJBYJLPGUSXRF-IAGOWNOFSA-N 1 1 354.454 3.738 20 5 FHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1conc1Cc1ccccc1 ZINC000513555077 942010302 /nfs/dbraw/zinc/01/03/02/942010302.db2.gz UWYPRHABXLWEFT-UHFFFAOYSA-N 1 1 351.406 3.848 20 5 FHBDMO C[C@H](C[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000513684653 942075326 /nfs/dbraw/zinc/07/53/26/942075326.db2.gz UAARNEOPDKESJI-AUUYWEPGSA-N 1 1 368.412 3.950 20 5 FHBDMO C[N@H+](CCn1cc([N+](=O)[O-])cn1)[C@H](c1ccc(Cl)cc1)c1ccccn1 ZINC000377931857 942075905 /nfs/dbraw/zinc/07/59/05/942075905.db2.gz LMTAPLBLXPXSFP-GOSISDBHSA-N 1 1 371.828 3.561 20 5 FHBDMO C[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@H](c1ccc(Cl)cc1)c1ccccn1 ZINC000377931857 942075907 /nfs/dbraw/zinc/07/59/07/942075907.db2.gz LMTAPLBLXPXSFP-GOSISDBHSA-N 1 1 371.828 3.561 20 5 FHBDMO O=[N+]([O-])c1cc2ccccc2nc1N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000473535632 942134052 /nfs/dbraw/zinc/13/40/52/942134052.db2.gz XSKDHLCCVXVXOG-YJBOKZPZSA-N 1 1 352.438 3.596 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC[C@@H](c2noc(C3CC3)n2)C1 ZINC000271188422 942141627 /nfs/dbraw/zinc/14/16/27/942141627.db2.gz FERUAWVFPJWYIT-WUTVXBCWSA-N 1 1 354.410 3.748 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@@H](c2noc(C3CC3)n2)C1 ZINC000271188422 942141635 /nfs/dbraw/zinc/14/16/35/942141635.db2.gz FERUAWVFPJWYIT-WUTVXBCWSA-N 1 1 354.410 3.748 20 5 FHBDMO O=[N+]([O-])c1cc2ccccc2nc1N1CC[NH+](Cc2cccs2)CC1 ZINC000473535355 942169447 /nfs/dbraw/zinc/16/94/47/942169447.db2.gz XQZHZOYRYUENNL-UHFFFAOYSA-N 1 1 354.435 3.527 20 5 FHBDMO CC(=O)c1cc(N2CC[N@H+](Cc3ccccc3)[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000396364359 942226214 /nfs/dbraw/zinc/22/62/14/942226214.db2.gz YFXAQQQMXBQAHR-OAHLLOKOSA-N 1 1 353.422 3.508 20 5 FHBDMO CC(=O)c1cc(N2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000396364359 942226221 /nfs/dbraw/zinc/22/62/21/942226221.db2.gz YFXAQQQMXBQAHR-OAHLLOKOSA-N 1 1 353.422 3.508 20 5 FHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420955300 942274597 /nfs/dbraw/zinc/27/45/97/942274597.db2.gz WEWXKOZEMIEEIP-VXGBXAGGSA-N 1 1 359.348 3.586 20 5 FHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420955300 942274601 /nfs/dbraw/zinc/27/46/01/942274601.db2.gz WEWXKOZEMIEEIP-VXGBXAGGSA-N 1 1 359.348 3.586 20 5 FHBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)c1 ZINC000085638401 942292167 /nfs/dbraw/zinc/29/21/67/942292167.db2.gz OESZDDIFHWVDCB-UHFFFAOYSA-N 1 1 370.453 3.985 20 5 FHBDMO CCc1[nH+]ccn1[C@H]1CCCN(c2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413130051 942325878 /nfs/dbraw/zinc/32/58/78/942325878.db2.gz QLCUGZKWGUUAJJ-AWEZNQCLSA-N 1 1 351.410 3.743 20 5 FHBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)c2cccc(SC)c2[N+](=O)[O-])c1 ZINC000188079100 942327363 /nfs/dbraw/zinc/32/73/63/942327363.db2.gz WPKSFXVABULXFC-UHFFFAOYSA-N 1 1 373.478 3.698 20 5 FHBDMO CCOc1cc(C[NH+]2CCC(c3noc(C4CC4)n3)CC2)ccc1[N+](=O)[O-] ZINC000366807219 942386056 /nfs/dbraw/zinc/38/60/56/942386056.db2.gz HLLKDPWNNGMIQY-UHFFFAOYSA-N 1 1 372.425 3.634 20 5 FHBDMO Cc1ccc([C@@H](C)NC(=O)CC[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000416169253 942428977 /nfs/dbraw/zinc/42/89/77/942428977.db2.gz CYBLELSAKIAONP-MRXNPFEDSA-N 1 1 367.449 3.529 20 5 FHBDMO O=[N+]([O-])c1ccc(N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c2cccnc21 ZINC000413199968 942472481 /nfs/dbraw/zinc/47/24/81/942472481.db2.gz JTKMKTVQBCDUCK-YOEHRIQHSA-N 1 1 352.438 3.596 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1CCC1CCN(c2ncc([N+](=O)[O-])cc2F)CC1 ZINC000413210330 942479360 /nfs/dbraw/zinc/47/93/60/942479360.db2.gz VQZAWSLELWSZEP-CQSZACIVSA-N 1 1 350.438 3.610 20 5 FHBDMO C[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CCCC[C@H]1C ZINC000501477243 942501611 /nfs/dbraw/zinc/50/16/11/942501611.db2.gz IPXSYPCGECEFFZ-VXGBXAGGSA-N 1 1 354.838 3.633 20 5 FHBDMO COc1cc(C[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)c([N+](=O)[O-])cc1OC ZINC000421395745 942546282 /nfs/dbraw/zinc/54/62/82/942546282.db2.gz VFLXIBAXECDADX-NSHDSACASA-N 1 1 362.348 3.776 20 5 FHBDMO COc1cc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)c([N+](=O)[O-])cc1OC ZINC000421395745 942546284 /nfs/dbraw/zinc/54/62/84/942546284.db2.gz VFLXIBAXECDADX-NSHDSACASA-N 1 1 362.348 3.776 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CCC[C@H](CCO)CC3)cs2)c1 ZINC000421398213 942549476 /nfs/dbraw/zinc/54/94/76/942549476.db2.gz NTSBPJCADJDPMV-AWEZNQCLSA-N 1 1 361.467 3.703 20 5 FHBDMO CC[N@@H+](CCNc1ccc([N+](=O)[O-])c2ncccc12)CCC(F)(F)F ZINC000413256038 942568686 /nfs/dbraw/zinc/56/86/86/942568686.db2.gz BSWPLMDNCSQGHS-UHFFFAOYSA-N 1 1 356.348 3.829 20 5 FHBDMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CCCC[N@H+]1C1CC1 ZINC000434350072 942597956 /nfs/dbraw/zinc/59/79/56/942597956.db2.gz OORWTAFBCUARKX-LJQANCHMSA-N 1 1 374.485 3.532 20 5 FHBDMO CC[N@H+]1CC[C@H](N(C)Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H](C)C1 ZINC000093638666 942632381 /nfs/dbraw/zinc/63/23/81/942632381.db2.gz SZFINNBZRYMOJK-KDOFPFPSSA-N 1 1 374.510 3.880 20 5 FHBDMO Cc1cccc([C@H]2CC[N@@H+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)C2)c1 ZINC000541391234 942670699 /nfs/dbraw/zinc/67/06/99/942670699.db2.gz XGNMQQAWONUPRN-KRWDZBQOSA-N 1 1 364.405 3.943 20 5 FHBDMO CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@H]1CCC[N@H+]1C ZINC000421709793 942763375 /nfs/dbraw/zinc/76/33/75/942763375.db2.gz HFYTVYLCXNEPHS-OAHLLOKOSA-N 1 1 365.499 3.653 20 5 FHBDMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000421700058 942771470 /nfs/dbraw/zinc/77/14/70/942771470.db2.gz CXWKRUWYAMXCJS-INIZCTEOSA-N 1 1 369.421 3.553 20 5 FHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)C1CCN(CCc2ccncc2)CC1 ZINC000378438399 942773434 /nfs/dbraw/zinc/77/34/34/942773434.db2.gz ZFVVLYOBMRSYTM-KRWDZBQOSA-N 1 1 368.481 3.690 20 5 FHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)C1CC[NH+](CCc2ccncc2)CC1 ZINC000378438399 942773436 /nfs/dbraw/zinc/77/34/36/942773436.db2.gz ZFVVLYOBMRSYTM-KRWDZBQOSA-N 1 1 368.481 3.690 20 5 FHBDMO Cc1ccccc1C[C@@H]1CCC[N@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000514185782 942794316 /nfs/dbraw/zinc/79/43/16/942794316.db2.gz KWMGAWIKSHGTSD-SFHVURJKSA-N 1 1 367.449 3.857 20 5 FHBDMO O=[N+]([O-])c1cccc([C@H](N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c2ccccc2)c1 ZINC000378494348 942826946 /nfs/dbraw/zinc/82/69/46/942826946.db2.gz KXJUKPAXOZSNRW-SVFBPWRDSA-N 1 1 351.450 3.901 20 5 FHBDMO O=[N+]([O-])c1cccc([C@H](N[C@H]2CC[N@H+]3CCC[C@H]3C2)c2ccccc2)c1 ZINC000378494339 942827230 /nfs/dbraw/zinc/82/72/30/942827230.db2.gz KXJUKPAXOZSNRW-IRFCIJBXSA-N 1 1 351.450 3.901 20 5 FHBDMO Cc1cc(F)cc2c1C[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)CC2 ZINC000502909358 942833610 /nfs/dbraw/zinc/83/36/10/942833610.db2.gz OQBIFGRQVHWQJC-UHFFFAOYSA-N 1 1 371.412 3.738 20 5 FHBDMO CC1(C)C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC[C@@H]1C(F)(F)F ZINC000190176527 942854310 /nfs/dbraw/zinc/85/43/10/942854310.db2.gz QIGCPSIZBOUORN-AWEZNQCLSA-N 1 1 373.375 3.834 20 5 FHBDMO CCc1ccc([C@@H]2CN(C(=O)c3ccc(Cl)cc3[N+](=O)[O-])CC[NH2+]2)cc1 ZINC000505476900 942878438 /nfs/dbraw/zinc/87/84/38/942878438.db2.gz PHBKCWMLLFRJTO-KRWDZBQOSA-N 1 1 373.840 3.597 20 5 FHBDMO Cn1ccnc1[C@H]([NH2+]CCc1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000513761778 942934862 /nfs/dbraw/zinc/93/48/62/942934862.db2.gz OKUUZIGXGKSBRY-GOSISDBHSA-N 1 1 370.840 3.903 20 5 FHBDMO O=[N+]([O-])c1ccccc1CNc1cc[nH+]c2ccc(Br)cc12 ZINC000503536720 943235853 /nfs/dbraw/zinc/23/58/53/943235853.db2.gz JDQOLRHOMJHCGV-UHFFFAOYSA-N 1 1 358.195 3.940 20 5 FHBDMO CCOc1ccc([C@H](C)[NH2+]C[C@H](N)c2ccccc2CC)cc1[N+](=O)[O-] ZINC000423513085 943541992 /nfs/dbraw/zinc/54/19/92/943541992.db2.gz VAZADTYVRRBQMQ-KSSFIOAISA-N 1 1 357.454 3.907 20 5 FHBDMO COc1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c(Br)c1 ZINC000318995493 943583683 /nfs/dbraw/zinc/58/36/83/943583683.db2.gz IVBIDFFOHKNUCL-UHFFFAOYSA-N 1 1 365.227 3.964 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C/CN1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000435771623 943601670 /nfs/dbraw/zinc/60/16/70/943601670.db2.gz MJENNCFFCBXXQO-IZZDOVSWSA-N 1 1 351.450 3.816 20 5 FHBDMO C[C@@H](c1ccccc1)N(C)C(=O)C[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000504590203 943701099 /nfs/dbraw/zinc/70/10/99/943701099.db2.gz QLAARRGQTBDYJZ-GQPJMJRUSA-N 1 1 367.449 3.759 20 5 FHBDMO C[C@@H](c1ccccc1)N(C)C(=O)C[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000504590203 943701100 /nfs/dbraw/zinc/70/11/00/943701100.db2.gz QLAARRGQTBDYJZ-GQPJMJRUSA-N 1 1 367.449 3.759 20 5 FHBDMO CCn1c(C)nc([N+](=O)[O-])c1N(C)[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000515325163 943789956 /nfs/dbraw/zinc/78/99/56/943789956.db2.gz MMGVPBQDTNAKJA-YJBOKZPZSA-N 1 1 371.485 3.609 20 5 FHBDMO CC[N@@H+](Cc1cnn(C)c1)Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000092437924 943839218 /nfs/dbraw/zinc/83/92/18/943839218.db2.gz ZATWVPULAHZXHJ-UHFFFAOYSA-N 1 1 370.409 3.619 20 5 FHBDMO CC[N@H+](Cc1cnn(C)c1)Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000092437924 943839223 /nfs/dbraw/zinc/83/92/23/943839223.db2.gz ZATWVPULAHZXHJ-UHFFFAOYSA-N 1 1 370.409 3.619 20 5 FHBDMO CCCN1CCC([NH2+][C@@H](CC)CSc2ccccc2[N+](=O)[O-])CC1 ZINC000504900199 943877366 /nfs/dbraw/zinc/87/73/66/943877366.db2.gz SZKPHPJHPYTVAO-HNNXBMFYSA-N 1 1 351.516 3.930 20 5 FHBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CCN(CC2CC2)CC1 ZINC000504911712 943907225 /nfs/dbraw/zinc/90/72/25/943907225.db2.gz KHEQCCDEELDJNT-INIZCTEOSA-N 1 1 363.527 3.930 20 5 FHBDMO CSC[C@@H]1CCC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425450872 943964564 /nfs/dbraw/zinc/96/45/64/943964564.db2.gz WFCJDDUBFLSPEL-LLVKDONJSA-N 1 1 359.289 3.932 20 5 FHBDMO CSC[C@@H]1CCC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425450872 943964570 /nfs/dbraw/zinc/96/45/70/943964570.db2.gz WFCJDDUBFLSPEL-LLVKDONJSA-N 1 1 359.289 3.932 20 5 FHBDMO COc1ccc([C@H](C)[N@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000506101274 944023789 /nfs/dbraw/zinc/02/37/89/944023789.db2.gz CNXYVOKKBPDSII-ZDUSSCGKSA-N 1 1 368.393 3.846 20 5 FHBDMO COc1ccc([C@H](C)[N@@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000506101274 944023795 /nfs/dbraw/zinc/02/37/95/944023795.db2.gz CNXYVOKKBPDSII-ZDUSSCGKSA-N 1 1 368.393 3.846 20 5 FHBDMO CN(C(=O)C[N@H+]1CCC[C@@H](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000436122964 944036878 /nfs/dbraw/zinc/03/68/78/944036878.db2.gz GPLGWVXFXJWWEV-SFHVURJKSA-N 1 1 367.449 3.512 20 5 FHBDMO O=C(CC[N@H+](Cc1cccc(O)c1)CC1CC1)Nc1ccccc1[N+](=O)[O-] ZINC000500091945 944082898 /nfs/dbraw/zinc/08/28/98/944082898.db2.gz NVJNFWXWHDVPNZ-UHFFFAOYSA-N 1 1 369.421 3.541 20 5 FHBDMO C[C@@H]1[C@@H](c2ccccc2)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500093948 944084718 /nfs/dbraw/zinc/08/47/18/944084718.db2.gz SWXAIUKYWYEQFH-WBVHZDCISA-N 1 1 353.422 3.801 20 5 FHBDMO COC[C@H]1CCC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000425495242 944120084 /nfs/dbraw/zinc/12/00/84/944120084.db2.gz SEZBEUMHOLZCBD-LBPRGKRZSA-N 1 1 357.248 3.606 20 5 FHBDMO COC[C@H]1CCC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000425495242 944120090 /nfs/dbraw/zinc/12/00/90/944120090.db2.gz SEZBEUMHOLZCBD-LBPRGKRZSA-N 1 1 357.248 3.606 20 5 FHBDMO CC[C@@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])c1nnc2n1CCCCC2 ZINC000517245743 944138340 /nfs/dbraw/zinc/13/83/40/944138340.db2.gz AJHVUWNNHZYEBY-CVEARBPZSA-N 1 1 355.442 3.641 20 5 FHBDMO C[C@@H]1C[C@H](c2ccc(F)cc2)C[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500126388 944141392 /nfs/dbraw/zinc/14/13/92/944141392.db2.gz RZXVNNFEZGRGKB-ZBFHGGJFSA-N 1 1 371.412 3.941 20 5 FHBDMO C[C@]1(c2ccccc2)CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000500142784 944156374 /nfs/dbraw/zinc/15/63/74/944156374.db2.gz WQFACZLDJIPJQM-NRFANRHFSA-N 1 1 367.449 3.977 20 5 FHBDMO O=C(NC[C@@H]1CCC[N@H+]1C1CCCCC1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000437855823 944176397 /nfs/dbraw/zinc/17/63/97/944176397.db2.gz ZTEMAQMLMVGTOT-HNNXBMFYSA-N 1 1 365.861 3.775 20 5 FHBDMO O=C(Nc1ccc(CC[NH+]2CCCCC2)cc1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000505798792 944233101 /nfs/dbraw/zinc/23/31/01/944233101.db2.gz HUROGWZAMKDOGB-UHFFFAOYSA-N 1 1 369.421 3.581 20 5 FHBDMO CC(C)C[N@H+]1CCC[C@@H](CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000436398550 944274685 /nfs/dbraw/zinc/27/46/85/944274685.db2.gz GDMCOIFDBFABEE-LBPRGKRZSA-N 1 1 360.380 3.789 20 5 FHBDMO Cc1ccc(C[C@@H]2CCC[N@@H+]2CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000500219342 944287305 /nfs/dbraw/zinc/28/73/05/944287305.db2.gz WXCQUPIBLLCWOH-FQEVSTJZSA-N 1 1 367.449 3.573 20 5 FHBDMO COc1cccc(N2CCC(c3[nH+]cc4n3CCCC4)CC2)c1[N+](=O)[O-] ZINC000278831544 944315943 /nfs/dbraw/zinc/31/59/43/944315943.db2.gz KDRPHKUMNXZPJI-UHFFFAOYSA-N 1 1 356.426 3.520 20 5 FHBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000506487100 944347974 /nfs/dbraw/zinc/34/79/74/944347974.db2.gz NLYHYLRDZRUAMQ-CQSZACIVSA-N 1 1 365.499 3.511 20 5 FHBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@@H+](C)[C@H](C)CC ZINC000506180870 944365626 /nfs/dbraw/zinc/36/56/26/944365626.db2.gz YKRDHOFGEIDYKM-CYBMUJFWSA-N 1 1 353.488 3.557 20 5 FHBDMO Cc1ccc(C[N@@H+]2CCCN(C(=O)CC3CCCC3)CC2)cc1[N+](=O)[O-] ZINC000506500964 944399981 /nfs/dbraw/zinc/39/99/81/944399981.db2.gz YVIDUULJEGLHGF-UHFFFAOYSA-N 1 1 359.470 3.518 20 5 FHBDMO Cc1ccc(C[N@H+]2CCCN(C(=O)CC3CCCC3)CC2)cc1[N+](=O)[O-] ZINC000506500964 944399985 /nfs/dbraw/zinc/39/99/85/944399985.db2.gz YVIDUULJEGLHGF-UHFFFAOYSA-N 1 1 359.470 3.518 20 5 FHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC2(C1)Oc1ccccc1O2 ZINC000516073984 944466213 /nfs/dbraw/zinc/46/62/13/944466213.db2.gz HTPKCTRACHEEDE-PTNGSMBKSA-N 1 1 352.390 3.872 20 5 FHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC2(C1)Oc1ccccc1O2 ZINC000516073984 944466216 /nfs/dbraw/zinc/46/62/16/944466216.db2.gz HTPKCTRACHEEDE-PTNGSMBKSA-N 1 1 352.390 3.872 20 5 FHBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000046934520 944494887 /nfs/dbraw/zinc/49/48/87/944494887.db2.gz JBSDWIAEALFEQM-AWEZNQCLSA-N 1 1 368.437 3.782 20 5 FHBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000046934521 944495084 /nfs/dbraw/zinc/49/50/84/944495084.db2.gz JBSDWIAEALFEQM-CQSZACIVSA-N 1 1 368.437 3.782 20 5 FHBDMO C[C@@H]1C[C@@H](c2ccccc2)CC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000439324323 944537603 /nfs/dbraw/zinc/53/76/03/944537603.db2.gz RZIKNSXFMUZXKC-AEFFLSMTSA-N 1 1 367.449 3.826 20 5 FHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+](CCO)Cc2ccccc2)o1 ZINC000505876671 944586591 /nfs/dbraw/zinc/58/65/91/944586591.db2.gz KUQHWIWQUUXPCT-UHFFFAOYSA-N 1 1 352.390 3.849 20 5 FHBDMO O=c1[nH]ccc2c1C[N@@H+](Cc1ccc(-c3ccc([N+](=O)[O-])cc3)o1)CC2 ZINC000426385290 944613069 /nfs/dbraw/zinc/61/30/69/944613069.db2.gz MOGIAVCMIQMJRA-UHFFFAOYSA-N 1 1 351.362 3.514 20 5 FHBDMO C[N@H+]1CC[C@@H](NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)[C@@H]1c1ccccc1 ZINC000536261086 944672158 /nfs/dbraw/zinc/67/21/58/944672158.db2.gz BENVAAWMCKZWRI-APWZRJJASA-N 1 1 365.389 3.516 20 5 FHBDMO Cc1ccc(NC(=O)c2ccc(NC[C@H]3CC[N@H+](C)C3)c([N+](=O)[O-])c2)cc1 ZINC000517827619 944690918 /nfs/dbraw/zinc/69/09/18/944690918.db2.gz DBZPHRAIYCMGLX-OAHLLOKOSA-N 1 1 368.437 3.519 20 5 FHBDMO C[C@@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000518791299 944773662 /nfs/dbraw/zinc/77/36/62/944773662.db2.gz ILJZHFSFBQAJIT-CQSZACIVSA-N 1 1 371.462 3.522 20 5 FHBDMO C[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000518791299 944773664 /nfs/dbraw/zinc/77/36/64/944773664.db2.gz ILJZHFSFBQAJIT-CQSZACIVSA-N 1 1 371.462 3.522 20 5 FHBDMO C[C@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000518791298 944773953 /nfs/dbraw/zinc/77/39/53/944773953.db2.gz ILJZHFSFBQAJIT-AWEZNQCLSA-N 1 1 371.462 3.522 20 5 FHBDMO C[C@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 ZINC000518791298 944773956 /nfs/dbraw/zinc/77/39/56/944773956.db2.gz ILJZHFSFBQAJIT-AWEZNQCLSA-N 1 1 371.462 3.522 20 5 FHBDMO Cc1ccc(NC(=O)N[C@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000506278902 944774569 /nfs/dbraw/zinc/77/45/69/944774569.db2.gz CKSLUBVUUINLSC-QAPCUYQASA-N 1 1 368.437 3.860 20 5 FHBDMO O=C(Nc1ccccc1)[C@@H]1CCC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000506296374 944836734 /nfs/dbraw/zinc/83/67/34/944836734.db2.gz YPUVOJVLWLMADB-OTIVFRFGSA-N 1 1 365.433 3.959 20 5 FHBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2nc3sccn3c2[N+](=O)[O-])C1 ZINC000507003131 944871055 /nfs/dbraw/zinc/87/10/55/944871055.db2.gz UBRNZYHMHGXENV-TZMCWYRMSA-N 1 1 357.439 3.551 20 5 FHBDMO O=[N+]([O-])c1ccc([O-])cc1CN1CCC(c2nc3ccccc3[nH]2)CC1 ZINC000506662154 944914862 /nfs/dbraw/zinc/91/48/62/944914862.db2.gz LXAXZJHWVBGPBO-UHFFFAOYSA-N 1 1 352.394 3.556 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@H+](CCO)C2CCC2)ccc1Oc1ccc(F)cc1 ZINC000439765160 944947731 /nfs/dbraw/zinc/94/77/31/944947731.db2.gz DZZAIYZTAWSHLH-UHFFFAOYSA-N 1 1 360.385 3.873 20 5 FHBDMO COc1cc(C[N@H+]2CCC[C@@H]2Cc2ccccc2)c([N+](=O)[O-])cc1OC ZINC000506675122 944966810 /nfs/dbraw/zinc/96/68/10/944966810.db2.gz KDNYQBCNHDWICG-QGZVFWFLSA-N 1 1 356.422 3.819 20 5 FHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2C[C@H](c3ccccc3)[C@@H]3COCC[C@@H]32)c(F)c1 ZINC000511754839 945024492 /nfs/dbraw/zinc/02/44/92/945024492.db2.gz JMEAFVSQKQVWJK-SYNHAJSKSA-N 1 1 374.387 3.878 20 5 FHBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC000516593746 945056025 /nfs/dbraw/zinc/05/60/25/945056025.db2.gz OGFFDDHMQVIXOR-RHSMWYFYSA-N 1 1 354.410 3.552 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](Cc1ccc(F)cc1)C(C)C ZINC000506821594 945410738 /nfs/dbraw/zinc/41/07/38/945410738.db2.gz NDUJGKSHTCZDHO-UHFFFAOYSA-N 1 1 359.401 3.891 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](Cc1ccc(F)cc1)C(C)C ZINC000506821594 945410743 /nfs/dbraw/zinc/41/07/43/945410743.db2.gz NDUJGKSHTCZDHO-UHFFFAOYSA-N 1 1 359.401 3.891 20 5 FHBDMO COc1cccc([C@H](C)[NH+]2CCN(Cc3c(F)cccc3[N+](=O)[O-])CC2)c1 ZINC000507683818 945450058 /nfs/dbraw/zinc/45/00/58/945450058.db2.gz NDPBZKLEQIRJDS-HNNXBMFYSA-N 1 1 373.428 3.621 20 5 FHBDMO COc1cccc([C@@H](C)N2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000507687710 945469442 /nfs/dbraw/zinc/46/94/42/945469442.db2.gz JKXZXDNYIBQMGS-QGZVFWFLSA-N 1 1 369.465 3.525 20 5 FHBDMO Cc1nc(C2([NH2+]CCOc3cccc([N+](=O)[O-])c3)CCCCCC2)no1 ZINC000507710165 945483388 /nfs/dbraw/zinc/48/33/88/945483388.db2.gz SVPLWAGYQUSDPE-UHFFFAOYSA-N 1 1 360.414 3.504 20 5 FHBDMO CC(C)c1ccc(C(=O)NCC[N@@H+]2CCc3sccc3C2)cc1[N+](=O)[O-] ZINC000473621119 945620369 /nfs/dbraw/zinc/62/03/69/945620369.db2.gz APYNLDXSOBQUKO-UHFFFAOYSA-N 1 1 373.478 3.568 20 5 FHBDMO CC(C)c1ccc(C(=O)NCC[N@H+]2CCc3sccc3C2)cc1[N+](=O)[O-] ZINC000473621119 945620375 /nfs/dbraw/zinc/62/03/75/945620375.db2.gz APYNLDXSOBQUKO-UHFFFAOYSA-N 1 1 373.478 3.568 20 5 FHBDMO CC1(C)CCC[N@@H+](CCNCc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000444016773 945727093 /nfs/dbraw/zinc/72/70/93/945727093.db2.gz NEBATJBCVRDYBZ-UHFFFAOYSA-N 1 1 374.510 3.930 20 5 FHBDMO CC1(C)CCCN(CC[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000444016773 945727102 /nfs/dbraw/zinc/72/71/02/945727102.db2.gz NEBATJBCVRDYBZ-UHFFFAOYSA-N 1 1 374.510 3.930 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)cnc1N1CCC[C@@H](c2[nH+]cc3n2CCCC3)C1 ZINC000281764814 945841167 /nfs/dbraw/zinc/84/11/67/945841167.db2.gz CWMIQWYQCHATHP-GFCCVEGCSA-N 1 1 361.833 3.560 20 5 FHBDMO COc1cccc(C[C@H]2CCC[N@H+]2CCOc2ccccc2[N+](=O)[O-])c1 ZINC000108089834 945855069 /nfs/dbraw/zinc/85/50/69/945855069.db2.gz ARMMEUSXDMIGDG-QGZVFWFLSA-N 1 1 356.422 3.689 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](Cc1ccc(F)cc1)C(C)C ZINC000506847424 945884027 /nfs/dbraw/zinc/88/40/27/945884027.db2.gz PDZPMSSVDDWHJG-UHFFFAOYSA-N 1 1 359.401 3.891 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](Cc1ccc(F)cc1)C(C)C ZINC000506847424 945884039 /nfs/dbraw/zinc/88/40/39/945884039.db2.gz PDZPMSSVDDWHJG-UHFFFAOYSA-N 1 1 359.401 3.891 20 5 FHBDMO CCOc1ccc(NC(=O)C[N@H+]2[C@H](C)C[C@@H]3CCCC[C@@H]32)c([N+](=O)[O-])c1 ZINC000444240760 946117191 /nfs/dbraw/zinc/11/71/91/946117191.db2.gz DGGAWPPBKJCSDC-KEYYUXOJSA-N 1 1 361.442 3.585 20 5 FHBDMO C[C@H]1C[N@@H+]2CCCC[C@H]2CN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000408182668 946301607 /nfs/dbraw/zinc/30/16/07/946301607.db2.gz LIIKEDAYXZGWRK-WFASDCNBSA-N 1 1 359.451 3.508 20 5 FHBDMO C[C@H]1C[N@H+]2CCCC[C@H]2CN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000408182668 946301614 /nfs/dbraw/zinc/30/16/14/946301614.db2.gz LIIKEDAYXZGWRK-WFASDCNBSA-N 1 1 359.451 3.508 20 5 FHBDMO CN(C)c1cccc([C@H]2CCC[N@H+]2CCOc2cccc([N+](=O)[O-])c2)c1 ZINC000441356417 946474046 /nfs/dbraw/zinc/47/40/46/946474046.db2.gz PTYZXYVANJOBLA-HXUWFJFHSA-N 1 1 355.438 3.877 20 5 FHBDMO CC[C@H](Cc1ccc(C)cc1)[N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000441373793 946525447 /nfs/dbraw/zinc/52/54/47/946525447.db2.gz FKQDDZMRJSKOEA-QUCCMNQESA-N 1 1 372.465 3.596 20 5 FHBDMO Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NCCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000843767241 946688736 /nfs/dbraw/zinc/68/87/36/946688736.db2.gz CGJJPVWIBGLPIT-OKILXGFUSA-N 1 1 365.449 3.530 20 5 FHBDMO C[C@H]([NH2+][C@H](c1cnn(C)c1)c1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000186647500 946781178 /nfs/dbraw/zinc/78/11/78/946781178.db2.gz GZWUPFUERLATHP-DJJJIMSYSA-N 1 1 354.385 3.908 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@@H]3c3ccccc3)n2)c1 ZINC000025934867 946905674 /nfs/dbraw/zinc/90/56/74/946905674.db2.gz VFQHSSKNJBFQCT-QGZVFWFLSA-N 1 1 350.378 3.982 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@@H]3c3ccccc3)n2)c1 ZINC000025934867 946905677 /nfs/dbraw/zinc/90/56/77/946905677.db2.gz VFQHSSKNJBFQCT-QGZVFWFLSA-N 1 1 350.378 3.982 20 5 FHBDMO CCC[N@@H+]1Cc2cccc(NC(=O)c3cccc([N+](=O)[O-])c3OC)c2C1 ZINC000475605365 946953330 /nfs/dbraw/zinc/95/33/30/946953330.db2.gz HIOTUGGVWFHHNH-UHFFFAOYSA-N 1 1 355.394 3.581 20 5 FHBDMO CCC[N@H+]1Cc2cccc(NC(=O)c3cccc([N+](=O)[O-])c3OC)c2C1 ZINC000475605365 946953337 /nfs/dbraw/zinc/95/33/37/946953337.db2.gz HIOTUGGVWFHHNH-UHFFFAOYSA-N 1 1 355.394 3.581 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC[C@@]1(CO)Cc1ccccc1 ZINC000475376098 946986176 /nfs/dbraw/zinc/98/61/76/946986176.db2.gz RLZNLEHCLVWMFD-LTSKSLEPSA-N 1 1 352.434 3.678 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCC[C@]1(CO)Cc1ccccc1 ZINC000475376097 946986257 /nfs/dbraw/zinc/98/62/57/946986257.db2.gz RLZNLEHCLVWMFD-JLXOPUERSA-N 1 1 352.434 3.678 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000074808352 947021811 /nfs/dbraw/zinc/02/18/11/947021811.db2.gz WLCKZBSDDJILPN-SFHVURJKSA-N 1 1 367.449 3.640 20 5 FHBDMO CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC)[C@H]1CCCC[C@H]1C ZINC000444679480 947104452 /nfs/dbraw/zinc/10/44/52/947104452.db2.gz VBVGKNGKXOVCGB-PBHICJAKSA-N 1 1 363.458 3.833 20 5 FHBDMO Cc1ccc(C)c([C@H](C)[N@@H+](C)C[C@H](O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000523438732 947268856 /nfs/dbraw/zinc/26/88/56/947268856.db2.gz NOURIPQRZBVXRG-WMZOPIPTSA-N 1 1 358.438 3.644 20 5 FHBDMO COCC[N@H+](Cc1cc(OC)c(OC)cc1[N+](=O)[O-])[C@H](C)c1ccccc1 ZINC000508516005 947440571 /nfs/dbraw/zinc/44/05/71/947440571.db2.gz HZLFLICITFJGRI-OAHLLOKOSA-N 1 1 374.437 3.822 20 5 FHBDMO COCC[N@@H+](Cc1cc(OC)c(OC)cc1[N+](=O)[O-])[C@H](C)c1ccccc1 ZINC000508516005 947440575 /nfs/dbraw/zinc/44/05/75/947440575.db2.gz HZLFLICITFJGRI-OAHLLOKOSA-N 1 1 374.437 3.822 20 5 FHBDMO COC(=O)[C@H](C)[C@@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000152074025 947520283 /nfs/dbraw/zinc/52/02/83/947520283.db2.gz ZSZDTDUDXLLJAP-SJKOYZFVSA-N 1 1 362.813 3.888 20 5 FHBDMO CN1CC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)Cc2ccccc21 ZINC000536362379 947742499 /nfs/dbraw/zinc/74/24/99/947742499.db2.gz HMEBAQAHLSHKKK-UHFFFAOYSA-N 1 1 364.405 3.702 20 5 FHBDMO CN1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)Cc2ccccc21 ZINC000536362379 947742509 /nfs/dbraw/zinc/74/25/09/947742509.db2.gz HMEBAQAHLSHKKK-UHFFFAOYSA-N 1 1 364.405 3.702 20 5 FHBDMO CC[N@H+]1CCC[C@H]1CNc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000015164201 947794132 /nfs/dbraw/zinc/79/41/32/947794132.db2.gz AQRVMMRBEBMYSX-KRWDZBQOSA-N 1 1 353.422 3.722 20 5 FHBDMO CN(C(=O)c1cccc(Cl)c1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311896322 948015291 /nfs/dbraw/zinc/01/52/91/948015291.db2.gz BMVCHQKPCSVJIL-HNNXBMFYSA-N 1 1 373.840 3.595 20 5 FHBDMO COc1ccc(NC(=O)CC[N@H+]2CCC[C@@]3(CC=CCC3)C2)c([N+](=O)[O-])c1 ZINC000512153761 948568776 /nfs/dbraw/zinc/56/87/76/948568776.db2.gz KWTHOSWWTDBIGM-FQEVSTJZSA-N 1 1 373.453 3.754 20 5 FHBDMO CC[N@H+]1CC[C@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000236826613 948617152 /nfs/dbraw/zinc/61/71/52/948617152.db2.gz KGCUDPHYHMIXKX-CYBMUJFWSA-N 1 1 363.845 3.940 20 5 FHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@](CO)(C(C)C)C1 ZINC000550433722 948644288 /nfs/dbraw/zinc/64/42/88/948644288.db2.gz SHVIINPURVACGM-IBGZPJMESA-N 1 1 350.459 3.613 20 5 FHBDMO CCC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H](C)C(=O)Nc1ccccc1 ZINC000109869032 206065190 /nfs/dbraw/zinc/06/51/90/206065190.db2.gz QAUGERBXIOWEIT-MRXNPFEDSA-N 1 1 355.438 3.877 20 5 FHBDMO O=C(C[N@@H+]1CCCC[C@H]1Cc1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000110001840 206067016 /nfs/dbraw/zinc/06/70/16/206067016.db2.gz JRPBZCIGVJYDFR-KRWDZBQOSA-N 1 1 353.422 3.631 20 5 FHBDMO O=C(C[N@H+]1CCCC[C@H]1Cc1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000110001840 206067021 /nfs/dbraw/zinc/06/70/21/206067021.db2.gz JRPBZCIGVJYDFR-KRWDZBQOSA-N 1 1 353.422 3.631 20 5 FHBDMO CC[C@](C)([NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1nc(C)cs1 ZINC000072865010 567840925 /nfs/dbraw/zinc/84/09/25/567840925.db2.gz UHYDFCZLJSSTNS-KRWDZBQOSA-N 1 1 362.455 3.522 20 5 FHBDMO Cn1cc(-c2ccc(C[N@@H+](C)CCc3ccccc3[N+](=O)[O-])s2)cn1 ZINC000517911423 567909611 /nfs/dbraw/zinc/90/96/11/567909611.db2.gz WWGKFWSYJHTVAH-UHFFFAOYSA-N 1 1 356.451 3.731 20 5 FHBDMO CCSCC[C@H](C)[N@@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000072900818 568056812 /nfs/dbraw/zinc/05/68/12/568056812.db2.gz DPFQDRCEHSANOB-ZDUSSCGKSA-N 1 1 353.488 3.695 20 5 FHBDMO CCSCC[C@@H](C)[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000072901609 568056926 /nfs/dbraw/zinc/05/69/26/568056926.db2.gz OAMGYWZMMPZEII-GFCCVEGCSA-N 1 1 350.444 3.608 20 5 FHBDMO COc1cc(C[N@H+]2CCC[C@]3(C2)OCc2ccccc23)ccc1[N+](=O)[O-] ZINC000481698413 568092449 /nfs/dbraw/zinc/09/24/49/568092449.db2.gz YASCKWFPYAUOQS-HXUWFJFHSA-N 1 1 354.406 3.625 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])c(N2CCC[N@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC000541931845 568251763 /nfs/dbraw/zinc/25/17/63/568251763.db2.gz CSZAXYFAGQTOPU-KRWDZBQOSA-N 1 1 354.454 3.707 20 5 FHBDMO Cn1ccnc1[C@H]([NH2+]CCCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000568910298 568251916 /nfs/dbraw/zinc/25/19/16/568251916.db2.gz OZAOAUOGVUKWSU-LJQANCHMSA-N 1 1 350.422 3.640 20 5 FHBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000568921883 568252503 /nfs/dbraw/zinc/25/25/03/568252503.db2.gz ORSRYEYAVSFUSW-GDBMZVCRSA-N 1 1 374.485 3.932 20 5 FHBDMO CCc1ccc([C@H](CO)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(C)C)cc1 ZINC000541984510 568312334 /nfs/dbraw/zinc/31/23/34/568312334.db2.gz XLPQOXLSTFNJJE-IBGZPJMESA-N 1 1 358.438 3.768 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@H](COC(F)F)C3)o2)c1 ZINC000570128342 568453006 /nfs/dbraw/zinc/45/30/06/568453006.db2.gz FVAVFJRLWVRBCJ-LBPRGKRZSA-N 1 1 352.337 3.916 20 5 FHBDMO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(-c3nn[nH]n3)cc2F)cc1[N+](=O)[O-] ZINC000826283221 609342842 /nfs/dbraw/zinc/34/28/42/609342842.db2.gz MZIBYNMEWSTVMP-NWDGAFQWSA-N 1 1 370.388 3.634 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)cnc1N1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001164621412 719056565 /nfs/dbraw/zinc/05/65/65/719056565.db2.gz JCYADDNBEWNBEU-QAPCUYQASA-N 1 1 372.856 3.744 20 5 FHBDMO Cc1c(C)c(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)ncc1[N+](=O)[O-] ZINC001164621040 719083017 /nfs/dbraw/zinc/08/30/17/719083017.db2.gz GLTZIUXGEJYSQZ-UYAOXDASSA-N 1 1 366.465 3.707 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc([C@H](C)[NH+]2CCOCC2)cc1 ZINC000110720999 945065260 /nfs/dbraw/zinc/06/52/60/945065260.db2.gz SYRXAHNSVGNYLD-HNNXBMFYSA-N 1 1 369.421 3.549 20 5 FHBDMO Cn1c[nH+]cc1CCCSc1ccc(Br)cc1[N+](=O)[O-] ZINC000579734995 927242487 /nfs/dbraw/zinc/24/24/87/927242487.db2.gz QXMZXVJMTLRBHE-UHFFFAOYSA-N 1 1 356.245 3.816 20 5 FHBDMO Cc1ccc(NC(=O)[C@@H](C)[N@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1C ZINC000583131498 937153143 /nfs/dbraw/zinc/15/31/43/937153143.db2.gz NPXWUJAWQNUQIM-MRXNPFEDSA-N 1 1 355.438 3.713 20 5 FHBDMO Cc1ccc(NC(=O)[C@@H](C)[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1C ZINC000583131498 937153145 /nfs/dbraw/zinc/15/31/45/937153145.db2.gz NPXWUJAWQNUQIM-MRXNPFEDSA-N 1 1 355.438 3.713 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]1Cn1cnc2ccccc21 ZINC000430209131 928091025 /nfs/dbraw/zinc/09/10/25/928091025.db2.gz XASVUWOPBIRQPC-KRWDZBQOSA-N 1 1 366.421 3.618 20 5 FHBDMO C[C@H]1C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@@H](c2ccc(F)cc2)O1 ZINC000610217630 928222329 /nfs/dbraw/zinc/22/23/29/928222329.db2.gz QUFLTCKGPOTFCY-YWZLYKJASA-N 1 1 374.412 3.965 20 5 FHBDMO C[C@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@@H](c2ccc(F)cc2)O1 ZINC000610217630 928222344 /nfs/dbraw/zinc/22/23/44/928222344.db2.gz QUFLTCKGPOTFCY-YWZLYKJASA-N 1 1 374.412 3.965 20 5 FHBDMO C[C@@H]1C[C@@H](CCNC(=O)c2ccc([N+](=O)[O-])s2)C[N@H+]1Cc1ccccc1 ZINC000510097868 928231915 /nfs/dbraw/zinc/23/19/15/928231915.db2.gz IQDNTKPJRIILMN-GDBMZVCRSA-N 1 1 373.478 3.687 20 5 FHBDMO COc1cccc(NC2CC[NH+](Cc3ccc([N+](=O)[O-])cc3OC)CC2)c1 ZINC000430237149 928386631 /nfs/dbraw/zinc/38/66/31/928386631.db2.gz HYSGGPRAOBKAJR-UHFFFAOYSA-N 1 1 371.437 3.689 20 5 FHBDMO CCOCCC[N@H+]1CC[C@H](N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000248170126 937281353 /nfs/dbraw/zinc/28/13/53/937281353.db2.gz UPEHRAHVRLIMRY-SCTDSRPQSA-N 1 1 363.502 3.691 20 5 FHBDMO CCOCCCN1CC[C@H]([NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000248170126 937281362 /nfs/dbraw/zinc/28/13/62/937281362.db2.gz UPEHRAHVRLIMRY-SCTDSRPQSA-N 1 1 363.502 3.691 20 5 FHBDMO O=[N+]([O-])c1ccc(NCCc2cn3c([nH+]2)CCCC3)nc1-c1ccccc1 ZINC000134595449 929093372 /nfs/dbraw/zinc/09/33/72/929093372.db2.gz ASXANYBIZUXWMI-UHFFFAOYSA-N 1 1 363.421 3.844 20 5 FHBDMO C[N@@H+](CCC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])C1CCCCC1 ZINC000547736027 929115258 /nfs/dbraw/zinc/11/52/58/929115258.db2.gz GXFCHRDRUPEJPB-UHFFFAOYSA-N 1 1 367.877 3.562 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000610238821 929143253 /nfs/dbraw/zinc/14/32/53/929143253.db2.gz IUPKYLRHLUOCMT-GOSISDBHSA-N 1 1 367.449 3.545 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCN(C(=O)CC2CCCC2)CC1 ZINC000569626794 937318981 /nfs/dbraw/zinc/31/89/81/937318981.db2.gz UYABIVKQFQTIJH-UHFFFAOYSA-N 1 1 359.470 3.518 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCN(C(=O)CC2CCCC2)CC1 ZINC000569626794 937318983 /nfs/dbraw/zinc/31/89/83/937318983.db2.gz UYABIVKQFQTIJH-UHFFFAOYSA-N 1 1 359.470 3.518 20 5 FHBDMO COc1cc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c(Br)cn1 ZINC000598600809 929493064 /nfs/dbraw/zinc/49/30/64/929493064.db2.gz KFCZEQNLJXFWCF-JTQLQIEISA-N 1 1 366.215 3.612 20 5 FHBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)C1 ZINC000278207403 937357303 /nfs/dbraw/zinc/35/73/03/937357303.db2.gz QQSKAQXPYQAKHU-HNNXBMFYSA-N 1 1 363.461 3.507 20 5 FHBDMO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCC[C@H]2C[C@H](O)c2cccs2)c1 ZINC000175825661 929769389 /nfs/dbraw/zinc/76/93/89/929769389.db2.gz INAHFFSOZQHQBB-YOEHRIQHSA-N 1 1 362.451 3.623 20 5 FHBDMO C[C@@H](c1ccc(-n2cncn2)cc1)[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000127133564 929784167 /nfs/dbraw/zinc/78/41/67/929784167.db2.gz GDGRIAQDNBQUPH-YERXGYGTSA-N 1 1 363.421 3.882 20 5 FHBDMO Cc1cc(C(=O)NCC[C@@H](C)[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000471471643 929835561 /nfs/dbraw/zinc/83/55/61/929835561.db2.gz OPRBZHZJFADREM-MRXNPFEDSA-N 1 1 355.438 3.544 20 5 FHBDMO CCOc1cc(C[N@H+]2CCCc3cc(OC)ccc3C2)ccc1[N+](=O)[O-] ZINC001167326556 929855849 /nfs/dbraw/zinc/85/58/49/929855849.db2.gz MTMYGZHHLOFSEB-UHFFFAOYSA-N 1 1 356.422 3.951 20 5 FHBDMO CCOc1ccccc1N1CC[NH+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000023697256 929914889 /nfs/dbraw/zinc/91/48/89/929914889.db2.gz KODVTQPHCFYGRP-INIZCTEOSA-N 1 1 355.438 3.877 20 5 FHBDMO Cc1c(C[N@H+]2CCC[C@H](C(=O)Nc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000052314986 937389045 /nfs/dbraw/zinc/38/90/45/937389045.db2.gz WEXZUPQAEISUCY-KRWDZBQOSA-N 1 1 353.422 3.754 20 5 FHBDMO Cc1cccn2cc(C[NH+]3CCC(Oc4ccc([N+](=O)[O-])cc4)CC3)nc12 ZINC000610370986 930175094 /nfs/dbraw/zinc/17/50/94/930175094.db2.gz CTJOIRGEHQRLOA-UHFFFAOYSA-N 1 1 366.421 3.594 20 5 FHBDMO COc1ccc(OCC[N@H+]2CCC[C@@H]2c2ccc(O)cc2)c([N+](=O)[O-])c1 ZINC000610390100 930302141 /nfs/dbraw/zinc/30/21/41/930302141.db2.gz GNVWJDCVEADUAQ-QGZVFWFLSA-N 1 1 358.394 3.525 20 5 FHBDMO C[N@H+]1CCC[C@H](CNC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H]1c1cccs1 ZINC000247252008 930512518 /nfs/dbraw/zinc/51/25/18/930512518.db2.gz DXZTXOWXLBZFBB-DYVFJYSZSA-N 1 1 374.466 3.861 20 5 FHBDMO Cc1cccc(C(=O)N2CC[N@H+](Cc3ccccc3)CC[C@@H]2C)c1[N+](=O)[O-] ZINC000610445940 930793342 /nfs/dbraw/zinc/79/33/42/930793342.db2.gz KXNHMYBRIHIALS-KRWDZBQOSA-N 1 1 367.449 3.640 20 5 FHBDMO CC[C@H]1c2ccccc2CC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC001167417097 930821584 /nfs/dbraw/zinc/82/15/84/930821584.db2.gz PSVMODGREIAJBY-IBGZPJMESA-N 1 1 353.422 3.851 20 5 FHBDMO CC[C@H]1c2ccccc2CC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC001167417097 930821589 /nfs/dbraw/zinc/82/15/89/930821589.db2.gz PSVMODGREIAJBY-IBGZPJMESA-N 1 1 353.422 3.851 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1CN1CCC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC001167443627 931512834 /nfs/dbraw/zinc/51/28/34/931512834.db2.gz YNHMDFKRILZTSX-QGZVFWFLSA-N 1 1 369.465 3.700 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000610476740 931558426 /nfs/dbraw/zinc/55/84/26/931558426.db2.gz ZIUMYVSWFWZOQJ-HXUWFJFHSA-N 1 1 356.422 3.957 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000610476740 931558432 /nfs/dbraw/zinc/55/84/32/931558432.db2.gz ZIUMYVSWFWZOQJ-HXUWFJFHSA-N 1 1 356.422 3.957 20 5 FHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@]2(CCCOC2)C1 ZINC000477045907 931739716 /nfs/dbraw/zinc/73/97/16/931739716.db2.gz FZCARQMPEVTKBD-LIRRHRJNSA-N 1 1 372.425 3.598 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H](c2ccccc2)[C@H](C)C1 ZINC000581343102 931860785 /nfs/dbraw/zinc/86/07/85/931860785.db2.gz YWZIZDPBHDKXGM-AEFFLSMTSA-N 1 1 367.449 3.967 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H](c2ccccc2)[C@H](C)C1 ZINC000581343102 931860789 /nfs/dbraw/zinc/86/07/89/931860789.db2.gz YWZIZDPBHDKXGM-AEFFLSMTSA-N 1 1 367.449 3.967 20 5 FHBDMO O=C(C[C@@H]1CCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccccc1 ZINC000610720135 932272196 /nfs/dbraw/zinc/27/21/96/932272196.db2.gz UFJSVWAANHCBPV-HNNXBMFYSA-N 1 1 365.389 3.973 20 5 FHBDMO O=C(C[C@@H]1CCC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccccc1 ZINC000610720135 932272202 /nfs/dbraw/zinc/27/22/02/932272202.db2.gz UFJSVWAANHCBPV-HNNXBMFYSA-N 1 1 365.389 3.973 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](C1CC1)[N@@H+](C)Cc1ccccc1 ZINC000477286949 932452256 /nfs/dbraw/zinc/45/22/56/932452256.db2.gz LUBLKKVNIQIQKS-HXUWFJFHSA-N 1 1 367.449 3.544 20 5 FHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](NC(=O)c2ccccc2)C1 ZINC001167483649 932698619 /nfs/dbraw/zinc/69/86/19/932698619.db2.gz YCDOGCPFUSRFFU-NVXWUHKLSA-N 1 1 353.422 3.550 20 5 FHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](NC(=O)c2ccccc2)C1 ZINC001167483649 932698623 /nfs/dbraw/zinc/69/86/23/932698623.db2.gz YCDOGCPFUSRFFU-NVXWUHKLSA-N 1 1 353.422 3.550 20 5 FHBDMO C[C@@H]1C[C@H](NC(=O)OC(C)(C)C)CC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000134661744 932837357 /nfs/dbraw/zinc/83/73/57/932837357.db2.gz HOIXBUXLJMBWCL-GDBMZVCRSA-N 1 1 363.458 3.515 20 5 FHBDMO C[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(F)cc1Cl ZINC000178206062 932884957 /nfs/dbraw/zinc/88/49/57/932884957.db2.gz XBBZAHUQZHIEBA-SNVBAGLBSA-N 1 1 351.765 3.677 20 5 FHBDMO C[N@H+]1CCC[C@@H](CNC(=O)c2csc([N+](=O)[O-])c2)[C@H]1c1cccs1 ZINC000247417991 932955574 /nfs/dbraw/zinc/95/55/74/932955574.db2.gz NSYJPQLMDXVSIR-NHYWBVRUSA-N 1 1 365.480 3.531 20 5 FHBDMO Cc1ccc(C[NH2+][C@@H](c2cnn(C)c2)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000187513771 932966414 /nfs/dbraw/zinc/96/64/14/932966414.db2.gz FNQMEYOFVFOWEE-LJQANCHMSA-N 1 1 354.385 3.655 20 5 FHBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCCCC[N@@H+]1CCC[C@@H](C)C1 ZINC000588444423 933100850 /nfs/dbraw/zinc/10/08/50/933100850.db2.gz AQGSKBADWOZUGL-DXFLKOCDSA-N 1 1 359.470 3.626 20 5 FHBDMO CC(C)(COCc1ccccc1)[NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000510604390 933264918 /nfs/dbraw/zinc/26/49/18/933264918.db2.gz YBXLUQSNCHDREY-UHFFFAOYSA-N 1 1 350.365 3.958 20 5 FHBDMO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCO[C@@]3(CCc4ccccc43)C2)cc1 ZINC000510640207 933335100 /nfs/dbraw/zinc/33/51/00/933335100.db2.gz ZGZACYQWEHXZGH-NRFANRHFSA-N 1 1 368.433 3.538 20 5 FHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCO[C@@]3(CCc4ccccc43)C2)cc1 ZINC000510640207 933335110 /nfs/dbraw/zinc/33/51/10/933335110.db2.gz ZGZACYQWEHXZGH-NRFANRHFSA-N 1 1 368.433 3.538 20 5 FHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+](CCc3ccccc3)[C@@H]3CCOC3)nc2c1 ZINC000610619444 933548006 /nfs/dbraw/zinc/54/80/06/933548006.db2.gz QILOKRRVYFAVFE-QGZVFWFLSA-N 1 1 367.405 3.570 20 5 FHBDMO C[C@@H]([NH2+]Cc1ccnn1CCc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000610676127 933748681 /nfs/dbraw/zinc/74/86/81/933748681.db2.gz NCFLWLMVAFLUJU-MRXNPFEDSA-N 1 1 350.422 3.885 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H](CC(=O)OC(C)(C)C)C1 ZINC000610763267 934122521 /nfs/dbraw/zinc/12/25/21/934122521.db2.gz OIDZSYNJBYZXPD-AWEZNQCLSA-N 1 1 364.442 3.547 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](CC(=O)OC(C)(C)C)C1 ZINC000610763267 934122524 /nfs/dbraw/zinc/12/25/24/934122524.db2.gz OIDZSYNJBYZXPD-AWEZNQCLSA-N 1 1 364.442 3.547 20 5 FHBDMO Cc1[nH+]ccn1-c1ccc([C@H](C)NC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000176187356 934556421 /nfs/dbraw/zinc/55/64/21/934556421.db2.gz DIETTXLYEPDHBI-AWEZNQCLSA-N 1 1 364.405 3.509 20 5 FHBDMO O=[N+]([O-])c1ccn(CC[N@H+](Cc2c(F)cccc2F)C2CCCC2)n1 ZINC000478009505 934739870 /nfs/dbraw/zinc/73/98/70/934739870.db2.gz MPRDZDMCESOPSC-UHFFFAOYSA-N 1 1 350.369 3.514 20 5 FHBDMO O=[N+]([O-])c1ccn(CC[N@@H+](Cc2c(F)cccc2F)C2CCCC2)n1 ZINC000478009505 934739872 /nfs/dbraw/zinc/73/98/72/934739872.db2.gz MPRDZDMCESOPSC-UHFFFAOYSA-N 1 1 350.369 3.514 20 5 FHBDMO CCOC(=O)CCC1CC[NH+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000610998111 934745453 /nfs/dbraw/zinc/74/54/53/934745453.db2.gz VPNKVTFNGVLRJB-UHFFFAOYSA-N 1 1 354.834 3.804 20 5 FHBDMO Cn1ccnc1[C@@H]([NH2+]CC(C)(C)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000611560342 934826586 /nfs/dbraw/zinc/82/65/86/934826586.db2.gz TXLHHWPOZRAOGS-IBGZPJMESA-N 1 1 364.449 3.985 20 5 FHBDMO COc1cc(C[N@H+]2CCC[C@H]2CSC)c([N+](=O)[O-])cc1OC(F)F ZINC000135466402 934878760 /nfs/dbraw/zinc/87/87/60/934878760.db2.gz HYQNFPHCGZTAKX-NSHDSACASA-N 1 1 362.398 3.532 20 5 FHBDMO CC[N@@H+](CCC1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1)CC1CC1 ZINC000538915157 934948563 /nfs/dbraw/zinc/94/85/63/934948563.db2.gz DAKALWJBRSQVAJ-UHFFFAOYSA-N 1 1 365.499 3.631 20 5 FHBDMO O=[N+]([O-])c1ccc(OC2CC[NH+](Cc3ccnn3C3CCC3)CC2)cc1 ZINC000892110321 935020272 /nfs/dbraw/zinc/02/02/72/935020272.db2.gz LOHKACMFHWRTLB-UHFFFAOYSA-N 1 1 356.426 3.560 20 5 FHBDMO C[C@H](CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[N@H+]1CCCC[C@H]1C ZINC000437151493 945071467 /nfs/dbraw/zinc/07/14/67/945071467.db2.gz GOXASQLLTOWSQT-VXGBXAGGSA-N 1 1 373.375 3.606 20 5 FHBDMO C[N@@H+](Cc1ccccc1CNC(=O)c1ccc([N+](=O)[O-])o1)C1CCCCC1 ZINC000072012583 935198883 /nfs/dbraw/zinc/19/88/83/935198883.db2.gz VZZYERJBUHJJBI-UHFFFAOYSA-N 1 1 371.437 3.882 20 5 FHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)Nc1ccc(F)cc1Cl ZINC000511090760 935391041 /nfs/dbraw/zinc/39/10/41/935391041.db2.gz NKVHFNUJDOSVOJ-UHFFFAOYSA-N 1 1 365.792 3.500 20 5 FHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)Nc1ccc(F)cc1Cl ZINC000511090760 935391047 /nfs/dbraw/zinc/39/10/47/935391047.db2.gz NKVHFNUJDOSVOJ-UHFFFAOYSA-N 1 1 365.792 3.500 20 5 FHBDMO COc1cc(C[N@@H+]2CCS[C@@H](C)[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000118415217 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WSNUEBSUFQDRGH-LJQANCHMSA-N 1 1 369.465 3.920 20 5 FHBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@@H](CC(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000278781154 938995092 /nfs/dbraw/zinc/99/50/92/938995092.db2.gz NOZWZAULEFEUJS-RYUDHWBXSA-N 1 1 359.348 3.505 20 5 FHBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H](CC(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000278781154 938995093 /nfs/dbraw/zinc/99/50/93/938995093.db2.gz NOZWZAULEFEUJS-RYUDHWBXSA-N 1 1 359.348 3.505 20 5 FHBDMO CSc1cccc(C(=O)NCC(C)(C)[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-] ZINC000188079423 939017668 /nfs/dbraw/zinc/01/76/68/939017668.db2.gz UUNDXEAPDPIJQK-ZDUSSCGKSA-N 1 1 365.499 3.557 20 5 FHBDMO C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000507441080 945224352 /nfs/dbraw/zinc/22/43/52/945224352.db2.gz LRLULYQRZMKKKF-OKILXGFUSA-N 1 1 373.453 3.827 20 5 FHBDMO COC[C@H](C)[N@H+](C)Cc1cc(OC)c(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000179373390 939127795 /nfs/dbraw/zinc/12/77/95/939127795.db2.gz LDNDWZXJJSEEHS-HNNXBMFYSA-N 1 1 374.437 3.649 20 5 FHBDMO COC[C@H](C)[N@@H+](C)Cc1cc(OC)c(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000179373390 939127799 /nfs/dbraw/zinc/12/77/99/939127799.db2.gz LDNDWZXJJSEEHS-HNNXBMFYSA-N 1 1 374.437 3.649 20 5 FHBDMO Cc1ccc(C[N@@H+](Cc2cccs2)[C@@H]2C=C[C@H](CO)C2)cc1[N+](=O)[O-] ZINC000518258587 945261893 /nfs/dbraw/zinc/26/18/93/945261893.db2.gz OAXKQEJFSKKGEA-DLBZAZTESA-N 1 1 358.463 3.904 20 5 FHBDMO CCc1[nH+]ccn1[C@H]1CCCN(C(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)C1 ZINC000179551844 939884320 /nfs/dbraw/zinc/88/43/20/939884320.db2.gz FGYRKUVHYYDHLV-INIZCTEOSA-N 1 1 370.453 3.756 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@H]1CC[N@H+](C)[C@H]1c1cccs1 ZINC000364120298 939905806 /nfs/dbraw/zinc/90/58/06/939905806.db2.gz HTHSLHOBJZXBIL-SUMWQHHRSA-N 1 1 374.466 3.779 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@@H]1CCc2ccccc21 ZINC000411155180 940004939 /nfs/dbraw/zinc/00/49/39/940004939.db2.gz NXRGDSLTWTWMGR-GOSISDBHSA-N 1 1 369.421 3.551 20 5 FHBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1N(C)C(=O)c1csc([N+](=O)[O-])c1 ZINC000364822560 940006486 /nfs/dbraw/zinc/00/64/86/940006486.db2.gz XZNZMGJWPLOYET-WMLDXEAASA-N 1 1 373.478 3.639 20 5 FHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000411298415 940024746 /nfs/dbraw/zinc/02/47/46/940024746.db2.gz NSHOFJIPVBXRGS-HOTGVXAUSA-N 1 1 351.472 3.529 20 5 FHBDMO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411615333 940073605 /nfs/dbraw/zinc/07/36/05/940073605.db2.gz HCWAFWAIOBIFFY-CYBMUJFWSA-N 1 1 359.348 3.586 20 5 FHBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCSC3(CCC3)CC2)cccc1[N+](=O)[O-] ZINC000411873249 940145554 /nfs/dbraw/zinc/14/55/54/940145554.db2.gz XRXSRIVOEUDMNG-AWEZNQCLSA-N 1 1 363.483 3.592 20 5 FHBDMO NC(=O)c1ccc(C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)cc1 ZINC000179983661 940196794 /nfs/dbraw/zinc/19/67/94/940196794.db2.gz FEJOICSPVKXEOU-HXUWFJFHSA-N 1 1 361.401 3.573 20 5 FHBDMO CC(C)(C)[N@H+](CC(=O)Nc1ccc(F)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000506789658 945317899 /nfs/dbraw/zinc/31/78/99/945317899.db2.gz IYWQLPBGLHFUBE-UHFFFAOYSA-N 1 1 359.401 3.973 20 5 FHBDMO CC(C)(C)[N@@H+](CC(=O)Nc1ccc(F)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000506789658 945317908 /nfs/dbraw/zinc/31/79/08/945317908.db2.gz IYWQLPBGLHFUBE-UHFFFAOYSA-N 1 1 359.401 3.973 20 5 FHBDMO CC[C@H]1CN(c2ccccc2)CC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000613130303 940462653 /nfs/dbraw/zinc/46/26/53/940462653.db2.gz VUXDILSBCCRPNZ-HNNXBMFYSA-N 1 1 366.421 3.837 20 5 FHBDMO CC[C@H]1CN(c2ccccc2)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000613130303 940462655 /nfs/dbraw/zinc/46/26/55/940462655.db2.gz VUXDILSBCCRPNZ-HNNXBMFYSA-N 1 1 366.421 3.837 20 5 FHBDMO O=[N+]([O-])c1cc2c(cc1C[NH2+]Cc1ccc(C(F)F)cc1)OCCO2 ZINC000613175714 940476039 /nfs/dbraw/zinc/47/60/39/940476039.db2.gz VJRLPNVDNVORGE-UHFFFAOYSA-N 1 1 350.321 3.593 20 5 FHBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000507599571 945361013 /nfs/dbraw/zinc/36/10/13/945361013.db2.gz KEQHJNHRKBQJSG-XJKSGUPXSA-N 1 1 373.840 3.814 20 5 FHBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1nnc(C2CC2)s1 ZINC000414327908 940977522 /nfs/dbraw/zinc/97/75/22/940977522.db2.gz PEZNJQZPGJVWSC-GFCCVEGCSA-N 1 1 364.496 3.984 20 5 FHBDMO CCN(C(=O)c1ccc([N+](=O)[O-])c(C)c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000186328599 940977744 /nfs/dbraw/zinc/97/77/44/940977744.db2.gz YQOAZGJTQMBPQG-LJQANCHMSA-N 1 1 367.449 3.640 20 5 FHBDMO CCCCNC(=O)[C@@H]1CC[C@@H](C)[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000511507695 941033870 /nfs/dbraw/zinc/03/38/70/941033870.db2.gz QXOIJGQPDCJCQZ-XPAKDJPHSA-N 1 1 359.470 3.625 20 5 FHBDMO C[C@@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2F)CC[N@H+]1Cc1ccccc1 ZINC000176583735 941060294 /nfs/dbraw/zinc/06/02/94/941060294.db2.gz HMNCLZXOQFCYQK-GDBMZVCRSA-N 1 1 371.412 3.517 20 5 FHBDMO C[C@@H]1C[C@@H](N[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C[N@@H+]1C1CC1 ZINC000180737397 941070535 /nfs/dbraw/zinc/07/05/35/941070535.db2.gz ZVWARDDKWNBNFM-FPDPHYFHSA-N 1 1 351.450 3.899 20 5 FHBDMO C[C@@H]1C[C@@H](N[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C[N@H+]1C1CC1 ZINC000180737397 941070536 /nfs/dbraw/zinc/07/05/36/941070536.db2.gz ZVWARDDKWNBNFM-FPDPHYFHSA-N 1 1 351.450 3.899 20 5 FHBDMO C[C@@H]1C[C@H](NC(=O)c2cc(F)ccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000176721155 941073726 /nfs/dbraw/zinc/07/37/26/941073726.db2.gz ZTPMHTJAFDLQCT-RHSMWYFYSA-N 1 1 371.412 3.517 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+](Cc3ccccn3)C3CC3)o2)c1 ZINC000180857418 941085900 /nfs/dbraw/zinc/08/59/00/941085900.db2.gz MSLVPRLWOLUSBE-UHFFFAOYSA-N 1 1 364.405 3.852 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@@H](c2nncn2C2CC2)C1 ZINC000180860809 941086104 /nfs/dbraw/zinc/08/61/04/941086104.db2.gz YUMBVHGDHMABRT-CYBMUJFWSA-N 1 1 361.833 3.554 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@@H](c2nncn2C2CC2)C1 ZINC000180860809 941086106 /nfs/dbraw/zinc/08/61/06/941086106.db2.gz YUMBVHGDHMABRT-CYBMUJFWSA-N 1 1 361.833 3.554 20 5 FHBDMO COCCn1cc2c(n1)[C@@H]([NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1)CCC2 ZINC000376504801 941092534 /nfs/dbraw/zinc/09/25/34/941092534.db2.gz IPALDUSZPQHINB-SFHVURJKSA-N 1 1 372.469 3.728 20 5 FHBDMO C[C@H](NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000181455647 941288291 /nfs/dbraw/zinc/28/82/91/941288291.db2.gz IYPMSRBLOHOCFS-QWHCGFSZSA-N 1 1 365.861 3.631 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCCO[C@@H](CF)C3)s2)cc1 ZINC000414479633 941330358 /nfs/dbraw/zinc/33/03/58/941330358.db2.gz SGJSNIHQMJBGKV-HNNXBMFYSA-N 1 1 350.415 3.884 20 5 FHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@H](N3CCCC3=O)CC2)cc1[N+](=O)[O-] ZINC000414552498 941377884 /nfs/dbraw/zinc/37/78/84/941377884.db2.gz QICGTHPDWDGWRR-KRWDZBQOSA-N 1 1 359.470 3.695 20 5 FHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccc(OC[C@H]2CCCO2)cc1 ZINC000549157846 941550901 /nfs/dbraw/zinc/55/09/01/941550901.db2.gz QKYWUQSNWJEHFF-OAQYLSRUSA-N 1 1 370.449 3.827 20 5 FHBDMO C[N@H+](CCOc1ccc(Cl)cc1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000023990798 941645387 /nfs/dbraw/zinc/64/53/87/941645387.db2.gz BQTYDBLBMOOLEM-UHFFFAOYSA-N 1 1 360.801 3.566 20 5 FHBDMO C[N@@H+](CCOc1ccc(Cl)cc1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000023990798 941645389 /nfs/dbraw/zinc/64/53/89/941645389.db2.gz BQTYDBLBMOOLEM-UHFFFAOYSA-N 1 1 360.801 3.566 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@@H](C)C[C@H]1c1ccccc1 ZINC000513257435 941821291 /nfs/dbraw/zinc/82/12/91/941821291.db2.gz QTHFMJNGIHPREW-KSSFIOAISA-N 1 1 369.421 3.625 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@@H](C)C[C@H]1c1ccccc1 ZINC000513257435 941821292 /nfs/dbraw/zinc/82/12/92/941821292.db2.gz QTHFMJNGIHPREW-KSSFIOAISA-N 1 1 369.421 3.625 20 5 FHBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH+]1CCC(OC[C@@H]2CCCCO2)CC1 ZINC000119300908 941877477 /nfs/dbraw/zinc/87/74/77/941877477.db2.gz MJJJXCQQZSNGHD-HNNXBMFYSA-N 1 1 368.861 3.798 20 5 FHBDMO C[C@H]1C[C@@H](CC[NH2+]Cc2ccccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000513488481 941959765 /nfs/dbraw/zinc/95/97/65/941959765.db2.gz VTZATUYMNGZQGU-PKOBYXMFSA-N 1 1 353.466 3.985 20 5 FHBDMO C[C@@H]1C[C@H](CC[NH2+]Cc2ccccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000513488480 941959983 /nfs/dbraw/zinc/95/99/83/941959983.db2.gz VTZATUYMNGZQGU-MJGOQNOKSA-N 1 1 353.466 3.985 20 5 FHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1 ZINC000101921559 942025290 /nfs/dbraw/zinc/02/52/90/942025290.db2.gz KJYFOGPOLWOWSO-GUYCJALGSA-N 1 1 372.400 3.691 20 5 FHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1 ZINC000101921559 942025294 /nfs/dbraw/zinc/02/52/94/942025294.db2.gz KJYFOGPOLWOWSO-GUYCJALGSA-N 1 1 372.400 3.691 20 5 FHBDMO Cn1ccnc1[C@@H]([NH2+]C1CC(c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000513673376 942067371 /nfs/dbraw/zinc/06/73/71/942067371.db2.gz QCQPHZFNAKONFE-QLOJAFMTSA-N 1 1 362.433 3.954 20 5 FHBDMO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C1CCN(Cc2ccncc2)CC1 ZINC000377926223 942071997 /nfs/dbraw/zinc/07/19/97/942071997.db2.gz WWEWUGJXGDISKK-GQCTYLIASA-N 1 1 366.465 3.599 20 5 FHBDMO C[C@]1(c2ccc(F)cc2)CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000501868609 942089464 /nfs/dbraw/zinc/08/94/64/942089464.db2.gz CHGJZULRXZGKIY-FQEVSTJZSA-N 1 1 371.412 3.726 20 5 FHBDMO COc1c(O)ccc(C[NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)c1[N+](=O)[O-] ZINC000893133413 942095545 /nfs/dbraw/zinc/09/55/45/942095545.db2.gz DNVDZZDXZYOOGS-OAHLLOKOSA-N 1 1 370.405 3.845 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H]2CCCC[C@@H]21 ZINC000103266281 942239467 /nfs/dbraw/zinc/23/94/67/942239467.db2.gz PIWUYWLBSGDVHY-PBHICJAKSA-N 1 1 361.442 3.587 20 5 FHBDMO CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(n2c[nH+]cc2C)CC1 ZINC000366397745 942271097 /nfs/dbraw/zinc/27/10/97/942271097.db2.gz NTSMGIZKTFRBMM-UHFFFAOYSA-N 1 1 374.466 3.689 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@@H](CC(F)(F)F)C3)o2)cc1 ZINC000420954734 942274434 /nfs/dbraw/zinc/27/44/34/942274434.db2.gz VBWYKCRJCJTYRQ-NSHDSACASA-N 1 1 370.331 3.809 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@@H](CC(F)(F)F)C3)o2)cc1 ZINC000420954734 942274437 /nfs/dbraw/zinc/27/44/37/942274437.db2.gz VBWYKCRJCJTYRQ-NSHDSACASA-N 1 1 370.331 3.809 20 5 FHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CC[C@](O)(Cc2ccc(F)cc2)C1 ZINC000421010450 942290421 /nfs/dbraw/zinc/29/04/21/942290421.db2.gz IDDGCHHCNKBFBS-SFHVURJKSA-N 1 1 364.804 3.567 20 5 FHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CC[C@](O)(Cc2ccc(F)cc2)C1 ZINC000421010450 942290423 /nfs/dbraw/zinc/29/04/23/942290423.db2.gz IDDGCHHCNKBFBS-SFHVURJKSA-N 1 1 364.804 3.567 20 5 FHBDMO Cc1ccc([C@@H](C)NC(=O)N2CCC([N@H+]3CCC[C@H]3C)CC2)cc1[N+](=O)[O-] ZINC000366433648 942335342 /nfs/dbraw/zinc/33/53/42/942335342.db2.gz DDPGGPHHNYSJNM-HZPDHXFCSA-N 1 1 374.485 3.623 20 5 FHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](c3ccncn3)C2)c(C(F)(F)F)c1 ZINC000378222398 942417244 /nfs/dbraw/zinc/41/72/44/942417244.db2.gz WEMYYCAKWMZXNM-CYBMUJFWSA-N 1 1 366.343 3.783 20 5 FHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](c3ccncn3)C2)c(C(F)(F)F)c1 ZINC000378222398 942417248 /nfs/dbraw/zinc/41/72/48/942417248.db2.gz WEMYYCAKWMZXNM-CYBMUJFWSA-N 1 1 366.343 3.783 20 5 FHBDMO COc1ccc(-c2ccc(C[N@@H+](CCO)C3CCCC3)o2)c([N+](=O)[O-])c1 ZINC000505284236 942443601 /nfs/dbraw/zinc/44/36/01/942443601.db2.gz UWEGPVPZAGNNLD-UHFFFAOYSA-N 1 1 360.410 3.600 20 5 FHBDMO C[C@H](c1ccncc1)[NH+]1CCC(NCc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000893202470 942577081 /nfs/dbraw/zinc/57/70/81/942577081.db2.gz ISEJBBKSAUSEEE-CQSZACIVSA-N 1 1 374.872 3.958 20 5 FHBDMO C[C@@H](c1ccncc1)[NH+]1CCC(NCc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000893202467 942577124 /nfs/dbraw/zinc/57/71/24/942577124.db2.gz ISEJBBKSAUSEEE-AWEZNQCLSA-N 1 1 374.872 3.958 20 5 FHBDMO C[C@H](O)C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C1CCCCC1 ZINC000104684937 942590026 /nfs/dbraw/zinc/59/00/26/942590026.db2.gz UWCRKYZPOYFOAE-HNNXBMFYSA-N 1 1 373.453 3.808 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000421513723 942619628 /nfs/dbraw/zinc/61/96/28/942619628.db2.gz QINGJXPUDQUMPO-HZPDHXFCSA-N 1 1 359.470 3.594 20 5 FHBDMO Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)cn2cc[nH+]c12 ZINC000502764212 942723876 /nfs/dbraw/zinc/72/38/76/942723876.db2.gz VHHFEFMEJCTSOY-UHFFFAOYSA-N 1 1 364.283 3.822 20 5 FHBDMO Cc1ccc(NC(=O)[C@@H](c2ccccc2)[N@@H+](C)CC2CC2)c([N+](=O)[O-])c1 ZINC000053183746 942743657 /nfs/dbraw/zinc/74/36/57/942743657.db2.gz BRQJFVMGNVIFAN-LJQANCHMSA-N 1 1 353.422 3.925 20 5 FHBDMO Cn1ccnc1[C@H]([NH2+]CCc1c(F)cccc1F)c1cccc([N+](=O)[O-])c1 ZINC000514104369 942748296 /nfs/dbraw/zinc/74/82/96/942748296.db2.gz JKBKONHSAHYSRE-GOSISDBHSA-N 1 1 372.375 3.528 20 5 FHBDMO CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@@H]1CCC[N@H+]1C ZINC000421710393 942763919 /nfs/dbraw/zinc/76/39/19/942763919.db2.gz KITKEZZZVKZVSW-HNNXBMFYSA-N 1 1 365.499 3.509 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H]1Cc1cccc(F)c1 ZINC000434659143 942843698 /nfs/dbraw/zinc/84/36/98/942843698.db2.gz MPNAUUFGQVUWHC-KRWDZBQOSA-N 1 1 371.412 3.688 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H]1Cc1cccc(F)c1 ZINC000434659143 942843705 /nfs/dbraw/zinc/84/37/05/942843705.db2.gz MPNAUUFGQVUWHC-KRWDZBQOSA-N 1 1 371.412 3.688 20 5 FHBDMO O=C(Cc1ccc([N+](=O)[O-])cc1Cl)Nc1cccc2c1C[N@H+](C1CC1)C2 ZINC000378528095 942863298 /nfs/dbraw/zinc/86/32/98/942863298.db2.gz HHRQUXNLGPVQJX-UHFFFAOYSA-N 1 1 371.824 3.907 20 5 FHBDMO CCc1ccc([C@H]2CN(C(=O)c3ccc(Cl)cc3[N+](=O)[O-])CC[NH2+]2)cc1 ZINC000505476901 942878226 /nfs/dbraw/zinc/87/82/26/942878226.db2.gz PHBKCWMLLFRJTO-QGZVFWFLSA-N 1 1 373.840 3.597 20 5 FHBDMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(C)c2[nH+]ccn2c1 ZINC000502987764 942885690 /nfs/dbraw/zinc/88/56/90/942885690.db2.gz VBVHHPVNEFRJKD-OAHLLOKOSA-N 1 1 352.394 3.758 20 5 FHBDMO CC(C)[C@H]1CCC[N@H+]1CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000434831957 942990476 /nfs/dbraw/zinc/99/04/76/942990476.db2.gz PTHBFYCTMQFBBH-MRXNPFEDSA-N 1 1 374.466 3.777 20 5 FHBDMO COCC[N@@H+](C)CC[C@@H](Nc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000505560900 943020677 /nfs/dbraw/zinc/02/06/77/943020677.db2.gz YQGPZRGTZHWNRB-GOSISDBHSA-N 1 1 361.417 3.855 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](c2ccccc2)[C@H]1C ZINC000434891420 943022161 /nfs/dbraw/zinc/02/21/61/943022161.db2.gz HRZYOCSGFYNSJP-QAPCUYQASA-N 1 1 353.422 3.720 20 5 FHBDMO C[C@@H]1[C@H](c2ccccc2)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000434899526 943037474 /nfs/dbraw/zinc/03/74/74/943037474.db2.gz IJWZAHIHZXAQMA-DNVCBOLYSA-N 1 1 353.422 3.801 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H](c2ccccc2)[C@@H]1C ZINC000434906335 943042935 /nfs/dbraw/zinc/04/29/35/943042935.db2.gz UABCDNBGRRDXQY-MAUKXSAKSA-N 1 1 353.422 3.720 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000416728347 943059831 /nfs/dbraw/zinc/05/98/31/943059831.db2.gz LPSUNSJLGPWQFG-MRXNPFEDSA-N 1 1 368.437 3.641 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000416728347 943059839 /nfs/dbraw/zinc/05/98/39/943059839.db2.gz LPSUNSJLGPWQFG-MRXNPFEDSA-N 1 1 368.437 3.641 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1OC(=O)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000760016910 943185147 /nfs/dbraw/zinc/18/51/47/943185147.db2.gz KDIVMSZGJWCPCJ-QGZVFWFLSA-N 1 1 354.406 3.721 20 5 FHBDMO C[N@H+]1CCCN(Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CC1 ZINC000435231645 943268681 /nfs/dbraw/zinc/26/86/81/943268681.db2.gz YALFYNRWOYIEME-UHFFFAOYSA-N 1 1 359.401 3.664 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H](c3ccccc3F)C2)c2c(c1)COCO2 ZINC000503656154 943313594 /nfs/dbraw/zinc/31/35/94/943313594.db2.gz ZALBTOPFYPIEQP-ZDUSSCGKSA-N 1 1 358.369 3.590 20 5 FHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H]([C@@H](O)C(F)(F)F)C1 ZINC000514910371 943381502 /nfs/dbraw/zinc/38/15/02/943381502.db2.gz SHMSUYZMGSEKLC-IIUKIDADSA-N 1 1 358.360 3.633 20 5 FHBDMO CCc1ccc([C@@H](NCC2(C)CC[NH2+]CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423315742 943473245 /nfs/dbraw/zinc/47/32/45/943473245.db2.gz ADWNSZFYEUOHSR-IBGZPJMESA-N 1 1 357.454 3.819 20 5 FHBDMO C[C@H](NC[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000423478688 943527097 /nfs/dbraw/zinc/52/70/97/943527097.db2.gz UJNJSPFYJIFZNE-GZRFBZBPSA-N 1 1 357.429 3.778 20 5 FHBDMO CCC[N@@H+](CC)Cc1ccc(C(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000511625293 943579600 /nfs/dbraw/zinc/57/96/00/943579600.db2.gz LVVBUHYRLOINLN-UHFFFAOYSA-N 1 1 369.465 3.799 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000516844643 943764570 /nfs/dbraw/zinc/76/45/70/943764570.db2.gz RZIJKMXBUJMKAF-CQSZACIVSA-N 1 1 359.426 3.725 20 5 FHBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@@H+]1CCCC2(CCOCC2)C1 ZINC000515348766 943813287 /nfs/dbraw/zinc/81/32/87/943813287.db2.gz KIYGBFABKGAQKZ-UHFFFAOYSA-N 1 1 369.259 3.750 20 5 FHBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1CCCC2(CCOCC2)C1 ZINC000515348766 943813296 /nfs/dbraw/zinc/81/32/96/943813296.db2.gz KIYGBFABKGAQKZ-UHFFFAOYSA-N 1 1 369.259 3.750 20 5 FHBDMO CCC(O)(CC)C(C)(C)C[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000566502004 943838806 /nfs/dbraw/zinc/83/88/06/943838806.db2.gz WHIAMSPULNDFDN-QGZVFWFLSA-N 1 1 374.485 3.585 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1cc(OC)c(OC)cc1C ZINC000506056097 943839764 /nfs/dbraw/zinc/83/97/64/943839764.db2.gz QGBHRYCIIMUEOH-UHFFFAOYSA-N 1 1 374.437 3.951 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1cc(OC)c(OC)cc1C ZINC000506056097 943839767 /nfs/dbraw/zinc/83/97/67/943839767.db2.gz QGBHRYCIIMUEOH-UHFFFAOYSA-N 1 1 374.437 3.951 20 5 FHBDMO CCOc1ccc([C@@H](C)N[C@@H](Cc2ccccc2)C[NH+](C)C)cc1[N+](=O)[O-] ZINC000504899062 943877431 /nfs/dbraw/zinc/87/74/31/943877431.db2.gz AEKGFAIVYCDIEL-APWZRJJASA-N 1 1 371.481 3.817 20 5 FHBDMO COc1ccc(OC)c([C@@H]2CCC[N@H+]2CCOc2ccccc2[N+](=O)[O-])c1 ZINC000515539976 943973969 /nfs/dbraw/zinc/97/39/69/943973969.db2.gz IGVLXZYMJAKZTH-KRWDZBQOSA-N 1 1 372.421 3.828 20 5 FHBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CCC[N@H+](C(C)(C)C)CC1 ZINC000584508952 943986297 /nfs/dbraw/zinc/98/62/97/943986297.db2.gz OSPORGWWDSKBJD-UHFFFAOYSA-N 1 1 353.850 3.503 20 5 FHBDMO Cc1noc(C)c1C(C)(C)[NH2+]Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425460613 944006023 /nfs/dbraw/zinc/00/60/23/944006023.db2.gz SFRGSOYCBRBVMW-UHFFFAOYSA-N 1 1 368.231 3.987 20 5 FHBDMO CO[C@@]1(C)CCC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000425466503 944023036 /nfs/dbraw/zinc/02/30/36/944023036.db2.gz AYDULJHGQBICJO-HNNXBMFYSA-N 1 1 357.248 3.748 20 5 FHBDMO CO[C@@]1(C)CCC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000425466503 944023043 /nfs/dbraw/zinc/02/30/43/944023043.db2.gz AYDULJHGQBICJO-HNNXBMFYSA-N 1 1 357.248 3.748 20 5 FHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+][C@H]2COCc3ccccc32)c1 ZINC000418093420 944147295 /nfs/dbraw/zinc/14/72/95/944147295.db2.gz BWENMRYMGKDCOJ-HNNXBMFYSA-N 1 1 350.321 3.557 20 5 FHBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CCC[C@H](C)C1 ZINC000505786568 944171867 /nfs/dbraw/zinc/17/18/67/944171867.db2.gz CBDJXEPUHMOBMF-AWEZNQCLSA-N 1 1 365.499 3.559 20 5 FHBDMO CC[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])[C@H](C)Cc1ccsc1 ZINC000425921037 944175507 /nfs/dbraw/zinc/17/55/07/944175507.db2.gz QNTFRHYIQSVPTE-CQSZACIVSA-N 1 1 361.467 3.856 20 5 FHBDMO CC(C)(C(=O)NC[C@H]1CCC[N@H+]1C1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000437878848 944194257 /nfs/dbraw/zinc/19/42/57/944194257.db2.gz VMFPYDCAGGHODU-LJQANCHMSA-N 1 1 373.497 3.786 20 5 FHBDMO O=[N+]([O-])c1cnc(C(F)(F)F)cc1NCC[N@@H+]1CCc2sccc2C1 ZINC000436317492 944196115 /nfs/dbraw/zinc/19/61/15/944196115.db2.gz MNSBQFPEKRKTAE-UHFFFAOYSA-N 1 1 372.372 3.540 20 5 FHBDMO O=[N+]([O-])c1cnc(C(F)(F)F)cc1NCC[N@H+]1CCc2sccc2C1 ZINC000436317492 944196119 /nfs/dbraw/zinc/19/61/19/944196119.db2.gz MNSBQFPEKRKTAE-UHFFFAOYSA-N 1 1 372.372 3.540 20 5 FHBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2c3c(ccc2[N+](=O)[O-])NCC3)C1 ZINC000436317063 944196445 /nfs/dbraw/zinc/19/64/45/944196445.db2.gz KFUOOFLZZGCGHT-GOEBONIOSA-N 1 1 352.438 3.810 20 5 FHBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1cccc(Br)c1 ZINC000515777043 944201374 /nfs/dbraw/zinc/20/13/74/944201374.db2.gz XPJPYRKPQPMDOC-UHFFFAOYSA-N 1 1 365.227 3.868 20 5 FHBDMO C[C@H](CNC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)[N@H+]1CCCC[C@@H]1C ZINC000437933604 944237095 /nfs/dbraw/zinc/23/70/95/944237095.db2.gz PPHIJZNIOYNVMB-JKSUJKDBSA-N 1 1 374.485 3.532 20 5 FHBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000437951874 944250311 /nfs/dbraw/zinc/25/03/11/944250311.db2.gz HYVCSHORCWJIPW-IYBDPMFKSA-N 1 1 374.485 3.532 20 5 FHBDMO O=[N+]([O-])c1cnc(C(F)(F)F)cc1N[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000436390327 944260323 /nfs/dbraw/zinc/26/03/23/944260323.db2.gz ODMISAKFGBZYRL-LBPRGKRZSA-N 1 1 358.364 3.685 20 5 FHBDMO COc1cc(C[NH+]2CCC(OCCC(C)C)CC2)c([N+](=O)[O-])cc1F ZINC000184246385 944335635 /nfs/dbraw/zinc/33/56/35/944335635.db2.gz RYSLZBMKPPWPOK-UHFFFAOYSA-N 1 1 354.422 3.770 20 5 FHBDMO C[C@H]1CCCC[N@H+]1CCCNc1cnc(Oc2ccc([N+](=O)[O-])cc2)nc1 ZINC001167754103 944375867 /nfs/dbraw/zinc/37/58/67/944375867.db2.gz VAWXPRZGSPOJMS-HNNXBMFYSA-N 1 1 371.441 3.854 20 5 FHBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@@H+](CC)C(C)C ZINC000506187932 944410858 /nfs/dbraw/zinc/41/08/58/944410858.db2.gz IGOXAMFDZVHLCV-UHFFFAOYSA-N 1 1 353.488 3.557 20 5 FHBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@H]2/C=C/c2ccccc2)c1 ZINC000505844004 944411943 /nfs/dbraw/zinc/41/19/43/944411943.db2.gz CRPOKQMRXVUZMK-WIMDODNTSA-N 1 1 368.433 3.512 20 5 FHBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C[C@@H](C)C1 ZINC000516190644 944579362 /nfs/dbraw/zinc/57/93/62/944579362.db2.gz BZIKNDVROHFMCM-IGCXYCKISA-N 1 1 371.403 3.776 20 5 FHBDMO C[C@@H]1[C@H](CO)CC[N@H+]1Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000425998161 944586290 /nfs/dbraw/zinc/58/62/90/944586290.db2.gz GHKNJJONXJKSRJ-HIFRSBDPSA-N 1 1 360.385 3.729 20 5 FHBDMO CC(C)[N@@H+](CCC(=O)NCC1CCCCC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000518754671 944697702 /nfs/dbraw/zinc/69/77/02/944697702.db2.gz WUEZZEXHEUARBX-UHFFFAOYSA-N 1 1 361.486 3.892 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC000517836304 944717052 /nfs/dbraw/zinc/71/70/52/944717052.db2.gz IOJYVZZRXPNNPA-UHFFFAOYSA-N 1 1 367.449 3.640 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC000517836304 944717058 /nfs/dbraw/zinc/71/70/58/944717058.db2.gz IOJYVZZRXPNNPA-UHFFFAOYSA-N 1 1 367.449 3.640 20 5 FHBDMO O=C(Nc1ccccc1)[C@H]1CCC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000506296373 944836884 /nfs/dbraw/zinc/83/68/84/944836884.db2.gz YPUVOJVLWLMADB-KKMIYCERSA-N 1 1 365.433 3.959 20 5 FHBDMO COc1cccc([C@@H](C)[NH+]2CCN(Cc3c(F)cccc3[N+](=O)[O-])CC2)c1 ZINC000507683819 945449719 /nfs/dbraw/zinc/44/97/19/945449719.db2.gz NDPBZKLEQIRJDS-OAHLLOKOSA-N 1 1 373.428 3.621 20 5 FHBDMO CC(=O)NCC[N@@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)Cc1ccsc1 ZINC000519655379 945604927 /nfs/dbraw/zinc/60/49/27/945604927.db2.gz VHFJQXJFZBEPHS-XNTDXEJSSA-N 1 1 373.478 3.698 20 5 FHBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)c2ccc([N+](=O)[O-])s2)cc1 ZINC000107554083 945705466 /nfs/dbraw/zinc/70/54/66/945705466.db2.gz LQBOGWAOWYYLMU-AWEZNQCLSA-N 1 1 373.478 3.961 20 5 FHBDMO CSCC[C@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)c1nnc2ccccn21 ZINC000164294627 945708758 /nfs/dbraw/zinc/70/87/58/945708758.db2.gz YDYWOJNFQQMSRB-CJNGLKHVSA-N 1 1 371.466 3.783 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000067361096 945723372 /nfs/dbraw/zinc/72/33/72/945723372.db2.gz CWXVPTMVDQPPDL-SFHVURJKSA-N 1 1 367.449 3.545 20 5 FHBDMO Cc1ccc(C(=O)NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000067361770 945746983 /nfs/dbraw/zinc/74/69/83/945746983.db2.gz YCSKNILSHZFMAB-GOSISDBHSA-N 1 1 367.449 3.545 20 5 FHBDMO C[C@@H]([NH2+]Cc1ccncc1OCC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000281817923 945876246 /nfs/dbraw/zinc/87/62/46/945876246.db2.gz ZLYMRQJHIMOEMV-LLVKDONJSA-N 1 1 355.316 3.782 20 5 FHBDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)c1ccc(SC)c([N+](=O)[O-])c1 ZINC000522887459 946060847 /nfs/dbraw/zinc/06/08/47/946060847.db2.gz KTDXJOCHLFQINX-HNNXBMFYSA-N 1 1 365.499 3.701 20 5 FHBDMO C[N@@H+](Cc1ccccc1)C1(CNC(=O)c2c(F)cccc2[N+](=O)[O-])CCC1 ZINC000714056442 946076951 /nfs/dbraw/zinc/07/69/51/946076951.db2.gz MPBJAVZHEGAFBC-UHFFFAOYSA-N 1 1 371.412 3.518 20 5 FHBDMO CC(C)c1ccc(C(=O)N[C@H]2C[N@@H+](C)C[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000439742335 946124696 /nfs/dbraw/zinc/12/46/96/946124696.db2.gz UBXNBYOCJRHXHP-MOPGFXCFSA-N 1 1 367.449 3.546 20 5 FHBDMO CCOC(=O)[C@@H]1C[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)Cc2ccccc21 ZINC000441128054 946241818 /nfs/dbraw/zinc/24/18/18/946241818.db2.gz RWVWXJKMYVVVAA-AUUYWEPGSA-N 1 1 354.406 3.818 20 5 FHBDMO CCOC(=O)[C@@H]1C[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)Cc2ccccc21 ZINC000441128054 946241829 /nfs/dbraw/zinc/24/18/29/946241829.db2.gz RWVWXJKMYVVVAA-AUUYWEPGSA-N 1 1 354.406 3.818 20 5 FHBDMO CCC[C@@H](C)NC(=O)[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000783555348 946252612 /nfs/dbraw/zinc/25/26/12/946252612.db2.gz PGELJIMXVZXIPT-UKRRQHHQSA-N 1 1 367.877 3.765 20 5 FHBDMO CCC[C@@H](C)NC(=O)[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000783555348 946252624 /nfs/dbraw/zinc/25/26/24/946252624.db2.gz PGELJIMXVZXIPT-UKRRQHHQSA-N 1 1 367.877 3.765 20 5 FHBDMO C[C@@H]1CCC[N@@H+](CCCCNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000045959998 946265023 /nfs/dbraw/zinc/26/50/23/946265023.db2.gz QZGYHCQIBRJPLD-CYBMUJFWSA-N 1 1 368.865 3.882 20 5 FHBDMO O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000186022120 946330976 /nfs/dbraw/zinc/33/09/76/946330976.db2.gz CIWSTRBBMNQOFY-AWEZNQCLSA-N 1 1 365.861 3.519 20 5 FHBDMO COc1ccc(OCC[N@@H+](CCc2cccc(F)c2)C2CC2)c([N+](=O)[O-])c1 ZINC000441397872 946554441 /nfs/dbraw/zinc/55/44/41/946554441.db2.gz ATTRDDLWEISHIP-UHFFFAOYSA-N 1 1 374.412 3.828 20 5 FHBDMO CCS[C@@H]1CCCC[N@@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000441396868 946554597 /nfs/dbraw/zinc/55/45/97/946554597.db2.gz DLBGYARSFPGGHQ-OAHLLOKOSA-N 1 1 354.472 3.590 20 5 FHBDMO C[C@@H]1C[NH+](Cc2ccccc2NCc2ccccc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000475174156 946565069 /nfs/dbraw/zinc/56/50/69/946565069.db2.gz MYDXGTMIFFTKEK-HZPDHXFCSA-N 1 1 355.438 3.816 20 5 FHBDMO CCS[C@@H]1CCCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000112089799 946667042 /nfs/dbraw/zinc/66/70/42/946667042.db2.gz RSPQRVOSWBHOAJ-CQSZACIVSA-N 1 1 351.472 3.531 20 5 FHBDMO CC(=O)c1cc(N2CC[N@@H+](Cc3ccccc3)C[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000323980183 946749655 /nfs/dbraw/zinc/74/96/55/946749655.db2.gz DZPJGXLPJUNCAO-MRXNPFEDSA-N 1 1 367.449 3.756 20 5 FHBDMO C[C@H]1OCC[C@@]12C[N@@H+](Cc1ccc(-c3ccccc3[N+](=O)[O-])s1)CCO2 ZINC000475290044 946829408 /nfs/dbraw/zinc/82/94/08/946829408.db2.gz DZDOLGIFHGLJRA-AUUYWEPGSA-N 1 1 374.462 3.703 20 5 FHBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H](C)Cc1ccc(OC)cc1 ZINC000444613297 947040080 /nfs/dbraw/zinc/04/00/80/947040080.db2.gz WDTOXCYNDNVCSJ-AWEZNQCLSA-N 1 1 368.437 3.933 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(C[N@@H+]2C[C@H](O)C3(CC3)C2)cc1 ZINC000428370904 947044648 /nfs/dbraw/zinc/04/46/48/947044648.db2.gz CEYZROSQPLWZML-SFHVURJKSA-N 1 1 374.824 3.997 20 5 FHBDMO C[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1cccc(OC(F)F)c1 ZINC000444683159 947109150 /nfs/dbraw/zinc/10/91/50/947109150.db2.gz DLRIXZQUTYMYQA-SNVBAGLBSA-N 1 1 362.336 3.923 20 5 FHBDMO Cc1cc(C)cc(C[N@H+](C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000444696647 947121543 /nfs/dbraw/zinc/12/15/43/947121543.db2.gz WEFBKVNULVPZLY-INIZCTEOSA-N 1 1 355.438 3.979 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)Cc1cc(F)cc(F)c1 ZINC000444698957 947122870 /nfs/dbraw/zinc/12/28/70/947122870.db2.gz DKUJDXAYLOWPGC-UHFFFAOYSA-N 1 1 363.364 3.642 20 5 FHBDMO Cc1c(C(=O)N(C)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000074448268 947171160 /nfs/dbraw/zinc/17/11/60/947171160.db2.gz WYCFXMPJSDSISO-SFHVURJKSA-N 1 1 367.449 3.640 20 5 FHBDMO C[C@@H](O)C[C@H]1CCCCC[N@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000567965797 947543357 /nfs/dbraw/zinc/54/33/57/947543357.db2.gz CBLIXRRLSGWJGE-DNVCBOLYSA-N 1 1 372.469 3.511 20 5 FHBDMO CC(C)c1ccccc1OC[C@H](O)C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088616535 947631761 /nfs/dbraw/zinc/63/17/61/947631761.db2.gz AOQCYHVZYVYCRG-LJQANCHMSA-N 1 1 370.449 3.516 20 5 FHBDMO CC(C)c1ccccc1OC[C@H](O)C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088616535 947631771 /nfs/dbraw/zinc/63/17/71/947631771.db2.gz AOQCYHVZYVYCRG-LJQANCHMSA-N 1 1 370.449 3.516 20 5 FHBDMO CC(C)(C)c1ncc(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cn1 ZINC000585765767 948276660 /nfs/dbraw/zinc/27/66/60/948276660.db2.gz WEYJJRPZHQTGFX-UHFFFAOYSA-N 1 1 370.453 3.726 20 5 FHBDMO CCC(C)(C)[C@@H]1CCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000441637246 948432485 /nfs/dbraw/zinc/43/24/85/948432485.db2.gz UOPSMMOMWCTYAS-KRWDZBQOSA-N 1 1 363.458 3.833 20 5 FHBDMO CC[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)Cc1c[nH]c2ccccc12 ZINC000190463924 948486511 /nfs/dbraw/zinc/48/65/11/948486511.db2.gz DYLFWYCQOKFUAT-UHFFFAOYSA-N 1 1 366.421 3.561 20 5 FHBDMO COc1cccc(C[N@H+](C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)c1 ZINC000728896775 948601074 /nfs/dbraw/zinc/60/10/74/948601074.db2.gz UKOPZJKPGAWAML-UHFFFAOYSA-N 1 1 352.394 3.556 20 5 FHBDMO COc1cccc(C[N@@H+](C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)c1 ZINC000728896775 948601083 /nfs/dbraw/zinc/60/10/83/948601083.db2.gz UKOPZJKPGAWAML-UHFFFAOYSA-N 1 1 352.394 3.556 20 5 FHBDMO CC(C)[C@H](C)NC(=O)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000182103021 948663018 /nfs/dbraw/zinc/66/30/18/948663018.db2.gz XRRARYUHZWRYRG-ZDUSSCGKSA-N 1 1 367.877 3.621 20 5 FHBDMO COc1ccc(CN2CCC[C@H](C[N@H+]3CCCC[C@H]3C)C2)cc1[N+](=O)[O-] ZINC000512182457 948706614 /nfs/dbraw/zinc/70/66/14/948706614.db2.gz SHAGMLVOVHCWFU-AEFFLSMTSA-N 1 1 361.486 3.690 20 5 FHBDMO NC(=O)c1ccc(C[N@@H+]2CCC[C@H]2c2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC000053157938 205190941 /nfs/dbraw/zinc/19/09/41/205190941.db2.gz FZXICKDDCQBNNA-INIZCTEOSA-N 1 1 359.813 3.684 20 5 FHBDMO NC(=O)c1ccc(C[N@H+]2CCC[C@H]2c2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC000053157938 205190946 /nfs/dbraw/zinc/19/09/46/205190946.db2.gz FZXICKDDCQBNNA-INIZCTEOSA-N 1 1 359.813 3.684 20 5 FHBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000569174915 568303941 /nfs/dbraw/zinc/30/39/41/568303941.db2.gz XAEZNVWZFNCHBI-UHFFFAOYSA-N 1 1 362.474 3.741 20 5 FHBDMO C[C@@]1(NC(=O)Nc2ccc([N+](=O)[O-])cc2F)CC[N@@H+](Cc2ccccc2)C1 ZINC000584723877 568554783 /nfs/dbraw/zinc/55/47/83/568554783.db2.gz PHANVOUKRMEFRC-LJQANCHMSA-N 1 1 372.400 3.520 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)n1 ZINC001164623610 719082895 /nfs/dbraw/zinc/08/28/95/719082895.db2.gz JXYCFZIVGROJFT-MOPGFXCFSA-N 1 1 366.465 3.707 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1cccc(N2CCCC2=O)c1 ZINC000178729628 936327082 /nfs/dbraw/zinc/32/70/82/936327082.db2.gz BVNKDNGCYBSFGC-CQSZACIVSA-N 1 1 369.421 3.581 20 5 FHBDMO CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1ccc([N+](=O)[O-])s1 ZINC000175271468 927147207 /nfs/dbraw/zinc/14/72/07/927147207.db2.gz RAVFMPKPMCXWRA-MRXNPFEDSA-N 1 1 373.478 3.641 20 5 FHBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2OC)cc1OC ZINC000430215427 928189182 /nfs/dbraw/zinc/18/91/82/928189182.db2.gz GZGXUBCLKGIVAE-CYBMUJFWSA-N 1 1 360.410 3.862 20 5 FHBDMO Cc1ccccc1[C@H]1C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)CCO1 ZINC000610217920 928218443 /nfs/dbraw/zinc/21/84/43/928218443.db2.gz XXDQAGFSLULXGG-HXUWFJFHSA-N 1 1 356.422 3.746 20 5 FHBDMO Cc1ccccc1[C@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CCO1 ZINC000610217920 928218451 /nfs/dbraw/zinc/21/84/51/928218451.db2.gz XXDQAGFSLULXGG-HXUWFJFHSA-N 1 1 356.422 3.746 20 5 FHBDMO CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NCc1c[nH+]c2n1CCCC2 ZINC000375593544 928228497 /nfs/dbraw/zinc/22/84/97/928228497.db2.gz WYKVLZNKOZZYDZ-UHFFFAOYSA-N 1 1 374.466 3.558 20 5 FHBDMO COc1cc(OC)c(OC)cc1C[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000126979902 928361173 /nfs/dbraw/zinc/36/11/73/928361173.db2.gz UXXUSLKEPSQMRS-UHFFFAOYSA-N 1 1 372.421 3.785 20 5 FHBDMO COc1cc(OC)c(OC)cc1C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000126979902 928361188 /nfs/dbraw/zinc/36/11/88/928361188.db2.gz UXXUSLKEPSQMRS-UHFFFAOYSA-N 1 1 372.421 3.785 20 5 FHBDMO CCOCCC[N@H+]1CC[C@H](N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000248170124 937281576 /nfs/dbraw/zinc/28/15/76/937281576.db2.gz UPEHRAHVRLIMRY-LMMKCTJWSA-N 1 1 363.502 3.691 20 5 FHBDMO CCOCCCN1CC[C@H]([NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000248170124 937281583 /nfs/dbraw/zinc/28/15/83/937281583.db2.gz UPEHRAHVRLIMRY-LMMKCTJWSA-N 1 1 363.502 3.691 20 5 FHBDMO CCN(CC)C[C@H](C)[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000609222442 929086794 /nfs/dbraw/zinc/08/67/94/929086794.db2.gz JVQXWIRANNPWRH-AWEZNQCLSA-N 1 1 361.442 3.683 20 5 FHBDMO CNC(=O)CC[C@H]1CCCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000580006280 929803712 /nfs/dbraw/zinc/80/37/12/929803712.db2.gz SXXITKWJORSMFS-MRXNPFEDSA-N 1 1 371.437 3.736 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H]([N@@H+](C)Cc2ccccc2)C1 ZINC000610317194 929868117 /nfs/dbraw/zinc/86/81/17/929868117.db2.gz PGINJEGQDIAFPV-SFHVURJKSA-N 1 1 368.437 3.641 20 5 FHBDMO Cc1ccc(NC(=O)N2CC[C@H]([N@@H+](C)Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000610316914 929874149 /nfs/dbraw/zinc/87/41/49/929874149.db2.gz JNDJQBLCEDVODE-SFHVURJKSA-N 1 1 368.437 3.641 20 5 FHBDMO C[C@@H]1C[C@@H](N(C)C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CC[N@H+]1C ZINC000275754788 930155891 /nfs/dbraw/zinc/15/58/91/930155891.db2.gz JQQYDDBAJCRGHN-ZBFHGGJFSA-N 1 1 363.461 3.648 20 5 FHBDMO COc1ccc(OCC[N@H+]2CCS[C@@H](c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000610369721 930173177 /nfs/dbraw/zinc/17/31/77/930173177.db2.gz FOHLBZVCQVLOMA-LJQANCHMSA-N 1 1 374.462 3.772 20 5 FHBDMO COc1cccc([C@H](C)[NH+]2CCN(Cc3ccc(F)cc3[N+](=O)[O-])CC2)c1 ZINC001167360843 930313974 /nfs/dbraw/zinc/31/39/74/930313974.db2.gz SIKSDTZTCGKZBK-HNNXBMFYSA-N 1 1 373.428 3.621 20 5 FHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cncn1Cc1ccccc1 ZINC000580218976 930373203 /nfs/dbraw/zinc/37/32/03/930373203.db2.gz FADHRZUVVLNHFC-UHFFFAOYSA-N 1 1 350.422 3.514 20 5 FHBDMO CCn1c(C)nc([N+](=O)[O-])c1NC[C@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC000583402569 937411097 /nfs/dbraw/zinc/41/10/97/937411097.db2.gz KWAFPMFCSPQQAB-UKRRQHHQSA-N 1 1 363.487 3.676 20 5 FHBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C1 ZINC000275830901 930504485 /nfs/dbraw/zinc/50/44/85/930504485.db2.gz UHSPUMZYDGNXPH-OAHLLOKOSA-N 1 1 363.461 3.507 20 5 FHBDMO CCn1c(C)nc([N+](=O)[O-])c1N[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379666729 930517773 /nfs/dbraw/zinc/51/77/73/930517773.db2.gz XFMQBKIFRHJLFD-YOEHRIQHSA-N 1 1 357.458 3.585 20 5 FHBDMO C[N@@H+](Cc1ccccc1)CC(C)(C)Nc1ncnc2sc([N+](=O)[O-])cc21 ZINC000379681479 930530184 /nfs/dbraw/zinc/53/01/84/930530184.db2.gz RAVYEFTWNZCHPO-UHFFFAOYSA-N 1 1 371.466 3.922 20 5 FHBDMO CCc1ccc(C(=O)NCc2ccccc2-n2cc[nH+]c2C)cc1[N+](=O)[O-] ZINC000610436463 930575781 /nfs/dbraw/zinc/57/57/81/930575781.db2.gz DBPMSXXKEXDAMQ-UHFFFAOYSA-N 1 1 364.405 3.581 20 5 FHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@](CO)(Cc2ccc(F)cc2)C1 ZINC000580798237 931156339 /nfs/dbraw/zinc/15/63/39/931156339.db2.gz YSKDRWWMIIMHJG-QRWLVFNGSA-N 1 1 358.413 3.722 20 5 FHBDMO Cc1ccc([C@@H](C)NC(=O)[C@@H]2CC[N@H+](C3CCCCC3)C2)cc1[N+](=O)[O-] ZINC000177837314 931266602 /nfs/dbraw/zinc/26/66/02/931266602.db2.gz JTFKNMDEOHLRBD-NVXWUHKLSA-N 1 1 359.470 3.735 20 5 FHBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCC(c2ccccc2F)CC1 ZINC001167443307 931511265 /nfs/dbraw/zinc/51/12/65/931511265.db2.gz RWROKCXXTIPGMH-CQSZACIVSA-N 1 1 371.412 3.941 20 5 FHBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000610475799 931545850 /nfs/dbraw/zinc/54/58/50/931545850.db2.gz MMWCBRGZDNFWCR-MRXNPFEDSA-N 1 1 368.437 3.723 20 5 FHBDMO Cn1ccnc1[C@@H]([NH2+]CCc1ccc(F)c(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000561314290 931668501 /nfs/dbraw/zinc/66/85/01/931668501.db2.gz FJCMEPHZBMPDMK-SFHVURJKSA-N 1 1 372.375 3.528 20 5 FHBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H](c3nccs3)C2)cccc1[N+](=O)[O-] ZINC000157014465 931774185 /nfs/dbraw/zinc/77/41/85/931774185.db2.gz CTSMVEIZGORGIU-CQSZACIVSA-N 1 1 374.466 3.568 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@H](c2ccccc2)[C@@H](C)C1 ZINC000581343103 931861076 /nfs/dbraw/zinc/86/10/76/931861076.db2.gz YWZIZDPBHDKXGM-FUHWJXTLSA-N 1 1 367.449 3.967 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@H](c2ccccc2)[C@@H](C)C1 ZINC000581343103 931861080 /nfs/dbraw/zinc/86/10/80/931861080.db2.gz YWZIZDPBHDKXGM-FUHWJXTLSA-N 1 1 367.449 3.967 20 5 FHBDMO Cc1csc([C@@H]2CCC[N@H+](Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)n1 ZINC000581467716 932104378 /nfs/dbraw/zinc/10/43/78/932104378.db2.gz CQGNWNLIGVZCII-GFCCVEGCSA-N 1 1 357.439 3.616 20 5 FHBDMO Cc1csc([C@@H]2CCC[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)n1 ZINC000581467716 932104381 /nfs/dbraw/zinc/10/43/81/932104381.db2.gz CQGNWNLIGVZCII-GFCCVEGCSA-N 1 1 357.439 3.616 20 5 FHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](CNC(=O)c2ccccc2)C1 ZINC000178043223 932217030 /nfs/dbraw/zinc/21/70/30/932217030.db2.gz VQJBPLNAMOLDAQ-IAGOWNOFSA-N 1 1 367.449 3.798 20 5 FHBDMO COC(=O)[C@H]1CC[N@@H+](Cc2cc(=O)oc3ccc4ccccc4c23)C[C@@H]1C ZINC000276398111 932339317 /nfs/dbraw/zinc/33/93/17/932339317.db2.gz JZKZWJXQYJKLLN-YOEHRIQHSA-N 1 1 365.429 3.577 20 5 FHBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C(C)C ZINC000477379254 932522060 /nfs/dbraw/zinc/52/20/60/932522060.db2.gz ZCYSCHAGQUYZSZ-CABCVRRESA-N 1 1 365.861 3.644 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H]1c1ccc2c(c1)OCO2 ZINC000477440178 932607665 /nfs/dbraw/zinc/60/76/65/932607665.db2.gz RAZVDTBCYMNKCS-INIZCTEOSA-N 1 1 356.378 3.669 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1c1ccc2c(c1)OCO2 ZINC000477440178 932607669 /nfs/dbraw/zinc/60/76/69/932607669.db2.gz RAZVDTBCYMNKCS-INIZCTEOSA-N 1 1 356.378 3.669 20 5 FHBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000581758104 932611419 /nfs/dbraw/zinc/61/14/19/932611419.db2.gz PWIRTNIPEHBQAL-OAHLLOKOSA-N 1 1 365.477 3.532 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H]1c1cccc(C)c1 ZINC000055911163 932735056 /nfs/dbraw/zinc/73/50/56/932735056.db2.gz NRZPMLLJKWMLCQ-GOSISDBHSA-N 1 1 369.421 3.687 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H]1c1cccc(C)c1 ZINC000055911163 932735061 /nfs/dbraw/zinc/73/50/61/932735061.db2.gz NRZPMLLJKWMLCQ-GOSISDBHSA-N 1 1 369.421 3.687 20 5 FHBDMO C[C@@H]1C[C@H](NC(=O)OC(C)(C)C)CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000134664328 932896966 /nfs/dbraw/zinc/89/69/66/932896966.db2.gz GRKIKEOHDTUWGB-TZMCWYRMSA-N 1 1 367.421 3.612 20 5 FHBDMO C[C@@H]1C[C@H](NC(=O)OC(C)(C)C)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000134664328 932896974 /nfs/dbraw/zinc/89/69/74/932896974.db2.gz GRKIKEOHDTUWGB-TZMCWYRMSA-N 1 1 367.421 3.612 20 5 FHBDMO Cn1cc([C@@H]([NH2+]C/C=C/c2ccccc2[N+](=O)[O-])c2ccc(F)cc2)cn1 ZINC000187512111 932966068 /nfs/dbraw/zinc/96/60/68/932966068.db2.gz BSZVXHOASMXZIO-XXIDSNJLSA-N 1 1 366.396 3.860 20 5 FHBDMO Cc1ccc(C[NH2+][C@H](c2cnn(C)c2)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000187513749 932966405 /nfs/dbraw/zinc/96/64/05/932966405.db2.gz FNQMEYOFVFOWEE-IBGZPJMESA-N 1 1 354.385 3.655 20 5 FHBDMO CC(C)c1ccc(C(=O)N2CC[N@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000187620493 933066488 /nfs/dbraw/zinc/06/64/88/933066488.db2.gz BVQGOGADUPKIOX-UHFFFAOYSA-N 1 1 353.422 3.810 20 5 FHBDMO CC(C)c1ccc(C(=O)N2CC[N@@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000187620493 933066493 /nfs/dbraw/zinc/06/64/93/933066493.db2.gz BVQGOGADUPKIOX-UHFFFAOYSA-N 1 1 353.422 3.810 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@@H](c4ncc[nH]4)C3)o2)c1 ZINC000510534513 933194641 /nfs/dbraw/zinc/19/46/41/933194641.db2.gz QPSMSYDDKFCADQ-OAHLLOKOSA-N 1 1 352.394 3.958 20 5 FHBDMO CC(C)c1ccc(C[N@@H+]2C[C@H](C)O[C@@]3(CCO[C@H](C)C3)C2)cc1[N+](=O)[O-] ZINC000430761504 933214425 /nfs/dbraw/zinc/21/44/25/933214425.db2.gz MAVCPGMXDUAKCJ-GQIGUUNPSA-N 1 1 362.470 3.877 20 5 FHBDMO CC(C)c1ccc(C[N@H+]2C[C@H](C)O[C@@]3(CCO[C@H](C)C3)C2)cc1[N+](=O)[O-] ZINC000430761504 933214432 /nfs/dbraw/zinc/21/44/32/933214432.db2.gz MAVCPGMXDUAKCJ-GQIGUUNPSA-N 1 1 362.470 3.877 20 5 FHBDMO COC(=O)c1cccc(Cl)c1C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000510610357 933279745 /nfs/dbraw/zinc/27/97/45/933279745.db2.gz XBYOIGAHSRQEPM-UHFFFAOYSA-N 1 1 362.813 3.709 20 5 FHBDMO COC(=O)c1cccc(Cl)c1C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000510610357 933279754 /nfs/dbraw/zinc/27/97/54/933279754.db2.gz XBYOIGAHSRQEPM-UHFFFAOYSA-N 1 1 362.813 3.709 20 5 FHBDMO O=[N+]([O-])c1ccc(OCC[N@@H+]2C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C2)cc1 ZINC000610604773 933514148 /nfs/dbraw/zinc/51/41/48/933514148.db2.gz LELSYDIMOQEQOW-TXEJJXNPSA-N 1 1 372.265 3.646 20 5 FHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C2)cc1 ZINC000610604773 933514167 /nfs/dbraw/zinc/51/41/67/933514167.db2.gz LELSYDIMOQEQOW-TXEJJXNPSA-N 1 1 372.265 3.646 20 5 FHBDMO Cc1ccc([C@H](C)NC(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)cc1[N+](=O)[O-] ZINC000610644919 933595056 /nfs/dbraw/zinc/59/50/56/933595056.db2.gz PPYMPZKXBGWZMF-JQHSSLGASA-N 1 1 374.485 3.621 20 5 FHBDMO CC1(c2ccccc2)CC[NH+](CC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000510787411 933723514 /nfs/dbraw/zinc/72/35/14/933723514.db2.gz NONFIOPEOPFHLH-UHFFFAOYSA-N 1 1 353.422 3.587 20 5 FHBDMO Cc1cc(N2CCC3(CC[N@@H+](Cc4ccccc4)C3)CC2)ncc1[N+](=O)[O-] ZINC000535686149 934280163 /nfs/dbraw/zinc/28/01/63/934280163.db2.gz QXYJQXIMSICRDB-UHFFFAOYSA-N 1 1 366.465 3.791 20 5 FHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H]2C[C@H](O)c2ccc(F)cc2)c(F)c1 ZINC000134812848 934338065 /nfs/dbraw/zinc/33/80/65/934338065.db2.gz JCYFSBAJHLSNBO-LPHOPBHVSA-N 1 1 362.376 3.961 20 5 FHBDMO Cn1cc(C[N@H+]2CCC[C@@H]2c2ccccn2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000535780768 934368858 /nfs/dbraw/zinc/36/88/58/934368858.db2.gz PJVDAAYEXKAXNX-LJQANCHMSA-N 1 1 363.421 3.727 20 5 FHBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)CCN1c1ncc(Cl)cc1[N+](=O)[O-] ZINC000610929659 934626425 /nfs/dbraw/zinc/62/64/25/934626425.db2.gz BSNQCGFOYWDDRC-CQSZACIVSA-N 1 1 360.845 3.744 20 5 FHBDMO Cc1nc(-c2ccccc2)sc1[C@@H](C)[N@@H+](C)CCn1ccc([N+](=O)[O-])n1 ZINC000119460935 934817638 /nfs/dbraw/zinc/81/76/38/934817638.db2.gz PGYYHNGMHGWJPP-CQSZACIVSA-N 1 1 371.466 3.916 20 5 FHBDMO O=[N+]([O-])c1ccc(OCCN2CCC[N@@H+](CC3CCCCC3)CC2)cc1 ZINC000065535816 934964414 /nfs/dbraw/zinc/96/44/14/934964414.db2.gz VTPDDYRFRUYFIQ-UHFFFAOYSA-N 1 1 361.486 3.562 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)c2c(c1)COCO2 ZINC000025360079 935071180 /nfs/dbraw/zinc/07/11/80/935071180.db2.gz SKHUVJMGKWPWSZ-GOSISDBHSA-N 1 1 358.369 3.938 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)c2c(c1)COCO2 ZINC000025360079 935071187 /nfs/dbraw/zinc/07/11/87/935071187.db2.gz SKHUVJMGKWPWSZ-GOSISDBHSA-N 1 1 358.369 3.938 20 5 FHBDMO C[C@H]1CCC[N@@H+](Cc2ccc(CNC(=O)c3csc([N+](=O)[O-])c3)cc2)C1 ZINC000071958290 935093721 /nfs/dbraw/zinc/09/37/21/935093721.db2.gz VNCUZLZXNYMABJ-AWEZNQCLSA-N 1 1 373.478 3.818 20 5 FHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1nnc(-c2ccccc2Cl)o1 ZINC000375663953 935156122 /nfs/dbraw/zinc/15/61/22/935156122.db2.gz FWPQMOQFOIJMPE-UHFFFAOYSA-N 1 1 372.812 3.973 20 5 FHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1nnc(-c2ccccc2Cl)o1 ZINC000375663953 935156124 /nfs/dbraw/zinc/15/61/24/935156124.db2.gz FWPQMOQFOIJMPE-UHFFFAOYSA-N 1 1 372.812 3.973 20 5 FHBDMO O=[N+]([O-])c1ccc(N2CC[C@H](n3c[nH+]c4c3CCCC4)C2)c2ccncc21 ZINC000548661526 935193831 /nfs/dbraw/zinc/19/38/31/935193831.db2.gz HXMLCDUSKBUBRA-AWEZNQCLSA-N 1 1 363.421 3.670 20 5 FHBDMO CCC[C@@H](NC(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000511072937 935240451 /nfs/dbraw/zinc/24/04/51/935240451.db2.gz NBYZEARSIHOBAO-LJQANCHMSA-N 1 1 369.465 3.727 20 5 FHBDMO CCC[C@@H](NC(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000511072937 935240456 /nfs/dbraw/zinc/24/04/56/935240456.db2.gz NBYZEARSIHOBAO-LJQANCHMSA-N 1 1 369.465 3.727 20 5 FHBDMO Cc1ccc(NC(=O)C[N@H+](C)CCc2ccccc2[N+](=O)[O-])cc1Cl ZINC000511072447 935248681 /nfs/dbraw/zinc/24/86/81/935248681.db2.gz LAIIFXMZMAFZQS-UHFFFAOYSA-N 1 1 361.829 3.670 20 5 FHBDMO Cc1ccc(NC(=O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1Cl ZINC000511072447 935248687 /nfs/dbraw/zinc/24/86/87/935248687.db2.gz LAIIFXMZMAFZQS-UHFFFAOYSA-N 1 1 361.829 3.670 20 5 FHBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@H](c3cccc(C(F)(F)F)c3)C2)c1 ZINC000511080213 935314728 /nfs/dbraw/zinc/31/47/28/935314728.db2.gz HUGVMLURDGMEDP-AWEZNQCLSA-N 1 1 368.359 3.690 20 5 FHBDMO C[C@@]12C[N@@H+](Cc3coc(-c4ccc([N+](=O)[O-])cc4)n3)C[C@H]1[C@@H]1C=C[C@H]2C1 ZINC000451360162 935365861 /nfs/dbraw/zinc/36/58/61/935365861.db2.gz DYLKNTMABTYLIE-QIJLZVCCSA-N 1 1 351.406 3.894 20 5 FHBDMO COc1ccc(OC)c([C@H]2CCC[N@@H+]2Cc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000051589228 935513067 /nfs/dbraw/zinc/51/30/67/935513067.db2.gz MMPGAALQLAZPPP-QGZVFWFLSA-N 1 1 372.421 3.958 20 5 FHBDMO COc1ccc(OC)c([C@H]2CCC[N@H+]2Cc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000051589228 935513068 /nfs/dbraw/zinc/51/30/68/935513068.db2.gz MMPGAALQLAZPPP-QGZVFWFLSA-N 1 1 372.421 3.958 20 5 FHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@H](OCCCc3ccccc3)C2)cc1 ZINC001167567379 935587369 /nfs/dbraw/zinc/58/73/69/935587369.db2.gz FRXWRFIANXXSRM-NRFANRHFSA-N 1 1 354.450 3.861 20 5 FHBDMO COc1ccc2nc(C[N@@H+](C)CCc3ccccc3[N+](=O)[O-])sc2c1 ZINC000511109536 935610168 /nfs/dbraw/zinc/61/01/68/935610168.db2.gz OOLJKGXENGZRMU-UHFFFAOYSA-N 1 1 357.435 3.888 20 5 FHBDMO C[C@H](CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)[N@H+]1CCCC[C@H]1C ZINC000478562590 935646645 /nfs/dbraw/zinc/64/66/45/935646645.db2.gz PJNGRHXKPICJBV-CHWSQXEVSA-N 1 1 361.467 3.802 20 5 FHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc(Cl)c2c(c1)OCCO2 ZINC000511125780 935706000 /nfs/dbraw/zinc/70/60/00/935706000.db2.gz WTZCVALRXIEGFS-UHFFFAOYSA-N 1 1 362.813 3.694 20 5 FHBDMO Cn1c2ccc(Cl)cc2nc1C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511127770 935717919 /nfs/dbraw/zinc/71/79/19/935717919.db2.gz VOLLWYUEQMJJRI-UHFFFAOYSA-N 1 1 358.829 3.809 20 5 FHBDMO Cn1c2ccc(Cl)cc2nc1C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511127770 935717923 /nfs/dbraw/zinc/71/79/23/935717923.db2.gz VOLLWYUEQMJJRI-UHFFFAOYSA-N 1 1 358.829 3.809 20 5 FHBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)c1ccccc1[N+](=O)[O-] ZINC000511788846 945120267 /nfs/dbraw/zinc/12/02/67/945120267.db2.gz RYLGLTDGOPIGBI-LJQANCHMSA-N 1 1 367.449 3.625 20 5 FHBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@H]1CCCc2ccccc21 ZINC000582737690 936045119 /nfs/dbraw/zinc/04/51/19/936045119.db2.gz VMKOOWUFIZAJLE-SFHVURJKSA-N 1 1 353.422 3.933 20 5 FHBDMO CCn1c(C)nc([N+](=O)[O-])c1NCC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000582747007 936071768 /nfs/dbraw/zinc/07/17/68/936071768.db2.gz ZQTXPXJYHILSSX-MAUKXSAKSA-N 1 1 371.485 3.832 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000277918209 936174753 /nfs/dbraw/zinc/17/47/53/936174753.db2.gz PQSWSPQOHIABKK-OAHLLOKOSA-N 1 1 363.461 3.698 20 5 FHBDMO Cc1nc(C)n(C[C@@H]2CCC[N@H+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC000245524303 938302696 /nfs/dbraw/zinc/30/26/96/938302696.db2.gz NJOSELNDUSCYDR-RHSMWYFYSA-N 1 1 357.458 3.585 20 5 FHBDMO C[N@H+](CCOc1ccc(Cl)cc1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000034867869 945184270 /nfs/dbraw/zinc/18/42/70/945184270.db2.gz HMHKPXMRPFTYEH-UHFFFAOYSA-N 1 1 360.801 3.635 20 5 FHBDMO C[N@@H+](CCOc1ccc(Cl)cc1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000034867869 945184273 /nfs/dbraw/zinc/18/42/73/945184273.db2.gz HMHKPXMRPFTYEH-UHFFFAOYSA-N 1 1 360.801 3.635 20 5 FHBDMO CC(C)[N@@H+](C)CC1CCN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000536183616 938527798 /nfs/dbraw/zinc/52/77/98/938527798.db2.gz SEXBORGNGXWYBR-UHFFFAOYSA-N 1 1 357.401 3.753 20 5 FHBDMO Cc1cccc(-c2n[nH]cc2C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000584304282 938678525 /nfs/dbraw/zinc/67/85/25/938678525.db2.gz ODTYCTCDENIIMO-UHFFFAOYSA-N 1 1 350.422 3.968 20 5 FHBDMO CC[C@H](c1cccc(OC)c1)[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000584315395 938683601 /nfs/dbraw/zinc/68/36/01/938683601.db2.gz WQGRWKRZCIYFOV-LJQANCHMSA-N 1 1 371.437 3.933 20 5 FHBDMO CC[C@H](c1cccc(OC)c1)[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000584315395 938683602 /nfs/dbraw/zinc/68/36/02/938683602.db2.gz WQGRWKRZCIYFOV-LJQANCHMSA-N 1 1 371.437 3.933 20 5 FHBDMO Cn1cc(C[C@H]2CC[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C2)cn1 ZINC000093870211 938931139 /nfs/dbraw/zinc/93/11/39/938931139.db2.gz QUNNHHZTEKCZDW-OAHLLOKOSA-N 1 1 366.421 3.653 20 5 FHBDMO CCOc1cccc(N2CCC[C@H](c3[nH+]cc4n3CCCC4)C2)c1[N+](=O)[O-] ZINC000409640468 938978781 /nfs/dbraw/zinc/97/87/81/938978781.db2.gz UVDVLXGGKBBOCO-HNNXBMFYSA-N 1 1 370.453 3.910 20 5 FHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH+]2CCC([C@@H]3CCCO3)CC2)c1 ZINC000188280593 939127899 /nfs/dbraw/zinc/12/78/99/939127899.db2.gz DDQCABWEGMMTHO-HNNXBMFYSA-N 1 1 356.369 3.587 20 5 FHBDMO COc1cc(C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])cc(OC)c1OC ZINC000892451699 939189573 /nfs/dbraw/zinc/18/95/73/939189573.db2.gz BXRZGIVXBYQLHQ-UHFFFAOYSA-N 1 1 366.801 3.564 20 5 FHBDMO O=C1O[C@@H](C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)CN1c1ccccc1 ZINC000179520530 939880973 /nfs/dbraw/zinc/88/09/73/939880973.db2.gz UXGDNDQMTSEDAV-IBGZPJMESA-N 1 1 367.405 3.585 20 5 FHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@H](Cn2cnc3ccccc32)C1 ZINC000614235855 939902298 /nfs/dbraw/zinc/90/22/98/939902298.db2.gz KVMRCZMCQMREOQ-HNNXBMFYSA-N 1 1 368.412 3.996 20 5 FHBDMO CC(C)c1ccc(C[N@H+]2CC[C@]3(C2)c2ccccc2NC3=O)cc1[N+](=O)[O-] ZINC000614660611 939920174 /nfs/dbraw/zinc/92/01/74/939920174.db2.gz NVYCKLCEOJVCHB-NRFANRHFSA-N 1 1 365.433 3.814 20 5 FHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@@]2(CCSC2)C1 ZINC000451964111 939944209 /nfs/dbraw/zinc/94/42/09/939944209.db2.gz IRGRZEIKBFHTIW-FZKQIMNGSA-N 1 1 374.466 3.925 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@H](C)c1ccc(C)cc1 ZINC000411178054 940007120 /nfs/dbraw/zinc/00/71/20/940007120.db2.gz XCVAIHPCCPBWPF-OAHLLOKOSA-N 1 1 371.437 3.933 20 5 FHBDMO Cc1cc(-c2nnc(C[N@H+](C)CCc3cccc([N+](=O)[O-])c3)o2)c(C)o1 ZINC000548927954 940052138 /nfs/dbraw/zinc/05/21/38/940052138.db2.gz JEWJUDMNGNGOSW-UHFFFAOYSA-N 1 1 356.382 3.529 20 5 FHBDMO Cc1cc(-c2nnc(C[N@@H+](C)CCc3cccc([N+](=O)[O-])c3)o2)c(C)o1 ZINC000548927954 940052145 /nfs/dbraw/zinc/05/21/45/940052145.db2.gz JEWJUDMNGNGOSW-UHFFFAOYSA-N 1 1 356.382 3.529 20 5 FHBDMO CSc1ccccc1NC(=O)[C@H](C)[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548928349 940053021 /nfs/dbraw/zinc/05/30/21/940053021.db2.gz OWCSDINCXLJILW-AWEZNQCLSA-N 1 1 373.478 3.818 20 5 FHBDMO CSc1ccccc1NC(=O)[C@H](C)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548928349 940053023 /nfs/dbraw/zinc/05/30/23/940053023.db2.gz OWCSDINCXLJILW-AWEZNQCLSA-N 1 1 373.478 3.818 20 5 FHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000612432572 940065542 /nfs/dbraw/zinc/06/55/42/940065542.db2.gz ZXDOGILXFSFZFA-QGZVFWFLSA-N 1 1 355.438 3.842 20 5 FHBDMO COc1ccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H](CO)C(C)C)cc1 ZINC000179929761 940135266 /nfs/dbraw/zinc/13/52/66/940135266.db2.gz BYMULMBERJVXJO-HXUWFJFHSA-N 1 1 358.438 3.623 20 5 FHBDMO COC(=O)[C@@H]1C[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C[C@H]1c1ccccc1 ZINC000451989923 940148007 /nfs/dbraw/zinc/14/80/07/940148007.db2.gz CKIRDDWZQVOCQY-MDASCCDHSA-N 1 1 354.406 3.544 20 5 FHBDMO COc1ccc(C[N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)cn1 ZINC000612586758 940164187 /nfs/dbraw/zinc/16/41/87/940164187.db2.gz KQEMLBCGXMRRQF-UHFFFAOYSA-N 1 1 353.378 3.890 20 5 FHBDMO COc1ccc(C[N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)cn1 ZINC000612586758 940164188 /nfs/dbraw/zinc/16/41/88/940164188.db2.gz KQEMLBCGXMRRQF-UHFFFAOYSA-N 1 1 353.378 3.890 20 5 FHBDMO C[C@H](c1ncc(-c2ccccc2)o1)[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000376036099 940224131 /nfs/dbraw/zinc/22/41/31/940224131.db2.gz WOEODGMPXZRRBN-CQSZACIVSA-N 1 1 367.409 3.844 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C/C[NH+]1CCC(c2noc(C(F)F)n2)CC1 ZINC000376048381 940240101 /nfs/dbraw/zinc/24/01/01/940240101.db2.gz YIHRIKYCWLFOCC-HWKANZROSA-N 1 1 364.352 3.808 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH2+][C@H](CCO)c3ccccc3)cs2)c1 ZINC000124452757 945307761 /nfs/dbraw/zinc/30/77/61/945307761.db2.gz IBMVXIQTMIYMEZ-GOSISDBHSA-N 1 1 369.446 3.932 20 5 FHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccn(-c2ccccc2F)n1 ZINC000581619873 940508322 /nfs/dbraw/zinc/50/83/22/940508322.db2.gz VGEQFZKOHRMBJS-UHFFFAOYSA-N 1 1 354.385 3.594 20 5 FHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccn(-c2ccccc2F)n1 ZINC000581619873 940508325 /nfs/dbraw/zinc/50/83/25/940508325.db2.gz VGEQFZKOHRMBJS-UHFFFAOYSA-N 1 1 354.385 3.594 20 5 FHBDMO CC1(C)CN(c2ncc([N+](=O)[O-])cc2Cl)CC[N@@H+]1Cc1ccccc1 ZINC000582087895 940652565 /nfs/dbraw/zinc/65/25/65/940652565.db2.gz GQKSNUZILVZLAE-UHFFFAOYSA-N 1 1 360.845 3.744 20 5 FHBDMO CC1(C)CN(c2ncc([N+](=O)[O-])cc2Cl)CC[N@H+]1Cc1ccccc1 ZINC000582087895 940652572 /nfs/dbraw/zinc/65/25/72/940652572.db2.gz GQKSNUZILVZLAE-UHFFFAOYSA-N 1 1 360.845 3.744 20 5 FHBDMO Cn1c(C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])nc2cc(Cl)ccc21 ZINC000582370446 940661783 /nfs/dbraw/zinc/66/17/83/940661783.db2.gz PXASZUCEXGXBHI-CQSZACIVSA-N 1 1 356.813 3.912 20 5 FHBDMO O=[N+]([O-])c1ccc(CC[NH2+]C2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)cc1 ZINC000180136132 940679123 /nfs/dbraw/zinc/67/91/23/940679123.db2.gz PRNLVSZXBYMMHW-XDNSSPFJSA-N 1 1 365.477 3.923 20 5 FHBDMO Cc1ccc([C@H](C)[NH2+][C@H]2c3sccc3OC(C)(C)[C@@H]2O)cc1[N+](=O)[O-] ZINC000414184976 940726579 /nfs/dbraw/zinc/72/65/79/940726579.db2.gz PARBAFIMTNFXLV-XNJJOIOASA-N 1 1 362.451 3.889 20 5 FHBDMO Cc1c[nH+]ccc1OC1CCN(c2ccc([N+](=O)[O-])c(OC(C)C)n2)CC1 ZINC000582677012 940807196 /nfs/dbraw/zinc/80/71/96/940807196.db2.gz MGSFTZCBNYDNGX-UHFFFAOYSA-N 1 1 372.425 3.528 20 5 FHBDMO Cc1[nH+]ccn1-c1ccc([C@@H](C)NC(=O)c2cccc(C)c2[N+](=O)[O-])cc1 ZINC000175792228 940930020 /nfs/dbraw/zinc/93/00/20/940930020.db2.gz KIMQABSMRCWTNH-CQSZACIVSA-N 1 1 364.405 3.888 20 5 FHBDMO Cc1[nH+]ccn1-c1ccc([C@H](C)NC(=O)c2cccc(C)c2[N+](=O)[O-])cc1 ZINC000175792213 940930164 /nfs/dbraw/zinc/93/01/64/940930164.db2.gz KIMQABSMRCWTNH-AWEZNQCLSA-N 1 1 364.405 3.888 20 5 FHBDMO C[N@H+](Cc1ccccc1)CC1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000066676485 940993291 /nfs/dbraw/zinc/99/32/91/940993291.db2.gz ZGIKWBHCYOIMEE-UHFFFAOYSA-N 1 1 373.478 3.641 20 5 FHBDMO Cn1cc(C[N@H+](C)Cc2cc(Cl)cn2C)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000180570858 941044137 /nfs/dbraw/zinc/04/41/37/941044137.db2.gz NANJDAGALIGFON-UHFFFAOYSA-N 1 1 373.844 3.619 20 5 FHBDMO Cn1cc(C[N@@H+](C)Cc2cc(Cl)cn2C)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000180570858 941044140 /nfs/dbraw/zinc/04/41/40/941044140.db2.gz NANJDAGALIGFON-UHFFFAOYSA-N 1 1 373.844 3.619 20 5 FHBDMO CC[C@H](NCC1([NH+]2CCCCC2)CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000180741423 941070725 /nfs/dbraw/zinc/07/07/25/941070725.db2.gz QLTUIDADNNMCDA-IBGZPJMESA-N 1 1 361.486 3.671 20 5 FHBDMO COCCOc1ccccc1C[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000892659955 941095084 /nfs/dbraw/zinc/09/50/84/941095084.db2.gz ODHMOZOZWWVKIE-UHFFFAOYSA-N 1 1 350.802 3.563 20 5 FHBDMO CC(C)[N@@H+](CCOCC(F)(F)C(F)F)Cc1ccc([N+](=O)[O-])cc1 ZINC000188879400 941127690 /nfs/dbraw/zinc/12/76/90/941127690.db2.gz JWLSMZOTAAPDBI-UHFFFAOYSA-N 1 1 352.328 3.722 20 5 FHBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000177755083 941149075 /nfs/dbraw/zinc/14/90/75/941149075.db2.gz PYVKGXAVEWLOFP-CVEARBPZSA-N 1 1 359.470 3.591 20 5 FHBDMO Cn1cc(C[N@@H+]2CCc3cc(F)ccc3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000181440718 941255178 /nfs/dbraw/zinc/25/51/78/941255178.db2.gz WRFHSLKVKZIDAO-UHFFFAOYSA-N 1 1 366.396 3.693 20 5 FHBDMO Cn1cc(C[N@H+]2CCc3cc(F)ccc3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000181440718 941255183 /nfs/dbraw/zinc/25/51/83/941255183.db2.gz WRFHSLKVKZIDAO-UHFFFAOYSA-N 1 1 366.396 3.693 20 5 FHBDMO Cn1ncc2c1CCC[N@@H+](Cc1ccc(-c3ccc([N+](=O)[O-])cc3)o1)C2 ZINC000414470314 941287608 /nfs/dbraw/zinc/28/76/08/941287608.db2.gz IQPWMBPXQSKLDT-UHFFFAOYSA-N 1 1 352.394 3.537 20 5 FHBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000178678084 941294446 /nfs/dbraw/zinc/29/44/46/941294446.db2.gz OSODXPWGBDTNGC-UTKZUKDTSA-N 1 1 359.473 3.944 20 5 FHBDMO Cn1ncc2c1CCC[N@@H+](Cc1ccc(-c3ccccc3[N+](=O)[O-])o1)C2 ZINC000414474774 941301729 /nfs/dbraw/zinc/30/17/29/941301729.db2.gz SYYAIJJLWFOLBV-UHFFFAOYSA-N 1 1 352.394 3.537 20 5 FHBDMO CC(=O)c1ccc(N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000311684174 941360032 /nfs/dbraw/zinc/36/00/32/941360032.db2.gz JGEREOGQGVLVKL-GOSISDBHSA-N 1 1 353.422 3.508 20 5 FHBDMO COc1ccc(C[NH2+][C@H](C)c2nccn2-c2ccccc2)cc1[N+](=O)[O-] ZINC000376622046 941368130 /nfs/dbraw/zinc/36/81/30/941368130.db2.gz MNYICWOXICGXHY-CQSZACIVSA-N 1 1 352.394 3.640 20 5 FHBDMO [NH3+]CC1CCN(Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CC1 ZINC000414648396 941424797 /nfs/dbraw/zinc/42/47/97/941424797.db2.gz BDRFJTJZFCRFTC-UHFFFAOYSA-N 1 1 359.401 3.697 20 5 FHBDMO [NH3+][C@@H]1CC[C@@H]2CN(Cc3ccc(-c4ccc([N+](=O)[O-])cc4Cl)o3)C[C@@H]12 ZINC000414675490 941433461 /nfs/dbraw/zinc/43/34/61/941433461.db2.gz TXSQTWOMSHIKSG-RGYTYGDFSA-N 1 1 361.829 3.677 20 5 FHBDMO [NH3+][C@@H]1CCC[C@@H](NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000414936274 941518122 /nfs/dbraw/zinc/51/81/22/941518122.db2.gz ZDZKSVQQOPUTOL-HZPDHXFCSA-N 1 1 359.401 3.886 20 5 FHBDMO Cc1cc(N2CCC[C@H](c3[nH+]ccn3C)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000365547155 941587408 /nfs/dbraw/zinc/58/74/08/941587408.db2.gz ODISLKAOMAVDPP-AWEZNQCLSA-N 1 1 351.410 3.569 20 5 FHBDMO C[C@H]1[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CC[N@H+]1Cc1ccccc1 ZINC000311925128 941652011 /nfs/dbraw/zinc/65/20/11/941652011.db2.gz FLDQYKRKBXMKBC-GUYCJALGSA-N 1 1 373.840 3.641 20 5 FHBDMO COc1cc(N2CCC(c3[nH+]cc4n3CCCC4)CC2)c([N+](=O)[O-])cc1F ZINC000278813221 941670515 /nfs/dbraw/zinc/67/05/15/941670515.db2.gz INFYHRQMRTWAPK-UHFFFAOYSA-N 1 1 374.416 3.659 20 5 FHBDMO COc1cc(NC[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000311959456 941706376 /nfs/dbraw/zinc/70/63/76/941706376.db2.gz IZXILAIWPDANFA-HXUWFJFHSA-N 1 1 355.438 3.928 20 5 FHBDMO CC[C@@H]([NH2+]Cc1ccc(O)c(OC)c1[N+](=O)[O-])c1ccc(F)cc1F ZINC000893001257 941870677 /nfs/dbraw/zinc/87/06/77/941870677.db2.gz KYERXRFXFSPLJI-CQSZACIVSA-N 1 1 352.337 3.828 20 5 FHBDMO Cc1cccc(CC[NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000513655073 942057956 /nfs/dbraw/zinc/05/79/56/942057956.db2.gz KVCSALYZQQXOGA-LJQANCHMSA-N 1 1 350.422 3.558 20 5 FHBDMO Cc1cccc([C@@H]2CC[N@@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])C2)c1 ZINC000501010165 942256317 /nfs/dbraw/zinc/25/63/17/942256317.db2.gz IIOKVKKAEQWRAP-QGZVFWFLSA-N 1 1 353.422 3.721 20 5 FHBDMO Cc1nc2c(s1)[C@H]([N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-])CCC2 ZINC000501017009 942263991 /nfs/dbraw/zinc/26/39/91/942263991.db2.gz YIRAIJDLXPZVBO-MRXNPFEDSA-N 1 1 374.466 3.698 20 5 FHBDMO Cc1nc2c(s1)[C@@H]([N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-])CCC2 ZINC000501017008 942264201 /nfs/dbraw/zinc/26/42/01/942264201.db2.gz YIRAIJDLXPZVBO-INIZCTEOSA-N 1 1 374.466 3.698 20 5 FHBDMO COc1ccc(OCC[N@H+]2CCC[C@H](CC(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000420948698 942271766 /nfs/dbraw/zinc/27/17/66/942271766.db2.gz OCJINVDHCFNNOP-GFCCVEGCSA-N 1 1 362.348 3.647 20 5 FHBDMO CN(C)[C@@H](C[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)C1CC1 ZINC000237172233 942403180 /nfs/dbraw/zinc/40/31/80/942403180.db2.gz OELUVVCDIFFNMK-IBGZPJMESA-N 1 1 373.428 3.956 20 5 FHBDMO C[N@H+]1CCCN(C(=O)Nc2cccc(Oc3ccc([N+](=O)[O-])cc3)c2)CC1 ZINC000501354411 942429427 /nfs/dbraw/zinc/42/94/27/942429427.db2.gz KJIUWXLJCMKESE-UHFFFAOYSA-N 1 1 370.409 3.557 20 5 FHBDMO O=[N+]([O-])c1cnc(N2CC[C@@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)c(F)c1 ZINC000413185600 942438401 /nfs/dbraw/zinc/43/84/01/942438401.db2.gz QPMWYYAAVLROLV-FQEVSTJZSA-N 1 1 370.428 3.621 20 5 FHBDMO COc1ccc(C[N@H+]2CCCN(Cc3ccc(C)c([N+](=O)[O-])c3)CC2)cc1 ZINC000505274969 942440695 /nfs/dbraw/zinc/44/06/95/942440695.db2.gz WRPIMFBZBIQHBX-UHFFFAOYSA-N 1 1 369.465 3.620 20 5 FHBDMO CN(C)C(C)(C)C[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000237079573 942555329 /nfs/dbraw/zinc/55/53/29/942555329.db2.gz HZTUBFLTSLOWEC-UHFFFAOYSA-N 1 1 361.417 3.956 20 5 FHBDMO Cc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000183578469 942634102 /nfs/dbraw/zinc/63/41/02/942634102.db2.gz OCWFYCMKNGAHJA-GFCCVEGCSA-N 1 1 353.378 3.599 20 5 FHBDMO CCc1ccc(C[NH+]2CCN(Cc3csc([N+](=O)[O-])c3)CC2)s1 ZINC000514098471 942758313 /nfs/dbraw/zinc/75/83/13/942758313.db2.gz HGMGTLOPADGOEB-UHFFFAOYSA-N 1 1 351.497 3.598 20 5 FHBDMO CCCC[N@@H+](CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)C1CC1 ZINC000434576432 942774778 /nfs/dbraw/zinc/77/47/78/942774778.db2.gz UFRILTAGESFKIT-UHFFFAOYSA-N 1 1 374.466 3.921 20 5 FHBDMO Cc1ccccc1C[C@H]1CCC[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000514169911 942796633 /nfs/dbraw/zinc/79/66/33/942796633.db2.gz METVGFAJLONEIP-HXUWFJFHSA-N 1 1 367.449 3.573 20 5 FHBDMO O=[N+]([O-])c1cccc(C[NH2+][C@@H](CCO)c2ccccc2Br)c1 ZINC000514246010 942860815 /nfs/dbraw/zinc/86/08/15/942860815.db2.gz GIMGOEVZCCSDHR-INIZCTEOSA-N 1 1 365.227 3.571 20 5 FHBDMO CCN(CC)C(=O)C[N@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000434980759 943074068 /nfs/dbraw/zinc/07/40/68/943074068.db2.gz BDKLFTQDLPEFGW-UHFFFAOYSA-N 1 1 361.467 3.624 20 5 FHBDMO CCN(CC)C(=O)C[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000434980759 943074075 /nfs/dbraw/zinc/07/40/75/943074075.db2.gz BDKLFTQDLPEFGW-UHFFFAOYSA-N 1 1 361.467 3.624 20 5 FHBDMO COc1ccc2oc(C[NH+]3CCN(c4ccccc4[N+](=O)[O-])CC3)cc2c1 ZINC000505611913 943190906 /nfs/dbraw/zinc/19/09/06/943190906.db2.gz RWXHZEKYJJWNHH-UHFFFAOYSA-N 1 1 367.405 3.672 20 5 FHBDMO COc1cccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C[C@@H]2CCCO2)c1 ZINC000053232650 943414829 /nfs/dbraw/zinc/41/48/29/943414829.db2.gz ZOGJZUDEWYEEHJ-FQEVSTJZSA-N 1 1 356.422 3.785 20 5 FHBDMO CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2NCCc3ccccc32)cc1[N+](=O)[O-] ZINC000423446943 943513480 /nfs/dbraw/zinc/51/34/80/943513480.db2.gz ZMFAAWHZXQBFDB-KDOFPFPSSA-N 1 1 355.438 3.531 20 5 FHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1nncn1-c1ccccc1)CCCC2 ZINC000417326101 943518261 /nfs/dbraw/zinc/51/82/61/943518261.db2.gz QZEIFXOOUWEMEF-LJQANCHMSA-N 1 1 363.421 3.733 20 5 FHBDMO C[C@H](NC[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000423481489 943528048 /nfs/dbraw/zinc/52/80/48/943528048.db2.gz WVECJVGRGKJJCO-GZRFBZBPSA-N 1 1 357.429 3.778 20 5 FHBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)c1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1 ZINC000515184417 943540275 /nfs/dbraw/zinc/54/02/75/943540275.db2.gz MBLVAIIJEQZNPP-CJNGLKHVSA-N 1 1 358.417 3.572 20 5 FHBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@@H+](CC)C[C@@H]1C ZINC000504591734 943703462 /nfs/dbraw/zinc/70/34/62/943703462.db2.gz JOTWUUMGKWQYFQ-KGLIPLIRSA-N 1 1 365.499 3.652 20 5 FHBDMO CCOC[C@H]1CCC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425409488 943761992 /nfs/dbraw/zinc/76/19/92/943761992.db2.gz WDVJVHXBTQPKSE-LBPRGKRZSA-N 1 1 357.248 3.606 20 5 FHBDMO CCOC[C@H]1CCC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425409488 943761994 /nfs/dbraw/zinc/76/19/94/943761994.db2.gz WDVJVHXBTQPKSE-LBPRGKRZSA-N 1 1 357.248 3.606 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)CCCOc1ccccc1C ZINC000515437647 943888653 /nfs/dbraw/zinc/88/86/53/943888653.db2.gz KZDQWIHASRWEBX-UHFFFAOYSA-N 1 1 371.437 3.551 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)CCCOc1ccccc1C ZINC000515437647 943888660 /nfs/dbraw/zinc/88/86/60/943888660.db2.gz KZDQWIHASRWEBX-UHFFFAOYSA-N 1 1 371.437 3.551 20 5 FHBDMO Cn1cc(C[N@@H+](C)C2Cc3ccccc3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000511640145 943898162 /nfs/dbraw/zinc/89/81/62/943898162.db2.gz LBJXTAWLISUJIB-UHFFFAOYSA-N 1 1 362.433 3.595 20 5 FHBDMO Cn1c2ccccc2nc1[C@H]1CCC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000437592484 943935702 /nfs/dbraw/zinc/93/57/02/943935702.db2.gz LUEZZZFKMIHKBK-LJQANCHMSA-N 1 1 366.421 3.697 20 5 FHBDMO Cn1c2ccccc2nc1[C@H]1CCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000437592484 943935707 /nfs/dbraw/zinc/93/57/07/943935707.db2.gz LUEZZZFKMIHKBK-LJQANCHMSA-N 1 1 366.421 3.697 20 5 FHBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@@H+]1CCC[C@H]1[C@@H]1CCCO1 ZINC000425444419 943953368 /nfs/dbraw/zinc/95/33/68/943953368.db2.gz NOUKWSQAGZTQKY-ZFWWWQNUSA-N 1 1 355.232 3.501 20 5 FHBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1CCC[C@H]1[C@@H]1CCCO1 ZINC000425444419 943953371 /nfs/dbraw/zinc/95/33/71/943953371.db2.gz NOUKWSQAGZTQKY-ZFWWWQNUSA-N 1 1 355.232 3.501 20 5 FHBDMO C[N@@H+](CCc1ccccc1O)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425457027 944013934 /nfs/dbraw/zinc/01/39/34/944013934.db2.gz KLQYGFOXOKLNCA-UHFFFAOYSA-N 1 1 365.227 3.737 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@@H](Cc2ccccc2)C1 ZINC000436126753 944040144 /nfs/dbraw/zinc/04/01/44/944040144.db2.gz KDJSPFNCVMFDFX-SFHVURJKSA-N 1 1 367.449 3.796 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@@H](Cc2ccccc2)C1 ZINC000436126753 944040153 /nfs/dbraw/zinc/04/01/53/944040153.db2.gz KDJSPFNCVMFDFX-SFHVURJKSA-N 1 1 367.449 3.796 20 5 FHBDMO CC(C)[N@@H+](C)CC1CCN(c2ncc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000584516404 944050349 /nfs/dbraw/zinc/05/03/49/944050349.db2.gz BSLPMNYONSUJSV-UHFFFAOYSA-N 1 1 360.380 3.565 20 5 FHBDMO CC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)c1cccc(O)c1 ZINC000500092034 944082828 /nfs/dbraw/zinc/08/28/28/944082828.db2.gz ORLYEKBBWJANKZ-AWEZNQCLSA-N 1 1 357.410 3.712 20 5 FHBDMO C[C@H]1CCC[N@@H+](CCCCNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000436324205 944201600 /nfs/dbraw/zinc/20/16/00/944201600.db2.gz VBXDNHDNUIIDGI-LBPRGKRZSA-N 1 1 360.380 3.933 20 5 FHBDMO CCC[N@@H+](CCc1cccc(F)c1)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000500202037 944256998 /nfs/dbraw/zinc/25/69/98/944256998.db2.gz MVPZHISVBAUTLM-UHFFFAOYSA-N 1 1 373.428 3.936 20 5 FHBDMO CCOc1cc(C[N@H+]2CC3(CCC3)[C@@H]2C2CCOCC2)ccc1[N+](=O)[O-] ZINC000425559243 944340819 /nfs/dbraw/zinc/34/08/19/944340819.db2.gz ZCKQVAKROHQNFZ-IBGZPJMESA-N 1 1 360.454 3.775 20 5 FHBDMO CCOc1cc(C[N@H+]2CC3(CCC3)[C@H]2C2CCOCC2)ccc1[N+](=O)[O-] ZINC000425559244 944340863 /nfs/dbraw/zinc/34/08/63/944340863.db2.gz ZCKQVAKROHQNFZ-LJQANCHMSA-N 1 1 360.454 3.775 20 5 FHBDMO O=[N+]([O-])c1ccc(NCC[N@H+]2CCc3sccc3C2)c2ccncc21 ZINC000053580151 944401859 /nfs/dbraw/zinc/40/18/59/944401859.db2.gz CPAJAMBUSCABQO-UHFFFAOYSA-N 1 1 354.435 3.675 20 5 FHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC[C@H]2[C@H](O)C(F)(F)F)o1 ZINC000123703916 944411897 /nfs/dbraw/zinc/41/18/97/944411897.db2.gz SCJXZVSRZKSHAR-HOCLYGCPSA-N 1 1 370.327 3.742 20 5 FHBDMO Cc1cc(NC(=O)N2CC[N@@H+](Cc3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000473781712 944452343 /nfs/dbraw/zinc/45/23/43/944452343.db2.gz ZQPHGAMBXYJCOO-MRXNPFEDSA-N 1 1 368.437 3.641 20 5 FHBDMO Cc1cc(NC(=O)N2CC[N@H+](Cc3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000473781712 944452348 /nfs/dbraw/zinc/45/23/48/944452348.db2.gz ZQPHGAMBXYJCOO-MRXNPFEDSA-N 1 1 368.437 3.641 20 5 FHBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000518525633 944471938 /nfs/dbraw/zinc/47/19/38/944471938.db2.gz YHTPDPXKTNSJCL-GFCCVEGCSA-N 1 1 368.865 3.880 20 5 FHBDMO CCN(C(=O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C)c1ccccc1 ZINC000518579793 944504846 /nfs/dbraw/zinc/50/48/46/944504846.db2.gz WKBPODNCENMHOB-UHFFFAOYSA-N 1 1 355.438 3.858 20 5 FHBDMO CCN(C(=O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C)c1ccccc1 ZINC000518579793 944504848 /nfs/dbraw/zinc/50/48/48/944504848.db2.gz WKBPODNCENMHOB-UHFFFAOYSA-N 1 1 355.438 3.858 20 5 FHBDMO Cc1cc(C(=O)NCc2cccc(C[N@H+](C)C(C)C)c2)cc([N+](=O)[O-])c1 ZINC000517685809 944512467 /nfs/dbraw/zinc/51/24/67/944512467.db2.gz HRSVTSQQDMBMGH-UHFFFAOYSA-N 1 1 355.438 3.673 20 5 FHBDMO Cc1c(NC(=O)CC[N@H+](C)Cc2ccc(F)cc2F)cccc1[N+](=O)[O-] ZINC000025071293 944545624 /nfs/dbraw/zinc/54/56/24/944545624.db2.gz ZDOVEGGINZZNJS-UHFFFAOYSA-N 1 1 363.364 3.642 20 5 FHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@H](COc4ccccc4)C3)nc2c1 ZINC000505875341 944580638 /nfs/dbraw/zinc/58/06/38/944580638.db2.gz VILNLLFEKXMPMV-AWEZNQCLSA-N 1 1 353.378 3.637 20 5 FHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@H](COc4ccccc4)C3)nc2c1 ZINC000505875341 944580640 /nfs/dbraw/zinc/58/06/40/944580640.db2.gz VILNLLFEKXMPMV-AWEZNQCLSA-N 1 1 353.378 3.637 20 5 FHBDMO Cc1ccccc1C(C)(C)[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000550262699 944621053 /nfs/dbraw/zinc/62/10/53/944621053.db2.gz OJKQZSOCFHPQLQ-UHFFFAOYSA-N 1 1 352.394 3.978 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1CNC[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1 ZINC000415001276 944749336 /nfs/dbraw/zinc/74/93/36/944749336.db2.gz KUKRAJCHBBPBLU-FXAWDEMLSA-N 1 1 357.429 3.525 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(C[N@@H+]2CCC[C@@H]2CO)cc1 ZINC000506329391 944947301 /nfs/dbraw/zinc/94/73/01/944947301.db2.gz ZMSGBCNAXDLVCF-OAHLLOKOSA-N 1 1 362.813 3.997 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(C[N@H+](CCO)C2CC2)cc1 ZINC000507109153 944959587 /nfs/dbraw/zinc/95/95/87/944959587.db2.gz BEMWMOFGKFUXJM-UHFFFAOYSA-N 1 1 362.813 3.997 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@@H]1CNCC[C@H]1c1ccc(F)c(F)c1 ZINC000414948940 945018081 /nfs/dbraw/zinc/01/80/81/945018081.db2.gz MXRQDQXRMQCFIA-BLWBWXFKSA-N 1 1 373.403 3.622 20 5 FHBDMO O=C(NC[C@H](c1cccc(Cl)c1)[NH+]1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000106167705 945039968 /nfs/dbraw/zinc/03/99/68/945039968.db2.gz MRPAHOXMQYUTPK-GOSISDBHSA-N 1 1 373.840 3.815 20 5 FHBDMO C[C@H](CNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)[N@@H+](C)C1CC1 ZINC000110698462 945053770 /nfs/dbraw/zinc/05/37/70/945053770.db2.gz XMKZXPQYNIEUBB-CQSZACIVSA-N 1 1 368.437 3.551 20 5 FHBDMO CC(=O)N1CC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC12CCCCC2 ZINC000408144129 945426362 /nfs/dbraw/zinc/42/63/62/945426362.db2.gz GVZMOUWJBDUDGW-MRXNPFEDSA-N 1 1 359.470 3.831 20 5 FHBDMO C[C@@H]1C[C@H](c2ccccc2F)[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000544150606 945492056 /nfs/dbraw/zinc/49/20/56/945492056.db2.gz OMNWLJOAIPOXOK-SPYBWZPUSA-N 1 1 374.412 3.557 20 5 FHBDMO CCC[N@H+](Cc1csc([N+](=O)[O-])c1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000729480313 945578693 /nfs/dbraw/zinc/57/86/93/945578693.db2.gz UJXPWDUKKGRDAW-CQSZACIVSA-N 1 1 369.487 3.878 20 5 FHBDMO CCC[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000729480313 945578697 /nfs/dbraw/zinc/57/86/97/945578697.db2.gz UJXPWDUKKGRDAW-CQSZACIVSA-N 1 1 369.487 3.878 20 5 FHBDMO CC[N@@H+](CCc1cccs1)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000519905554 945892274 /nfs/dbraw/zinc/89/22/74/945892274.db2.gz SDJFUATXRBAZHE-UHFFFAOYSA-N 1 1 358.423 3.771 20 5 FHBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3ccccc3)CC2)c(OC(F)F)c1 ZINC000302044120 946093336 /nfs/dbraw/zinc/09/33/36/946093336.db2.gz JOEYNXUHMJOTLV-UHFFFAOYSA-N 1 1 363.364 3.518 20 5 FHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](n3cnc4c3CCCC4)C2)c(Cl)c1 ZINC000614740432 946390451 /nfs/dbraw/zinc/39/04/51/946390451.db2.gz BMBYZNAZJSNELJ-OAHLLOKOSA-N 1 1 360.845 3.771 20 5 FHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](n3cnc4c3CCCC4)C2)c(Cl)c1 ZINC000614740432 946390457 /nfs/dbraw/zinc/39/04/57/946390457.db2.gz BMBYZNAZJSNELJ-OAHLLOKOSA-N 1 1 360.845 3.771 20 5 FHBDMO CCOc1ccc(CCC2CC[NH+](Cc3c([N+](=O)[O-])ncn3C)CC2)cc1 ZINC000475538261 946623873 /nfs/dbraw/zinc/62/38/73/946623873.db2.gz RSFVXEMMSDNVCW-UHFFFAOYSA-N 1 1 372.469 3.572 20 5 FHBDMO CCS[C@@H]1CCCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000112088289 946658934 /nfs/dbraw/zinc/65/89/34/946658934.db2.gz WFZARVFENAIKPC-OAHLLOKOSA-N 1 1 362.455 3.752 20 5 FHBDMO COc1c([N+](=O)[O-])cc(Cl)c(C)c1N(C(N)=[NH2+])c1ccc(F)cc1 ZINC001167991006 946699048 /nfs/dbraw/zinc/69/90/48/946699048.db2.gz DBAAOCFZDUUCAS-UHFFFAOYSA-N 1 1 352.753 3.736 20 5 FHBDMO COC(=O)COc1ccc(C[N@@H+](CC(C)C)C2CCCC2)cc1[N+](=O)[O-] ZINC000475587255 946762261 /nfs/dbraw/zinc/76/22/61/946762261.db2.gz YPBVQRRVPKAPSY-UHFFFAOYSA-N 1 1 364.442 3.547 20 5 FHBDMO CCc1ccc([C@H]([NH2+][C@@H](C)CC[S@](C)=O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544380948 946770732 /nfs/dbraw/zinc/77/07/32/946770732.db2.gz VLKCSGKFLQBVIO-XZFRQNIJSA-N 1 1 364.467 3.586 20 5 FHBDMO Cc1ccc(C[NH+]2CC(c3nc(-c4ccccc4)no3)C2)cc1[N+](=O)[O-] ZINC000897320151 946829149 /nfs/dbraw/zinc/82/91/49/946829149.db2.gz MFRJXSZXHIWDRZ-UHFFFAOYSA-N 1 1 350.378 3.553 20 5 FHBDMO COc1cccc(N2CCC(C[N@@H+](C)Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000475425474 947065687 /nfs/dbraw/zinc/06/56/87/947065687.db2.gz WGRYHCPSEVESPP-UHFFFAOYSA-N 1 1 369.465 3.952 20 5 FHBDMO C[C@H]1[C@H](Cc2ccccc2)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444649438 947070160 /nfs/dbraw/zinc/07/01/60/947070160.db2.gz JLRMIIOHTFVTFX-HOCLYGCPSA-N 1 1 350.422 3.924 20 5 FHBDMO COc1cc(C)c([C@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1OC ZINC000444673587 947098017 /nfs/dbraw/zinc/09/80/17/947098017.db2.gz NFQKADJIWWHJNZ-LBPRGKRZSA-N 1 1 370.409 3.648 20 5 FHBDMO CC(C)O[C@@H](C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000428387518 947440486 /nfs/dbraw/zinc/44/04/86/947440486.db2.gz YLJQXMYMCMJZTK-HKUYNNGSSA-N 1 1 370.453 3.642 20 5 FHBDMO Cc1ccccc1[C@H]1C[N@H+](CCOc2cccc([N+](=O)[O-])c2)[C@H](C)CO1 ZINC000441447942 947486584 /nfs/dbraw/zinc/48/65/84/947486584.db2.gz FIPLZFSSYGSQPV-OXQOHEQNSA-N 1 1 356.422 3.744 20 5 FHBDMO Cc1ccccc1[C@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)[C@H](C)CO1 ZINC000441447942 947486587 /nfs/dbraw/zinc/48/65/87/947486587.db2.gz FIPLZFSSYGSQPV-OXQOHEQNSA-N 1 1 356.422 3.744 20 5 FHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000072837841 947569919 /nfs/dbraw/zinc/56/99/19/947569919.db2.gz FWTLPJGRGMSPPV-HOCLYGCPSA-N 1 1 365.499 3.838 20 5 FHBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000072838448 947570150 /nfs/dbraw/zinc/57/01/50/947570150.db2.gz LSBYVGKCKREIAS-LSDHHAIUSA-N 1 1 362.455 3.751 20 5 FHBDMO COc1ccc(OCC[N@H+]2CC[C@@H](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000441459192 947571899 /nfs/dbraw/zinc/57/18/99/947571899.db2.gz AFLLNBUVJWXPIK-KRWDZBQOSA-N 1 1 356.422 3.547 20 5 FHBDMO O=C(CC[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1)Nc1ccccc1Cl ZINC000088606346 947576649 /nfs/dbraw/zinc/57/66/49/947576649.db2.gz CMEDXYKPAWRYJD-UHFFFAOYSA-N 1 1 359.813 3.635 20 5 FHBDMO O=C(CC[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1)Nc1ccccc1Cl ZINC000088606346 947576640 /nfs/dbraw/zinc/57/66/40/947576640.db2.gz CMEDXYKPAWRYJD-UHFFFAOYSA-N 1 1 359.813 3.635 20 5 FHBDMO Cc1cc(C(=O)N2C[C@H](C)[N@@H+](Cc3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000500441176 947803796 /nfs/dbraw/zinc/80/37/96/947803796.db2.gz XOQSSTCLYBLGGQ-IRXDYDNUSA-N 1 1 367.449 3.638 20 5 FHBDMO Cc1cc(C(=O)N2C[C@H](C)[N@H+](Cc3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000500441176 947803801 /nfs/dbraw/zinc/80/38/01/947803801.db2.gz XOQSSTCLYBLGGQ-IRXDYDNUSA-N 1 1 367.449 3.638 20 5 FHBDMO CC(C)c1ccc(C[N@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000105323550 948004961 /nfs/dbraw/zinc/00/49/61/948004961.db2.gz IMHLDGOIUMTMLA-UHFFFAOYSA-N 1 1 355.438 3.813 20 5 FHBDMO CC(C)c1ccc(C[N@@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000105323550 948004971 /nfs/dbraw/zinc/00/49/71/948004971.db2.gz IMHLDGOIUMTMLA-UHFFFAOYSA-N 1 1 355.438 3.813 20 5 FHBDMO Cc1cc(N2CCC(Nc3c(Cl)cccc3[N+](=O)[O-])CC2)nc(C)[nH+]1 ZINC000432326747 948071684 /nfs/dbraw/zinc/07/16/84/948071684.db2.gz PZCGJSNMUPMVNZ-UHFFFAOYSA-N 1 1 361.833 3.736 20 5 FHBDMO Cc1ccc(C[N@H+]2CCC[C@@H]2Cn2cnc3ccccc32)cc1[N+](=O)[O-] ZINC000574726285 948397717 /nfs/dbraw/zinc/39/77/17/948397717.db2.gz LWOQVCOCPNIPRH-QGZVFWFLSA-N 1 1 350.422 3.918 20 5 FHBDMO Cc1ccc(C[N@H+]2CCC[C@H]2Cn2cnc3ccccc32)cc1[N+](=O)[O-] ZINC000574726283 948397984 /nfs/dbraw/zinc/39/79/84/948397984.db2.gz LWOQVCOCPNIPRH-KRWDZBQOSA-N 1 1 350.422 3.918 20 5 FHBDMO CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)[N@H+](C)C[C@H]1C ZINC000512122399 948479150 /nfs/dbraw/zinc/47/91/50/948479150.db2.gz LMRHMHBXTGSWSA-UONOGXRCSA-N 1 1 365.499 3.508 20 5 FHBDMO CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)[N@@H+](C)C[C@H]1C ZINC000512122399 948479155 /nfs/dbraw/zinc/47/91/55/948479155.db2.gz LMRHMHBXTGSWSA-UONOGXRCSA-N 1 1 365.499 3.508 20 5 FHBDMO CC(C)c1ccc(C[NH2+][C@@H](C[S@@](C)=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000182097287 948663225 /nfs/dbraw/zinc/66/32/25/948663225.db2.gz VUUUCDAXQZDNIS-AVRWGWEMSA-N 1 1 360.479 3.928 20 5 FHBDMO O=[N+]([O-])c1cnc2c(c1)C[N@H+](CCc1cc(Cl)cc(Cl)c1)CC2 ZINC000447307188 948732631 /nfs/dbraw/zinc/73/26/31/948732631.db2.gz XHWSXFDFXCFYDC-UHFFFAOYSA-N 1 1 352.221 3.897 20 5 FHBDMO COc1ccc([C@@H](C)[N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000109094508 209298433 /nfs/dbraw/zinc/29/84/33/209298433.db2.gz YSUBSTPOJKYSLK-OAHLLOKOSA-N 1 1 371.437 3.933 20 5 FHBDMO C[N@H+]1CCCC[C@@H]1CCC(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452853529 567818902 /nfs/dbraw/zinc/81/89/02/567818902.db2.gz NVSQNIFMPIVLTJ-ZWKOTPCHSA-N 1 1 359.470 3.565 20 5 FHBDMO C[C@H]1CCCC[N@H+]1CCCCNC(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000541787707 567833962 /nfs/dbraw/zinc/83/39/62/567833962.db2.gz WBTKBQLMGXULSJ-ZDUSSCGKSA-N 1 1 352.410 3.510 20 5 FHBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3ccsc3)CC2)cc1OC(F)F ZINC000568459880 568040123 /nfs/dbraw/zinc/04/01/23/568040123.db2.gz DTRKKAHXVQBVLA-UHFFFAOYSA-N 1 1 369.393 3.580 20 5 FHBDMO CCSCC[C@@H](C)[N@@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000072900817 568056833 /nfs/dbraw/zinc/05/68/33/568056833.db2.gz DPFQDRCEHSANOB-CYBMUJFWSA-N 1 1 353.488 3.695 20 5 FHBDMO C[C@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000481738697 568100099 /nfs/dbraw/zinc/10/00/99/568100099.db2.gz FGOMTDQPCFBJCX-IINYFYTJSA-N 1 1 360.332 3.624 20 5 FHBDMO C[C@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000481738697 568100100 /nfs/dbraw/zinc/10/01/00/568100100.db2.gz FGOMTDQPCFBJCX-IINYFYTJSA-N 1 1 360.332 3.624 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(N2CC[C@@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)n1 ZINC000481996425 568219131 /nfs/dbraw/zinc/21/91/31/568219131.db2.gz AEWNVKJYNQQTPL-NRFANRHFSA-N 1 1 366.465 3.791 20 5 FHBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2ccc3c(n2)CCC3)cc(C(F)(F)F)c1 ZINC000568848543 568236081 /nfs/dbraw/zinc/23/60/81/568236081.db2.gz BINDHRCAENBVQX-UHFFFAOYSA-N 1 1 351.328 3.787 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@H]1CCCc2ccccc21 ZINC000008126889 568268673 /nfs/dbraw/zinc/26/86/73/568268673.db2.gz AFXFDGPJCCPRKJ-SFHVURJKSA-N 1 1 369.421 3.551 20 5 FHBDMO C[C@H]1CC[C@@]2(CC[N@H+](CC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)C2)C1 ZINC000541949701 568272528 /nfs/dbraw/zinc/27/25/28/568272528.db2.gz VBOZPAFPNUHIDU-YVEFUNNKSA-N 1 1 351.834 3.699 20 5 FHBDMO C[C@H]1CC[C@@]2(CC[N@@H+](CC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)C2)C1 ZINC000541949701 568272530 /nfs/dbraw/zinc/27/25/30/568272530.db2.gz VBOZPAFPNUHIDU-YVEFUNNKSA-N 1 1 351.834 3.699 20 5 FHBDMO Cc1ccc(C[N@H+](CCO)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000181971659 568299201 /nfs/dbraw/zinc/29/92/01/568299201.db2.gz BQGHSTYOIPYFHD-UHFFFAOYSA-N 1 1 367.405 3.553 20 5 FHBDMO Cc1ccc(C[N@@H+](CCO)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000181971659 568299202 /nfs/dbraw/zinc/29/92/02/568299202.db2.gz BQGHSTYOIPYFHD-UHFFFAOYSA-N 1 1 367.405 3.553 20 5 FHBDMO CSc1ccc(NC(=O)[C@@H](C)[N@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000570296029 568473449 /nfs/dbraw/zinc/47/34/49/568473449.db2.gz BGCVDKNMAGGSTI-CQSZACIVSA-N 1 1 373.478 3.818 20 5 FHBDMO CSc1ccc(NC(=O)[C@@H](C)[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000570296029 568473450 /nfs/dbraw/zinc/47/34/50/568473450.db2.gz BGCVDKNMAGGSTI-CQSZACIVSA-N 1 1 373.478 3.818 20 5 FHBDMO O=[N+]([O-])c1cnc(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)c(Cl)c1 ZINC001164624682 719054703 /nfs/dbraw/zinc/05/47/03/719054703.db2.gz OUGUICJUVQIIQE-YJBOKZPZSA-N 1 1 372.856 3.744 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCCCC[N@@H+]1CCCC[C@H]1C ZINC000120309647 928050213 /nfs/dbraw/zinc/05/02/13/928050213.db2.gz NEIXJKYDIHKUQJ-MRXNPFEDSA-N 1 1 362.474 3.988 20 5 FHBDMO Cc1ccc([C@@H]2CCCC[N@H+]2C[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC000610215320 928171036 /nfs/dbraw/zinc/17/10/36/928171036.db2.gz ZJWGXJGTPVTHGY-CTNGQTDRSA-N 1 1 370.449 3.870 20 5 FHBDMO Cc1ccc([C@H]2CCCC[N@H+]2C[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC000610215323 928171258 /nfs/dbraw/zinc/17/12/58/928171258.db2.gz ZJWGXJGTPVTHGY-TZIWHRDSSA-N 1 1 370.449 3.870 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](COCc2ccccc2)C1 ZINC000430217780 928258388 /nfs/dbraw/zinc/25/83/88/928258388.db2.gz IJQUYZBAGDUBIC-QGZVFWFLSA-N 1 1 356.422 3.642 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1CN(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000430235591 928372750 /nfs/dbraw/zinc/37/27/50/928372750.db2.gz DYQSWYOTJGVAGS-GOSISDBHSA-N 1 1 369.465 3.557 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H]1CCCN(c2ccccc2)C1 ZINC000471169450 928445689 /nfs/dbraw/zinc/44/56/89/928445689.db2.gz OFWFZDIOLFBZCY-IBGZPJMESA-N 1 1 355.438 3.704 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+]C1(C(F)F)CCCCC1 ZINC000510128327 928855683 /nfs/dbraw/zinc/85/56/83/928855683.db2.gz RCGFMZBBRYPHQP-UHFFFAOYSA-N 1 1 355.385 3.789 20 5 FHBDMO COc1ccc(C[N@H+]2CCC[C@H]2C[C@H](O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000134794356 929274665 /nfs/dbraw/zinc/27/46/65/929274665.db2.gz QDKUIFOMHVCKBW-HKUYNNGSSA-N 1 1 374.412 3.831 20 5 FHBDMO C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000165333689 929509273 /nfs/dbraw/zinc/50/92/73/929509273.db2.gz KCLXVJUSCIGDQE-MJGOQNOKSA-N 1 1 353.466 3.810 20 5 FHBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)C1 ZINC000278207407 937357144 /nfs/dbraw/zinc/35/71/44/937357144.db2.gz QQSKAQXPYQAKHU-OAHLLOKOSA-N 1 1 363.461 3.507 20 5 FHBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000580017291 929895116 /nfs/dbraw/zinc/89/51/16/929895116.db2.gz YHWKLMJVUPRSDZ-KXBFYZLASA-N 1 1 372.469 3.638 20 5 FHBDMO CN(c1ccccc1)c1ccc(C[N@H+]2CCC[C@@H](CO)CC2)cc1[N+](=O)[O-] ZINC000560628531 929933012 /nfs/dbraw/zinc/93/30/12/929933012.db2.gz FPDTUODDHFUJPQ-QGZVFWFLSA-N 1 1 369.465 3.957 20 5 FHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCC[C@@H]1C[C@H](O)c1cccs1 ZINC000175845966 929953595 /nfs/dbraw/zinc/95/35/95/929953595.db2.gz ZFCUFSLJBLSGQG-ZBFHGGJFSA-N 1 1 350.415 3.884 20 5 FHBDMO COc1ccc(C)cc1C[NH+]1CCN([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000610367434 930163554 /nfs/dbraw/zinc/16/35/54/930163554.db2.gz HWDBVUIHCUPSQT-QGZVFWFLSA-N 1 1 369.465 3.791 20 5 FHBDMO COc1ccc(CN2CC[C@@H](C)[N@@H+](Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000610372014 930178650 /nfs/dbraw/zinc/17/86/50/930178650.db2.gz GUUIAUKFAPJHKA-QGZVFWFLSA-N 1 1 369.465 3.700 20 5 FHBDMO COCC1(C[NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CCCCC1 ZINC000564426663 930300211 /nfs/dbraw/zinc/30/02/11/930300211.db2.gz CGKPODGUKBVBRB-SFHVURJKSA-N 1 1 372.469 3.604 20 5 FHBDMO COc1ccc(OCC[N@H+]2CCC[C@@H]2Cc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC001167387152 930591693 /nfs/dbraw/zinc/59/16/93/930591693.db2.gz OSYMVVBPNBQFFP-GOSISDBHSA-N 1 1 370.449 3.998 20 5 FHBDMO COC[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000536671295 930605305 /nfs/dbraw/zinc/60/53/05/930605305.db2.gz GMKRTZBEINMNBW-GFCCVEGCSA-N 1 1 350.802 3.977 20 5 FHBDMO Cc1cccc(C(=O)N2CCC[N@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000610121871 930720745 /nfs/dbraw/zinc/72/07/45/930720745.db2.gz HQWWNSCPRDDHRR-QGZVFWFLSA-N 1 1 367.449 3.640 20 5 FHBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCCN1CCOc1ccccc1[N+](=O)[O-] ZINC000610133947 930810892 /nfs/dbraw/zinc/81/08/92/930810892.db2.gz WWOUAFCMVPSRHE-SFHVURJKSA-N 1 1 369.465 3.570 20 5 FHBDMO Cc1ccc([C@H](C)[NH2+][C@@H](C)C(=O)c2c[nH]c3ncccc23)cc1[N+](=O)[O-] ZINC000537175675 930857275 /nfs/dbraw/zinc/85/72/75/930857275.db2.gz VJDNNGDJTPUSNW-STQMWFEESA-N 1 1 352.394 3.702 20 5 FHBDMO O=[N+]([O-])c1cc(C[NH2+]C2(c3ccc(Cl)cc3)CC2)c2c(c1)COCO2 ZINC000561156890 930994435 /nfs/dbraw/zinc/99/44/35/930994435.db2.gz FQXUDBVDEVXMTK-UHFFFAOYSA-N 1 1 360.797 3.894 20 5 FHBDMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC001167434212 931139876 /nfs/dbraw/zinc/13/98/76/931139876.db2.gz SQXMKFXKBGSAOM-JMSVASOKSA-N 1 1 351.834 3.840 20 5 FHBDMO COCc1cc([N+](=O)[O-])ccc1NCCc1[nH+]ccn1Cc1ccccc1 ZINC000156752600 931428938 /nfs/dbraw/zinc/42/89/38/931428938.db2.gz SDCXZWSYXGTVBV-UHFFFAOYSA-N 1 1 366.421 3.641 20 5 FHBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000610475819 931545396 /nfs/dbraw/zinc/54/53/96/931545396.db2.gz VFRDQDONWGTXLJ-INIZCTEOSA-N 1 1 368.437 3.723 20 5 FHBDMO Cc1cccc(C[N@H+](C)Cc2ccc(Br)c([N+](=O)[O-])c2)n1 ZINC000157820580 931865858 /nfs/dbraw/zinc/86/58/58/931865858.db2.gz WHNIXCITDVQSBO-UHFFFAOYSA-N 1 1 350.216 3.693 20 5 FHBDMO Cc1cccc(C[N@@H+](C)Cc2ccc(Br)c([N+](=O)[O-])c2)n1 ZINC000157820580 931865863 /nfs/dbraw/zinc/86/58/63/931865863.db2.gz WHNIXCITDVQSBO-UHFFFAOYSA-N 1 1 350.216 3.693 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H]1c1cccc(F)c1 ZINC000610505442 932012536 /nfs/dbraw/zinc/01/25/36/932012536.db2.gz LPOYFHYXXNZMHJ-KRWDZBQOSA-N 1 1 373.384 3.518 20 5 FHBDMO COC(=O)[C@H]1CC[N@@H+](Cc2cc(=O)oc3ccc4ccccc4c23)C[C@H]1C ZINC000276398062 932339457 /nfs/dbraw/zinc/33/94/57/932339457.db2.gz JZKZWJXQYJKLLN-PBHICJAKSA-N 1 1 365.429 3.577 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1CCC1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000157460598 932565698 /nfs/dbraw/zinc/56/56/98/932565698.db2.gz FOFZZSBZLKEZIG-MRXNPFEDSA-N 1 1 359.470 3.712 20 5 FHBDMO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(OC)c([N+](=O)[O-])c2)c(OC)c1 ZINC000051260305 932757551 /nfs/dbraw/zinc/75/75/51/932757551.db2.gz FSRWMAXGKIKVOZ-KRWDZBQOSA-N 1 1 372.421 3.958 20 5 FHBDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(OC)c([N+](=O)[O-])c2)c(OC)c1 ZINC000051260305 932757555 /nfs/dbraw/zinc/75/75/55/932757555.db2.gz FSRWMAXGKIKVOZ-KRWDZBQOSA-N 1 1 372.421 3.958 20 5 FHBDMO C[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(F)cc1Cl ZINC000178206055 932884637 /nfs/dbraw/zinc/88/46/37/932884637.db2.gz XBBZAHUQZHIEBA-JTQLQIEISA-N 1 1 351.765 3.677 20 5 FHBDMO CCN1C[C@@H](C[N@@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)Oc2ccccc21 ZINC000610556989 932969386 /nfs/dbraw/zinc/96/93/86/932969386.db2.gz HXTQDEFXIJGSLB-CRAIPNDOSA-N 1 1 355.438 3.875 20 5 FHBDMO CCOC(=O)C1CCC([N@@H+](CC)Cc2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC000510633078 933332043 /nfs/dbraw/zinc/33/20/43/933332043.db2.gz JBDQHOSMFQFINR-UHFFFAOYSA-N 1 1 370.396 3.817 20 5 FHBDMO CC(C)c1ccc(C(=O)N2CC[N@H+]([C@H]3C[C@@H]3C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000561748690 933969419 /nfs/dbraw/zinc/96/94/19/933969419.db2.gz PATOJRWUUUFFPY-MPGHIAIKSA-N 1 1 359.470 3.521 20 5 FHBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000535799945 934396139 /nfs/dbraw/zinc/39/61/39/934396139.db2.gz JETKSICXEMCVNA-AEFFLSMTSA-N 1 1 355.438 3.913 20 5 FHBDMO CCN1CC[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000535799945 934396148 /nfs/dbraw/zinc/39/61/48/934396148.db2.gz JETKSICXEMCVNA-AEFFLSMTSA-N 1 1 355.438 3.913 20 5 FHBDMO CCN1CC[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000535799945 934396157 /nfs/dbraw/zinc/39/61/57/934396157.db2.gz JETKSICXEMCVNA-AEFFLSMTSA-N 1 1 355.438 3.913 20 5 FHBDMO COc1cc(C[N@@H+](C)[C@@H](C)C2CC2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000158064061 934416886 /nfs/dbraw/zinc/41/68/86/934416886.db2.gz ZVYCTSKXAACVEX-JTQLQIEISA-N 1 1 362.348 3.775 20 5 FHBDMO Cc1ccc(C[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C(C)C)s1 ZINC000065161943 934509349 /nfs/dbraw/zinc/50/93/49/934509349.db2.gz QVFFHRCATAGVCB-UHFFFAOYSA-N 1 1 373.478 3.764 20 5 FHBDMO O=[N+]([O-])c1ccccc1N1CC[NH+](Cc2cccc(OC(F)F)c2)CC1 ZINC000065234197 934751245 /nfs/dbraw/zinc/75/12/45/934751245.db2.gz LBSNMKPQNULPMS-UHFFFAOYSA-N 1 1 363.364 3.518 20 5 FHBDMO Cn1ccnc1[C@@H]([NH2+]CC(C)(C)[C@H]1CCCCO1)c1cccc([N+](=O)[O-])c1 ZINC000611560715 934847136 /nfs/dbraw/zinc/84/71/36/934847136.db2.gz BMFAJZSPEPSWSK-MSOLQXFVSA-N 1 1 372.469 3.603 20 5 FHBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)c2csc([N+](=O)[O-])c2)cc1 ZINC000071958541 935094420 /nfs/dbraw/zinc/09/44/20/935094420.db2.gz HBZQKFHJVYVZCO-AWEZNQCLSA-N 1 1 373.478 3.961 20 5 FHBDMO Cc1ccc(NC(=O)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000072035426 935229280 /nfs/dbraw/zinc/22/92/80/935229280.db2.gz FYAMYCKZVHPYLM-QGZVFWFLSA-N 1 1 353.422 3.754 20 5 FHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1 ZINC000439921239 945091972 /nfs/dbraw/zinc/09/19/72/945091972.db2.gz YOYYMXRKEANQNL-CZUORRHYSA-N 1 1 372.400 3.691 20 5 FHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1 ZINC000439921239 945091979 /nfs/dbraw/zinc/09/19/79/945091979.db2.gz YOYYMXRKEANQNL-CZUORRHYSA-N 1 1 372.400 3.691 20 5 FHBDMO CSc1cccc(NC(=O)[C@H](C)[N@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511083385 935340970 /nfs/dbraw/zinc/34/09/70/935340970.db2.gz YUURSOGMJAOZLP-AWEZNQCLSA-N 1 1 373.478 3.818 20 5 FHBDMO CSc1cccc(NC(=O)[C@H](C)[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511083385 935340974 /nfs/dbraw/zinc/34/09/74/935340974.db2.gz YUURSOGMJAOZLP-AWEZNQCLSA-N 1 1 373.478 3.818 20 5 FHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])[C@@H]1CCN(c2ccc(Cl)cc2)C1=O ZINC000511106212 935591326 /nfs/dbraw/zinc/59/13/26/935591326.db2.gz LPVHBYZQYBTDQS-GOSISDBHSA-N 1 1 373.840 3.528 20 5 FHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])[C@@H]1CCN(c2ccc(Cl)cc2)C1=O ZINC000511106212 935591328 /nfs/dbraw/zinc/59/13/28/935591328.db2.gz LPVHBYZQYBTDQS-GOSISDBHSA-N 1 1 373.840 3.528 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21 ZINC000511785136 945111551 /nfs/dbraw/zinc/11/15/51/945111551.db2.gz IYROCCUZXZUGIR-AABGKKOBSA-N 1 1 368.433 3.608 20 5 FHBDMO O=[N+]([O-])c1ccn(CC[N@@H+](Cc2ccc(Cl)c(Cl)c2)C2CC2)n1 ZINC000478440303 935626380 /nfs/dbraw/zinc/62/63/80/935626380.db2.gz XEIYZWXHPNJIPJ-UHFFFAOYSA-N 1 1 355.225 3.763 20 5 FHBDMO C[C@H](c1nc2ccccc2s1)[N@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000178569798 935651170 /nfs/dbraw/zinc/65/11/70/935651170.db2.gz XVDVHVIUGSSYLH-WBMJQRKESA-N 1 1 357.435 3.931 20 5 FHBDMO C[C@H](c1nc2ccccc2s1)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000178569798 935651173 /nfs/dbraw/zinc/65/11/73/935651173.db2.gz XVDVHVIUGSSYLH-WBMJQRKESA-N 1 1 357.435 3.931 20 5 FHBDMO COc1cc(C[NH+]2CCC(c3nc(C)cc(C)n3)CC2)c([N+](=O)[O-])cc1F ZINC000375704104 935672657 /nfs/dbraw/zinc/67/26/57/935672657.db2.gz KQAOIIBVRDWDCC-UHFFFAOYSA-N 1 1 374.416 3.529 20 5 FHBDMO COc1ccccc1C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C[C@@H]1CCCO1 ZINC000051799264 935890247 /nfs/dbraw/zinc/89/02/47/935890247.db2.gz PRLKVPNJEZRBTM-IBGZPJMESA-N 1 1 356.422 3.785 20 5 FHBDMO COc1ccccc1C[N@H+](Cc1cccc([N+](=O)[O-])c1)C[C@@H]1CCCO1 ZINC000051799264 935890250 /nfs/dbraw/zinc/89/02/50/935890250.db2.gz PRLKVPNJEZRBTM-IBGZPJMESA-N 1 1 356.422 3.785 20 5 FHBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CCC[C@@H]2COC)cc1OC ZINC000611668876 935891821 /nfs/dbraw/zinc/89/18/21/935891821.db2.gz UTCYMVVILXLYCA-GOEBONIOSA-N 1 1 366.458 3.639 20 5 FHBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H]2COC)cc1OC ZINC000611668876 935891825 /nfs/dbraw/zinc/89/18/25/935891825.db2.gz UTCYMVVILXLYCA-GOEBONIOSA-N 1 1 366.458 3.639 20 5 FHBDMO COc1cccc([N+](=O)[O-])c1NC[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000516682652 945137533 /nfs/dbraw/zinc/13/75/33/945137533.db2.gz BGGJCZLCCPNLLS-QGZVFWFLSA-N 1 1 355.438 3.580 20 5 FHBDMO CCC[N@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@H](C)C(=O)Nc1ccccc1 ZINC000507320000 945139679 /nfs/dbraw/zinc/13/96/79/945139679.db2.gz XWFCMARUJIFHID-OAHLLOKOSA-N 1 1 371.437 3.843 20 5 FHBDMO CCC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@H](C)C(=O)Nc1ccccc1 ZINC000507320000 945139684 /nfs/dbraw/zinc/13/96/84/945139684.db2.gz XWFCMARUJIFHID-OAHLLOKOSA-N 1 1 371.437 3.843 20 5 FHBDMO CCC[N@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@@H](C)C(=O)Nc1ccccc1 ZINC000507319999 945139903 /nfs/dbraw/zinc/13/99/03/945139903.db2.gz XWFCMARUJIFHID-HNNXBMFYSA-N 1 1 371.437 3.843 20 5 FHBDMO CCC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@@H](C)C(=O)Nc1ccccc1 ZINC000507319999 945139908 /nfs/dbraw/zinc/13/99/08/945139908.db2.gz XWFCMARUJIFHID-HNNXBMFYSA-N 1 1 371.437 3.843 20 5 FHBDMO C[C@@H](Cc1cccs1)[N@@H+](C)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001167610066 936071052 /nfs/dbraw/zinc/07/10/52/936071052.db2.gz ZFMDASXBHMGEQB-LBPRGKRZSA-N 1 1 358.423 3.769 20 5 FHBDMO C[C@@H]1C[C@@H](N(C)C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CC[N@H+]1C ZINC000277876536 936076337 /nfs/dbraw/zinc/07/63/37/936076337.db2.gz CEMMSPXKJWZFNY-CABCVRRESA-N 1 1 363.461 3.648 20 5 FHBDMO CC(C)[N@@H+](C)CCCNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000277974509 936295523 /nfs/dbraw/zinc/29/55/23/936295523.db2.gz VHYBJFWMGBOTLH-UHFFFAOYSA-N 1 1 351.450 3.554 20 5 FHBDMO Cc1c(NC(=O)CC[N@H+]2CCS[C@H]3CCCC[C@H]32)cccc1[N+](=O)[O-] ZINC000246085418 938337627 /nfs/dbraw/zinc/33/76/27/938337627.db2.gz GBFOBFFVUKUUKD-SJORKVTESA-N 1 1 363.483 3.592 20 5 FHBDMO Cc1[nH+]ccn1-c1ccc(CNc2ccc([N+](=O)[O-])c3cccnc23)cn1 ZINC000052510475 938353340 /nfs/dbraw/zinc/35/33/40/938353340.db2.gz MVMOAZCFWUHGHE-UHFFFAOYSA-N 1 1 360.377 3.644 20 5 FHBDMO C[C@@H](NC(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000458638186 938359462 /nfs/dbraw/zinc/35/94/62/938359462.db2.gz SVNRFKGNYGMUOA-ZMSDIMECSA-N 1 1 374.485 3.608 20 5 FHBDMO CCOC(=O)c1ccc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)o1 ZINC000278763085 938832521 /nfs/dbraw/zinc/83/25/21/938832521.db2.gz TXSUFUDWPGCAQQ-UHFFFAOYSA-N 1 1 372.299 3.673 20 5 FHBDMO COc1ccc(NC(=O)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000140807034 938942031 /nfs/dbraw/zinc/94/20/31/938942031.db2.gz VBAXZUDKZWVGBS-UHFFFAOYSA-N 1 1 371.437 3.843 20 5 FHBDMO Cc1ccc([C@@H](C)[N@@H+](C)C[C@@H](O)COc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000544069377 938991592 /nfs/dbraw/zinc/99/15/92/938991592.db2.gz NXIDUXNVQMOSMT-IAGOWNOFSA-N 1 1 358.438 3.644 20 5 FHBDMO C[C@@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@H]1c1cccc(F)c1 ZINC000472344989 939006218 /nfs/dbraw/zinc/00/62/18/939006218.db2.gz BNTUFKKTUDHFKZ-JLTOFOAXSA-N 1 1 371.412 3.780 20 5 FHBDMO C[C@@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@H]1c1cccc(F)c1 ZINC000472344989 939006219 /nfs/dbraw/zinc/00/62/19/939006219.db2.gz BNTUFKKTUDHFKZ-JLTOFOAXSA-N 1 1 371.412 3.780 20 5 FHBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000061865957 939014343 /nfs/dbraw/zinc/01/43/43/939014343.db2.gz KSQJGIRTJXHCGN-OAHLLOKOSA-N 1 1 370.453 3.607 20 5 FHBDMO Cc1cnn(-c2cc[nH+]cc2NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)c1 ZINC000188068777 939017551 /nfs/dbraw/zinc/01/75/51/939017551.db2.gz ZKJUPEPWAYPOEI-UHFFFAOYSA-N 1 1 365.393 3.860 20 5 FHBDMO COc1cc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])ccc1OC(=O)C1CC1 ZINC000179315655 939080843 /nfs/dbraw/zinc/08/08/43/939080843.db2.gz QOEKQVFUKLVMEZ-UHFFFAOYSA-N 1 1 370.405 3.551 20 5 FHBDMO COc1cc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])ccc1OC(=O)C1CC1 ZINC000179315655 939080844 /nfs/dbraw/zinc/08/08/44/939080844.db2.gz QOEKQVFUKLVMEZ-UHFFFAOYSA-N 1 1 370.405 3.551 20 5 FHBDMO C[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc(NC(=O)C2CC2)cc1 ZINC000179774507 939933768 /nfs/dbraw/zinc/93/37/68/939933768.db2.gz XZBALHXYHMWQIB-LBPRGKRZSA-N 1 1 357.385 3.933 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000364694656 939982429 /nfs/dbraw/zinc/98/24/29/939982429.db2.gz HSXJNVNIMYPJIC-MDKPJZGXSA-N 1 1 368.481 3.984 20 5 FHBDMO COc1ccc(NC(=O)CC[N@H+]2CCC[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000411132385 940001907 /nfs/dbraw/zinc/00/19/07/940001907.db2.gz YLRYSZGWRSHFLQ-SFHVURJKSA-N 1 1 369.421 3.769 20 5 FHBDMO C[C@@H](Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1 ZINC000511349115 940047478 /nfs/dbraw/zinc/04/74/78/940047478.db2.gz BKYPCOVYRTYDGP-OAHLLOKOSA-N 1 1 365.433 3.888 20 5 FHBDMO O=[N+]([O-])c1cnn(CC[N@@H+](Cc2ccc(F)cc2F)C2CCCC2)c1 ZINC000472433330 940092550 /nfs/dbraw/zinc/09/25/50/940092550.db2.gz RVFVOVZGXBPVSF-UHFFFAOYSA-N 1 1 350.369 3.514 20 5 FHBDMO COC(=O)[C@@H]1C[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C[C@H]1c1ccccc1 ZINC000451989928 940094796 /nfs/dbraw/zinc/09/47/96/940094796.db2.gz CKIRDDWZQVOCQY-ZOCIIQOWSA-N 1 1 354.406 3.544 20 5 FHBDMO Cn1c2ccc(Cl)cc2nc1C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548935800 940101035 /nfs/dbraw/zinc/10/10/35/940101035.db2.gz YRVPNMNYQNFHKR-UHFFFAOYSA-N 1 1 358.829 3.809 20 5 FHBDMO Cn1c2ccc(Cl)cc2nc1C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548935800 940101037 /nfs/dbraw/zinc/10/10/37/940101037.db2.gz YRVPNMNYQNFHKR-UHFFFAOYSA-N 1 1 358.829 3.809 20 5 FHBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@H]1CCCC[C@H]1C(F)(F)F ZINC000411747806 940105768 /nfs/dbraw/zinc/10/57/68/940105768.db2.gz YFUSIWBCDNIDCY-OCCSQVGLSA-N 1 1 373.375 3.976 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCSC2(CCC2)CC1 ZINC000411871334 940148894 /nfs/dbraw/zinc/14/88/94/940148894.db2.gz RGKOQDDMKBTFBD-UHFFFAOYSA-N 1 1 363.483 3.593 20 5 FHBDMO COc1ccc(C[N@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)cn1 ZINC000612586698 940164123 /nfs/dbraw/zinc/16/41/23/940164123.db2.gz DLBDNVZYUQEWIH-UHFFFAOYSA-N 1 1 353.378 3.890 20 5 FHBDMO COc1ccc(C[N@@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)cn1 ZINC000612586698 940164125 /nfs/dbraw/zinc/16/41/25/940164125.db2.gz DLBDNVZYUQEWIH-UHFFFAOYSA-N 1 1 353.378 3.890 20 5 FHBDMO O=[N+]([O-])c1cccc([C@@H]([NH2+]C2CCN(C3CC3)CC2)c2ccccc2)c1 ZINC000180029048 940276570 /nfs/dbraw/zinc/27/65/70/940276570.db2.gz PCZGDZGKGKQQAZ-NRFANRHFSA-N 1 1 351.450 3.901 20 5 FHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@H](CC2CC2)C1 ZINC000580336089 940473281 /nfs/dbraw/zinc/47/32/81/940473281.db2.gz XPBFGMJTPFNYLR-DGCLKSJQSA-N 1 1 351.834 3.697 20 5 FHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@H](CC2CC2)C1 ZINC000580336089 940473282 /nfs/dbraw/zinc/47/32/82/940473282.db2.gz XPBFGMJTPFNYLR-DGCLKSJQSA-N 1 1 351.834 3.697 20 5 FHBDMO COc1ccc([C@@H](CN(C)C)[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000580459157 940478219 /nfs/dbraw/zinc/47/82/19/940478219.db2.gz FDHPIHWMFOVECZ-DNVCBOLYSA-N 1 1 357.454 3.865 20 5 FHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H](O)c1ccc(F)cc1F ZINC000066434591 940486865 /nfs/dbraw/zinc/48/68/65/940486865.db2.gz UZRLDUJTVAFCLZ-SFHVURJKSA-N 1 1 350.365 3.817 20 5 FHBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CCCN3c4ccccc4C[C@@H]3C2)c(F)c1 ZINC000582091558 940652587 /nfs/dbraw/zinc/65/25/87/940652587.db2.gz XWUNOCBXWJBDOO-OAHLLOKOSA-N 1 1 359.376 3.510 20 5 FHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CCCN3c4ccccc4C[C@@H]3C2)c(F)c1 ZINC000582091558 940652588 /nfs/dbraw/zinc/65/25/88/940652588.db2.gz XWUNOCBXWJBDOO-OAHLLOKOSA-N 1 1 359.376 3.510 20 5 FHBDMO CCC[C@@H]([NH2+]Cc1ccccc1S(C)(=O)=O)c1cccc([N+](=O)[O-])c1 ZINC000414229123 940800705 /nfs/dbraw/zinc/80/07/05/940800705.db2.gz FBQYQUUZMMRNGS-QGZVFWFLSA-N 1 1 362.451 3.629 20 5 FHBDMO COc1cc(C[N@@H+](C)[C@@H](C)C2(C)CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180260638 940891307 /nfs/dbraw/zinc/89/13/07/940891307.db2.gz OFAXHZWFXFYIIX-NSHDSACASA-N 1 1 358.385 3.868 20 5 FHBDMO Cc1c(NC(=O)CC[N@H+]2CCc3ccccc3[C@@H]2C)cccc1[N+](=O)[O-] ZINC000170955284 940930372 /nfs/dbraw/zinc/93/03/72/940930372.db2.gz VRTONFRZOVPGDW-HNNXBMFYSA-N 1 1 353.422 3.851 20 5 FHBDMO O=[N+]([O-])c1cc(F)c(C[NH2+][C@@H](c2cccs2)C2(CO)CCC2)c(F)c1 ZINC000452058167 941000335 /nfs/dbraw/zinc/00/03/35/941000335.db2.gz HSFQOYXNAUOGHP-INIZCTEOSA-N 1 1 368.405 3.928 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCOC4(CCOCC4)C3)s2)cc1 ZINC000180525802 941037256 /nfs/dbraw/zinc/03/72/56/941037256.db2.gz GHDPHTKSLDHHEF-UHFFFAOYSA-N 1 1 374.462 3.705 20 5 FHBDMO CC[N@H+](Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1)C[C@@H]1CCCO1 ZINC000511510332 941085799 /nfs/dbraw/zinc/08/57/99/941085799.db2.gz YDEDTDIDZXROQN-HNNXBMFYSA-N 1 1 360.410 3.864 20 5 FHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@@H](c3nncn3C3CC3)C2)c1 ZINC000180855093 941085956 /nfs/dbraw/zinc/08/59/56/941085956.db2.gz DEYJIALGTZYRDW-GFCCVEGCSA-N 1 1 361.833 3.554 20 5 FHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@@H](c3nncn3C3CC3)C2)c1 ZINC000180855093 941085959 /nfs/dbraw/zinc/08/59/59/941085959.db2.gz DEYJIALGTZYRDW-GFCCVEGCSA-N 1 1 361.833 3.554 20 5 FHBDMO Cc1ccccc1C[NH+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000188852257 941119030 /nfs/dbraw/zinc/11/90/30/941119030.db2.gz RNMQESOVUSTWEE-UHFFFAOYSA-N 1 1 368.437 3.561 20 5 FHBDMO C[C@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1cccc(N2CCOC2=O)c1 ZINC000181308009 941119955 /nfs/dbraw/zinc/11/99/55/941119955.db2.gz ADLGSWKECXHIKR-LBPRGKRZSA-N 1 1 359.357 3.541 20 5 FHBDMO C[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1cccc(N2CCOC2=O)c1 ZINC000181323099 941121911 /nfs/dbraw/zinc/12/19/11/941121911.db2.gz MWNMZEBVKJSYJA-GFCCVEGCSA-N 1 1 359.357 3.541 20 5 FHBDMO CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000181380902 941141146 /nfs/dbraw/zinc/14/11/46/941141146.db2.gz ZSVQCXRPESHXJX-AWEZNQCLSA-N 1 1 365.499 3.509 20 5 FHBDMO O=C(C[N@H+](Cc1ccco1)C1CCCC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000053140291 941240256 /nfs/dbraw/zinc/24/02/56/941240256.db2.gz YXJHJBDPGGOXIY-UHFFFAOYSA-N 1 1 369.421 3.522 20 5 FHBDMO O=C(C[N@@H+](Cc1ccco1)C1CCCC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000053140291 941240258 /nfs/dbraw/zinc/24/02/58/941240258.db2.gz YXJHJBDPGGOXIY-UHFFFAOYSA-N 1 1 369.421 3.522 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@@H]1CC[N@H+](C)[C@@H]1c1ccccc1 ZINC000189717919 941267128 /nfs/dbraw/zinc/26/71/28/941267128.db2.gz DVNQTRJCFAOATO-VQIMIIECSA-N 1 1 368.437 3.779 20 5 FHBDMO COc1cccc(NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000311405453 941280359 /nfs/dbraw/zinc/28/03/59/941280359.db2.gz WEMFAKGPZAINAA-QGZVFWFLSA-N 1 1 355.438 3.928 20 5 FHBDMO C[C@H](NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000181455685 941288345 /nfs/dbraw/zinc/28/83/45/941288345.db2.gz IYPMSRBLOHOCFS-STQMWFEESA-N 1 1 365.861 3.631 20 5 FHBDMO CC[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H](O)C(F)(F)F ZINC000189865243 941294514 /nfs/dbraw/zinc/29/45/14/941294514.db2.gz NROKPTXSLKGVEP-HNNXBMFYSA-N 1 1 358.316 3.600 20 5 FHBDMO CC[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H](O)C(F)(F)F ZINC000189865243 941294517 /nfs/dbraw/zinc/29/45/17/941294517.db2.gz NROKPTXSLKGVEP-HNNXBMFYSA-N 1 1 358.316 3.600 20 5 FHBDMO COc1ccc(C[NH2+][C@@H](C)c2nccn2-c2ccccc2)cc1[N+](=O)[O-] ZINC000376622044 941368360 /nfs/dbraw/zinc/36/83/60/941368360.db2.gz MNYICWOXICGXHY-AWEZNQCLSA-N 1 1 352.394 3.640 20 5 FHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1nccc(C(F)(F)F)n1 ZINC000414511056 941369830 /nfs/dbraw/zinc/36/98/30/941369830.db2.gz WXTUWCSVIYMRNT-XFFZJAGNSA-N 1 1 352.316 3.597 20 5 FHBDMO O=C(Nc1cccc2c1C[N@H+](C1CC1)C2)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000377191020 941545472 /nfs/dbraw/zinc/54/54/72/941545472.db2.gz ZYZYJDDRHKWZDP-UHFFFAOYSA-N 1 1 357.797 3.979 20 5 FHBDMO Cc1c(C[NH+]2CCN(c3cncc4ccccc43)CC2)cccc1[N+](=O)[O-] ZINC000472752662 941683635 /nfs/dbraw/zinc/68/36/35/941683635.db2.gz PWDYYXKTQLDHGV-UHFFFAOYSA-N 1 1 362.433 3.774 20 5 FHBDMO COc1ccc(NC(=O)C[N@@H+]2C[C@H](C)C[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000513277450 941826915 /nfs/dbraw/zinc/82/69/15/941826915.db2.gz YCHKSOCQJOHJCD-KDOFPFPSSA-N 1 1 369.421 3.625 20 5 FHBDMO COc1ccc(NC(=O)C[N@H+]2C[C@H](C)C[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000513277450 941826919 /nfs/dbraw/zinc/82/69/19/941826919.db2.gz YCHKSOCQJOHJCD-KDOFPFPSSA-N 1 1 369.421 3.625 20 5 FHBDMO CC[C@H]([NH2+]Cc1ccc(O)c(OC)c1[N+](=O)[O-])c1ccc(F)cc1F ZINC000893001255 941870724 /nfs/dbraw/zinc/87/07/24/941870724.db2.gz KYERXRFXFSPLJI-AWEZNQCLSA-N 1 1 352.337 3.828 20 5 FHBDMO Cc1cccc(C)c1OC[C@@H](O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000513397326 941890685 /nfs/dbraw/zinc/89/06/85/941890685.db2.gz KIOQCDQIFIZIFE-FQEVSTJZSA-N 1 1 372.465 3.862 20 5 FHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1 ZINC000101921562 942020362 /nfs/dbraw/zinc/02/03/62/942020362.db2.gz KJYFOGPOLWOWSO-DYVFJYSZSA-N 1 1 372.400 3.691 20 5 FHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1 ZINC000101921562 942020368 /nfs/dbraw/zinc/02/03/68/942020368.db2.gz KJYFOGPOLWOWSO-DYVFJYSZSA-N 1 1 372.400 3.691 20 5 FHBDMO CO[C@]1(C)CCC[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000280572642 942209743 /nfs/dbraw/zinc/20/97/43/942209743.db2.gz SCIMHMYOSYWRNW-SCLBCKFNSA-N 1 1 360.414 3.597 20 5 FHBDMO O=[N+]([O-])c1cnc(NCC[N@@H+]2CCc3sccc3C2)c(C(F)(F)F)c1 ZINC000413067922 942250138 /nfs/dbraw/zinc/25/01/38/942250138.db2.gz HGDZVJRBGFPGHB-UHFFFAOYSA-N 1 1 372.372 3.540 20 5 FHBDMO O=[N+]([O-])c1cnc(NCC[N@H+]2CCc3sccc3C2)c(C(F)(F)F)c1 ZINC000413067922 942250142 /nfs/dbraw/zinc/25/01/42/942250142.db2.gz HGDZVJRBGFPGHB-UHFFFAOYSA-N 1 1 372.372 3.540 20 5 FHBDMO C[C@@H]1[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2Cl)CC[N@H+]1Cc1ccccc1 ZINC000312024077 942284838 /nfs/dbraw/zinc/28/48/38/942284838.db2.gz WYOWHLKUPHVCRY-CJNGLKHVSA-N 1 1 373.840 3.641 20 5 FHBDMO O=[N+]([O-])c1cnc(NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)c(F)c1 ZINC000413098097 942285646 /nfs/dbraw/zinc/28/56/46/942285646.db2.gz DSCVPBZETSKMNB-GFCCVEGCSA-N 1 1 350.419 3.515 20 5 FHBDMO C[C@H]1C[C@@H](N(C)c2ncc([N+](=O)[O-])cc2F)CC[N@H+]1Cc1ccccc1 ZINC000413153666 942352112 /nfs/dbraw/zinc/35/21/12/942352112.db2.gz HUWJUKVEAKEMKX-HOCLYGCPSA-N 1 1 358.417 3.618 20 5 FHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](c3ncc[nH]3)C2)c(C(F)(F)F)c1 ZINC000378248609 942455147 /nfs/dbraw/zinc/45/51/47/942455147.db2.gz NNYLFOURLXIGMY-GFCCVEGCSA-N 1 1 354.332 3.716 20 5 FHBDMO COc1cc(C[N@@H+](C)[C@@H]2CC[C@@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000429590655 942567145 /nfs/dbraw/zinc/56/71/45/942567145.db2.gz PHZWKFLHWGATMX-DGCLKSJQSA-N 1 1 358.385 3.868 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@@H](c1ccco1)[NH+]1CCCCC1 ZINC000421462865 942582977 /nfs/dbraw/zinc/58/29/77/942582977.db2.gz YWPDLHZRLZJTPQ-SFHVURJKSA-N 1 1 371.437 3.762 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000421513722 942619464 /nfs/dbraw/zinc/61/94/64/942619464.db2.gz QINGJXPUDQUMPO-HOTGVXAUSA-N 1 1 359.470 3.594 20 5 FHBDMO Cn1ccnc1[C@@H]([NH2+]CCCOC1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000514081035 942731465 /nfs/dbraw/zinc/73/14/65/942731465.db2.gz AFOXQOZLBKSGNQ-IBGZPJMESA-N 1 1 372.469 3.747 20 5 FHBDMO CCOc1ccccc1C[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000514124006 942769939 /nfs/dbraw/zinc/76/99/39/942769939.db2.gz FJCWRYMUJWNXBI-UHFFFAOYSA-N 1 1 371.437 3.763 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000421770954 942814512 /nfs/dbraw/zinc/81/45/12/942814512.db2.gz LDFSHFZDLGRBKQ-QZTJIDSGSA-N 1 1 373.497 3.938 20 5 FHBDMO CCC[C@@H](C)[N@@H+](C)CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000434639133 942831009 /nfs/dbraw/zinc/83/10/09/942831009.db2.gz UWALPEYVZQOFTB-GFCCVEGCSA-N 1 1 362.455 3.777 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H]1Cc1cccc(F)c1 ZINC000434659144 942843616 /nfs/dbraw/zinc/84/36/16/942843616.db2.gz MPNAUUFGQVUWHC-QGZVFWFLSA-N 1 1 371.412 3.688 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H]1Cc1cccc(F)c1 ZINC000434659144 942843620 /nfs/dbraw/zinc/84/36/20/942843620.db2.gz MPNAUUFGQVUWHC-QGZVFWFLSA-N 1 1 371.412 3.688 20 5 FHBDMO Cc1cc(C)c2c(c1)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])CCO2 ZINC000365804334 942916950 /nfs/dbraw/zinc/91/69/50/942916950.db2.gz DQPADXKIODSOIP-INIZCTEOSA-N 1 1 357.366 3.733 20 5 FHBDMO Cc1ccc([C@@]2(C)CC[N@H+](CC(=O)Nc3c(C)cccc3[N+](=O)[O-])C2)cc1 ZINC000434751847 942943518 /nfs/dbraw/zinc/94/35/18/942943518.db2.gz JDRUIZQVYQUTHA-NRFANRHFSA-N 1 1 367.449 3.814 20 5 FHBDMO Cc1ccc([C@@]2(C)CC[N@@H+](CC(=O)Nc3c(C)cccc3[N+](=O)[O-])C2)cc1 ZINC000434751847 942943522 /nfs/dbraw/zinc/94/35/22/942943522.db2.gz JDRUIZQVYQUTHA-NRFANRHFSA-N 1 1 367.449 3.814 20 5 FHBDMO C[N@H+](CCOc1cccc(Cl)c1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000434837943 942994789 /nfs/dbraw/zinc/99/47/89/942994789.db2.gz WSGIBXFRZFLKNH-UHFFFAOYSA-N 1 1 361.785 3.900 20 5 FHBDMO C[N@@H+](CCOc1cccc(Cl)c1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000434837943 942994791 /nfs/dbraw/zinc/99/47/91/942994791.db2.gz WSGIBXFRZFLKNH-UHFFFAOYSA-N 1 1 361.785 3.900 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](Cc1ccccc1)C[C@H]1CCCO1 ZINC000505546376 943004907 /nfs/dbraw/zinc/00/49/07/943004907.db2.gz FOVYNHVSAAFMFU-LJQANCHMSA-N 1 1 356.422 3.785 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](Cc1ccccc1)C[C@H]1CCCO1 ZINC000505546376 943004917 /nfs/dbraw/zinc/00/49/17/943004917.db2.gz FOVYNHVSAAFMFU-LJQANCHMSA-N 1 1 356.422 3.785 20 5 FHBDMO C[C@@H]1[C@@H](c2ccccc2)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000434899525 943037369 /nfs/dbraw/zinc/03/73/69/943037369.db2.gz IJWZAHIHZXAQMA-BEFAXECRSA-N 1 1 353.422 3.801 20 5 FHBDMO CCn1c(C)nc([N+](=O)[O-])c1S[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000425256584 943067382 /nfs/dbraw/zinc/06/73/82/943067382.db2.gz AIJOFEMLPFTGFK-MRXNPFEDSA-N 1 1 360.483 3.876 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1CNC[C@H](c1ccc(C)o1)[NH+]1CCCC1 ZINC000236847961 943123732 /nfs/dbraw/zinc/12/37/32/943123732.db2.gz QACKTULCPDNPOR-GOSISDBHSA-N 1 1 373.453 3.822 20 5 FHBDMO CC(=O)c1cc(N2C[C@@H]3CC[N@@H+](Cc4ccccc4)[C@@H]3C2)ccc1[N+](=O)[O-] ZINC000425278792 943175573 /nfs/dbraw/zinc/17/55/73/943175573.db2.gz SZKCTQXNTLPQPZ-LAUBAEHRSA-N 1 1 365.433 3.508 20 5 FHBDMO C[C@@H]([NH2+][C@@H](Cn1ccccc1=O)c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000503926904 943412522 /nfs/dbraw/zinc/41/25/22/943412522.db2.gz IAHQFCOQDAWMSL-APWZRJJASA-N 1 1 363.417 3.849 20 5 FHBDMO CCc1ccc([C@@H](NCC[C@H]2CCC[NH2+]C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423258873 943461995 /nfs/dbraw/zinc/46/19/95/943461995.db2.gz MXKCUVMFJKOZAQ-QRWLVFNGSA-N 1 1 357.454 3.819 20 5 FHBDMO CC[C@H]([NH2+][C@H]1CNCC[C@@H]1c1ccc(OC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000423328552 943481376 /nfs/dbraw/zinc/48/13/76/943481376.db2.gz KUVQLFDOSNGKIR-HKBOAZHASA-N 1 1 369.465 3.790 20 5 FHBDMO CCc1ccc([C@H](NCCC2=CC[NH2+]CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423541207 943552484 /nfs/dbraw/zinc/55/24/84/943552484.db2.gz RLEURTVUVFWEQF-HXUWFJFHSA-N 1 1 355.438 3.739 20 5 FHBDMO C[C@H](c1ccccc1)N(C)C(=O)C[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000504590205 943701370 /nfs/dbraw/zinc/70/13/70/943701370.db2.gz QLAARRGQTBDYJZ-JZUUQJBKSA-N 1 1 367.449 3.759 20 5 FHBDMO C[C@H](c1ccccc1)N(C)C(=O)C[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000504590205 943701375 /nfs/dbraw/zinc/70/13/75/943701375.db2.gz QLAARRGQTBDYJZ-JZUUQJBKSA-N 1 1 367.449 3.759 20 5 FHBDMO C[C@@H]1CCC[N@@H+](CCCCNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000516845199 943765838 /nfs/dbraw/zinc/76/58/38/943765838.db2.gz WEKOFJLHBXARLR-CQSZACIVSA-N 1 1 359.426 3.583 20 5 FHBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000425416280 943858116 /nfs/dbraw/zinc/85/81/16/943858116.db2.gz GBWAEGAYXHIQSH-GXTWGEPZSA-N 1 1 369.259 3.606 20 5 FHBDMO CCOc1ccc([C@@H](C)NC[C@H](Cc2ccccc2)[NH+](C)C)cc1[N+](=O)[O-] ZINC000504912351 943908848 /nfs/dbraw/zinc/90/88/48/943908848.db2.gz VBRAGELXKYYOQT-APWZRJJASA-N 1 1 371.481 3.817 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000504915376 943910969 /nfs/dbraw/zinc/91/09/69/943910969.db2.gz SRPPQRKKTIDXJM-QGZVFWFLSA-N 1 1 368.437 3.689 20 5 FHBDMO CCOc1ccc([C@@H](C)N[C@@H]2CC[N@@H+](CC3CCCC3)C2)cc1[N+](=O)[O-] ZINC000504929771 943926311 /nfs/dbraw/zinc/92/63/11/943926311.db2.gz LGUJRZGSXRCMAH-CRAIPNDOSA-N 1 1 361.486 3.909 20 5 FHBDMO CCOc1ccc([C@@H](C)[NH2+][C@@H]2CCN(CC3CCCC3)C2)cc1[N+](=O)[O-] ZINC000504929771 943926313 /nfs/dbraw/zinc/92/63/13/943926313.db2.gz LGUJRZGSXRCMAH-CRAIPNDOSA-N 1 1 361.486 3.909 20 5 FHBDMO C[C@@H](c1nc(-c2cccs2)no1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000517042804 943944949 /nfs/dbraw/zinc/94/49/49/943944949.db2.gz BNQZTTAYYCPOMJ-LBPRGKRZSA-N 1 1 358.423 3.942 20 5 FHBDMO C[C@@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000312614931 943979663 /nfs/dbraw/zinc/97/96/63/943979663.db2.gz ZYYRLKLZOPDTNP-GDBMZVCRSA-N 1 1 370.409 3.826 20 5 FHBDMO O=C(Nc1ccc(C[NH+]2CCCCCC2)cc1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000506108168 944045763 /nfs/dbraw/zinc/04/57/63/944045763.db2.gz RGONBYFTAOIMQL-UHFFFAOYSA-N 1 1 369.421 3.929 20 5 FHBDMO C[C@@]1(c2ccccc2)CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000500072491 944050773 /nfs/dbraw/zinc/05/07/73/944050773.db2.gz DFYOOFDTYFVVSN-HXUWFJFHSA-N 1 1 353.422 3.587 20 5 FHBDMO Cc1ccc(C[C@H](C)[N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000500125039 944131727 /nfs/dbraw/zinc/13/17/27/944131727.db2.gz OVKNLWULORXIRO-INIZCTEOSA-N 1 1 355.438 3.795 20 5 FHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1Nc1c2c(ccc1[N+](=O)[O-])NCC2 ZINC000436415098 944288525 /nfs/dbraw/zinc/28/85/25/944288525.db2.gz WKRWDBYMOZTQNV-QAPCUYQASA-N 1 1 366.465 3.885 20 5 FHBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000506478389 944308904 /nfs/dbraw/zinc/30/89/04/944308904.db2.gz GIRFPCVQJXGIHT-ROUUACIJSA-N 1 1 361.486 3.560 20 5 FHBDMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)NC[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC000438138148 944363025 /nfs/dbraw/zinc/36/30/25/944363025.db2.gz IYYJYQSLHOZOBX-SFHVURJKSA-N 1 1 374.485 3.533 20 5 FHBDMO CC[C@H](O)C[N@H+](Cc1ccccc1)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000184267216 944371494 /nfs/dbraw/zinc/37/14/94/944371494.db2.gz XKEQRKLAQALTPB-INIZCTEOSA-N 1 1 362.401 3.516 20 5 FHBDMO CC[C@H](O)C[N@@H+](Cc1ccccc1)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000184267216 944371500 /nfs/dbraw/zinc/37/15/00/944371500.db2.gz XKEQRKLAQALTPB-INIZCTEOSA-N 1 1 362.401 3.516 20 5 FHBDMO CSC[C@@H]1CCC[N@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000312695644 944449724 /nfs/dbraw/zinc/44/97/24/944449724.db2.gz NCNYFWHGPCPTHK-GFCCVEGCSA-N 1 1 359.289 3.932 20 5 FHBDMO CSC[C@@H]1CCC[N@@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000312695644 944449726 /nfs/dbraw/zinc/44/97/26/944449726.db2.gz NCNYFWHGPCPTHK-GFCCVEGCSA-N 1 1 359.289 3.932 20 5 FHBDMO CC[C@@](C)(O)C[N@@H+](Cc1ccccc1)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000439276022 944497118 /nfs/dbraw/zinc/49/71/18/944497118.db2.gz PUWYOTZJLFGNKD-HXUWFJFHSA-N 1 1 358.438 3.767 20 5 FHBDMO C[N@@H+](Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)CC1(CO)CC1 ZINC000438343323 944523795 /nfs/dbraw/zinc/52/37/95/944523795.db2.gz XCKBCWVIPDQUCK-UHFFFAOYSA-N 1 1 360.385 3.731 20 5 FHBDMO Cc1nc(N2CC[C@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000133906525 944544352 /nfs/dbraw/zinc/54/43/52/944544352.db2.gz IHCFALDBXJCEER-QUCCMNQESA-N 1 1 366.465 3.789 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCC[C@@H](Oc2ncccc2F)C1 ZINC000425999921 944577492 /nfs/dbraw/zinc/57/74/92/944577492.db2.gz QPSDDDHOXVKAEB-HQQUCIOCSA-N 1 1 357.385 3.686 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@@H](Oc2ncccc2F)C1 ZINC000425999921 944577494 /nfs/dbraw/zinc/57/74/94/944577494.db2.gz QPSDDDHOXVKAEB-HQQUCIOCSA-N 1 1 357.385 3.686 20 5 FHBDMO CCC[N@@H+](Cc1cc(I)cc([N+](=O)[O-])c1)C1CC1 ZINC000516216877 944599274 /nfs/dbraw/zinc/59/92/74/944599274.db2.gz XQGODVINDHWTSD-UHFFFAOYSA-N 1 1 360.195 3.574 20 5 FHBDMO C[C@H](C[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccccc1 ZINC000066854545 944642256 /nfs/dbraw/zinc/64/22/56/944642256.db2.gz CPCGKSFNBDOMDN-CQSZACIVSA-N 1 1 352.394 3.880 20 5 FHBDMO C[C@H]1C[N@H+](C2CCN(c3c(Cl)cc(Cl)cc3[N+](=O)[O-])CC2)CCO1 ZINC000408101258 944708318 /nfs/dbraw/zinc/70/83/18/944708318.db2.gz JGPSDBLFEKMIKB-NSHDSACASA-N 1 1 374.268 3.591 20 5 FHBDMO CC(C)[N@@H+](C)CCCNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000518021073 944940343 /nfs/dbraw/zinc/94/03/43/944940343.db2.gz SSBYLHPVOHEWSP-UHFFFAOYSA-N 1 1 371.437 3.847 20 5 FHBDMO Cc1ccccc1[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000507165303 944997710 /nfs/dbraw/zinc/99/77/10/944997710.db2.gz PASMAHIMJWNCAT-MRXNPFEDSA-N 1 1 353.422 3.721 20 5 FHBDMO CC(C)[N@@H+](Cc1cnn(CC(F)(F)F)c1)Cc1ccc([N+](=O)[O-])cc1 ZINC000507151913 945000899 /nfs/dbraw/zinc/00/08/99/945000899.db2.gz MENRXIPQRVARHG-UHFFFAOYSA-N 1 1 356.348 3.764 20 5 FHBDMO Cc1ccccc1[C@@H]1CC[N@H+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000507179749 945010526 /nfs/dbraw/zinc/01/05/26/945010526.db2.gz HTKCHEOATPUHGB-HZPDHXFCSA-N 1 1 353.422 3.720 20 5 FHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)c(F)c1 ZINC000511754837 945024634 /nfs/dbraw/zinc/02/46/34/945024634.db2.gz JMEAFVSQKQVWJK-MDYRTPRTSA-N 1 1 374.387 3.878 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](c2ccccc2C)C1 ZINC000507201145 945026428 /nfs/dbraw/zinc/02/64/28/945026428.db2.gz DPXSYJRDNSIDPR-INIZCTEOSA-N 1 1 353.422 3.640 20 5 FHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21 ZINC000511762755 945052338 /nfs/dbraw/zinc/05/23/38/945052338.db2.gz OITFDMSKMRHOTP-SUMDDJOVSA-N 1 1 356.397 3.738 20 5 FHBDMO COc1ccc(CN(C)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000509548450 945059901 /nfs/dbraw/zinc/05/99/01/945059901.db2.gz HNJUWKGLLQIVMR-LJQANCHMSA-N 1 1 369.465 3.700 20 5 FHBDMO COc1ccc(C[N@H+](C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000509548450 945059910 /nfs/dbraw/zinc/05/99/10/945059910.db2.gz HNJUWKGLLQIVMR-LJQANCHMSA-N 1 1 369.465 3.700 20 5 FHBDMO COc1ccc(C[N@@H+](C)[C@@H]2CCCN(Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000509548450 945059921 /nfs/dbraw/zinc/05/99/21/945059921.db2.gz HNJUWKGLLQIVMR-LJQANCHMSA-N 1 1 369.465 3.700 20 5 FHBDMO CCC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C[C@@H]1CCCCO1 ZINC000106866593 945419007 /nfs/dbraw/zinc/41/90/07/945419007.db2.gz FUOSQGUOTHBHQV-INIZCTEOSA-N 1 1 363.458 3.513 20 5 FHBDMO C[C@@H](O)[C@@H]1CC[N@@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000507706889 945479898 /nfs/dbraw/zinc/47/98/98/945479898.db2.gz ZXTWIPIRONIZAH-NVXWUHKLSA-N 1 1 355.438 3.565 20 5 FHBDMO O=[N+]([O-])c1cnc(N2CCC[C@H](c3[nH+]cc4n3CCCC4)C2)c(Cl)c1 ZINC000281735457 945832938 /nfs/dbraw/zinc/83/29/38/945832938.db2.gz AXBHVSARVWMNCF-LBPRGKRZSA-N 1 1 361.833 3.560 20 5 FHBDMO CC(C)(C)[N@H+]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000519896461 945868814 /nfs/dbraw/zinc/86/88/14/945868814.db2.gz PXSUQXHFBIAHHO-UHFFFAOYSA-N 1 1 354.838 3.586 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@]2(C1)OCc1ccccc12 ZINC000186438498 945916240 /nfs/dbraw/zinc/91/62/40/945916240.db2.gz OHHBQDQIIKMFOV-HXUWFJFHSA-N 1 1 354.406 3.625 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@]2(C1)OCc1ccccc12 ZINC000186438498 945916244 /nfs/dbraw/zinc/91/62/44/945916244.db2.gz OHHBQDQIIKMFOV-HXUWFJFHSA-N 1 1 354.406 3.625 20 5 FHBDMO COc1ccc([C@@H](C)[N@H+](C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000484544981 946014660 /nfs/dbraw/zinc/01/46/60/946014660.db2.gz RDWXSUIOQCTLAK-CQSZACIVSA-N 1 1 357.410 3.543 20 5 FHBDMO COc1ccc([C@@H](C)[N@@H+](C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000484544981 946014671 /nfs/dbraw/zinc/01/46/71/946014671.db2.gz RDWXSUIOQCTLAK-CQSZACIVSA-N 1 1 357.410 3.543 20 5 FHBDMO CC[C@@H](Cc1ccc(C)cc1)[N@@H+](CC)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000444237326 946108500 /nfs/dbraw/zinc/10/85/00/946108500.db2.gz JDMCDGDLVCWAIY-IBGZPJMESA-N 1 1 369.465 3.845 20 5 FHBDMO CC[N@@H+](CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)C1CCC1 ZINC000444254189 946131889 /nfs/dbraw/zinc/13/18/89/946131889.db2.gz RHBIPLHWRRBBFF-UHFFFAOYSA-N 1 1 360.439 3.531 20 5 FHBDMO Cc1ccc(C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])c(N2CCCC2)n1 ZINC000893480007 946365068 /nfs/dbraw/zinc/36/50/68/946365068.db2.gz HETVNHHALLBULP-UHFFFAOYSA-N 1 1 360.845 3.842 20 5 FHBDMO Cc1cc(Cl)c(C(=O)N[C@@H]2CC[N@@H+](CC3CCCC3)C2)cc1[N+](=O)[O-] ZINC001126597164 946387092 /nfs/dbraw/zinc/38/70/92/946387092.db2.gz KYVIRSQASCEUHM-CQSZACIVSA-N 1 1 365.861 3.551 20 5 FHBDMO CC[C@@]1(CO)CCC[N@H+]1Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000475129440 946434692 /nfs/dbraw/zinc/43/46/92/946434692.db2.gz QGLUBFRCPMXTNW-IBGZPJMESA-N 1 1 360.410 3.600 20 5 FHBDMO COc1ccc(OCC[N@H+]2C[C@H](c3ccc(F)cc3)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC000441395902 946551307 /nfs/dbraw/zinc/55/13/07/946551307.db2.gz NYMUMGAJKCORBX-GOEBONIOSA-N 1 1 374.412 3.999 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1Cc2ccccc2C2(CC2)C1 ZINC000186181032 946585536 /nfs/dbraw/zinc/58/55/36/946585536.db2.gz METJMWNHVSWFPU-UHFFFAOYSA-N 1 1 365.433 3.779 20 5 FHBDMO Cc1ccc([C@@H](C)NC(=O)N2CCC([N@H+]3CCC[C@@H]3C)CC2)cc1[N+](=O)[O-] ZINC000129512205 946591817 /nfs/dbraw/zinc/59/18/17/946591817.db2.gz DDPGGPHHNYSJNM-JKSUJKDBSA-N 1 1 374.485 3.623 20 5 FHBDMO CCS[C@H]1CCCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000112088292 946659703 /nfs/dbraw/zinc/65/97/03/946659703.db2.gz WFZARVFENAIKPC-HNNXBMFYSA-N 1 1 362.455 3.752 20 5 FHBDMO CC(C)(C)OC(=O)c1ccc(N(C(N)=[NH2+])c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC001167990875 946691498 /nfs/dbraw/zinc/69/14/98/946691498.db2.gz ATDDTKUCGPHHOZ-UHFFFAOYSA-N 1 1 374.372 3.721 20 5 FHBDMO CCC[N@@H+](CC)Cc1ccc(C(=O)Nc2ccc([N+](=O)[O-])c(C)n2)cc1 ZINC000475308900 946862548 /nfs/dbraw/zinc/86/25/48/946862548.db2.gz SEEIYCYHZDAJOH-UHFFFAOYSA-N 1 1 356.426 3.782 20 5 FHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000408194807 946912484 /nfs/dbraw/zinc/91/24/84/946912484.db2.gz ZHSFQARYFOWOIY-DVOMOZLQSA-N 1 1 365.861 3.726 20 5 FHBDMO CCC[N@@H+](Cc1c([N+](=O)[O-])ncn1C)[C@H]1C[C@@H](OCC)C12CCCCC2 ZINC000475356198 946937049 /nfs/dbraw/zinc/93/70/49/946937049.db2.gz SEDSLKGWPGXTKI-DLBZAZTESA-N 1 1 364.490 3.668 20 5 FHBDMO COc1ccc(C2CC[NH+](Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)cc1 ZINC000444635487 947047566 /nfs/dbraw/zinc/04/75/66/947047566.db2.gz DFQIJKKQZXAMLL-UHFFFAOYSA-N 1 1 366.421 3.859 20 5 FHBDMO CCSc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CCCC(C)(C)C1 ZINC000444618591 947050820 /nfs/dbraw/zinc/05/08/20/947050820.db2.gz KOCDPSWDWUWMMF-UHFFFAOYSA-N 1 1 365.499 3.559 20 5 FHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+](CCc3ccc(F)cc3)C3CC3)nc2c1 ZINC000444653863 947072729 /nfs/dbraw/zinc/07/27/29/947072729.db2.gz NFZXRJVHONPPNL-UHFFFAOYSA-N 1 1 354.385 3.817 20 5 FHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@@H](CCO)c1ccccc1 ZINC000441429576 947089980 /nfs/dbraw/zinc/08/99/80/947089980.db2.gz OHQYSPNOAXSJQE-IBGZPJMESA-N 1 1 358.438 3.938 20 5 FHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H](CCO)c1ccccc1 ZINC000441429576 947089991 /nfs/dbraw/zinc/08/99/91/947089991.db2.gz OHQYSPNOAXSJQE-IBGZPJMESA-N 1 1 358.438 3.938 20 5 FHBDMO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444688360 947113483 /nfs/dbraw/zinc/11/34/83/947113483.db2.gz JFEKJKYEMOWJQL-NSHDSACASA-N 1 1 356.430 3.582 20 5 FHBDMO C[C@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1cccc(OCc2ccccc2)c1 ZINC000444705557 947133448 /nfs/dbraw/zinc/13/34/48/947133448.db2.gz NFSYLLKHRLZCNR-HNNXBMFYSA-N 1 1 366.421 3.758 20 5 FHBDMO C[C@@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1cccc(OCc2ccccc2)c1 ZINC000444725481 947168879 /nfs/dbraw/zinc/16/88/79/947168879.db2.gz NFSYLLKHRLZCNR-OAHLLOKOSA-N 1 1 366.421 3.758 20 5 FHBDMO C[C@@H]1C[C@@H](NC(=O)c2ccc(F)cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000150781170 947535547 /nfs/dbraw/zinc/53/55/47/947535547.db2.gz ZVILIDPPHKKONY-PBHICJAKSA-N 1 1 371.412 3.517 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCC([N@@H+]2CCC[C@H]2C)CC1 ZINC000120347101 947599371 /nfs/dbraw/zinc/59/93/71/947599371.db2.gz BDANQIIBWDHXHR-OAHLLOKOSA-N 1 1 360.458 3.692 20 5 FHBDMO CCC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@H](C)c1cc2ccccc2o1 ZINC000536378150 947847882 /nfs/dbraw/zinc/84/78/82/947847882.db2.gz KLFHAAJIVWTNHX-OAHLLOKOSA-N 1 1 369.421 3.976 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)C(C)(C)c1ccccc1 ZINC000585754406 948261196 /nfs/dbraw/zinc/26/11/96/948261196.db2.gz MOVLIVYGSGBAJT-UHFFFAOYSA-N 1 1 371.437 3.799 20 5 FHBDMO C[N@@H+](CCCOc1ccccc1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728896732 948588303 /nfs/dbraw/zinc/58/83/03/948588303.db2.gz KIYLZMXEHJWBMM-UHFFFAOYSA-N 1 1 366.421 3.817 20 5 FHBDMO C[N@H+]1CCC[C@@H]2CN(c3ccc([N+](=O)[O-])c(-c4ccccc4)n3)CC[C@@H]21 ZINC000090112788 948662962 /nfs/dbraw/zinc/66/29/62/948662962.db2.gz DOQNLBLJZWOFEU-SJORKVTESA-N 1 1 352.438 3.577 20 5 FHBDMO CC(C)c1ccc(C[NH2+][C@H](C[S@](C)=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000182097269 948663244 /nfs/dbraw/zinc/66/32/44/948663244.db2.gz VUUUCDAXQZDNIS-CJAUYULYSA-N 1 1 360.479 3.928 20 5 FHBDMO COc1ccc(CN2CCC[C@@H](C[N@H+]3CCCC[C@H]3C)C2)cc1[N+](=O)[O-] ZINC000512182460 948706236 /nfs/dbraw/zinc/70/62/36/948706236.db2.gz SHAGMLVOVHCWFU-SJLPKXTDSA-N 1 1 361.486 3.690 20 5 FHBDMO COc1ccc([C@H](C)[N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000109094506 209298159 /nfs/dbraw/zinc/29/81/59/209298159.db2.gz YSUBSTPOJKYSLK-HNNXBMFYSA-N 1 1 371.437 3.933 20 5 FHBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3cccs3)CC2)c(C(F)(F)F)c1 ZINC000108930237 132244139 /nfs/dbraw/zinc/24/41/39/132244139.db2.gz RLPMGACSOPRXOD-UHFFFAOYSA-N 1 1 371.384 3.997 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H](C)[N@@H+]1CCc2sccc2C1 ZINC000043148872 567826939 /nfs/dbraw/zinc/82/69/39/567826939.db2.gz NFJJMSKBUBLQQD-CYBMUJFWSA-N 1 1 374.466 3.533 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H](C)[N@H+]1CCc2sccc2C1 ZINC000043148872 567826941 /nfs/dbraw/zinc/82/69/41/567826941.db2.gz NFJJMSKBUBLQQD-CYBMUJFWSA-N 1 1 374.466 3.533 20 5 FHBDMO CC[C@@H]1[C@H](C)CC[N@H+]1Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000481414149 567909384 /nfs/dbraw/zinc/90/93/84/567909384.db2.gz OEVMLQBTLVJKSX-DGCLKSJQSA-N 1 1 358.385 3.868 20 5 FHBDMO CC(=O)NCC[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000568448369 568039233 /nfs/dbraw/zinc/03/92/33/568039233.db2.gz IOWMYBMINORMKJ-INIZCTEOSA-N 1 1 371.437 3.593 20 5 FHBDMO C[C@@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@H](c2ccco2)C1 ZINC000072905303 568057048 /nfs/dbraw/zinc/05/70/48/568057048.db2.gz ZHMDCCQKQKDIMR-PBHICJAKSA-N 1 1 357.410 3.624 20 5 FHBDMO C[C@@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@H](c2ccco2)C1 ZINC000072905303 568057049 /nfs/dbraw/zinc/05/70/49/568057049.db2.gz ZHMDCCQKQKDIMR-PBHICJAKSA-N 1 1 357.410 3.624 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@]2(C1)OCc1ccccc12 ZINC000481715162 568094013 /nfs/dbraw/zinc/09/40/13/568094013.db2.gz XITUVHLDDSZNJR-FQEVSTJZSA-N 1 1 354.406 3.625 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@]2(C1)OCc1ccccc12 ZINC000481715162 568094014 /nfs/dbraw/zinc/09/40/14/568094014.db2.gz XITUVHLDDSZNJR-FQEVSTJZSA-N 1 1 354.406 3.625 20 5 FHBDMO CSc1ccc(NC(=O)[C@H](C)[N@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000570296028 568473511 /nfs/dbraw/zinc/47/35/11/568473511.db2.gz BGCVDKNMAGGSTI-AWEZNQCLSA-N 1 1 373.478 3.818 20 5 FHBDMO CSc1ccc(NC(=O)[C@H](C)[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000570296028 568473512 /nfs/dbraw/zinc/47/35/12/568473512.db2.gz BGCVDKNMAGGSTI-AWEZNQCLSA-N 1 1 373.478 3.818 20 5 FHBDMO O=[N+]([O-])c1c(Cl)ccnc1N1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001164618859 719055919 /nfs/dbraw/zinc/05/59/19/719055919.db2.gz BZQUXJUVAZULQO-NVXWUHKLSA-N 1 1 372.856 3.744 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccc2c(c1)OCCCO2 ZINC000178729222 936326692 /nfs/dbraw/zinc/32/66/92/936326692.db2.gz ATPIESMBVINKEM-ZDUSSCGKSA-N 1 1 358.394 3.616 20 5 FHBDMO CC(C)([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1cccc(Cl)c1F ZINC000186891233 927481806 /nfs/dbraw/zinc/48/18/06/927481806.db2.gz ZZABARZADAQQJK-UHFFFAOYSA-N 1 1 365.792 3.851 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@](O)(C(F)(F)F)CC2)ccc1Cl ZINC000285605729 927847276 /nfs/dbraw/zinc/84/72/76/927847276.db2.gz PVMDYLKPKXVMDP-ZDUSSCGKSA-N 1 1 352.740 3.528 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@](O)(C(F)(F)F)CC2)ccc1Cl ZINC000285605729 927847294 /nfs/dbraw/zinc/84/72/94/927847294.db2.gz PVMDYLKPKXVMDP-ZDUSSCGKSA-N 1 1 352.740 3.528 20 5 FHBDMO C[C@H]1C[C@H](CCNC(=O)c2ccc([N+](=O)[O-])cc2)C[N@H+]1Cc1ccccc1 ZINC000510084874 927945094 /nfs/dbraw/zinc/94/50/94/927945094.db2.gz GQYJLGVIELKJPQ-WMZOPIPTSA-N 1 1 367.449 3.625 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1CN[C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000430203833 928002743 /nfs/dbraw/zinc/00/27/43/928002743.db2.gz JJGUYZPJHUEQEO-JXFKEZNVSA-N 1 1 369.465 3.604 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H]1c1ccc2c(c1)OCO2 ZINC000430214591 928177210 /nfs/dbraw/zinc/17/72/10/928177210.db2.gz BXSHVPUDEXWMHX-INIZCTEOSA-N 1 1 356.378 3.669 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]1c1ccc2c(c1)OCO2 ZINC000430214591 928177216 /nfs/dbraw/zinc/17/72/16/928177216.db2.gz BXSHVPUDEXWMHX-INIZCTEOSA-N 1 1 356.378 3.669 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1ccc(SC)c(OC)c1 ZINC000430225913 928305027 /nfs/dbraw/zinc/30/50/27/928305027.db2.gz NEMHCVNJLBFFJN-UHFFFAOYSA-N 1 1 362.451 3.966 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1ccc(SC)c(OC)c1 ZINC000430225913 928305040 /nfs/dbraw/zinc/30/50/40/928305040.db2.gz NEMHCVNJLBFFJN-UHFFFAOYSA-N 1 1 362.451 3.966 20 5 FHBDMO Cc1ccccc1OCCC[N@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001167083749 928755082 /nfs/dbraw/zinc/75/50/82/928755082.db2.gz IREQVARTFDEODZ-INIZCTEOSA-N 1 1 371.437 3.631 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H]2C[C@H](O)c2ccc(F)cc2)cs1 ZINC000134780718 929237113 /nfs/dbraw/zinc/23/71/13/929237113.db2.gz UYUSGAHZEHYHEO-HOTGVXAUSA-N 1 1 350.415 3.884 20 5 FHBDMO CN(C(=O)[C@@H]1CC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1)c1ccccc1 ZINC000430295860 929387760 /nfs/dbraw/zinc/38/77/60/929387760.db2.gz BQLYBEJJBNZWJA-OAHLLOKOSA-N 1 1 373.840 3.733 20 5 FHBDMO C[C@H]([NH2+]C[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000165333561 929509569 /nfs/dbraw/zinc/50/95/69/929509569.db2.gz KCLXVJUSCIGDQE-HKUYNNGSSA-N 1 1 353.466 3.810 20 5 FHBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275676361 929834536 /nfs/dbraw/zinc/83/45/36/929834536.db2.gz BTYXXPYWCKLNBV-VBKZILBWSA-N 1 1 363.461 3.506 20 5 FHBDMO Cc1cc(C(=O)N[C@H]2CC[N@@H+](C)[C@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000536370132 930480002 /nfs/dbraw/zinc/48/00/02/930480002.db2.gz JKKJPKQHTFZVEQ-WMZOPIPTSA-N 1 1 373.840 3.732 20 5 FHBDMO Cc1cc(C(=O)N[C@H]2CC[N@H+](C)[C@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000536370132 930480009 /nfs/dbraw/zinc/48/00/09/930480009.db2.gz JKKJPKQHTFZVEQ-WMZOPIPTSA-N 1 1 373.840 3.732 20 5 FHBDMO COc1ccc([C@H](CN(C)C)[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000580459156 930700126 /nfs/dbraw/zinc/70/01/26/930700126.db2.gz FDHPIHWMFOVECZ-BEFAXECRSA-N 1 1 357.454 3.865 20 5 FHBDMO Cc1ccnc(-c2n[nH]c([C@@H](C)[NH2+][C@@H](C)c3cc([N+](=O)[O-])ccc3C)n2)c1 ZINC000580511418 930785651 /nfs/dbraw/zinc/78/56/51/930785651.db2.gz FHNNORMDPQEDDD-UONOGXRCSA-N 1 1 366.425 3.804 20 5 FHBDMO Cc1cc(C(=O)N2CC[N@H+](Cc3ccccc3)CC[C@H]2C)cc([N+](=O)[O-])c1 ZINC000610445883 930792378 /nfs/dbraw/zinc/79/23/78/930792378.db2.gz JGGWJZQPQZWCAP-QGZVFWFLSA-N 1 1 367.449 3.640 20 5 FHBDMO Cc1cc(C(=O)N2CC[N@H+](Cc3ccccc3)CC[C@H]2C)ccc1[N+](=O)[O-] ZINC000610446398 930817555 /nfs/dbraw/zinc/81/75/55/930817555.db2.gz WYKOXPAGNXCNGG-QGZVFWFLSA-N 1 1 367.449 3.640 20 5 FHBDMO CC[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)[C@H](C)c1ccc(F)cc1 ZINC000516616600 945070133 /nfs/dbraw/zinc/07/01/33/945070133.db2.gz LQVAQCMVKHBZPY-RDTXWAMCSA-N 1 1 362.401 3.557 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H](c2nccs2)C1 ZINC000157013062 931774571 /nfs/dbraw/zinc/77/45/71/931774571.db2.gz SAKNLNYYPFNHIF-AWEZNQCLSA-N 1 1 374.466 3.568 20 5 FHBDMO Cc1noc(C2(C)CC[NH+](Cc3cc([N+](=O)[O-])ccc3OC(C)C)CC2)n1 ZINC000510437884 932343829 /nfs/dbraw/zinc/34/38/29/932343829.db2.gz KBGAVDYLFJJZRR-UHFFFAOYSA-N 1 1 374.441 3.627 20 5 FHBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000588441939 933073989 /nfs/dbraw/zinc/07/39/89/933073989.db2.gz OEFBQTSTGCXREQ-WWVZVDDJSA-N 1 1 371.481 3.767 20 5 FHBDMO C[N@@H+](C1CCCC1)C(C)(C)C(=O)OCc1cc([N+](=O)[O-])ccc1Cl ZINC000754868535 933162698 /nfs/dbraw/zinc/16/26/98/933162698.db2.gz KZIXDFWJIQOIEA-UHFFFAOYSA-N 1 1 354.834 3.944 20 5 FHBDMO CC(C)c1ccc(C[N@@H+]2C[C@@H](C)O[C@]3(CCO[C@H](C)C3)C2)cc1[N+](=O)[O-] ZINC000430761510 933215295 /nfs/dbraw/zinc/21/52/95/933215295.db2.gz MAVCPGMXDUAKCJ-QINHECLXSA-N 1 1 362.470 3.877 20 5 FHBDMO CC(C)c1ccc(C[N@H+]2C[C@@H](C)O[C@]3(CCO[C@H](C)C3)C2)cc1[N+](=O)[O-] ZINC000430761510 933215297 /nfs/dbraw/zinc/21/52/97/933215297.db2.gz MAVCPGMXDUAKCJ-QINHECLXSA-N 1 1 362.470 3.877 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCSC2(CCCCC2)C1 ZINC000430771056 933224273 /nfs/dbraw/zinc/22/42/73/933224273.db2.gz AXRCQXWJWSMAHF-UHFFFAOYSA-N 1 1 363.483 3.593 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCSC2(CCCCC2)C1 ZINC000430771056 933224276 /nfs/dbraw/zinc/22/42/76/933224276.db2.gz AXRCQXWJWSMAHF-UHFFFAOYSA-N 1 1 363.483 3.593 20 5 FHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@H](C)O[C@]2(CCO[C@H](C)C2)C1 ZINC000430780863 933233480 /nfs/dbraw/zinc/23/34/80/933233480.db2.gz PPTJTRAFSDEPFE-JTQVLOKQSA-N 1 1 360.454 3.657 20 5 FHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1C[C@H](C)O[C@]2(CCO[C@H](C)C2)C1 ZINC000430780863 933233485 /nfs/dbraw/zinc/23/34/85/933233485.db2.gz PPTJTRAFSDEPFE-JTQVLOKQSA-N 1 1 360.454 3.657 20 5 FHBDMO Cn1nccc1[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000510616172 933297871 /nfs/dbraw/zinc/29/78/71/933297871.db2.gz FFDPMDAEEOBKSB-MRXNPFEDSA-N 1 1 366.421 3.968 20 5 FHBDMO CCCn1cc[nH+]c1CCCN(C)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000510796594 933736504 /nfs/dbraw/zinc/73/65/04/933736504.db2.gz MUDXQNDDMVDOGE-UHFFFAOYSA-N 1 1 352.385 3.544 20 5 FHBDMO Cc1cccc(C(=O)NC[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)c1[N+](=O)[O-] ZINC000247511401 934011383 /nfs/dbraw/zinc/01/13/83/934011383.db2.gz VSBRCUNWKOPXMR-RDTXWAMCSA-N 1 1 373.478 3.778 20 5 FHBDMO Cc1ccc(C[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C(C)C)s1 ZINC000065161861 934509313 /nfs/dbraw/zinc/50/93/13/934509313.db2.gz LYWZDBAEOAKRJH-UHFFFAOYSA-N 1 1 373.478 3.764 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@H](C)Cc1ccc(O)cc1 ZINC000119424628 934513155 /nfs/dbraw/zinc/51/31/55/934513155.db2.gz CNBNLCWQFCPILC-OAHLLOKOSA-N 1 1 371.437 3.500 20 5 FHBDMO Cn1cc[nH+]c1C[C@@H](Nc1ncc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000610929469 934626173 /nfs/dbraw/zinc/62/61/73/934626173.db2.gz LSBPEOCBHOOTER-CQSZACIVSA-N 1 1 357.801 3.773 20 5 FHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@H]2c2ccc3c(c2)OCCO3)cc1 ZINC000065208806 934667570 /nfs/dbraw/zinc/66/75/70/934667570.db2.gz JJSROFRJJIESAQ-SFHVURJKSA-N 1 1 370.405 3.582 20 5 FHBDMO CCC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)Cc1ccc(C)cc1 ZINC000611565419 934936332 /nfs/dbraw/zinc/93/63/32/934936332.db2.gz BDGCVZUUVMJGRS-UHFFFAOYSA-N 1 1 371.437 3.763 20 5 FHBDMO Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CCc2ccccc2[C@H]1Cc1ccccc1 ZINC000536394503 934950902 /nfs/dbraw/zinc/95/09/02/934950902.db2.gz JDSKDYDEPSTYAH-LJQANCHMSA-N 1 1 362.433 3.670 20 5 FHBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCc2ccccc2[C@H]1Cc1ccccc1 ZINC000536394503 934950907 /nfs/dbraw/zinc/95/09/07/934950907.db2.gz JDSKDYDEPSTYAH-LJQANCHMSA-N 1 1 362.433 3.670 20 5 FHBDMO C[C@@H](C(=O)Nc1cccc(Cl)c1)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511074878 935263573 /nfs/dbraw/zinc/26/35/73/935263573.db2.gz WUWYRTBTIYXKDJ-ZDUSSCGKSA-N 1 1 361.829 3.750 20 5 FHBDMO C[C@@H](C(=O)Nc1cccc(Cl)c1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511074878 935263577 /nfs/dbraw/zinc/26/35/77/935263577.db2.gz WUWYRTBTIYXKDJ-ZDUSSCGKSA-N 1 1 361.829 3.750 20 5 FHBDMO COCC[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@@H]1CCOC1 ZINC000426531392 945093554 /nfs/dbraw/zinc/09/35/54/945093554.db2.gz SJBYLDWFUHANBT-CQSZACIVSA-N 1 1 362.451 3.561 20 5 FHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3cnccn3)CC2)c(C(F)(F)F)c1 ZINC000375674131 935353898 /nfs/dbraw/zinc/35/38/98/935353898.db2.gz SCNIKAHMMGJMQF-UHFFFAOYSA-N 1 1 366.343 3.783 20 5 FHBDMO Cc1ccc(CNC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c(N2CCCC2)[nH+]1 ZINC000611582622 935419801 /nfs/dbraw/zinc/41/98/01/935419801.db2.gz KQNIRLFYFGMMNI-UHFFFAOYSA-N 1 1 369.425 3.529 20 5 FHBDMO Cc1ccc(Cl)cc1NC(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511105635 935582544 /nfs/dbraw/zinc/58/25/44/935582544.db2.gz FHIZUBFMFBWHHZ-UHFFFAOYSA-N 1 1 361.829 3.670 20 5 FHBDMO Cc1ccc(Cl)cc1NC(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511105635 935582546 /nfs/dbraw/zinc/58/25/46/935582546.db2.gz FHIZUBFMFBWHHZ-UHFFFAOYSA-N 1 1 361.829 3.670 20 5 FHBDMO CCCC[N@@H+](C)Cc1cc(OC)c(OCC(F)(F)F)cc1[N+](=O)[O-] ZINC000158158600 935596837 /nfs/dbraw/zinc/59/68/37/935596837.db2.gz NYKYDLUZDQBKSC-UHFFFAOYSA-N 1 1 350.337 3.776 20 5 FHBDMO CC(C)C[N@H+]1Cc2cccc(NC(=O)COc3ccc([N+](=O)[O-])cc3)c2C1 ZINC000158268012 935665668 /nfs/dbraw/zinc/66/56/68/935665668.db2.gz AGQCCGKBCMKICL-UHFFFAOYSA-N 1 1 369.421 3.584 20 5 FHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc(Oc2ccccc2)nn1 ZINC000511119541 935677606 /nfs/dbraw/zinc/67/76/06/935677606.db2.gz AFPKQDZXWATOBU-UHFFFAOYSA-N 1 1 364.405 3.852 20 5 FHBDMO CCN(C(=O)[C@H](C)[N@H+](C)CCc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000511126603 935715607 /nfs/dbraw/zinc/71/56/07/935715607.db2.gz ZILCRUGMKHBKSN-INIZCTEOSA-N 1 1 361.486 3.639 20 5 FHBDMO CCN(C(=O)[C@H](C)[N@@H+](C)CCc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000511126603 935715610 /nfs/dbraw/zinc/71/56/10/935715610.db2.gz ZILCRUGMKHBKSN-INIZCTEOSA-N 1 1 361.486 3.639 20 5 FHBDMO CC(C)[C@@H](NC(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000511138585 935772168 /nfs/dbraw/zinc/77/21/68/935772168.db2.gz OEPQUGMLWUPUFC-OAQYLSRUSA-N 1 1 369.465 3.583 20 5 FHBDMO CC(C)[C@@H](NC(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000511138585 935772170 /nfs/dbraw/zinc/77/21/70/935772170.db2.gz OEPQUGMLWUPUFC-OAQYLSRUSA-N 1 1 369.465 3.583 20 5 FHBDMO COc1cc(C[N@@H+](C)CC2CCC2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000127778218 935785276 /nfs/dbraw/zinc/78/52/76/935785276.db2.gz AFAAOHOSTHCHPM-UHFFFAOYSA-N 1 1 362.348 3.776 20 5 FHBDMO CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)[C@@H](C)[C@@H]1C ZINC000540793625 935797443 /nfs/dbraw/zinc/79/74/43/935797443.db2.gz FFYQPAAVJWGYHS-KBPBESRZSA-N 1 1 365.499 3.652 20 5 FHBDMO CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)[C@@H](C)[C@@H]1C ZINC000540793625 935797445 /nfs/dbraw/zinc/79/74/45/935797445.db2.gz FFYQPAAVJWGYHS-KBPBESRZSA-N 1 1 365.499 3.652 20 5 FHBDMO Cn1cc([C@@H]([NH2+]C/C=C\c2ccccc2[N+](=O)[O-])c2ccc(F)cc2)cn1 ZINC000479411980 935837365 /nfs/dbraw/zinc/83/73/65/935837365.db2.gz BSZVXHOASMXZIO-MNBNYPOFSA-N 1 1 366.396 3.860 20 5 FHBDMO CC(C)[N@H+]1CCCN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CC1 ZINC000277747432 935877998 /nfs/dbraw/zinc/87/79/98/935877998.db2.gz PUHVQGWQJMTOIZ-UHFFFAOYSA-N 1 1 363.461 3.650 20 5 FHBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CCC[C@H]2COC)cc1OC ZINC000611668878 935891745 /nfs/dbraw/zinc/89/17/45/935891745.db2.gz UTCYMVVILXLYCA-HOCLYGCPSA-N 1 1 366.458 3.639 20 5 FHBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CCC[C@H]2COC)cc1OC ZINC000611668878 935891748 /nfs/dbraw/zinc/89/17/48/935891748.db2.gz UTCYMVVILXLYCA-HOCLYGCPSA-N 1 1 366.458 3.639 20 5 FHBDMO C[C@@]1(CCc2ccccc2)CC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC001167599248 935945879 /nfs/dbraw/zinc/94/58/79/935945879.db2.gz RGPWVSPRXQBQDW-OAQYLSRUSA-N 1 1 367.449 3.878 20 5 FHBDMO C[C@@]1(CCc2ccccc2)CC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC001167599248 935945881 /nfs/dbraw/zinc/94/58/81/935945881.db2.gz RGPWVSPRXQBQDW-OAQYLSRUSA-N 1 1 367.449 3.878 20 5 FHBDMO Cc1c(C[N@H+](C)[C@@H](C)c2ccc(-n3cncn3)cc2)cccc1[N+](=O)[O-] ZINC000051855290 935953801 /nfs/dbraw/zinc/95/38/01/935953801.db2.gz RFPVCMKBQGQOMY-HNNXBMFYSA-N 1 1 351.410 3.677 20 5 FHBDMO C[C@@H](Cc1cccs1)[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC001167609096 936050286 /nfs/dbraw/zinc/05/02/86/936050286.db2.gz SAEXVEPQNPCMJK-LBPRGKRZSA-N 1 1 365.430 3.687 20 5 FHBDMO CCn1c(C)nc([N+](=O)[O-])c1NCC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000582747006 936071630 /nfs/dbraw/zinc/07/16/30/936071630.db2.gz ZQTXPXJYHILSSX-CRAIPNDOSA-N 1 1 371.485 3.832 20 5 FHBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)NCCCC[N@H+]1CCCC[C@H]1C ZINC000582756137 936081128 /nfs/dbraw/zinc/08/11/28/936081128.db2.gz UMCGVPRXMZEEJY-OAHLLOKOSA-N 1 1 362.474 3.933 20 5 FHBDMO CC[N@@H+](C)C[C@H]1CCN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C1 ZINC000078583616 936211688 /nfs/dbraw/zinc/21/16/88/936211688.db2.gz ATCSLNINXPTEKB-MRXNPFEDSA-N 1 1 367.449 3.604 20 5 FHBDMO Cc1nc(C)n(C[C@@H]2CCC[N@H+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC000245524305 938302765 /nfs/dbraw/zinc/30/27/65/938302765.db2.gz NJOSELNDUSCYDR-WMLDXEAASA-N 1 1 357.458 3.585 20 5 FHBDMO CC(C)(C(=O)NC[C@@H]1CCC[N@H+]1C1CCCCC1)c1ccccc1[N+](=O)[O-] ZINC000511806523 945166325 /nfs/dbraw/zinc/16/63/25/945166325.db2.gz JYJHGWWCECHMEU-KRWDZBQOSA-N 1 1 373.497 3.786 20 5 FHBDMO CCCCNC(=O)[C@@H]1CC[C@@H](C)[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000543853327 938399528 /nfs/dbraw/zinc/39/95/28/938399528.db2.gz NIMMXZSJMJTOJO-UKRRQHHQSA-N 1 1 367.877 3.765 20 5 FHBDMO CS[C@@H]1CCCC[N@@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000246979506 938424983 /nfs/dbraw/zinc/42/49/83/938424983.db2.gz VVIFPAPWOLEHKK-DGCLKSJQSA-N 1 1 371.890 3.793 20 5 FHBDMO CS[C@@H]1CCCC[N@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000246979506 938424984 /nfs/dbraw/zinc/42/49/84/938424984.db2.gz VVIFPAPWOLEHKK-DGCLKSJQSA-N 1 1 371.890 3.793 20 5 FHBDMO Cc1c[nH+]ccc1OC1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000278525537 938503370 /nfs/dbraw/zinc/50/33/70/938503370.db2.gz GWTOBFWIYPWGIZ-UHFFFAOYSA-N 1 1 374.372 3.513 20 5 FHBDMO COC(=O)c1cc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)oc1C ZINC000278574430 938546891 /nfs/dbraw/zinc/54/68/91/938546891.db2.gz GQRBSCVWRVJTPB-UHFFFAOYSA-N 1 1 372.299 3.591 20 5 FHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](C)[C@@H](n2ccnc2)C1 ZINC000136085706 938991330 /nfs/dbraw/zinc/99/13/30/938991330.db2.gz BMWYYCJBXWVZOF-YJBOKZPZSA-N 1 1 358.442 3.662 20 5 FHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CC[C@@H](Cc3ccncc3)C2)c1 ZINC000611983710 939011803 /nfs/dbraw/zinc/01/18/03/939011803.db2.gz BGOIESNZFXNPPX-AWEZNQCLSA-N 1 1 363.364 3.656 20 5 FHBDMO COc1ccc(-c2ccc(C[NH2+]Cc3cccnc3OC)o2)c([N+](=O)[O-])c1 ZINC000102421480 939018557 /nfs/dbraw/zinc/01/85/57/939018557.db2.gz KUXDZKZSSLGVJA-UHFFFAOYSA-N 1 1 369.377 3.557 20 5 FHBDMO COC[C@@H](C)[N@@H+](C)Cc1ccc(OCc2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000179373219 939126662 /nfs/dbraw/zinc/12/66/62/939126662.db2.gz LNQFQKIPFYVNBL-OAHLLOKOSA-N 1 1 374.437 3.649 20 5 FHBDMO C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCc2ccccc21 ZINC000073741557 945231403 /nfs/dbraw/zinc/23/14/03/945231403.db2.gz ADOGSPXZKBENHJ-QGZVFWFLSA-N 1 1 350.378 3.764 20 5 FHBDMO C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCc2ccccc21 ZINC000073741557 945231408 /nfs/dbraw/zinc/23/14/08/945231408.db2.gz ADOGSPXZKBENHJ-QGZVFWFLSA-N 1 1 350.378 3.764 20 5 FHBDMO Cc1ccc(C[N@@H+]2CC[C@@H](CN(C)C(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000179449626 939164483 /nfs/dbraw/zinc/16/44/83/939164483.db2.gz WYGMFOVYSSDHFN-INIZCTEOSA-N 1 1 363.458 3.592 20 5 FHBDMO O=[N+]([O-])c1ccccc1CN1CCC[N@@H+](CCCc2ccccc2)CC1 ZINC000507448605 945242882 /nfs/dbraw/zinc/24/28/82/945242882.db2.gz KYNMBEJXLDIYTG-UHFFFAOYSA-N 1 1 353.466 3.735 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCOC4(CCOCC4)CC3)o2)c1 ZINC000364238174 939915349 /nfs/dbraw/zinc/91/53/49/939915349.db2.gz QJSZOKSHCWISIB-UHFFFAOYSA-N 1 1 372.421 3.626 20 5 FHBDMO Cc1nc(C)c([C@H](C)[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)s1 ZINC000411282504 940027426 /nfs/dbraw/zinc/02/74/26/940027426.db2.gz UZYLJCKTSRVQFR-LBPRGKRZSA-N 1 1 362.455 3.690 20 5 FHBDMO CCC[N@@H+](C[C@H]1CCCCO1)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000411371162 940032881 /nfs/dbraw/zinc/03/28/81/940032881.db2.gz WUVHWDXLQGNFBQ-RHSMWYFYSA-N 1 1 374.441 3.987 20 5 FHBDMO CCc1ccc([C@H](N[C@@H]2CC[N@@H+](CC3CC3)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612410057 940054434 /nfs/dbraw/zinc/05/44/34/940054434.db2.gz YCVUASLUDRINSX-DYESRHJHSA-N 1 1 369.465 3.914 20 5 FHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)[C@@H]1CCN(c2ccccc2Cl)C1=O ZINC000548934539 940094871 /nfs/dbraw/zinc/09/48/71/940094871.db2.gz JALYXQDSMMGYQP-GOSISDBHSA-N 1 1 373.840 3.528 20 5 FHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)[C@@H]1CCN(c2ccccc2Cl)C1=O ZINC000548934539 940094874 /nfs/dbraw/zinc/09/48/74/940094874.db2.gz JALYXQDSMMGYQP-GOSISDBHSA-N 1 1 373.840 3.528 20 5 FHBDMO Cc1cc(Cl)ccc1NC(=O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548935761 940101029 /nfs/dbraw/zinc/10/10/29/940101029.db2.gz WTGPWKXWXBBQFD-UHFFFAOYSA-N 1 1 361.829 3.670 20 5 FHBDMO Cc1cc(Cl)ccc1NC(=O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548935761 940101030 /nfs/dbraw/zinc/10/10/30/940101030.db2.gz WTGPWKXWXBBQFD-UHFFFAOYSA-N 1 1 361.829 3.670 20 5 FHBDMO CC(=O)c1cc(N2CCC[C@@H](n3cc[nH+]c3C(C)C)C2)ccc1[N+](=O)[O-] ZINC000376172090 940412895 /nfs/dbraw/zinc/41/28/95/940412895.db2.gz KCEQQNORRZNRTI-MRXNPFEDSA-N 1 1 356.426 3.959 20 5 FHBDMO CC[C@@H]1CN(c2ccccc2)CC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000613130304 940462663 /nfs/dbraw/zinc/46/26/63/940462663.db2.gz VUXDILSBCCRPNZ-OAHLLOKOSA-N 1 1 366.421 3.837 20 5 FHBDMO CC[C@@H]1CN(c2ccccc2)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000613130304 940462665 /nfs/dbraw/zinc/46/26/65/940462665.db2.gz VUXDILSBCCRPNZ-OAHLLOKOSA-N 1 1 366.421 3.837 20 5 FHBDMO C[C@@H]1C[C@@H](c2ccc(F)cc2)C[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000580602024 940482127 /nfs/dbraw/zinc/48/21/27/940482127.db2.gz ZMPHSBQYXSGUAR-GDBMZVCRSA-N 1 1 371.412 3.941 20 5 FHBDMO CC(C)(C)OC(=O)NC[C@H]1CC[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000178012430 940506352 /nfs/dbraw/zinc/50/63/52/940506352.db2.gz YQRCIVCURDKBSB-CYBMUJFWSA-N 1 1 369.849 3.595 20 5 FHBDMO CC(C)(C)OC(=O)NC[C@H]1CC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000178012430 940506354 /nfs/dbraw/zinc/50/63/54/940506354.db2.gz YQRCIVCURDKBSB-CYBMUJFWSA-N 1 1 369.849 3.595 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]Cc1ccc(N2CCCCC2)nc1 ZINC000892592174 940882650 /nfs/dbraw/zinc/88/26/50/940882650.db2.gz NWFHVOXYZCPYCR-UHFFFAOYSA-N 1 1 360.845 3.923 20 5 FHBDMO CCOCc1nc([C@H](C)[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])no1 ZINC000290200179 940924650 /nfs/dbraw/zinc/92/46/50/940924650.db2.gz PALIMZGBLCLVJW-DZKIICNBSA-N 1 1 374.441 3.576 20 5 FHBDMO CCN(C(=O)c1ccc([N+](=O)[O-])cc1C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000186330367 940978032 /nfs/dbraw/zinc/97/80/32/940978032.db2.gz XWMDBDTYEJRQDO-IBGZPJMESA-N 1 1 367.449 3.640 20 5 FHBDMO Cc1nn(C)c(C)c1C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180364723 940989411 /nfs/dbraw/zinc/98/94/11/940989411.db2.gz YOBJIOIMAWDPRW-HXUWFJFHSA-N 1 1 350.422 3.824 20 5 FHBDMO O=[N+]([O-])c1cc(F)c(C[NH2+][C@H](c2cccs2)C2(CO)CCC2)c(F)c1 ZINC000452058173 941012856 /nfs/dbraw/zinc/01/28/56/941012856.db2.gz HSFQOYXNAUOGHP-MRXNPFEDSA-N 1 1 368.405 3.928 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCS[C@@H]4COCC[C@@H]43)o2)c1 ZINC000180456607 941023070 /nfs/dbraw/zinc/02/30/70/941023070.db2.gz JGGFWWAVYYRTRC-FUHWJXTLSA-N 1 1 360.435 3.561 20 5 FHBDMO CC(C)n1cnnc1[C@@H]1CCC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000180628594 941056936 /nfs/dbraw/zinc/05/69/36/941056936.db2.gz KMUAEPFKBIBOLH-CQSZACIVSA-N 1 1 363.849 3.800 20 5 FHBDMO CC(C)n1cnnc1[C@@H]1CCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000180628594 941056939 /nfs/dbraw/zinc/05/69/39/941056939.db2.gz KMUAEPFKBIBOLH-CQSZACIVSA-N 1 1 363.849 3.800 20 5 FHBDMO CO[C@@H]1CC[C@H]2OCC[N@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)[C@@H]2C1 ZINC000180815566 941080679 /nfs/dbraw/zinc/08/06/79/941080679.db2.gz AVLSDNCWZODHQZ-YVWKXTFCSA-N 1 1 372.421 3.623 20 5 FHBDMO CO[C@@H]1CC[C@H]2OCC[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)[C@@H]2C1 ZINC000180815566 941080680 /nfs/dbraw/zinc/08/06/80/941080680.db2.gz AVLSDNCWZODHQZ-YVWKXTFCSA-N 1 1 372.421 3.623 20 5 FHBDMO C[C@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3c(N)cccc3[N+](=O)[O-])cc2)C1 ZINC000180939287 941094145 /nfs/dbraw/zinc/09/41/45/941094145.db2.gz SLCNLSDWDSOYAC-AWEZNQCLSA-N 1 1 368.437 3.661 20 5 FHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@@H](Cc4ccc(F)cc4)C3)nc2c1 ZINC000177087215 941099157 /nfs/dbraw/zinc/09/91/57/941099157.db2.gz HZQIXSNCGSXYTJ-AWEZNQCLSA-N 1 1 355.369 3.940 20 5 FHBDMO C[C@@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1cccc(N2CCOC2=O)c1 ZINC000181308026 941119989 /nfs/dbraw/zinc/11/99/89/941119989.db2.gz ADLGSWKECXHIKR-GFCCVEGCSA-N 1 1 359.357 3.541 20 5 FHBDMO COc1cc(C[NH2+][C@H]2CCOc3c(C)cccc32)c([N+](=O)[O-])cc1OC ZINC000188951136 941133051 /nfs/dbraw/zinc/13/30/51/941133051.db2.gz LKPPNKUGFTYGKN-HNNXBMFYSA-N 1 1 358.394 3.534 20 5 FHBDMO O=C(N[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000311251120 941151528 /nfs/dbraw/zinc/15/15/28/941151528.db2.gz PDPQELFAEFPTIJ-HNNXBMFYSA-N 1 1 373.840 3.643 20 5 FHBDMO C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)CC1(c2ccccc2)CC1 ZINC000189316479 941156201 /nfs/dbraw/zinc/15/62/01/941156201.db2.gz ZKBBGOGRECDCRR-UHFFFAOYSA-N 1 1 364.405 3.808 20 5 FHBDMO C[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])c3cnccc23)[C@@H]1c1cccnc1 ZINC000376738394 941398446 /nfs/dbraw/zinc/39/84/46/941398446.db2.gz DZMQRSRBDPAQOA-YWZLYKJASA-N 1 1 363.421 3.643 20 5 FHBDMO [NH3+][C@H]1CCC[C@@H](NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000414936279 941518038 /nfs/dbraw/zinc/51/80/38/941518038.db2.gz ZDZKSVQQOPUTOL-JKSUJKDBSA-N 1 1 359.401 3.886 20 5 FHBDMO [NH3+][C@H]1CCC[C@H](NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000414936269 941518139 /nfs/dbraw/zinc/51/81/39/941518139.db2.gz ZDZKSVQQOPUTOL-HOTGVXAUSA-N 1 1 359.401 3.886 20 5 FHBDMO CSc1cccc(NC(=O)[C@@H](C)[N@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000549170054 941571942 /nfs/dbraw/zinc/57/19/42/941571942.db2.gz GDCQDTVHUPREAM-CQSZACIVSA-N 1 1 373.478 3.818 20 5 FHBDMO CSc1cccc(NC(=O)[C@@H](C)[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000549170054 941571944 /nfs/dbraw/zinc/57/19/44/941571944.db2.gz GDCQDTVHUPREAM-CQSZACIVSA-N 1 1 373.478 3.818 20 5 FHBDMO CC(C)(C)OC(=O)CC[C@@H]1CCC[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000412069198 941621397 /nfs/dbraw/zinc/62/13/97/941621397.db2.gz NGXJZYKQRQFAJR-ZDUSSCGKSA-N 1 1 354.472 3.990 20 5 FHBDMO CC(C)(C)OC(=O)CC[C@@H]1CCC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000412069198 941621399 /nfs/dbraw/zinc/62/13/99/941621399.db2.gz NGXJZYKQRQFAJR-ZDUSSCGKSA-N 1 1 354.472 3.990 20 5 FHBDMO Cc1cc(N2CCC3(CCC[N@@H+]3C)CC2)c(Br)cc1[N+](=O)[O-] ZINC000473521222 941745849 /nfs/dbraw/zinc/74/58/49/941745849.db2.gz FFBXYBZYPFVGKW-UHFFFAOYSA-N 1 1 368.275 3.730 20 5 FHBDMO CSCC[N@H+](C)[C@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000151142792 941761875 /nfs/dbraw/zinc/76/18/75/941761875.db2.gz QLBGNJLUTBYTIG-SFHVURJKSA-N 1 1 373.478 3.878 20 5 FHBDMO CSCC[N@@H+](C)[C@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000151142792 941761876 /nfs/dbraw/zinc/76/18/76/941761876.db2.gz QLBGNJLUTBYTIG-SFHVURJKSA-N 1 1 373.478 3.878 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@@H](C)C[C@@H]1c1ccccc1 ZINC000513257432 941821310 /nfs/dbraw/zinc/82/13/10/941821310.db2.gz QTHFMJNGIHPREW-KBXCAEBGSA-N 1 1 369.421 3.625 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@@H](C)C[C@@H]1c1ccccc1 ZINC000513257432 941821313 /nfs/dbraw/zinc/82/13/13/941821313.db2.gz QTHFMJNGIHPREW-KBXCAEBGSA-N 1 1 369.421 3.625 20 5 FHBDMO Cn1cc[nH+]c1[C@@H]1CCN(c2c3cccc(Cl)c3ncc2[N+](=O)[O-])C1 ZINC000892986006 941841998 /nfs/dbraw/zinc/84/19/98/941841998.db2.gz SPNLOEIYCURRGX-LLVKDONJSA-N 1 1 357.801 3.524 20 5 FHBDMO CC(C)C[C@@H]1CCC[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)C1 ZINC000469110811 942002067 /nfs/dbraw/zinc/00/20/67/942002067.db2.gz XWQYWCBRWOPOSZ-HNNXBMFYSA-N 1 1 361.442 3.651 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@H](c2nnc(C3CC3)[nH]2)C1 ZINC000182975414 942042304 /nfs/dbraw/zinc/04/23/04/942042304.db2.gz SBUNOSYOFSCNMJ-HIFRSBDPSA-N 1 1 355.442 3.839 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCC[C@H](c2nc(C3CC3)n[nH]2)C1 ZINC000182975414 942042308 /nfs/dbraw/zinc/04/23/08/942042308.db2.gz SBUNOSYOFSCNMJ-HIFRSBDPSA-N 1 1 355.442 3.839 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@H](c2nc(C3CC3)n[nH]2)C1 ZINC000182975414 942042314 /nfs/dbraw/zinc/04/23/14/942042314.db2.gz SBUNOSYOFSCNMJ-HIFRSBDPSA-N 1 1 355.442 3.839 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC[C@H](c2noc(C3CC3)n2)C1 ZINC000271188421 942141735 /nfs/dbraw/zinc/14/17/35/942141735.db2.gz FERUAWVFPJWYIT-GIZXNFQBSA-N 1 1 354.410 3.748 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@H](c2noc(C3CC3)n2)C1 ZINC000271188421 942141737 /nfs/dbraw/zinc/14/17/37/942141737.db2.gz FERUAWVFPJWYIT-GIZXNFQBSA-N 1 1 354.410 3.748 20 5 FHBDMO COc1cc(C[N@H+]2CCC[C@](C)(OC)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000280425238 942180798 /nfs/dbraw/zinc/18/07/98/942180798.db2.gz ZKFURCPEXBXQNO-KRWDZBQOSA-N 1 1 374.384 3.596 20 5 FHBDMO CCS[C@H]1CCCC[N@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000480920859 942199127 /nfs/dbraw/zinc/19/91/27/942199127.db2.gz KVTWDROLEFYULE-CJNGLKHVSA-N 1 1 351.472 3.529 20 5 FHBDMO CC(=O)c1cc(N2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000396364358 942226394 /nfs/dbraw/zinc/22/63/94/942226394.db2.gz YFXAQQQMXBQAHR-HNNXBMFYSA-N 1 1 353.422 3.508 20 5 FHBDMO CC(=O)c1cc(N2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000396364358 942226397 /nfs/dbraw/zinc/22/63/97/942226397.db2.gz YFXAQQQMXBQAHR-HNNXBMFYSA-N 1 1 353.422 3.508 20 5 FHBDMO O=C(CC[N@H+]1CCC[C@@H](CC(F)(F)F)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000420943660 942268314 /nfs/dbraw/zinc/26/83/14/942268314.db2.gz IJFYILCRCXAWBB-LBPRGKRZSA-N 1 1 359.348 3.588 20 5 FHBDMO CC(C)[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])[C@H](C)c1ccsc1 ZINC000421005468 942298839 /nfs/dbraw/zinc/29/88/39/942298839.db2.gz JIQLGEYOGRMLHL-GDBMZVCRSA-N 1 1 364.467 3.868 20 5 FHBDMO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(OC)c([N+](=O)[O-])c2)cc1OC ZINC000051283952 942343587 /nfs/dbraw/zinc/34/35/87/942343587.db2.gz HOOIHGQULIMFLG-INIZCTEOSA-N 1 1 372.421 3.958 20 5 FHBDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(OC)c([N+](=O)[O-])c2)cc1OC ZINC000051283952 942343593 /nfs/dbraw/zinc/34/35/93/942343593.db2.gz HOOIHGQULIMFLG-INIZCTEOSA-N 1 1 372.421 3.958 20 5 FHBDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000502443421 942455624 /nfs/dbraw/zinc/45/56/24/942455624.db2.gz GKGBELWPAATWBB-AWEZNQCLSA-N 1 1 353.850 3.633 20 5 FHBDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000502471435 942455791 /nfs/dbraw/zinc/45/57/91/942455791.db2.gz ZIFRGVCPQIYWQB-CQSZACIVSA-N 1 1 353.850 3.633 20 5 FHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccc2c(c1)COC(C)(C)O2 ZINC000549407143 942464830 /nfs/dbraw/zinc/46/48/30/942464830.db2.gz AVJGYHNYDWOAPA-UHFFFAOYSA-N 1 1 356.422 3.914 20 5 FHBDMO COc1cc(C[N@@H+](C)[C@H]2CC[C@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000429590653 942566958 /nfs/dbraw/zinc/56/69/58/942566958.db2.gz PHZWKFLHWGATMX-AAEUAGOBSA-N 1 1 358.385 3.868 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000421491115 942605638 /nfs/dbraw/zinc/60/56/38/942605638.db2.gz NKFYXTXHWDWJBP-GOSISDBHSA-N 1 1 367.449 3.558 20 5 FHBDMO Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@@H+](C)CC2CC2)c([N+](=O)[O-])c1 ZINC000053183748 942728009 /nfs/dbraw/zinc/72/80/09/942728009.db2.gz BRQJFVMGNVIFAN-IBGZPJMESA-N 1 1 353.422 3.925 20 5 FHBDMO Cc1ccc(C[C@H]2CCC[N@H+]2Cc2cc([N+](=O)[O-])cc3c2OCOC3)cc1 ZINC000513754950 942756285 /nfs/dbraw/zinc/75/62/85/942756285.db2.gz OOXJPNMTOZQJKJ-LJQANCHMSA-N 1 1 368.433 3.977 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)C1CCN(Cc2ccncc2)CC1 ZINC000378505598 942840891 /nfs/dbraw/zinc/84/08/91/942840891.db2.gz DMWBZUTYNNSGRM-QGZVFWFLSA-N 1 1 368.481 3.956 20 5 FHBDMO CC1(C)C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC[C@H]1C(F)(F)F ZINC000190176548 942854099 /nfs/dbraw/zinc/85/40/99/942854099.db2.gz QIGCPSIZBOUORN-CQSZACIVSA-N 1 1 373.375 3.834 20 5 FHBDMO CCc1ccc([C@@H]2CN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3)CC[NH2+]2)cc1 ZINC000505469209 942863055 /nfs/dbraw/zinc/86/30/55/942863055.db2.gz NTRUPXYRKWCEHP-SFHVURJKSA-N 1 1 373.840 3.597 20 5 FHBDMO O=C(Nc1cccc2c1C[N@H+](C1CC1)C2)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000378527547 942863920 /nfs/dbraw/zinc/86/39/20/942863920.db2.gz VMHBXTSHERBVJS-UHFFFAOYSA-N 1 1 357.797 3.979 20 5 FHBDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000502996703 942898818 /nfs/dbraw/zinc/89/88/18/942898818.db2.gz GLGROMIJXPSGFB-KRWDZBQOSA-N 1 1 374.485 3.554 20 5 FHBDMO COc1ccc(C(=O)C2CC[NH+](Cc3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000014324977 943026348 /nfs/dbraw/zinc/02/63/48/943026348.db2.gz JCELNHYXMPGOCV-UHFFFAOYSA-N 1 1 354.406 3.698 20 5 FHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](c2ccccc2)[C@H]1C ZINC000434895768 943033795 /nfs/dbraw/zinc/03/37/95/943033795.db2.gz NBGOYQORBFCDCA-INMHGKMJSA-N 1 1 353.422 3.800 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](c2ccccc2)[C@H]1C ZINC000434906336 943042768 /nfs/dbraw/zinc/04/27/68/943042768.db2.gz UABCDNBGRRDXQY-QAPCUYQASA-N 1 1 353.422 3.720 20 5 FHBDMO CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ncc(Cl)cc1[N+](=O)[O-] ZINC000434944374 943056916 /nfs/dbraw/zinc/05/69/16/943056916.db2.gz VPNWZLHTVJGBLN-MRXNPFEDSA-N 1 1 374.872 3.992 20 5 FHBDMO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1noc(-c2ccccc2F)n1 ZINC000435031246 943114005 /nfs/dbraw/zinc/11/40/05/943114005.db2.gz ZFSHAZDLPRWHIU-CYBMUJFWSA-N 1 1 370.384 3.895 20 5 FHBDMO CC[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)Cc1ccccc1C ZINC000048059139 943154969 /nfs/dbraw/zinc/15/49/69/943154969.db2.gz VSHLLJQZMGBCOM-UHFFFAOYSA-N 1 1 352.394 3.975 20 5 FHBDMO CC[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)Cc1ccccc1C ZINC000048059139 943154974 /nfs/dbraw/zinc/15/49/74/943154974.db2.gz VSHLLJQZMGBCOM-UHFFFAOYSA-N 1 1 352.394 3.975 20 5 FHBDMO CN(c1ccccc1)c1ccc(CN2CCC[N@@H+](C)CC2)cc1[N+](=O)[O-] ZINC000435249931 943280494 /nfs/dbraw/zinc/28/04/94/943280494.db2.gz QBFHQFOMGFKIIE-UHFFFAOYSA-N 1 1 354.454 3.500 20 5 FHBDMO CC[C@H](N[C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000422832866 943299809 /nfs/dbraw/zinc/29/98/09/943299809.db2.gz GMQHECFODFTOOD-IRFCIJBXSA-N 1 1 367.449 3.891 20 5 FHBDMO C[C@H](N[C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000422934574 943337111 /nfs/dbraw/zinc/33/71/11/943337111.db2.gz CPKAYDNBBHSTLQ-QMIHWGKISA-N 1 1 353.422 3.501 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@H](n4ccnn4)C3)s2)cc1 ZINC000425349004 943351992 /nfs/dbraw/zinc/35/19/92/943351992.db2.gz KAWXFSDBCAMHSY-INIZCTEOSA-N 1 1 369.450 3.752 20 5 FHBDMO C[N@H+]1CCC[C@@]2(CCN(C(=O)c3cc4ccccc4c4cccnc34)C2)C1 ZINC000505681183 943368315 /nfs/dbraw/zinc/36/83/15/943368315.db2.gz IKEFCVQDKQQXLW-HSZRJFAPSA-N 1 1 359.473 3.946 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H]1c1ccccc1C ZINC000053279170 943585129 /nfs/dbraw/zinc/58/51/29/943585129.db2.gz AVKJYGYDLRVRCG-SFHVURJKSA-N 1 1 369.421 3.687 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H]1c1ccccc1C ZINC000053279170 943585132 /nfs/dbraw/zinc/58/51/32/943585132.db2.gz AVKJYGYDLRVRCG-SFHVURJKSA-N 1 1 369.421 3.687 20 5 FHBDMO O=C(NC[C@H]1CCC[N@H+]1C1CCCCC1)Nc1ccc([N+](=O)[O-])cc1F ZINC000435773734 943602708 /nfs/dbraw/zinc/60/27/08/943602708.db2.gz WOYDRQAQIQPNBR-OAHLLOKOSA-N 1 1 364.421 3.653 20 5 FHBDMO CC[N@@H+](Cc1ccc(C(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1)C1CC1 ZINC000511629807 943630762 /nfs/dbraw/zinc/63/07/62/943630762.db2.gz XDSSWASQXVDVAM-UHFFFAOYSA-N 1 1 367.449 3.552 20 5 FHBDMO Cn1cc(C[NH2+][C@@H]2C[C@]2(F)c2ccccc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000424203738 943787158 /nfs/dbraw/zinc/78/71/58/943787158.db2.gz UTJNCOJBPHFRBU-QUCCMNQESA-N 1 1 366.396 3.722 20 5 FHBDMO Cc1cnc(CC[N@H+](C)Cc2ccc(Br)cc2[N+](=O)[O-])s1 ZINC000425428031 943904081 /nfs/dbraw/zinc/90/40/81/943904081.db2.gz ZZVJHQRNVDGKBP-UHFFFAOYSA-N 1 1 370.272 3.797 20 5 FHBDMO C[C@H]1[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])CCC12CCOCC2 ZINC000425431162 943921583 /nfs/dbraw/zinc/92/15/83/943921583.db2.gz HKTCRPCNEOUJJA-GFCCVEGCSA-N 1 1 369.259 3.748 20 5 FHBDMO CCOc1ccc([C@H](C)N[C@H]2CC[N@@H+](CC3CCCC3)C2)cc1[N+](=O)[O-] ZINC000504929774 943926653 /nfs/dbraw/zinc/92/66/53/943926653.db2.gz LGUJRZGSXRCMAH-YJBOKZPZSA-N 1 1 361.486 3.909 20 5 FHBDMO CCOc1ccc([C@H](C)[NH2+][C@H]2CCN(CC3CCCC3)C2)cc1[N+](=O)[O-] ZINC000504929774 943926657 /nfs/dbraw/zinc/92/66/57/943926657.db2.gz LGUJRZGSXRCMAH-YJBOKZPZSA-N 1 1 361.486 3.909 20 5 FHBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@@H+]1CCC[C@H]1[C@H]1CCCO1 ZINC000425444416 943953000 /nfs/dbraw/zinc/95/30/00/943953000.db2.gz NOUKWSQAGZTQKY-DZGCQCFKSA-N 1 1 355.232 3.501 20 5 FHBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1CCC[C@H]1[C@H]1CCCO1 ZINC000425444416 943953026 /nfs/dbraw/zinc/95/30/26/943953026.db2.gz NOUKWSQAGZTQKY-DZGCQCFKSA-N 1 1 355.232 3.501 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21 ZINC000566529106 943965220 /nfs/dbraw/zinc/96/52/20/943965220.db2.gz IDORLWGSONJFMJ-HKBOAZHASA-N 1 1 352.434 3.908 20 5 FHBDMO COc1cc(C[N@@H+](C)C[C@@H](C)OC)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000517263108 944142339 /nfs/dbraw/zinc/14/23/39/944142339.db2.gz VINSKJOFYOEGSZ-OAHLLOKOSA-N 1 1 374.437 3.649 20 5 FHBDMO COc1cc(C[N@H+](C)C[C@@H](C)OC)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000517263108 944142345 /nfs/dbraw/zinc/14/23/45/944142345.db2.gz VINSKJOFYOEGSZ-OAHLLOKOSA-N 1 1 374.437 3.649 20 5 FHBDMO C[C@H]1[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1Cc1ccccc1 ZINC000382118480 944180591 /nfs/dbraw/zinc/18/05/91/944180591.db2.gz WHPUQBONQMIPHN-UGSOOPFHSA-N 1 1 373.840 3.641 20 5 FHBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CCCC[C@@H]1C ZINC000505788892 944183375 /nfs/dbraw/zinc/18/33/75/944183375.db2.gz YJWWMMSTDBYUIT-AWEZNQCLSA-N 1 1 365.499 3.701 20 5 FHBDMO CN(CC[N@@H+](C)C1CCCCC1)c1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000436316350 944194536 /nfs/dbraw/zinc/19/45/36/944194536.db2.gz JANFQNPDTWTKNG-UHFFFAOYSA-N 1 1 360.380 3.709 20 5 FHBDMO CCCn1cc[nH+]c1CCCN(C)c1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000436364431 944236428 /nfs/dbraw/zinc/23/64/28/944236428.db2.gz GXUULBXFUCGISZ-UHFFFAOYSA-N 1 1 371.363 3.684 20 5 FHBDMO COc1cc(C[N@H+]2CC[C@H](COCc3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC000184223983 944286439 /nfs/dbraw/zinc/28/64/39/944286439.db2.gz RCDDXJTXRRACLY-INIZCTEOSA-N 1 1 374.412 3.781 20 5 FHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@@H](C(C)(C)C)C1 ZINC000543248772 944295760 /nfs/dbraw/zinc/29/57/60/944295760.db2.gz JODTVTIVWSCOOH-NWDGAFQWSA-N 1 1 353.850 3.943 20 5 FHBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(CCOc2ccccc2[N+](=O)[O-])C1 ZINC000506474082 944300990 /nfs/dbraw/zinc/30/09/90/944300990.db2.gz LAXOAUKUYWJTCY-ROUUACIJSA-N 1 1 361.486 3.560 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000506478388 944307054 /nfs/dbraw/zinc/30/70/54/944307054.db2.gz GIRFPCVQJXGIHT-QZTJIDSGSA-N 1 1 361.486 3.560 20 5 FHBDMO Cc1cccc(C(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)c1[N+](=O)[O-] ZINC000140075974 944365385 /nfs/dbraw/zinc/36/53/85/944365385.db2.gz GGLNQLKCDTXGBW-OAHLLOKOSA-N 1 1 373.478 3.607 20 5 FHBDMO COC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)c1cccc(Cl)c1 ZINC000566624516 944374847 /nfs/dbraw/zinc/37/48/47/944374847.db2.gz ASEGEIFQWOCMTE-MRXNPFEDSA-N 1 1 350.802 3.734 20 5 FHBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC[N@H+](C)CC12CCCCC2 ZINC000439171691 944397102 /nfs/dbraw/zinc/39/71/02/944397102.db2.gz SMSBEMWSNGTTBD-UHFFFAOYSA-N 1 1 365.861 3.647 20 5 FHBDMO CC[N@@H+](CCC(F)(F)F)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000092737629 944439228 /nfs/dbraw/zinc/43/92/28/944439228.db2.gz BCWVEDDIGIGDJG-UHFFFAOYSA-N 1 1 356.348 3.770 20 5 FHBDMO COc1cc(C[NH2+][C@H](c2ccccc2)C(C)(C)CO)c([N+](=O)[O-])cc1F ZINC000566648395 944465737 /nfs/dbraw/zinc/46/57/37/944465737.db2.gz SGGBZNCDQGTSMJ-GOSISDBHSA-N 1 1 362.401 3.592 20 5 FHBDMO COc1cc2c(c(C[N@@H+](C)CCc3ccccc3[N+](=O)[O-])c1)O[C@@H](C)C2 ZINC000516116899 944500357 /nfs/dbraw/zinc/50/03/57/944500357.db2.gz YYAIWWDVBMBFTC-AWEZNQCLSA-N 1 1 356.422 3.601 20 5 FHBDMO C[C@@H]1C[C@H](c2ccccc2)CC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000439333701 944544652 /nfs/dbraw/zinc/54/46/52/944544652.db2.gz WGCCDSLQFYTIRV-YVWKXTFCSA-N 1 1 370.449 3.603 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC[C@H](Oc2ncccc2F)C1 ZINC000425999924 944577796 /nfs/dbraw/zinc/57/77/96/944577796.db2.gz QPSDDDHOXVKAEB-RRGWEWPQSA-N 1 1 357.385 3.686 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@H](Oc2ncccc2F)C1 ZINC000425999924 944577800 /nfs/dbraw/zinc/57/78/00/944577800.db2.gz QPSDDDHOXVKAEB-RRGWEWPQSA-N 1 1 357.385 3.686 20 5 FHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@](C)(c2ccccc2)C1 ZINC000438505741 944682683 /nfs/dbraw/zinc/68/26/83/944682683.db2.gz OBMQKUJMSDZWIU-QRWLVFNGSA-N 1 1 353.422 3.585 20 5 FHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@](C)(c2ccccc2)C1 ZINC000438505741 944682692 /nfs/dbraw/zinc/68/26/92/944682692.db2.gz OBMQKUJMSDZWIU-QRWLVFNGSA-N 1 1 353.422 3.585 20 5 FHBDMO C[C@@H](CNC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)[N@H+]1CCCC[C@@H]1C ZINC000426031534 944694373 /nfs/dbraw/zinc/69/43/73/944694373.db2.gz YHKBEMJBKAKXGS-HOTGVXAUSA-N 1 1 374.485 3.532 20 5 FHBDMO C[C@@H](CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)[N@H+]1CCC[C@@H](C)C1 ZINC000506259770 944710952 /nfs/dbraw/zinc/71/09/52/944710952.db2.gz NLMPPJOUOJEGFP-OLZOCXBDSA-N 1 1 361.467 3.660 20 5 FHBDMO C[C@@H](CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)[N@H+]1CCC[C@H](C)C1 ZINC000506259772 944711423 /nfs/dbraw/zinc/71/14/23/944711423.db2.gz NLMPPJOUOJEGFP-STQMWFEESA-N 1 1 361.467 3.660 20 5 FHBDMO O=C(Nc1ccccc1)[C@H]1CCC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000506296375 944836492 /nfs/dbraw/zinc/83/64/92/944836492.db2.gz YPUVOJVLWLMADB-YOCVDRLZSA-N 1 1 365.433 3.959 20 5 FHBDMO O=C(C[N@H+]1CC[C@@H]2CCC[C@@H]21)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000426455516 944840043 /nfs/dbraw/zinc/84/00/43/944840043.db2.gz TWROVJBEYWOWGE-LRDDRELGSA-N 1 1 372.450 3.531 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C1CC1)[C@@H]1CCc2ccccc21 ZINC000438733512 944962809 /nfs/dbraw/zinc/96/28/09/944962809.db2.gz PKPAEGZMBVIXDC-HXUWFJFHSA-N 1 1 365.433 3.994 20 5 FHBDMO COCC[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@H]1CCOC1 ZINC000426505411 945008634 /nfs/dbraw/zinc/00/86/34/945008634.db2.gz WOXLMLONXCWVTG-INIZCTEOSA-N 1 1 362.451 3.561 20 5 FHBDMO CC[C@@H](Cc1ccccc1)[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000444223661 946090625 /nfs/dbraw/zinc/09/06/25/946090625.db2.gz JEEZRLSLBBLYIV-KRWDZBQOSA-N 1 1 355.438 3.795 20 5 FHBDMO O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC(c2nc3ccccc3[nH]2)CC1 ZINC000111234031 946410692 /nfs/dbraw/zinc/41/06/92/946410692.db2.gz UFGHIJNDBZGEQF-UHFFFAOYSA-N 1 1 354.385 3.990 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+](CCO)[C@H]3CCCSC3)o2)cc1 ZINC000475494337 946442046 /nfs/dbraw/zinc/44/20/46/946442046.db2.gz QFFSFKRHUCSTCD-INIZCTEOSA-N 1 1 362.451 3.545 20 5 FHBDMO COc1ccc(-c2ccc(C[NH2+]Cc3ccnc(OC)c3)o2)c([N+](=O)[O-])c1 ZINC000237436143 946551790 /nfs/dbraw/zinc/55/17/90/946551790.db2.gz NWPDSTYCODFGOC-UHFFFAOYSA-N 1 1 369.377 3.557 20 5 FHBDMO O=[N+]([O-])c1sc(C[NH2+][C@@H]2CCCc3cccnc32)cc1Br ZINC000897070890 946566293 /nfs/dbraw/zinc/56/62/93/946566293.db2.gz QPZOGVKXDRWGIM-GFCCVEGCSA-N 1 1 368.256 3.981 20 5 FHBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCC(C)(C)[N@H+]1CCC[C@@H](C)C1 ZINC000475544515 946628863 /nfs/dbraw/zinc/62/88/63/946628863.db2.gz GNFLIVXYOFLGKT-CYBMUJFWSA-N 1 1 362.474 3.844 20 5 FHBDMO CC[N@H+]1C[C@@H](C)N(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[C@H]1C ZINC000475194477 946677832 /nfs/dbraw/zinc/67/78/32/946677832.db2.gz QPACKDCEPGXPRS-GHMZBOCLSA-N 1 1 374.363 3.560 20 5 FHBDMO COc1cc(C[N@@H+]2CCCC3(CC3)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000186622739 946725187 /nfs/dbraw/zinc/72/51/87/946725187.db2.gz GMLNCVNEFDAQAY-UHFFFAOYSA-N 1 1 356.369 3.623 20 5 FHBDMO COc1cc(C[N@H+]2CCCC3(CC3)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000186622739 946725197 /nfs/dbraw/zinc/72/51/97/946725197.db2.gz GMLNCVNEFDAQAY-UHFFFAOYSA-N 1 1 356.369 3.623 20 5 FHBDMO C[C@H]([NH2+][C@@H](c1cnn(C)c1)c1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000186647534 946780843 /nfs/dbraw/zinc/78/08/43/946780843.db2.gz GZWUPFUERLATHP-ORAYPTAESA-N 1 1 354.385 3.908 20 5 FHBDMO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000475278422 946796960 /nfs/dbraw/zinc/79/69/60/946796960.db2.gz WARHBNODKHYXQT-IAQYHMDHSA-N 1 1 368.359 3.768 20 5 FHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000408194816 946913795 /nfs/dbraw/zinc/91/37/95/946913795.db2.gz ZHSFQARYFOWOIY-ZENOOKHLSA-N 1 1 365.861 3.726 20 5 FHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](Cc3ccc(Cl)cc3Cl)C2)nc1 ZINC000112656696 946919892 /nfs/dbraw/zinc/91/98/92/946919892.db2.gz YJLPHBXSAJLANO-ZDUSSCGKSA-N 1 1 367.236 3.983 20 5 FHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3ccc(Cl)cc3Cl)C2)nc1 ZINC000112656696 946919898 /nfs/dbraw/zinc/91/98/98/946919898.db2.gz YJLPHBXSAJLANO-ZDUSSCGKSA-N 1 1 367.236 3.983 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1cccc(Br)c1 ZINC000048818880 946929347 /nfs/dbraw/zinc/92/93/47/946929347.db2.gz DVCKBZKXPPTWOR-UHFFFAOYSA-N 1 1 351.200 3.656 20 5 FHBDMO O=C(NC1CC1)[C@H]1CCC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000121471025 946967370 /nfs/dbraw/zinc/96/73/70/946967370.db2.gz VQPDDSJYUQUGAU-QGZVFWFLSA-N 1 1 371.462 3.566 20 5 FHBDMO O=C(NC1CC1)[C@@H]1CCC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000121471178 946967667 /nfs/dbraw/zinc/96/76/67/946967667.db2.gz VQPDDSJYUQUGAU-KRWDZBQOSA-N 1 1 371.462 3.566 20 5 FHBDMO COCC[N@@H+](CCCc1ccccc1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444595960 947020951 /nfs/dbraw/zinc/02/09/51/947020951.db2.gz KHAJMXDJICLSPA-UHFFFAOYSA-N 1 1 368.437 3.552 20 5 FHBDMO Cc1ccc(C(=O)N(C)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000074445746 947068346 /nfs/dbraw/zinc/06/83/46/947068346.db2.gz HUJHRCNQSSTSPJ-LJQANCHMSA-N 1 1 367.449 3.640 20 5 FHBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H](COC)Cc1ccccc1 ZINC000444649658 947070049 /nfs/dbraw/zinc/07/00/49/947070049.db2.gz QUVODPJPCBPFDS-KRWDZBQOSA-N 1 1 368.437 3.551 20 5 FHBDMO C[C@@H]1[C@H](Cc2ccccc2)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444649439 947070462 /nfs/dbraw/zinc/07/04/62/947070462.db2.gz JLRMIIOHTFVTFX-ZBFHGGJFSA-N 1 1 350.422 3.924 20 5 FHBDMO C[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1OC(F)F ZINC000444673650 947097719 /nfs/dbraw/zinc/09/77/19/947097719.db2.gz IHGFVJGDISDFED-SNVBAGLBSA-N 1 1 362.336 3.923 20 5 FHBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)CC1(c2ccccc2)CC1 ZINC000444676492 947101372 /nfs/dbraw/zinc/10/13/72/947101372.db2.gz QOICJEOAQJIHBX-HNNXBMFYSA-N 1 1 353.422 3.585 20 5 FHBDMO C[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(OC(F)F)cc1 ZINC000444682498 947107124 /nfs/dbraw/zinc/10/71/24/947107124.db2.gz ACDORVYTUDJCMV-SNVBAGLBSA-N 1 1 362.336 3.923 20 5 FHBDMO C[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1cccc(OC(F)F)c1 ZINC000444683158 947108406 /nfs/dbraw/zinc/10/84/06/947108406.db2.gz DLRIXZQUTYMYQA-JTQLQIEISA-N 1 1 362.336 3.923 20 5 FHBDMO CCOc1ccc(NC(=O)C[N@@H+](C)Cc2cc(C)cc(C)c2)c([N+](=O)[O-])c1 ZINC000444689136 947113432 /nfs/dbraw/zinc/11/34/32/947113432.db2.gz FIABEAVZXJTJFK-UHFFFAOYSA-N 1 1 371.437 3.681 20 5 FHBDMO CCOc1ccc(NC(=O)C[N@H+](C)Cc2cc(C)cc(C)c2)c([N+](=O)[O-])c1 ZINC000444689136 947113427 /nfs/dbraw/zinc/11/34/27/947113427.db2.gz FIABEAVZXJTJFK-UHFFFAOYSA-N 1 1 371.437 3.681 20 5 FHBDMO Cc1cc(C)cc(C[N@@H+](C)CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)c1 ZINC000444699287 947125762 /nfs/dbraw/zinc/12/57/62/947125762.db2.gz DHJDYQFAESYYFG-UHFFFAOYSA-N 1 1 369.421 3.642 20 5 FHBDMO CC(C)[C@H]1CCC[N@@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000444771298 947207556 /nfs/dbraw/zinc/20/75/56/947207556.db2.gz OQVJZXFIXSFPAG-STQMWFEESA-N 1 1 353.850 3.943 20 5 FHBDMO CC(C)[C@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000444771298 947207564 /nfs/dbraw/zinc/20/75/64/947207564.db2.gz OQVJZXFIXSFPAG-STQMWFEESA-N 1 1 353.850 3.943 20 5 FHBDMO C[N@H+](Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)C[C@@H]1CCOC1 ZINC000093840155 947382273 /nfs/dbraw/zinc/38/22/73/947382273.db2.gz KNGZEQHIEFPLAC-HNNXBMFYSA-N 1 1 360.385 3.995 20 5 FHBDMO C[C@H](O)C[C@H]1CCCCC[N@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000567965798 947542702 /nfs/dbraw/zinc/54/27/02/947542702.db2.gz CBLIXRRLSGWJGE-HNAYVOBHSA-N 1 1 372.469 3.511 20 5 FHBDMO O=C1[C@H]([N@@H+]2CCC[C@@H]2c2ccsc2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000067377193 947559523 /nfs/dbraw/zinc/55/95/23/947559523.db2.gz IFKCNGGIWUXQIZ-IAGOWNOFSA-N 1 1 357.435 3.599 20 5 FHBDMO O=C1[C@H]([N@H+]2CCC[C@@H]2c2ccsc2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000067377193 947559536 /nfs/dbraw/zinc/55/95/36/947559536.db2.gz IFKCNGGIWUXQIZ-IAGOWNOFSA-N 1 1 357.435 3.599 20 5 FHBDMO C[C@@H](c1ccccc1)[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)CC1CCC1 ZINC000536378182 947847768 /nfs/dbraw/zinc/84/77/68/947847768.db2.gz MUEUGFMHGMBNGN-INIZCTEOSA-N 1 1 355.438 3.620 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)cnc1N1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000278886897 947993084 /nfs/dbraw/zinc/99/30/84/947993084.db2.gz PEJDMXSULZCTRY-UHFFFAOYSA-N 1 1 361.833 3.560 20 5 FHBDMO C[C@@H]1CC[C@@H](c2ccccc2)[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000512165031 948602905 /nfs/dbraw/zinc/60/29/05/948602905.db2.gz KQDDACKIDOVSHM-KDOFPFPSSA-N 1 1 353.422 3.667 20 5 FHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@H](Cc3nccn3C)C2)cc1[N+](=O)[O-] ZINC000182088652 948634442 /nfs/dbraw/zinc/63/44/42/948634442.db2.gz SUMLCFRDLJJIJS-INIZCTEOSA-N 1 1 356.470 3.906 20 5 FHBDMO CCOc1ccc(NC(=O)C[N@@H+]2CCC[C@]3(CC=CCC3)C2)c([N+](=O)[O-])c1 ZINC000512176295 948662806 /nfs/dbraw/zinc/66/28/06/948662806.db2.gz UVZBBDISEMFIQC-HXUWFJFHSA-N 1 1 373.453 3.754 20 5 FHBDMO CCOc1ccc(NC(=O)C[N@H+]2CCC[C@]3(CC=CCC3)C2)c([N+](=O)[O-])c1 ZINC000512176295 948662808 /nfs/dbraw/zinc/66/28/08/948662808.db2.gz UVZBBDISEMFIQC-HXUWFJFHSA-N 1 1 373.453 3.754 20 5 FHBDMO COc1ccc(C[N@@H+](Cc2cccs2)C[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000051429686 567879055 /nfs/dbraw/zinc/87/90/55/567879055.db2.gz ZTKXMZHFEFJQIK-HNNXBMFYSA-N 1 1 362.451 3.846 20 5 FHBDMO COc1ccc(C[N@H+](Cc2cccs2)C[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000051429686 567879057 /nfs/dbraw/zinc/87/90/57/567879057.db2.gz ZTKXMZHFEFJQIK-HNNXBMFYSA-N 1 1 362.451 3.846 20 5 FHBDMO Cc1nc(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000150814724 567929499 /nfs/dbraw/zinc/92/94/99/567929499.db2.gz UNAYUEGOHOTEOJ-AYHJJNSGSA-N 1 1 352.438 3.906 20 5 FHBDMO Cc1cnn([C@H]2CC[N@H+](Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)C2)c1 ZINC000291013578 567955759 /nfs/dbraw/zinc/95/57/59/567955759.db2.gz XBZPVKQVARZTCZ-KRWDZBQOSA-N 1 1 369.450 3.670 20 5 FHBDMO Cc1cnn([C@H]2CC[N@@H+](Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)C2)c1 ZINC000291013578 567955760 /nfs/dbraw/zinc/95/57/60/567955760.db2.gz XBZPVKQVARZTCZ-KRWDZBQOSA-N 1 1 369.450 3.670 20 5 FHBDMO Cc1cc(C)c(C[NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)cn1 ZINC000602681119 568010108 /nfs/dbraw/zinc/01/01/08/568010108.db2.gz JVXISLFHTXUZDT-UHFFFAOYSA-N 1 1 356.245 3.720 20 5 FHBDMO Cc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2ccc(C(N)=O)cc2[N+](=O)[O-])o1 ZINC000072895890 568015006 /nfs/dbraw/zinc/01/50/06/568015006.db2.gz DAZMOFQMXMNIRV-YVEFUNNKSA-N 1 1 357.410 3.568 20 5 FHBDMO Cc1ccc([C@H]2C[C@@H](C)CC[N@H+]2Cc2ccc(C(N)=O)cc2[N+](=O)[O-])o1 ZINC000072895890 568015007 /nfs/dbraw/zinc/01/50/07/568015007.db2.gz DAZMOFQMXMNIRV-YVEFUNNKSA-N 1 1 357.410 3.568 20 5 FHBDMO Cc1ccc(C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC2CC2)cn1 ZINC000602699589 568016910 /nfs/dbraw/zinc/01/69/10/568016910.db2.gz IUHJDMJCMGUIHH-UHFFFAOYSA-N 1 1 352.394 3.852 20 5 FHBDMO Cc1ccc(C[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC2CC2)cn1 ZINC000602699589 568016912 /nfs/dbraw/zinc/01/69/12/568016912.db2.gz IUHJDMJCMGUIHH-UHFFFAOYSA-N 1 1 352.394 3.852 20 5 FHBDMO COc1cc(C[NH2+][C@H](C)c2cnc(C)s2)c([N+](=O)[O-])cc1OC(F)F ZINC000602958360 568029554 /nfs/dbraw/zinc/02/95/54/568029554.db2.gz XGCGXSDSYBLOAP-MRVPVSSYSA-N 1 1 373.381 3.821 20 5 FHBDMO COc1cc(C[NH2+][C@@H](C)c2cnc(C)s2)c([N+](=O)[O-])cc1OC(F)F ZINC000602958370 568029557 /nfs/dbraw/zinc/02/95/57/568029557.db2.gz XGCGXSDSYBLOAP-QMMMGPOBSA-N 1 1 373.381 3.821 20 5 FHBDMO COc1cc(C[N@H+]2CCCC[C@@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000481597702 568064089 /nfs/dbraw/zinc/06/40/89/568064089.db2.gz MSCCPZOLAIHALC-GFCCVEGCSA-N 1 1 358.385 3.869 20 5 FHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC(F)(F)[C@@H](CO)C2)s1 ZINC000291351740 568118498 /nfs/dbraw/zinc/11/84/98/568118498.db2.gz XGZRAYWNUCQVAM-GFCCVEGCSA-N 1 1 368.405 3.773 20 5 FHBDMO Cc1ccc(C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C2CC2)cc1C ZINC000603903677 568180635 /nfs/dbraw/zinc/18/06/35/568180635.db2.gz RYYPBGCLIAUJAA-HXUWFJFHSA-N 1 1 370.449 3.616 20 5 FHBDMO O=[N+]([O-])c1c(NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)nc2sccn21 ZINC000311913226 568203415 /nfs/dbraw/zinc/20/34/15/568203415.db2.gz HUKLHLWACPFCOU-OAHLLOKOSA-N 1 1 371.466 3.628 20 5 FHBDMO CC[C@@H](Cc1ccccc1)[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000128722958 568220040 /nfs/dbraw/zinc/22/00/40/568220040.db2.gz UKOJBHLLZIDETK-SFHVURJKSA-N 1 1 356.422 3.914 20 5 FHBDMO Cc1ccccc1C[NH+]1CCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000018110375 568257079 /nfs/dbraw/zinc/25/70/79/568257079.db2.gz WHKDHPNARIVNEY-UHFFFAOYSA-N 1 1 373.840 3.515 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])c(N2CCC(C[N@H+](C)Cc3ccccc3)CC2)n1 ZINC000541935318 568259535 /nfs/dbraw/zinc/25/95/35/568259535.db2.gz OHTCJOWUAHKWMV-UHFFFAOYSA-N 1 1 368.481 3.955 20 5 FHBDMO Cc1cnn([C@H]2CC[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2)c1 ZINC000569310222 568361648 /nfs/dbraw/zinc/36/16/48/568361648.db2.gz IKCZVYXOZXONMQ-KRWDZBQOSA-N 1 1 352.394 3.807 20 5 FHBDMO O=[N+]([O-])c1cccc(N2CC[NH+](Cc3ccc(F)c4cccnc34)CC2)c1 ZINC000051855713 568477377 /nfs/dbraw/zinc/47/73/77/568477377.db2.gz YSNDSPGGBBXROL-UHFFFAOYSA-N 1 1 366.396 3.604 20 5 FHBDMO CC(=O)c1ccc([N+](=O)[O-])cc1N1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000570597841 568490095 /nfs/dbraw/zinc/49/00/95/568490095.db2.gz ZTXJIDKVCCWKMK-WBVHZDCISA-N 1 1 359.470 3.888 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[N@H+](C2CCC2)C[C@H](C)C1 ZINC000570673638 568494511 /nfs/dbraw/zinc/49/45/11/568494511.db2.gz DGVCNYOJRNEQIR-ZDUSSCGKSA-N 1 1 360.458 3.550 20 5 FHBDMO COC(=O)COc1ccc(C[N@@H+](C)[C@H](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000570742340 568513583 /nfs/dbraw/zinc/51/35/83/568513583.db2.gz FHQIWXWRDGSHAN-CQSZACIVSA-N 1 1 364.442 3.547 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)n1 ZINC001164623617 719082966 /nfs/dbraw/zinc/08/29/66/719082966.db2.gz JXYCFZIVGROJFT-RTBURBONSA-N 1 1 366.465 3.707 20 5 FHBDMO O=[N+]([O-])c1cc2nc(Cl)ccc2cc1N1CC2(C1)CC[N@@H+](CC1CC1)C2 ZINC001164774412 721303190 /nfs/dbraw/zinc/30/31/90/721303190.db2.gz BIKOHMCCXPMSRF-UHFFFAOYSA-N 1 1 372.856 3.719 20 5 FHBDMO O=[N+]([O-])c1cnc(N2CCC[C@]3(CC[N@@H+]3Cc3cccc(F)c3)C2)c(F)c1 ZINC001164995851 722197033 /nfs/dbraw/zinc/19/70/33/722197033.db2.gz YSNMZDJYNMNUQH-IBGZPJMESA-N 1 1 374.391 3.513 20 5 FHBDMO O=[N+]([O-])c1cnc(N2CCC[C@]3(CC[N@H+]3Cc3cccc(F)c3)C2)c(F)c1 ZINC001164995851 722197034 /nfs/dbraw/zinc/19/70/34/722197034.db2.gz YSNMZDJYNMNUQH-IBGZPJMESA-N 1 1 374.391 3.513 20 5 FHBDMO O=[N+]([O-])c1cnc(N2CCC[C@@]3(CC[N@@H+]3Cc3cccc(F)c3)C2)c(F)c1 ZINC001164995853 722197356 /nfs/dbraw/zinc/19/73/56/722197356.db2.gz YSNMZDJYNMNUQH-LJQANCHMSA-N 1 1 374.391 3.513 20 5 FHBDMO O=[N+]([O-])c1cnc(N2CCC[C@@]3(CC[N@H+]3Cc3cccc(F)c3)C2)c(F)c1 ZINC001164995853 722197357 /nfs/dbraw/zinc/19/73/57/722197357.db2.gz YSNMZDJYNMNUQH-LJQANCHMSA-N 1 1 374.391 3.513 20 5 FHBDMO COc1ccc2c(c1)[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)CCCO2 ZINC000178728336 936326398 /nfs/dbraw/zinc/32/63/98/936326398.db2.gz WYIYYAAEWORMNO-KRWDZBQOSA-N 1 1 358.394 3.616 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC[C@H]1CCC[N@H+](CC(C)C)C1 ZINC000120091725 927139629 /nfs/dbraw/zinc/13/96/29/927139629.db2.gz IKCNZMISFVLDHT-MRXNPFEDSA-N 1 1 362.474 3.701 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1CN1CCC(CCC[NH+]2CCCC2)CC1 ZINC000430192125 927767608 /nfs/dbraw/zinc/76/76/08/927767608.db2.gz AEGSJACBZNAYDM-UHFFFAOYSA-N 1 1 361.486 3.691 20 5 FHBDMO COc1cc(C[N@@H+]2CC[C@H](Oc3cccc(F)c3)C2)c([N+](=O)[O-])cc1F ZINC000613384128 937195356 /nfs/dbraw/zinc/19/53/56/937195356.db2.gz ZODYGZJHYBOZPY-HNNXBMFYSA-N 1 1 364.348 3.535 20 5 FHBDMO COc1cc(C[N@H+]2CC[C@H](Oc3cccc(F)c3)C2)c([N+](=O)[O-])cc1F ZINC000613384128 937195359 /nfs/dbraw/zinc/19/53/59/937195359.db2.gz ZODYGZJHYBOZPY-HNNXBMFYSA-N 1 1 364.348 3.535 20 5 FHBDMO C[C@@H]1C[C@@H](CCNC(=O)c2ccc([N+](=O)[O-])cc2)C[N@H+]1Cc1ccccc1 ZINC000510084873 927945395 /nfs/dbraw/zinc/94/53/95/927945395.db2.gz GQYJLGVIELKJPQ-SJLPKXTDSA-N 1 1 367.449 3.625 20 5 FHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)Cc1cc2ccccc2o1 ZINC000472282004 937234029 /nfs/dbraw/zinc/23/40/29/937234029.db2.gz DTTCNKRXFJXVFK-ZDUSSCGKSA-N 1 1 353.378 3.800 20 5 FHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1cc2ccccc2o1 ZINC000472282004 937234032 /nfs/dbraw/zinc/23/40/32/937234032.db2.gz DTTCNKRXFJXVFK-ZDUSSCGKSA-N 1 1 353.378 3.800 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)NCC[C@@H](C)[N@@H+](C)Cc1ccccc1 ZINC000471458140 929736445 /nfs/dbraw/zinc/73/64/45/929736445.db2.gz CRJOPWLCMDQJEC-MRXNPFEDSA-N 1 1 355.438 3.544 20 5 FHBDMO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCC[C@@H]2C[C@H](O)c2cccs2)c1 ZINC000175825638 929769598 /nfs/dbraw/zinc/76/95/98/929769598.db2.gz INAHFFSOZQHQBB-PBHICJAKSA-N 1 1 362.451 3.623 20 5 FHBDMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)CC[N@@H+](C)C1CCCCC1 ZINC000548060508 930233587 /nfs/dbraw/zinc/23/35/87/930233587.db2.gz RNMGHEYMIHVGOQ-UHFFFAOYSA-N 1 1 361.486 3.986 20 5 FHBDMO COc1cc(C[NH+]2CCC(CC(F)(F)F)CC2)c([N+](=O)[O-])cc1OC ZINC000583396278 937406834 /nfs/dbraw/zinc/40/68/34/937406834.db2.gz KJBNITWISAMMEZ-UHFFFAOYSA-N 1 1 362.348 3.776 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1CNC(C)(C)C[N@@H+](C)Cc1ccccc1 ZINC000379674209 930517750 /nfs/dbraw/zinc/51/77/50/930517750.db2.gz SXJSRGQTYHXJBC-UHFFFAOYSA-N 1 1 357.454 3.604 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]C(C)(C)CN(C)Cc1ccccc1 ZINC000379674209 930517762 /nfs/dbraw/zinc/51/77/62/930517762.db2.gz SXJSRGQTYHXJBC-UHFFFAOYSA-N 1 1 357.454 3.604 20 5 FHBDMO Cc1cc(C(=O)N2CC[N@H+](Cc3ccccc3)CC[C@@H]2C)cc([N+](=O)[O-])c1 ZINC000610445882 930792093 /nfs/dbraw/zinc/79/20/93/930792093.db2.gz JGGWJZQPQZWCAP-KRWDZBQOSA-N 1 1 367.449 3.640 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](Cc2ccccc2)CC[C@H]1C ZINC000610445636 930809060 /nfs/dbraw/zinc/80/90/60/930809060.db2.gz ACNNFWDRIUABBI-QGZVFWFLSA-N 1 1 367.449 3.640 20 5 FHBDMO COc1ccc(NC(=O)CC[N@H+]2CC[C@@H]2c2cccc(F)c2)c([N+](=O)[O-])c1 ZINC000610505260 932015556 /nfs/dbraw/zinc/01/55/56/932015556.db2.gz DPJTZCGYGZTYMQ-QGZVFWFLSA-N 1 1 373.384 3.518 20 5 FHBDMO C[C@H](CNC(=O)OC(C)(C)C)[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000178018295 932106304 /nfs/dbraw/zinc/10/63/04/932106304.db2.gz JQGFMGQUJMMYAL-LLVKDONJSA-N 1 1 357.838 3.593 20 5 FHBDMO O=C(Nc1ccccc1)C1CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000276307150 932159601 /nfs/dbraw/zinc/15/96/01/932159601.db2.gz LEAYDKGBPVTVGA-UHFFFAOYSA-N 1 1 357.385 3.585 20 5 FHBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2cc(=O)oc3ccc4ccccc4c23)C[C@H]1C ZINC000276398078 932339401 /nfs/dbraw/zinc/33/94/01/932339401.db2.gz JZKZWJXQYJKLLN-RHSMWYFYSA-N 1 1 365.429 3.577 20 5 FHBDMO C[C@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)[NH+]1C2CCC1CC2 ZINC000610538542 932682819 /nfs/dbraw/zinc/68/28/19/932682819.db2.gz QWWFATQHOGTVGX-LMWSTFAQSA-N 1 1 372.450 3.672 20 5 FHBDMO CCc1ccc(C(=O)N2CCC[N@@H+](CC3CCCCC3)CC2)cc1[N+](=O)[O-] ZINC000471800587 932954577 /nfs/dbraw/zinc/95/45/77/932954577.db2.gz SEXDRTOQCORBRQ-UHFFFAOYSA-N 1 1 373.497 3.885 20 5 FHBDMO Cn1c2c(nc1[C@H]1CCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1)CCCC2 ZINC000548350831 933070269 /nfs/dbraw/zinc/07/02/69/933070269.db2.gz ZXUMYOCTOGMUMQ-LJQANCHMSA-N 1 1 354.454 3.587 20 5 FHBDMO CO[C@@]1(C)C[C@@H]([N@@H+](C)Cc2ccc(Br)cc2[N+](=O)[O-])C1(C)C ZINC001167490567 933076014 /nfs/dbraw/zinc/07/60/14/933076014.db2.gz DMLOYNAVVPSAIF-ZBFHGGJFSA-N 1 1 371.275 3.993 20 5 FHBDMO CC(C)[C@H]1CCC[N@@H+]1Cc1cc(I)cc([N+](=O)[O-])c1 ZINC001167490542 933076061 /nfs/dbraw/zinc/07/60/61/933076061.db2.gz CZRYHBHEVXWOIU-CQSZACIVSA-N 1 1 374.222 3.820 20 5 FHBDMO CC(C)[C@H]1CCC[N@H+]1Cc1cc(I)cc([N+](=O)[O-])c1 ZINC001167490542 933076063 /nfs/dbraw/zinc/07/60/63/933076063.db2.gz CZRYHBHEVXWOIU-CQSZACIVSA-N 1 1 374.222 3.820 20 5 FHBDMO COc1cc(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)ccc1SC ZINC000510507068 933168190 /nfs/dbraw/zinc/16/81/90/933168190.db2.gz WUHJWHBWLMKOQJ-UHFFFAOYSA-N 1 1 373.478 3.648 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@@H](c4ncc[nH]4)C3)o2)cc1 ZINC000510524854 933181101 /nfs/dbraw/zinc/18/11/01/933181101.db2.gz REWWAZFDEWJZBH-OAHLLOKOSA-N 1 1 352.394 3.958 20 5 FHBDMO CC(C)c1ccc(C[N@@H+]2C[C@H](C)O[C@]3(CCO[C@H](C)C3)C2)cc1[N+](=O)[O-] ZINC000430761506 933214837 /nfs/dbraw/zinc/21/48/37/933214837.db2.gz MAVCPGMXDUAKCJ-GUXCAODWSA-N 1 1 362.470 3.877 20 5 FHBDMO CC(C)c1ccc(C[N@H+]2C[C@H](C)O[C@]3(CCO[C@H](C)C3)C2)cc1[N+](=O)[O-] ZINC000430761506 933214844 /nfs/dbraw/zinc/21/48/44/933214844.db2.gz MAVCPGMXDUAKCJ-GUXCAODWSA-N 1 1 362.470 3.877 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@H](Cn1cccn1)c1ccccc1 ZINC000610582745 933358858 /nfs/dbraw/zinc/35/88/58/933358858.db2.gz UMGJUULGTQOXPP-QGZVFWFLSA-N 1 1 356.813 3.976 20 5 FHBDMO O=C(C[C@H]1CCC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1)c1cccs1 ZINC000430988929 933627034 /nfs/dbraw/zinc/62/70/34/933627034.db2.gz NICXZEBOBVEROQ-CQSZACIVSA-N 1 1 360.435 3.773 20 5 FHBDMO C[N@@H+](CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)C1CCCCC1 ZINC000610655706 933658990 /nfs/dbraw/zinc/65/89/90/933658990.db2.gz QQTIPBYZMZRXBN-UHFFFAOYSA-N 1 1 374.466 3.921 20 5 FHBDMO C[C@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)[N@@H+]1CCC[C@H](C)C1 ZINC000610655868 933659509 /nfs/dbraw/zinc/65/95/09/933659509.db2.gz VWUAOZQHJJUGGR-QWHCGFSZSA-N 1 1 374.466 3.777 20 5 FHBDMO C[C@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)[N@H+]1CCC[C@H](C)C1 ZINC000610655868 933659514 /nfs/dbraw/zinc/65/95/14/933659514.db2.gz VWUAOZQHJJUGGR-QWHCGFSZSA-N 1 1 374.466 3.777 20 5 FHBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[C@@H](C)C1 ZINC000247463507 933779250 /nfs/dbraw/zinc/77/92/50/933779250.db2.gz RFQGGYVNQZTLCE-WFASDCNBSA-N 1 1 361.467 3.612 20 5 FHBDMO Cc1ccc(NC(=O)[C@@H]2C[N@H+](C(C)(C)C)C[C@H]2C(F)(F)F)cc1[N+](=O)[O-] ZINC000431241694 934231689 /nfs/dbraw/zinc/23/16/89/934231689.db2.gz FSDCOUGFYKMPAM-CHWSQXEVSA-N 1 1 373.375 3.751 20 5 FHBDMO COc1cc(N[C@H]2CCC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)cc(OC)c1 ZINC000610865326 934541061 /nfs/dbraw/zinc/54/10/61/934541061.db2.gz NFGKXUQLBKHZDM-INIZCTEOSA-N 1 1 371.437 3.689 20 5 FHBDMO Cc1nc(-c2ccccc2)sc1[C@H](C)[N@@H+](C)CCn1cc([N+](=O)[O-])cn1 ZINC000119455023 934815355 /nfs/dbraw/zinc/81/53/55/934815355.db2.gz OKDITBLLZCSIKI-AWEZNQCLSA-N 1 1 371.466 3.916 20 5 FHBDMO COc1c(O)ccc(C[N@H+](C)[C@@H]2CCCc3nc(C)sc32)c1[N+](=O)[O-] ZINC000892035775 934865405 /nfs/dbraw/zinc/86/54/05/934865405.db2.gz NUYUJSYQWCPDRE-CYBMUJFWSA-N 1 1 363.439 3.583 20 5 FHBDMO COc1c(O)ccc(C[N@@H+](C)[C@@H]2CCCc3nc(C)sc32)c1[N+](=O)[O-] ZINC000892035775 934865408 /nfs/dbraw/zinc/86/54/08/934865408.db2.gz NUYUJSYQWCPDRE-CYBMUJFWSA-N 1 1 363.439 3.583 20 5 FHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@H]2c2ccc3c(c2)OCCO3)c1 ZINC000071906180 934976779 /nfs/dbraw/zinc/97/67/79/934976779.db2.gz XPZKZNPPTDKJGZ-SFHVURJKSA-N 1 1 370.405 3.582 20 5 FHBDMO Cc1c(Cl)cccc1NC(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511059311 935175308 /nfs/dbraw/zinc/17/53/08/935175308.db2.gz LORIDFRQVYTGIB-UHFFFAOYSA-N 1 1 361.829 3.670 20 5 FHBDMO Cc1c(Cl)cccc1NC(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511059311 935175311 /nfs/dbraw/zinc/17/53/11/935175311.db2.gz LORIDFRQVYTGIB-UHFFFAOYSA-N 1 1 361.829 3.670 20 5 FHBDMO C[C@@H](NCc1ccc([N+](=O)[O-])cc1F)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381711594 935544590 /nfs/dbraw/zinc/54/45/90/935544590.db2.gz JIBHNNDYKMFFCG-QAPCUYQASA-N 1 1 357.429 3.734 20 5 FHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])[C@H]1CCN(c2cccc(Cl)c2)C1=O ZINC000511104678 935578097 /nfs/dbraw/zinc/57/80/97/935578097.db2.gz ICDRAEMLKZATLI-SFHVURJKSA-N 1 1 373.840 3.528 20 5 FHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])[C@H]1CCN(c2cccc(Cl)c2)C1=O ZINC000511104678 935578102 /nfs/dbraw/zinc/57/81/02/935578102.db2.gz ICDRAEMLKZATLI-SFHVURJKSA-N 1 1 373.840 3.528 20 5 FHBDMO CCN(C(=O)[C@H](C)[N@H+](C)CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000511118645 935665526 /nfs/dbraw/zinc/66/55/26/935665526.db2.gz BCCNQXMGVGAPND-INIZCTEOSA-N 1 1 355.438 3.511 20 5 FHBDMO CCN(C(=O)[C@H](C)[N@@H+](C)CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000511118645 935665528 /nfs/dbraw/zinc/66/55/28/935665528.db2.gz BCCNQXMGVGAPND-INIZCTEOSA-N 1 1 355.438 3.511 20 5 FHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccn(-c2ccccc2F)n1 ZINC000511120981 935674157 /nfs/dbraw/zinc/67/41/57/935674157.db2.gz JERDHFGIIGCROC-UHFFFAOYSA-N 1 1 354.385 3.594 20 5 FHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccn(-c2ccccc2F)n1 ZINC000511120981 935674159 /nfs/dbraw/zinc/67/41/59/935674159.db2.gz JERDHFGIIGCROC-UHFFFAOYSA-N 1 1 354.385 3.594 20 5 FHBDMO CC(C)C[N@H+]1Cc2cccc(NC(=O)Cc3ccc([N+](=O)[O-])cc3)c2C1 ZINC000158337524 935737047 /nfs/dbraw/zinc/73/70/47/935737047.db2.gz FCYXGSRPGMIKOE-UHFFFAOYSA-N 1 1 353.422 3.748 20 5 FHBDMO Cn1c2cc(F)ccc2[nH+]c1NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000431423716 935763264 /nfs/dbraw/zinc/76/32/64/935763264.db2.gz UXYGUFORIWLJKR-UHFFFAOYSA-N 1 1 368.290 3.673 20 5 FHBDMO COc1ccc(OCC[N@H+]2CC[C@H](c3ccccc3)[C@H]2C)c([N+](=O)[O-])c1 ZINC001167599144 935943519 /nfs/dbraw/zinc/94/35/19/935943519.db2.gz PMGROUILCMNQGY-QAPCUYQASA-N 1 1 356.422 3.860 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2ncnc3ccc([N+](=O)[O-])cc32)C1 ZINC000611707493 935948988 /nfs/dbraw/zinc/94/89/88/935948988.db2.gz NOZJBGQAKMMFRM-CVEARBPZSA-N 1 1 369.469 3.629 20 5 FHBDMO CCn1nc(C)c([N+](=O)[O-])c1NCC[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000480078836 935959443 /nfs/dbraw/zinc/95/94/43/935959443.db2.gz BEUMPFUQLRYTOQ-MAUKXSAKSA-N 1 1 371.485 3.832 20 5 FHBDMO CC(C)(C)c1ccc2c(c1)C[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])CC2 ZINC000511190422 936024414 /nfs/dbraw/zinc/02/44/14/936024414.db2.gz YCVGMTZWOBGSFX-UHFFFAOYSA-N 1 1 367.449 3.550 20 5 FHBDMO CC(C)(C)c1ccc2c(c1)C[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])CC2 ZINC000511190422 936024417 /nfs/dbraw/zinc/02/44/17/936024417.db2.gz YCVGMTZWOBGSFX-UHFFFAOYSA-N 1 1 367.449 3.550 20 5 FHBDMO C[N@H+](CCc1cccc2ccccc21)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000507323456 945144590 /nfs/dbraw/zinc/14/45/90/945144590.db2.gz ZLCFTXQRURYQEN-UHFFFAOYSA-N 1 1 363.417 3.861 20 5 FHBDMO C[N@@H+](CCc1cccc2ccccc21)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000507323456 945144593 /nfs/dbraw/zinc/14/45/93/945144593.db2.gz ZLCFTXQRURYQEN-UHFFFAOYSA-N 1 1 363.417 3.861 20 5 FHBDMO Cc1noc([C@H]2CCC[N@H+](Cc3ccc([N+](=O)[O-])cc3C(F)(F)F)C2)n1 ZINC000178921649 938300476 /nfs/dbraw/zinc/30/04/76/938300476.db2.gz WMGFEWGIZNLJHM-LBPRGKRZSA-N 1 1 370.331 3.685 20 5 FHBDMO Cc1noc([C@H]2CCC[N@@H+](Cc3ccc([N+](=O)[O-])cc3C(F)(F)F)C2)n1 ZINC000178921649 938300478 /nfs/dbraw/zinc/30/04/78/938300478.db2.gz WMGFEWGIZNLJHM-LBPRGKRZSA-N 1 1 370.331 3.685 20 5 FHBDMO Cc1c(C[N@H+]2CCC[C@@H]2Cn2cnc3ccccc32)cccc1[N+](=O)[O-] ZINC000536069091 938302535 /nfs/dbraw/zinc/30/25/35/938302535.db2.gz SSVVTCOKMSPCJF-QGZVFWFLSA-N 1 1 350.422 3.918 20 5 FHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000052638623 938460362 /nfs/dbraw/zinc/46/03/62/938460362.db2.gz DIXXVTUYCGMBIX-IRXDYDNUSA-N 1 1 367.232 3.992 20 5 FHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000052638623 938460364 /nfs/dbraw/zinc/46/03/64/938460364.db2.gz DIXXVTUYCGMBIX-IRXDYDNUSA-N 1 1 367.232 3.992 20 5 FHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](Cc2ccccc2)[C@H]1C ZINC000472308467 938491012 /nfs/dbraw/zinc/49/10/12/938491012.db2.gz AABVJPZXPLEQOH-NUJGCVRESA-N 1 1 367.449 3.875 20 5 FHBDMO CC(C)(C)n1cc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cn1 ZINC000278701992 938669886 /nfs/dbraw/zinc/66/98/86/938669886.db2.gz JTJJNTOLKUXZQT-UHFFFAOYSA-N 1 1 356.348 3.855 20 5 FHBDMO CC(C)[N@H+]1CCC[C@@H](NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)C1 ZINC000278712992 938678569 /nfs/dbraw/zinc/67/85/69/938678569.db2.gz QXZPEBLBGGTLSS-OAHLLOKOSA-N 1 1 363.461 3.696 20 5 FHBDMO CCC[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])[C@H]1CCc2ccccc21 ZINC000544060536 938912776 /nfs/dbraw/zinc/91/27/76/938912776.db2.gz KPPHOCYJKIUXFQ-MJGOQNOKSA-N 1 1 370.449 3.734 20 5 FHBDMO Cc1ccc(C(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)cc1[N+](=O)[O-] ZINC000140212613 938945399 /nfs/dbraw/zinc/94/53/99/938945399.db2.gz NUMVBCYTXHYBKD-HNNXBMFYSA-N 1 1 373.478 3.607 20 5 FHBDMO CC[N@@H+](Cc1ccc(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1)C1CC1 ZINC000511277222 938979949 /nfs/dbraw/zinc/97/99/49/938979949.db2.gz LPVBYOMKXUZWFD-UHFFFAOYSA-N 1 1 367.449 3.851 20 5 FHBDMO O=C(CC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1)Nc1ccccc1F ZINC000179240010 938996431 /nfs/dbraw/zinc/99/64/31/938996431.db2.gz ZFEQPHVEANZHQK-UHFFFAOYSA-N 1 1 357.385 3.727 20 5 FHBDMO CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000609441817 939015789 /nfs/dbraw/zinc/01/57/89/939015789.db2.gz GLYFRGHQUTXOGJ-UHFFFAOYSA-N 1 1 359.401 3.504 20 5 FHBDMO CCC[N@H+]1CC[C@H](CNCc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)C1 ZINC000102424108 939018535 /nfs/dbraw/zinc/01/85/35/939018535.db2.gz MSFZDCFLCSNSCH-OAHLLOKOSA-N 1 1 373.453 3.685 20 5 FHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)cn1 ZINC000612101618 939050749 /nfs/dbraw/zinc/05/07/49/939050749.db2.gz BVSGEGREFYXELJ-NZSAHSFTSA-N 1 1 352.438 3.702 20 5 FHBDMO O=C(CC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1)Nc1ccccc1F ZINC000179518601 939876377 /nfs/dbraw/zinc/87/63/77/939876377.db2.gz JLGIZKGJYOFFPH-UHFFFAOYSA-N 1 1 357.385 3.727 20 5 FHBDMO CCCn1cc[nH+]c1CCCN(C)c1ccnc2c1cccc2[N+](=O)[O-] ZINC000432180087 945280286 /nfs/dbraw/zinc/28/02/86/945280286.db2.gz SYXZSIFHBMCPHY-UHFFFAOYSA-N 1 1 353.426 3.819 20 5 FHBDMO COc1ccccc1COC1CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000179752893 939931366 /nfs/dbraw/zinc/93/13/66/939931366.db2.gz CHLZQSMPLFYJEP-UHFFFAOYSA-N 1 1 374.412 3.924 20 5 FHBDMO COc1cc(C[N@H+]2CC=C(c3ccc(O)cc3)CC2)c([N+](=O)[O-])cc1OC ZINC000179803946 939947719 /nfs/dbraw/zinc/94/77/19/939947719.db2.gz BNIXUVOSOKPLET-UHFFFAOYSA-N 1 1 370.405 3.607 20 5 FHBDMO COc1cc(C[N@@H+]2CC=C(c3ccc(O)cc3)CC2)c([N+](=O)[O-])cc1OC ZINC000179803946 939947722 /nfs/dbraw/zinc/94/77/22/939947722.db2.gz BNIXUVOSOKPLET-UHFFFAOYSA-N 1 1 370.405 3.607 20 5 FHBDMO C[C@H](c1ccc(-n2cncn2)cc1)[N@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000047540894 945287859 /nfs/dbraw/zinc/28/78/59/945287859.db2.gz VCJAQEGICVPTAQ-CYBMUJFWSA-N 1 1 355.373 3.508 20 5 FHBDMO C[C@H](c1ccc(-n2cncn2)cc1)[N@@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000047540894 945287867 /nfs/dbraw/zinc/28/78/67/945287867.db2.gz VCJAQEGICVPTAQ-CYBMUJFWSA-N 1 1 355.373 3.508 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@H](C)c1ccccc1 ZINC000411140565 940002447 /nfs/dbraw/zinc/00/24/47/940002447.db2.gz XTSIGHCVKZJDMC-CQSZACIVSA-N 1 1 357.410 3.625 20 5 FHBDMO C[C@@H](c1ccc(-n2cncn2)cc1)[N@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000047540891 945288359 /nfs/dbraw/zinc/28/83/59/945288359.db2.gz VCJAQEGICVPTAQ-ZDUSSCGKSA-N 1 1 355.373 3.508 20 5 FHBDMO C[C@@H](c1ccc(-n2cncn2)cc1)[N@@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000047540891 945288363 /nfs/dbraw/zinc/28/83/63/945288363.db2.gz VCJAQEGICVPTAQ-ZDUSSCGKSA-N 1 1 355.373 3.508 20 5 FHBDMO Cc1c(-c2nc([C@@H]3C[N@@H+](C4CCCCC4)CCO3)no2)cccc1[N+](=O)[O-] ZINC000364993269 940034527 /nfs/dbraw/zinc/03/45/27/940034527.db2.gz GZCMKFRHGNXTMN-KRWDZBQOSA-N 1 1 372.425 3.659 20 5 FHBDMO Cc1c(-c2nc([C@@H]3C[N@H+](C4CCCCC4)CCO3)no2)cccc1[N+](=O)[O-] ZINC000364993269 940034533 /nfs/dbraw/zinc/03/45/33/940034533.db2.gz GZCMKFRHGNXTMN-KRWDZBQOSA-N 1 1 372.425 3.659 20 5 FHBDMO CCn1c2cccc(F)c2nc1C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548928094 940054727 /nfs/dbraw/zinc/05/47/27/940054727.db2.gz RYLFXOXTYMUFGU-UHFFFAOYSA-N 1 1 356.401 3.778 20 5 FHBDMO CCn1c2cccc(F)c2nc1C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548928094 940054730 /nfs/dbraw/zinc/05/47/30/940054730.db2.gz RYLFXOXTYMUFGU-UHFFFAOYSA-N 1 1 356.401 3.778 20 5 FHBDMO C[C@@H]1C[C@@H](C(F)(F)F)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411809091 940123851 /nfs/dbraw/zinc/12/38/51/940123851.db2.gz SYTJKRCVKGCSDO-NEPJUHHUSA-N 1 1 359.348 3.586 20 5 FHBDMO Cn1cc(C[N@@H+]2CCOC3(CCCCC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000179934236 940146272 /nfs/dbraw/zinc/14/62/72/940146272.db2.gz KDGVODJFKQSYII-UHFFFAOYSA-N 1 1 370.453 3.530 20 5 FHBDMO Cn1cc(C[N@H+]2CCOC3(CCCCC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000179934236 940146274 /nfs/dbraw/zinc/14/62/74/940146274.db2.gz KDGVODJFKQSYII-UHFFFAOYSA-N 1 1 370.453 3.530 20 5 FHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@H](O)C[C@H]1c1ccccc1 ZINC000411947158 940160863 /nfs/dbraw/zinc/16/08/63/940160863.db2.gz OUZNTNHMCKIUKG-MOPGFXCFSA-N 1 1 356.422 3.690 20 5 FHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](O)C[C@H]1c1ccccc1 ZINC000411947158 940160864 /nfs/dbraw/zinc/16/08/64/940160864.db2.gz OUZNTNHMCKIUKG-MOPGFXCFSA-N 1 1 356.422 3.690 20 5 FHBDMO COc1ccc(C[N@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)cn1 ZINC000612586857 940164178 /nfs/dbraw/zinc/16/41/78/940164178.db2.gz RJGZSAOOJLBPBG-UHFFFAOYSA-N 1 1 353.378 3.890 20 5 FHBDMO COc1ccc(C[N@@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)cn1 ZINC000612586857 940164180 /nfs/dbraw/zinc/16/41/80/940164180.db2.gz RJGZSAOOJLBPBG-UHFFFAOYSA-N 1 1 353.378 3.890 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1CC[N@H+](C)[C@H]1c1cccs1 ZINC000365479511 940172245 /nfs/dbraw/zinc/17/22/45/940172245.db2.gz DQKHCFHJCJFVCI-SUMWQHHRSA-N 1 1 374.466 3.779 20 5 FHBDMO C[C@]1(O)CC[N@@H+](Cc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)C1 ZINC000180183919 940782103 /nfs/dbraw/zinc/78/21/03/940782103.db2.gz IGYLRKZPEZOIPI-SFHVURJKSA-N 1 1 362.813 3.997 20 5 FHBDMO CCC(=O)c1ccc(NC2CC[NH+](Cc3cccnc3)CC2)c([N+](=O)[O-])c1 ZINC000376466865 941058766 /nfs/dbraw/zinc/05/87/66/941058766.db2.gz KUQYGRPMBSWJIK-UHFFFAOYSA-N 1 1 368.437 3.659 20 5 FHBDMO CC(=O)c1cc(N2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)ccc1[N+](=O)[O-] ZINC000376474983 941067104 /nfs/dbraw/zinc/06/71/04/941067104.db2.gz QIBIQEOTUKJFDP-OAHLLOKOSA-N 1 1 368.437 3.714 20 5 FHBDMO Cc1cc(C[C@@H](C)[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)n[nH]1 ZINC000180963911 941097841 /nfs/dbraw/zinc/09/78/41/941097841.db2.gz BVZWTHIRVUKKME-JLTOFOAXSA-N 1 1 350.422 3.937 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])c(N2CC[C@H](C)[N@H+](Cc3ccccc3)CC2)n1 ZINC000541006387 941098271 /nfs/dbraw/zinc/09/82/71/941098271.db2.gz PREBHFRWWWHEBT-KRWDZBQOSA-N 1 1 354.454 3.707 20 5 FHBDMO O=C(N[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000311251170 941151590 /nfs/dbraw/zinc/15/15/90/941151590.db2.gz JHNCHAYJEGTPDL-INIZCTEOSA-N 1 1 373.840 3.643 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](Cc1ccco1)C1CCCC1 ZINC000053139581 941247310 /nfs/dbraw/zinc/24/73/10/941247310.db2.gz HWGFYFCCEZNTKH-UHFFFAOYSA-N 1 1 373.409 3.580 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](Cc1ccco1)C1CCCC1 ZINC000053139581 941247312 /nfs/dbraw/zinc/24/73/12/941247312.db2.gz HWGFYFCCEZNTKH-UHFFFAOYSA-N 1 1 373.409 3.580 20 5 FHBDMO [NH3+][C@@H]1CC[C@H]2CN(Cc3ccc(-c4ccc([N+](=O)[O-])cc4Cl)o3)C[C@@H]12 ZINC000414675495 941433770 /nfs/dbraw/zinc/43/37/70/941433770.db2.gz TXSQTWOMSHIKSG-UXEPBGEESA-N 1 1 361.829 3.677 20 5 FHBDMO CO[C@H](C)C[N@H+](C)[C@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000513261802 941814757 /nfs/dbraw/zinc/81/47/57/941814757.db2.gz POCKKXRNSVBWOG-BEFAXECRSA-N 1 1 371.437 3.550 20 5 FHBDMO CO[C@H](C)C[N@@H+](C)[C@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000513261802 941814760 /nfs/dbraw/zinc/81/47/60/941814760.db2.gz POCKKXRNSVBWOG-BEFAXECRSA-N 1 1 371.437 3.550 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H](Oc2ccccc2OC)C1 ZINC000513378227 941875298 /nfs/dbraw/zinc/87/52/98/941875298.db2.gz ZYMZIBPTWBMSTC-QGZVFWFLSA-N 1 1 372.421 3.655 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](Oc2ccccc2OC)C1 ZINC000513378227 941875303 /nfs/dbraw/zinc/87/53/03/941875303.db2.gz ZYMZIBPTWBMSTC-QGZVFWFLSA-N 1 1 372.421 3.655 20 5 FHBDMO CCOc1ccc(NC(=O)C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000513386760 941884781 /nfs/dbraw/zinc/88/47/81/941884781.db2.gz PYMRKZWJHXABKB-UHFFFAOYSA-N 1 1 371.437 3.843 20 5 FHBDMO CCOc1ccc(NC(=O)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000513386760 941884782 /nfs/dbraw/zinc/88/47/82/941884782.db2.gz PYMRKZWJHXABKB-UHFFFAOYSA-N 1 1 371.437 3.843 20 5 FHBDMO COc1ccccc1CC[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000513479864 941957136 /nfs/dbraw/zinc/95/71/36/941957136.db2.gz SJIYIUBGCLTCBT-UHFFFAOYSA-N 1 1 366.364 3.879 20 5 FHBDMO CC(C)c1[nH+]ccn1CC(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000182824028 941973779 /nfs/dbraw/zinc/97/37/79/941973779.db2.gz JBLWHTYUKXOZIV-UHFFFAOYSA-N 1 1 356.304 3.572 20 5 FHBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cccc2[nH]ccc21 ZINC000501902993 942108014 /nfs/dbraw/zinc/10/80/14/942108014.db2.gz ZRMFUBSXDRKORZ-UHFFFAOYSA-N 1 1 352.394 3.537 20 5 FHBDMO CCS[C@@H]1CCCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000480969996 942244780 /nfs/dbraw/zinc/24/47/80/942244780.db2.gz XFFCHKJSFSOYLA-OAHLLOKOSA-N 1 1 362.455 3.752 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)c2c(c1)COCO2 ZINC000420941511 942279577 /nfs/dbraw/zinc/27/95/77/942279577.db2.gz FSSISQUOFOYXHJ-NSHDSACASA-N 1 1 360.332 3.626 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)c2c(c1)COCO2 ZINC000420941511 942279581 /nfs/dbraw/zinc/27/95/81/942279581.db2.gz FSSISQUOFOYXHJ-NSHDSACASA-N 1 1 360.332 3.626 20 5 FHBDMO CC(C)[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])[C@@H](C)c1ccsc1 ZINC000421005475 942299085 /nfs/dbraw/zinc/29/90/85/942299085.db2.gz JIQLGEYOGRMLHL-GOEBONIOSA-N 1 1 364.467 3.868 20 5 FHBDMO Cn1ccnc1[C@H]([NH2+]CCc1cccc(F)c1F)c1cccc([N+](=O)[O-])c1 ZINC000513708732 942347939 /nfs/dbraw/zinc/34/79/39/942347939.db2.gz WOEDNNRAZFOGBU-GOSISDBHSA-N 1 1 372.375 3.528 20 5 FHBDMO C[C@@H]1C[C@H](N(C)c2ncc([N+](=O)[O-])cc2F)CC[N@H+]1Cc1ccccc1 ZINC000413153664 942352171 /nfs/dbraw/zinc/35/21/71/942352171.db2.gz HUWJUKVEAKEMKX-GDBMZVCRSA-N 1 1 358.417 3.618 20 5 FHBDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000502471434 942455571 /nfs/dbraw/zinc/45/55/71/942455571.db2.gz ZIFRGVCPQIYWQB-AWEZNQCLSA-N 1 1 353.850 3.633 20 5 FHBDMO O=[N+]([O-])c1ccc2ccnc(N3CC[C@H]4[C@@H](CCC[N@H+]4C4CC4)C3)c2c1 ZINC000413199116 942458159 /nfs/dbraw/zinc/45/81/59/942458159.db2.gz IRTKPKAKPFSSCB-KXBFYZLASA-N 1 1 352.438 3.596 20 5 FHBDMO C[N@@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])cc2F)[C@H]1c1ccc(Cl)cc1 ZINC000413200737 942473016 /nfs/dbraw/zinc/47/30/16/942473016.db2.gz FICWALRATIJNFV-HUUCEWRRSA-N 1 1 350.781 3.640 20 5 FHBDMO C[N@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])cc2F)[C@H]1c1ccc(Cl)cc1 ZINC000413200737 942473021 /nfs/dbraw/zinc/47/30/21/942473021.db2.gz FICWALRATIJNFV-HUUCEWRRSA-N 1 1 350.781 3.640 20 5 FHBDMO Cc1c(NC(=O)[C@H](C)[NH+]2CCC(c3ccccn3)CC2)cccc1[N+](=O)[O-] ZINC000378262231 942478028 /nfs/dbraw/zinc/47/80/28/942478028.db2.gz WCJYWQWXSADTBC-HNNXBMFYSA-N 1 1 368.437 3.505 20 5 FHBDMO CC[N@@H+](CCC1CCN(c2ncc([N+](=O)[O-])cc2F)CC1)CC(C)C ZINC000413220903 942499205 /nfs/dbraw/zinc/49/92/05/942499205.db2.gz HQIXPCTXIUHZMH-UHFFFAOYSA-N 1 1 352.454 3.713 20 5 FHBDMO C[N@H+](CCOc1ccc(Br)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000501756519 942655811 /nfs/dbraw/zinc/65/58/11/942655811.db2.gz OFTMPZLJOAQPOO-UHFFFAOYSA-N 1 1 365.227 3.868 20 5 FHBDMO C[N@@H+](CCOc1ccc(Br)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000501756519 942655813 /nfs/dbraw/zinc/65/58/13/942655813.db2.gz OFTMPZLJOAQPOO-UHFFFAOYSA-N 1 1 365.227 3.868 20 5 FHBDMO Cc1ccccc1CC[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000513755357 942748526 /nfs/dbraw/zinc/74/85/26/942748526.db2.gz RRVGXJFQFANYTO-LJQANCHMSA-N 1 1 350.422 3.558 20 5 FHBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000514197735 942808072 /nfs/dbraw/zinc/80/80/72/942808072.db2.gz SDDVBLYLWGKVKH-CYBMUJFWSA-N 1 1 357.376 3.782 20 5 FHBDMO Cc1ccc([C@@]2(C)CC[N@H+](CC(=O)Nc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000434750126 942939570 /nfs/dbraw/zinc/93/95/70/942939570.db2.gz YBVJIPOHWOBLJH-FQEVSTJZSA-N 1 1 353.422 3.505 20 5 FHBDMO Cc1ccc([C@@]2(C)CC[N@@H+](CC(=O)Nc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000434750126 942939572 /nfs/dbraw/zinc/93/95/72/942939572.db2.gz YBVJIPOHWOBLJH-FQEVSTJZSA-N 1 1 353.422 3.505 20 5 FHBDMO O=C(c1ccc([N+](=O)[O-])s1)N1CC[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000378619399 942967788 /nfs/dbraw/zinc/96/77/88/942967788.db2.gz VFIFVDDKHPWYMN-CVEARBPZSA-N 1 1 371.462 3.535 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H](CC(C)C)C1 ZINC000469266235 943169422 /nfs/dbraw/zinc/16/94/22/943169422.db2.gz LFJKOLSCYIXLRC-OAHLLOKOSA-N 1 1 363.458 3.690 20 5 FHBDMO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]C1CCN(C2CCC2)CC1 ZINC000513789026 943192532 /nfs/dbraw/zinc/19/25/32/943192532.db2.gz BGYOBQOOJATQGF-OXJNMPFZSA-N 1 1 357.498 3.913 20 5 FHBDMO CC[C@H](N[C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000422832877 943299633 /nfs/dbraw/zinc/29/96/33/943299633.db2.gz GMQHECFODFTOOD-QKNQBKEWSA-N 1 1 367.449 3.891 20 5 FHBDMO C[C@H]([NH2+][C@@H](Cn1ccccc1=O)c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000503926905 943412238 /nfs/dbraw/zinc/41/22/38/943412238.db2.gz IAHQFCOQDAWMSL-LPHOPBHVSA-N 1 1 363.417 3.849 20 5 FHBDMO Cc1cccc(C(=O)NC[C@]2(C)CCC[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000162376668 943491925 /nfs/dbraw/zinc/49/19/25/943491925.db2.gz FYEGMDDGEBDUIC-NRFANRHFSA-N 1 1 367.449 3.688 20 5 FHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@](O)(C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000515254601 943605374 /nfs/dbraw/zinc/60/53/74/943605374.db2.gz URBGPUMOLIDDLP-INIZCTEOSA-N 1 1 360.376 3.998 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[N@@H+](C)C[C@@H]1c1ccccc1 ZINC000515403157 943851534 /nfs/dbraw/zinc/85/15/34/943851534.db2.gz MTDHXDGHDNYQEM-LJQANCHMSA-N 1 1 368.437 3.732 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[N@H+](C)C[C@@H]1c1ccccc1 ZINC000515403157 943851541 /nfs/dbraw/zinc/85/15/41/943851541.db2.gz MTDHXDGHDNYQEM-LJQANCHMSA-N 1 1 368.437 3.732 20 5 FHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCCN(CC(F)F)CC2)o1 ZINC000516962919 943867589 /nfs/dbraw/zinc/86/75/89/943867589.db2.gz LBFQZEANNCBIPR-UHFFFAOYSA-N 1 1 365.380 3.628 20 5 FHBDMO CC[N@H+]1CC[C@@H](N(C)Cc2ccc(Br)cc2[N+](=O)[O-])C[C@@H]1C ZINC000425422343 943880079 /nfs/dbraw/zinc/88/00/79/943880079.db2.gz NASWEWKOUNNZGK-SWLSCSKDSA-N 1 1 370.291 3.662 20 5 FHBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1CC[C@@H](C2CCOCC2)C1 ZINC000425423372 943884979 /nfs/dbraw/zinc/88/49/79/943884979.db2.gz QQCQCUVJTVXDCQ-CYBMUJFWSA-N 1 1 369.259 3.606 20 5 FHBDMO COC[C@@H]1CCCC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425430826 943890604 /nfs/dbraw/zinc/89/06/04/943890604.db2.gz GPCWNKJFJMJLPS-GFCCVEGCSA-N 1 1 357.248 3.606 20 5 FHBDMO O=[N+]([O-])c1cccc(OCCN2CCC[N@@H+](CC3CCCCC3)CC2)c1 ZINC000515531259 943966292 /nfs/dbraw/zinc/96/62/92/943966292.db2.gz NJZOTAXZZZKNSI-UHFFFAOYSA-N 1 1 361.486 3.562 20 5 FHBDMO COc1ccc(OCC[N@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)cc1 ZINC000517094496 943994547 /nfs/dbraw/zinc/99/45/47/943994547.db2.gz XUIQOZPKDJDWQU-UHFFFAOYSA-N 1 1 374.437 3.901 20 5 FHBDMO COc1ccc(OCC[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)cc1 ZINC000517094496 943994551 /nfs/dbraw/zinc/99/45/51/943994551.db2.gz XUIQOZPKDJDWQU-UHFFFAOYSA-N 1 1 374.437 3.901 20 5 FHBDMO C[C@H](NC(=O)NC[C@@H]1CCC[N@H+]1C1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000437637343 944004512 /nfs/dbraw/zinc/00/45/12/944004512.db2.gz VHJVWOCNTPETQW-KXBFYZLASA-N 1 1 374.485 3.752 20 5 FHBDMO C[C@]1(c2ccccc2)CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000500072490 944051325 /nfs/dbraw/zinc/05/13/25/944051325.db2.gz DFYOOFDTYFVVSN-FQEVSTJZSA-N 1 1 353.422 3.587 20 5 FHBDMO O=C(CC[N@H+]1CC[C@@H](c2ccccc2F)C1)Nc1ccccc1[N+](=O)[O-] ZINC000500069868 944051653 /nfs/dbraw/zinc/05/16/53/944051653.db2.gz KFAMBVTYNXOMLB-CQSZACIVSA-N 1 1 357.385 3.552 20 5 FHBDMO Cc1c(NC(=O)NC[C@@H]2CCC[N@H+]2C2CCCCC2)cccc1[N+](=O)[O-] ZINC000436265779 944141654 /nfs/dbraw/zinc/14/16/54/944141654.db2.gz YLHLEEITJDQILQ-INIZCTEOSA-N 1 1 360.458 3.822 20 5 FHBDMO Cc1ccc(C[C@@H]2CCC[N@H+]2CCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000500139427 944162181 /nfs/dbraw/zinc/16/21/81/944162181.db2.gz NZEABVHGGTXWIV-SFHVURJKSA-N 1 1 367.449 3.939 20 5 FHBDMO COc1ccc(CNC[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000312655972 944192226 /nfs/dbraw/zinc/19/22/26/944192226.db2.gz LOPRSFIYXUDLQU-OAQYLSRUSA-N 1 1 369.465 3.605 20 5 FHBDMO CC[N@@H+](CCNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])CCC(F)(F)F ZINC000436380085 944250244 /nfs/dbraw/zinc/25/02/44/944250244.db2.gz VWVZUARYWTZRRD-UHFFFAOYSA-N 1 1 374.285 3.695 20 5 FHBDMO CCC[C@H]([NH2+]Cc1cc(C)nc(N2CCCC2)n1)c1cccc([N+](=O)[O-])c1 ZINC000426325302 944447986 /nfs/dbraw/zinc/44/79/86/944447986.db2.gz IHLXPMJXTIWXFC-IBGZPJMESA-N 1 1 369.469 3.924 20 5 FHBDMO Cc1cccc(C(=O)NC[C@H]2CCC[N@H+]2CC2CCCCC2)c1[N+](=O)[O-] ZINC000517623402 944451113 /nfs/dbraw/zinc/45/11/13/944451113.db2.gz ZMEOBXXMGCSEMD-QGZVFWFLSA-N 1 1 359.470 3.678 20 5 FHBDMO Cc1c[nH+]ccc1OC1CCN(Cc2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC000584558964 944455814 /nfs/dbraw/zinc/45/58/14/944455814.db2.gz UOKGANDVGYHNEA-UHFFFAOYSA-N 1 1 363.364 3.620 20 5 FHBDMO Cc1cc(NC(=O)N[C@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000473789235 944469089 /nfs/dbraw/zinc/46/90/89/944469089.db2.gz RTDBPIHMKOOCLY-YJBOKZPZSA-N 1 1 368.437 3.860 20 5 FHBDMO CC[N@@H+](CCNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)C(C)C ZINC000110419444 944482762 /nfs/dbraw/zinc/48/27/62/944482762.db2.gz FSWQWDKFUDWPNQ-UHFFFAOYSA-N 1 1 370.453 3.799 20 5 FHBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[N@@H+](CC)C1 ZINC000506209273 944527061 /nfs/dbraw/zinc/52/70/61/944527061.db2.gz VGZZXJIVFRIEEP-CQSZACIVSA-N 1 1 365.499 3.559 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC[C@@H](Oc2ncccc2F)C1 ZINC000425999922 944577582 /nfs/dbraw/zinc/57/75/82/944577582.db2.gz QPSDDDHOXVKAEB-IEXSPKMKSA-N 1 1 357.385 3.686 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@@H](Oc2ncccc2F)C1 ZINC000425999922 944577587 /nfs/dbraw/zinc/57/75/87/944577587.db2.gz QPSDDDHOXVKAEB-IEXSPKMKSA-N 1 1 357.385 3.686 20 5 FHBDMO COc1cc(C[N@H+](Cc2ccccc2)CC(C)(C)O)c([N+](=O)[O-])cc1F ZINC000184328441 944621625 /nfs/dbraw/zinc/62/16/25/944621625.db2.gz YWANUZUDUGBUJN-UHFFFAOYSA-N 1 1 362.401 3.516 20 5 FHBDMO COc1cc(C[N@@H+](Cc2ccccc2)CC(C)(C)O)c([N+](=O)[O-])cc1F ZINC000184328441 944621630 /nfs/dbraw/zinc/62/16/30/944621630.db2.gz YWANUZUDUGBUJN-UHFFFAOYSA-N 1 1 362.401 3.516 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)C[C@H](C)c1ccccc1 ZINC000066854658 944639264 /nfs/dbraw/zinc/63/92/64/944639264.db2.gz MLQCEIFUMUHMEG-HNNXBMFYSA-N 1 1 371.437 3.668 20 5 FHBDMO C[C@H](CNC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)[N@H+]1CCCC[C@H]1C ZINC000437933603 944810919 /nfs/dbraw/zinc/81/09/19/944810919.db2.gz PPHIJZNIOYNVMB-HZPDHXFCSA-N 1 1 374.485 3.532 20 5 FHBDMO Cc1c(C(=O)N[C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000487340945 944907145 /nfs/dbraw/zinc/90/71/45/944907145.db2.gz CJXJFPBNBNRDIU-SJLPKXTDSA-N 1 1 367.449 3.544 20 5 FHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCCC[C@@H]1c1ccc(F)cc1F ZINC001167772676 945408134 /nfs/dbraw/zinc/40/81/34/945408134.db2.gz WQLSJQONTQPKNC-MRXNPFEDSA-N 1 1 350.369 3.605 20 5 FHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCCC[C@@H]1c1ccc(F)cc1F ZINC001167772676 945408143 /nfs/dbraw/zinc/40/81/43/945408143.db2.gz WQLSJQONTQPKNC-MRXNPFEDSA-N 1 1 350.369 3.605 20 5 FHBDMO COc1cccc([C@@H](C)[NH+]2CCN(Cc3cccc([N+](=O)[O-])c3C)CC2)c1 ZINC000507687482 945436778 /nfs/dbraw/zinc/43/67/78/945436778.db2.gz HPXFZMTUXSKRPZ-QGZVFWFLSA-N 1 1 369.465 3.791 20 5 FHBDMO COc1ccc(C[N@H+](C)[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000015440703 945468864 /nfs/dbraw/zinc/46/88/64/945468864.db2.gz SXZMIXXCTYISPG-CYBMUJFWSA-N 1 1 368.393 3.846 20 5 FHBDMO COc1ccc(C[N@@H+](C)[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000015440703 945468872 /nfs/dbraw/zinc/46/88/72/945468872.db2.gz SXZMIXXCTYISPG-CYBMUJFWSA-N 1 1 368.393 3.846 20 5 FHBDMO Cc1cc(N2CC[C@H]3[C@@H](CCC[N@@H+]3C)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549524980 945605225 /nfs/dbraw/zinc/60/52/25/945605225.db2.gz OYFYHCVGWNQEHN-JSGCOSHPSA-N 1 1 357.376 3.843 20 5 FHBDMO O=[N+]([O-])c1cnc(N2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)c(Cl)c1 ZINC000281732999 945832067 /nfs/dbraw/zinc/83/20/67/945832067.db2.gz AXBHVSARVWMNCF-GFCCVEGCSA-N 1 1 361.833 3.560 20 5 FHBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccc(Br)cc1 ZINC000108101682 945860701 /nfs/dbraw/zinc/86/07/01/945860701.db2.gz YOXNTPMUMJOSKT-UHFFFAOYSA-N 1 1 365.227 3.868 20 5 FHBDMO CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ncc([N+](=O)[O-])cc1Cl ZINC000439698183 945936133 /nfs/dbraw/zinc/93/61/33/945936133.db2.gz XEVLICWPZHEWPL-INIZCTEOSA-N 1 1 374.872 3.992 20 5 FHBDMO CC(C)(C)OC(=O)Nc1ncc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)s1 ZINC000281928891 945941847 /nfs/dbraw/zinc/94/18/47/945941847.db2.gz HHADTJUBWYLRLJ-UHFFFAOYSA-N 1 1 364.427 3.688 20 5 FHBDMO COc1ccc(-c2ccc(C[N@@H+](C)CC3CCOCC3)o2)c([N+](=O)[O-])c1 ZINC000093314745 946262067 /nfs/dbraw/zinc/26/20/67/946262067.db2.gz SIGMFFVBPXNQAZ-UHFFFAOYSA-N 1 1 360.410 3.722 20 5 FHBDMO C[C@H]1C[N@@H+]2CCCC[C@@H]2CN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000408182667 946301855 /nfs/dbraw/zinc/30/18/55/946301855.db2.gz LIIKEDAYXZGWRK-SWLSCSKDSA-N 1 1 359.451 3.508 20 5 FHBDMO C[C@H]1C[N@H+]2CCCC[C@@H]2CN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000408182667 946301863 /nfs/dbraw/zinc/30/18/63/946301863.db2.gz LIIKEDAYXZGWRK-SWLSCSKDSA-N 1 1 359.451 3.508 20 5 FHBDMO C[C@@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1nnc2n1CCC2 ZINC000237419828 946362599 /nfs/dbraw/zinc/36/25/99/946362599.db2.gz GYBYKROPKBEYRK-GFCCVEGCSA-N 1 1 369.450 3.712 20 5 FHBDMO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000441344604 946492765 /nfs/dbraw/zinc/49/27/65/946492765.db2.gz IWMLTNZXGFFXHP-WNYOCNMUSA-N 1 1 374.412 3.557 20 5 FHBDMO O=C(C[N@H+](Cc1ccccc1)C1CC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000025120894 946502887 /nfs/dbraw/zinc/50/28/87/946502887.db2.gz XXEWRVAJODMWFR-UHFFFAOYSA-N 1 1 359.813 3.851 20 5 FHBDMO O=C(C[N@@H+](Cc1ccccc1)C1CC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000025120894 946502898 /nfs/dbraw/zinc/50/28/98/946502898.db2.gz XXEWRVAJODMWFR-UHFFFAOYSA-N 1 1 359.813 3.851 20 5 FHBDMO COc1ccc(OCC[N@H+]2CC[C@@H](Cc3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000441383420 946506698 /nfs/dbraw/zinc/50/66/98/946506698.db2.gz LOCBRUWFVYPIGM-INIZCTEOSA-N 1 1 374.412 3.686 20 5 FHBDMO COc1ccc(OCC[N@H+]2C[C@@H](c3ccccc3)C[C@H]2C)c([N+](=O)[O-])c1 ZINC000441400628 946556795 /nfs/dbraw/zinc/55/67/95/946556795.db2.gz WWSNLTVYHAGFNT-WBVHZDCISA-N 1 1 356.422 3.860 20 5 FHBDMO COc1ccc(OCC[N@H+]2CCSC[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000441410236 946565717 /nfs/dbraw/zinc/56/57/17/946565717.db2.gz KYMWPYVHVRCDJR-GOSISDBHSA-N 1 1 374.462 3.772 20 5 FHBDMO CC(C)c1ccc(C(=O)N2CC[C@@H](C[N@@H+](C)CC3CC3)C2)cc1[N+](=O)[O-] ZINC000473904410 946605304 /nfs/dbraw/zinc/60/53/04/946605304.db2.gz XCGCOIZNZKJHPU-INIZCTEOSA-N 1 1 359.470 3.522 20 5 FHBDMO CC(C)OC(=O)C[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000184452054 946697533 /nfs/dbraw/zinc/69/75/33/946697533.db2.gz GHJDVQYSRRMUFQ-ZDUSSCGKSA-N 1 1 354.834 3.802 20 5 FHBDMO CC(C)OC(=O)C[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000184452054 946697546 /nfs/dbraw/zinc/69/75/46/946697546.db2.gz GHJDVQYSRRMUFQ-ZDUSSCGKSA-N 1 1 354.834 3.802 20 5 FHBDMO C[C@H]([NH2+][C@H](c1cnn(C)c1)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000186639411 946768594 /nfs/dbraw/zinc/76/85/94/946768594.db2.gz CBHHWXXEPLYFDR-DJJJIMSYSA-N 1 1 354.385 3.908 20 5 FHBDMO 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CC[C@H]1C[N@H+]2CCC[C@@H]2CN1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000182076273 948557943 /nfs/dbraw/zinc/55/79/43/948557943.db2.gz JXNBZCYHNAEMFF-FUHWJXTLSA-N 1 1 372.494 3.777 20 5 FHBDMO COc1cc(C[N@H+]2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)c([N+](=O)[O-])cc1F ZINC000574854960 948634215 /nfs/dbraw/zinc/63/42/15/948634215.db2.gz FYDUTTBXXQFIJC-QGPMSJSTSA-N 1 1 366.433 3.648 20 5 FHBDMO C[C@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)c1ccc([N+](=O)[O-])s1 ZINC000107584670 209276880 /nfs/dbraw/zinc/27/68/80/209276880.db2.gz CPNRNXHHTQJZLK-AWEZNQCLSA-N 1 1 373.478 3.961 20 5 FHBDMO CCOc1ccc(C[NH+]2CCN(c3ccc([N+](=O)[O-])c(C)c3)CC2)cc1 ZINC000108100648 132242787 /nfs/dbraw/zinc/24/27/87/132242787.db2.gz VINOCVLXXJVHRH-UHFFFAOYSA-N 1 1 355.438 3.624 20 5 FHBDMO Cc1sc(C(=O)N2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)cc1[N+](=O)[O-] ZINC000265004323 568060802 /nfs/dbraw/zinc/06/08/02/568060802.db2.gz FGYPQLXIQWPJTK-HIFRSBDPSA-N 1 1 365.499 3.691 20 5 FHBDMO CC[C@@H](C[N@@H+](CC)Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000481688620 568089005 /nfs/dbraw/zinc/08/90/05/568089005.db2.gz LPJMAWBLEMHOSO-HNNXBMFYSA-N 1 1 355.438 3.709 20 5 FHBDMO Cn1ccnc1[C@H]([NH2+][C@@H]1C[C@@H]1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000568660947 568113064 /nfs/dbraw/zinc/11/30/64/568113064.db2.gz ZALFKGOGCOWKCQ-DFQSSKMNSA-N 1 1 362.433 3.639 20 5 FHBDMO CCN1CC[NH+](Cc2ccccc2CNc2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC000302981499 568246245 /nfs/dbraw/zinc/24/62/45/568246245.db2.gz VJAFHGYJFRPYON-UHFFFAOYSA-N 1 1 368.481 3.653 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])c(N(C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)n1 ZINC000541935025 568259621 /nfs/dbraw/zinc/25/96/21/568259621.db2.gz HGGMBFWIZLBJLJ-GOSISDBHSA-N 1 1 354.454 3.565 20 5 FHBDMO COc1ccc([C@H](O)C2CC[NH+](Cc3ccc([N+](=O)[O-])c(F)c3)CC2)cc1 ZINC000291749740 568296444 /nfs/dbraw/zinc/29/64/44/568296444.db2.gz KLYUNLBLQVUBSV-FQEVSTJZSA-N 1 1 374.412 3.688 20 5 FHBDMO CCc1ccc(C[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000569522546 568404692 /nfs/dbraw/zinc/40/46/92/568404692.db2.gz QOGAUIWQZMKZRJ-UHFFFAOYSA-N 1 1 353.422 3.760 20 5 FHBDMO CCc1ccc(C[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000569522546 568404693 /nfs/dbraw/zinc/40/46/93/568404693.db2.gz QOGAUIWQZMKZRJ-UHFFFAOYSA-N 1 1 353.422 3.760 20 5 FHBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@H](c3cccc(F)c3)C2)cccc1[N+](=O)[O-] ZINC000569875135 568433045 /nfs/dbraw/zinc/43/30/45/568433045.db2.gz HPUUUSHFYMOEMB-INIZCTEOSA-N 1 1 371.412 3.860 20 5 FHBDMO O=C(CC[N@H+]1CCC=C(c2ccccc2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000569874018 568433049 /nfs/dbraw/zinc/43/30/49/568433049.db2.gz IJZNOFLFUNEELQ-UHFFFAOYSA-N 1 1 351.406 3.713 20 5 FHBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)C[N@@H+](C)C(C)C ZINC000569979351 568445620 /nfs/dbraw/zinc/44/56/20/568445620.db2.gz PNMVIRLNBAUPRA-ZDUSSCGKSA-N 1 1 353.488 3.555 20 5 FHBDMO O=[N+]([O-])c1cnc(Cl)cc1N1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001164618553 719063355 /nfs/dbraw/zinc/06/33/55/719063355.db2.gz BBIANLPRMBMXRS-MAUKXSAKSA-N 1 1 372.856 3.744 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)cc(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)n1 ZINC001164626761 719072330 /nfs/dbraw/zinc/07/23/30/719072330.db2.gz PHEDDXDEBNGHOS-RDJZCZTQSA-N 1 1 372.856 3.744 20 5 FHBDMO C[C@@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)[N@@H+]1CCC[C@@H]1C ZINC000178724336 936322943 /nfs/dbraw/zinc/32/29/43/936322943.db2.gz RJEGCNOHMGIACC-RYUDHWBXSA-N 1 1 360.439 3.530 20 5 FHBDMO C[C@@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)[N@H+]1CCC[C@@H]1C ZINC000178724336 936322946 /nfs/dbraw/zinc/32/29/46/936322946.db2.gz RJEGCNOHMGIACC-RYUDHWBXSA-N 1 1 360.439 3.530 20 5 FHBDMO C[N@H+](Cc1ccccc1)CC1CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1 ZINC000153684975 936382664 /nfs/dbraw/zinc/38/26/64/936382664.db2.gz GYDZNIAAJAXZIV-UHFFFAOYSA-N 1 1 374.872 3.992 20 5 FHBDMO CC[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)[C@@H](C)c1ccc(F)cc1 ZINC000516616597 945069093 /nfs/dbraw/zinc/06/90/93/945069093.db2.gz LQVAQCMVKHBZPY-KBXCAEBGSA-N 1 1 362.401 3.557 20 5 FHBDMO CCOCCC[N@@H+]1CC[C@H](N[C@H](CC)c2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000247983784 937151417 /nfs/dbraw/zinc/15/14/17/937151417.db2.gz IPUZUDQHXJDZIU-AHRSYUTCSA-N 1 1 363.502 3.773 20 5 FHBDMO CCOCCC[N@H+]1CC[C@H](N[C@H](CC)c2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000247983784 937151420 /nfs/dbraw/zinc/15/14/20/937151420.db2.gz IPUZUDQHXJDZIU-AHRSYUTCSA-N 1 1 363.502 3.773 20 5 FHBDMO CCOCCCN1CC[C@H]([NH2+][C@H](CC)c2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000247983784 937151422 /nfs/dbraw/zinc/15/14/22/937151422.db2.gz IPUZUDQHXJDZIU-AHRSYUTCSA-N 1 1 363.502 3.773 20 5 FHBDMO Cc1ccc(NC(=O)[C@H](C)[N@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1C ZINC000583131497 937153257 /nfs/dbraw/zinc/15/32/57/937153257.db2.gz NPXWUJAWQNUQIM-INIZCTEOSA-N 1 1 355.438 3.713 20 5 FHBDMO Cc1ccc(NC(=O)[C@H](C)[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1C ZINC000583131497 937153259 /nfs/dbraw/zinc/15/32/59/937153259.db2.gz NPXWUJAWQNUQIM-INIZCTEOSA-N 1 1 355.438 3.713 20 5 FHBDMO CCOCCC[N@H+]1CC[C@H](N[C@H](C)c2cccc([N+](=O)[O-])c2C)[C@H](C)C1 ZINC000248012192 937174239 /nfs/dbraw/zinc/17/42/39/937174239.db2.gz LIVYFSNAYIQICZ-SUMDDJOVSA-N 1 1 363.502 3.691 20 5 FHBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000120313687 928080127 /nfs/dbraw/zinc/08/01/27/928080127.db2.gz IEKQAPTZRHWCDQ-UHFFFAOYSA-N 1 1 370.453 3.985 20 5 FHBDMO CC(C)(C)OC(=O)[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000559107336 928210085 /nfs/dbraw/zinc/21/00/85/928210085.db2.gz KBULZQFMQOVYOI-NSHDSACASA-N 1 1 374.359 3.777 20 5 FHBDMO CC(C)(C)OC(=O)[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000559107336 928210095 /nfs/dbraw/zinc/21/00/95/928210095.db2.gz KBULZQFMQOVYOI-NSHDSACASA-N 1 1 374.359 3.777 20 5 FHBDMO C[C@@H]1C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@H](c2ccc(F)cc2)O1 ZINC000610217627 928222408 /nfs/dbraw/zinc/22/24/08/928222408.db2.gz QUFLTCKGPOTFCY-FOIQADDNSA-N 1 1 374.412 3.965 20 5 FHBDMO C[C@@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@H](c2ccc(F)cc2)O1 ZINC000610217627 928222415 /nfs/dbraw/zinc/22/24/15/928222415.db2.gz QUFLTCKGPOTFCY-FOIQADDNSA-N 1 1 374.412 3.965 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)c1cnn(Cc2ccccc2)c1 ZINC000430216951 928240239 /nfs/dbraw/zinc/24/02/39/928240239.db2.gz JSNJRHZDMJQSOP-OAHLLOKOSA-N 1 1 366.421 3.699 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CCC[N@@H+](Cc3ccccc3C)CC2)c1 ZINC000610238064 929044311 /nfs/dbraw/zinc/04/43/11/929044311.db2.gz FNIXCGIZQNQUNL-UHFFFAOYSA-N 1 1 367.449 3.560 20 5 FHBDMO O=C(CC[N@H+]1CCC[C@@H]1c1cccc(F)c1)Nc1ccc([N+](=O)[O-])cc1 ZINC001167094495 929146913 /nfs/dbraw/zinc/14/69/13/929146913.db2.gz RXRQFKRUEJQIQN-GOSISDBHSA-N 1 1 357.385 3.900 20 5 FHBDMO C[C@@H](C[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)c1ccccc1 ZINC000066853631 929208205 /nfs/dbraw/zinc/20/82/05/929208205.db2.gz GOIMDXGNUWZJMP-AWEZNQCLSA-N 1 1 352.394 3.880 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H]2C[C@@H](O)c2ccc(F)cc2)cs1 ZINC000134780697 929237442 /nfs/dbraw/zinc/23/74/42/929237442.db2.gz UYUSGAHZEHYHEO-JKSUJKDBSA-N 1 1 350.415 3.884 20 5 FHBDMO Cc1ccc([C@@H]2CCCCC[N@H+]2C[C@H](O)COc2cccc([N+](=O)[O-])c2)o1 ZINC000610004511 929772350 /nfs/dbraw/zinc/77/23/50/929772350.db2.gz PXFXXBZDRSLVOJ-HKUYNNGSSA-N 1 1 374.437 3.853 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CC[C@@H](n2cnc3c2CCCC3)C1 ZINC000548010621 929937114 /nfs/dbraw/zinc/93/71/14/929937114.db2.gz WPLXLVGPTDNLJL-OAHLLOKOSA-N 1 1 360.845 3.771 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@@H](n2cnc3c2CCCC3)C1 ZINC000548010621 929937123 /nfs/dbraw/zinc/93/71/23/929937123.db2.gz WPLXLVGPTDNLJL-OAHLLOKOSA-N 1 1 360.845 3.771 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC(Oc2cc[nH+]cc2C)CC1 ZINC000278234191 937401201 /nfs/dbraw/zinc/40/12/01/937401201.db2.gz VKOJZRZHCPIRPG-UHFFFAOYSA-N 1 1 370.409 3.682 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1CN[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379654499 930497972 /nfs/dbraw/zinc/49/79/72/930497972.db2.gz IRFPXDDDBBKQJM-APWZRJJASA-N 1 1 369.465 3.746 20 5 FHBDMO CCn1c(C)nc([N+](=O)[O-])c1N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379666727 930517378 /nfs/dbraw/zinc/51/73/78/930517378.db2.gz XFMQBKIFRHJLFD-RHSMWYFYSA-N 1 1 357.458 3.585 20 5 FHBDMO CCn1nc(C)c([N+](=O)[O-])c1NC[C@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000379681526 930530268 /nfs/dbraw/zinc/53/02/68/930530268.db2.gz RGJSSMKKRYFVGV-QGZVFWFLSA-N 1 1 357.458 3.586 20 5 FHBDMO Cc1sc(C(=O)N2CC[N@@H+](Cc3ccccc3)CC[C@@H]2C)cc1[N+](=O)[O-] ZINC000610445908 930792014 /nfs/dbraw/zinc/79/20/14/930792014.db2.gz JUJFLAWIWSDCQA-AWEZNQCLSA-N 1 1 373.478 3.701 20 5 FHBDMO Cc1sc(C(=O)N2CC[N@H+](Cc3ccccc3)CC[C@@H]2C)cc1[N+](=O)[O-] ZINC000610445908 930792027 /nfs/dbraw/zinc/79/20/27/930792027.db2.gz JUJFLAWIWSDCQA-AWEZNQCLSA-N 1 1 373.478 3.701 20 5 FHBDMO CC[C@H]1CC[C@@H](C)[N@H+]1CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000537852652 931339835 /nfs/dbraw/zinc/33/98/35/931339835.db2.gz IDGDUKGETNNKNE-OCCSQVGLSA-N 1 1 374.466 3.920 20 5 FHBDMO COc1ccc(OC2CC[NH+](Cc3ccc([N+](=O)[O-])cc3OC)CC2)cc1 ZINC000580929067 931362394 /nfs/dbraw/zinc/36/23/94/931362394.db2.gz NFNQJCHTYXGRDL-UHFFFAOYSA-N 1 1 372.421 3.655 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H](c2ccccc2)[C@@H](C)C1 ZINC000581343105 931860741 /nfs/dbraw/zinc/86/07/41/931860741.db2.gz YWZIZDPBHDKXGM-WMZOPIPTSA-N 1 1 367.449 3.967 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H](c2ccccc2)[C@@H](C)C1 ZINC000581343105 931860750 /nfs/dbraw/zinc/86/07/50/931860750.db2.gz YWZIZDPBHDKXGM-WMZOPIPTSA-N 1 1 367.449 3.967 20 5 FHBDMO Cc1csc([C@H]2CCC[N@H+](Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)n1 ZINC000581467717 932104744 /nfs/dbraw/zinc/10/47/44/932104744.db2.gz CQGNWNLIGVZCII-LBPRGKRZSA-N 1 1 357.439 3.616 20 5 FHBDMO Cc1csc([C@H]2CCC[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)n1 ZINC000581467717 932104749 /nfs/dbraw/zinc/10/47/49/932104749.db2.gz CQGNWNLIGVZCII-LBPRGKRZSA-N 1 1 357.439 3.616 20 5 FHBDMO O=[N+]([O-])c1ccc(CNC[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000394053997 932322963 /nfs/dbraw/zinc/32/29/63/932322963.db2.gz ZBTKSTOJQHCHSA-FQEVSTJZSA-N 1 1 353.466 3.987 20 5 FHBDMO Cc1ccc(C(=O)NC[C@H](C2CC2)[N@@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000477258731 932435545 /nfs/dbraw/zinc/43/55/45/932435545.db2.gz VKTCWCJABJCNNO-HXUWFJFHSA-N 1 1 367.449 3.544 20 5 FHBDMO Cc1ccc(C(=O)NC[C@@H](C2CC2)[N@@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000477258730 932435771 /nfs/dbraw/zinc/43/57/71/932435771.db2.gz VKTCWCJABJCNNO-FQEVSTJZSA-N 1 1 367.449 3.544 20 5 FHBDMO COc1cc(C[N@H+](C)CCCOc2ccccc2C)c([N+](=O)[O-])cc1OC ZINC000510450664 932500535 /nfs/dbraw/zinc/50/05/35/932500535.db2.gz XAIMSZPMCJZRLY-UHFFFAOYSA-N 1 1 374.437 3.821 20 5 FHBDMO COc1cc(C[N@@H+](C)CCCOc2ccccc2C)c([N+](=O)[O-])cc1OC ZINC000510450664 932500536 /nfs/dbraw/zinc/50/05/36/932500536.db2.gz XAIMSZPMCJZRLY-UHFFFAOYSA-N 1 1 374.437 3.821 20 5 FHBDMO C[C@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)[NH+]1CCCCC1 ZINC000175930033 932569964 /nfs/dbraw/zinc/56/99/64/932569964.db2.gz HEAUOVZZWCCEEL-GFCCVEGCSA-N 1 1 360.439 3.531 20 5 FHBDMO C[C@@H]1CC[C@H](C)[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC001167487426 932849866 /nfs/dbraw/zinc/84/98/66/932849866.db2.gz LXSWMKFFXKYXNH-MNOVXSKESA-N 1 1 350.806 3.919 20 5 FHBDMO C[C@H]1C[C@@H](NC(=O)OC(C)(C)C)CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000134664385 932895116 /nfs/dbraw/zinc/89/51/16/932895116.db2.gz GRKIKEOHDTUWGB-JSGCOSHPSA-N 1 1 367.421 3.612 20 5 FHBDMO C[C@H]1C[C@@H](NC(=O)OC(C)(C)C)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000134664385 932895121 /nfs/dbraw/zinc/89/51/21/932895121.db2.gz GRKIKEOHDTUWGB-JSGCOSHPSA-N 1 1 367.421 3.612 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](c1cnn(C)c1)c1ccc(F)cc1 ZINC000187512466 932966496 /nfs/dbraw/zinc/96/64/96/932966496.db2.gz YVTVEWRNKSSPJH-IBGZPJMESA-N 1 1 354.385 3.655 20 5 FHBDMO C[C@@H]1C[C@H](O)C[N@H+]1Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000471809712 932992758 /nfs/dbraw/zinc/99/27/58/932992758.db2.gz MKRIFOFYFKHGOI-DOMZBBRYSA-N 1 1 362.813 3.996 20 5 FHBDMO CCc1ccc(C(=O)N2CC[N@H+](Cc3ccccc3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000471910754 933675237 /nfs/dbraw/zinc/67/52/37/933675237.db2.gz JGWWPLDKUGNONZ-MRXNPFEDSA-N 1 1 367.449 3.504 20 5 FHBDMO CCc1ccc(C(=O)N2CC[N@@H+](Cc3ccccc3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000471910754 933675241 /nfs/dbraw/zinc/67/52/41/933675241.db2.gz JGWWPLDKUGNONZ-MRXNPFEDSA-N 1 1 367.449 3.504 20 5 FHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+]C(C)(C)C(=O)Nc1ccccc1 ZINC000610844471 934514754 /nfs/dbraw/zinc/51/47/54/934514754.db2.gz VHXJSOTUMPJYPQ-UHFFFAOYSA-N 1 1 371.437 3.889 20 5 FHBDMO O=[N+]([O-])c1c(NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)nc2sccn21 ZINC000065202182 934637752 /nfs/dbraw/zinc/63/77/52/934637752.db2.gz HUKLHLWACPFCOU-HNNXBMFYSA-N 1 1 371.466 3.628 20 5 FHBDMO COc1ccc([C@H]2CCC[N@H+]2CCOc2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000065208989 934666717 /nfs/dbraw/zinc/66/67/17/934666717.db2.gz ZRIKRFRFZYZYFD-LJQANCHMSA-N 1 1 372.421 3.828 20 5 FHBDMO Cc1nn(C[N@H+](CCc2nccs2)C(C)C)c2cc([N+](=O)[O-])ccc12 ZINC000121278572 934818505 /nfs/dbraw/zinc/81/85/05/934818505.db2.gz AXXIQDRHDWJOJR-UHFFFAOYSA-N 1 1 359.455 3.620 20 5 FHBDMO C[C@@H]([NH2+]Cc1cc(C(N)=O)co1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000187708811 934855534 /nfs/dbraw/zinc/85/55/34/934855534.db2.gz GPVBYMWTOJQRKI-LLVKDONJSA-N 1 1 371.418 3.866 20 5 FHBDMO Cc1cc(C(=O)N[C@@H]2CC[N@@H+](C)[C@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000536370125 934928355 /nfs/dbraw/zinc/92/83/55/934928355.db2.gz JKKJPKQHTFZVEQ-AEFFLSMTSA-N 1 1 373.840 3.732 20 5 FHBDMO Cc1cc(C(=O)N[C@@H]2CC[N@H+](C)[C@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000536370125 934928362 /nfs/dbraw/zinc/92/83/62/934928362.db2.gz JKKJPKQHTFZVEQ-AEFFLSMTSA-N 1 1 373.840 3.732 20 5 FHBDMO C[C@H]1CCCC[N@H+]1CCC1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000157462388 935079371 /nfs/dbraw/zinc/07/93/71/935079371.db2.gz HISAIZMMZOXUCZ-AWEZNQCLSA-N 1 1 365.499 3.773 20 5 FHBDMO Cc1cnc(CC[N@@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)s1 ZINC000157673780 935134989 /nfs/dbraw/zinc/13/49/89/935134989.db2.gz PIICXIBJOYESGV-UHFFFAOYSA-N 1 1 372.450 3.732 20 5 FHBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCCCC[C@H]1/C=C\c1ccccc1 ZINC000551269967 935237438 /nfs/dbraw/zinc/23/74/38/935237438.db2.gz AIBWCRCIIOVAAB-GDWUOILNSA-N 1 1 367.449 3.715 20 5 FHBDMO O=[N+]([O-])c1ccc(CC[N@@H+](Cc2ccccc2)C[C@H](O)C(F)(F)F)cc1 ZINC000611575009 935246236 /nfs/dbraw/zinc/24/62/36/935246236.db2.gz BEEQBCICHYNTKY-KRWDZBQOSA-N 1 1 368.355 3.563 20 5 FHBDMO C[N@@H+](CCC(=O)Nc1cccc(Cl)c1)CCc1ccccc1[N+](=O)[O-] ZINC000511080986 935309418 /nfs/dbraw/zinc/30/94/18/935309418.db2.gz LBJPSEBKXJQNTK-UHFFFAOYSA-N 1 1 361.829 3.751 20 5 FHBDMO O=[N+]([O-])c1ccc([C@@H](NCc2c[nH+]c3n2CCCC3)C(F)(F)F)cc1 ZINC000563263424 935325854 /nfs/dbraw/zinc/32/58/54/935325854.db2.gz FURPHOHSPAQNDO-OAHLLOKOSA-N 1 1 354.332 3.521 20 5 FHBDMO CCn1cnnc1C[NH2+][C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000158343124 935514226 /nfs/dbraw/zinc/51/42/26/935514226.db2.gz PHBLYUNLTCHNIN-GFCCVEGCSA-N 1 1 357.439 3.786 20 5 FHBDMO C[N@@H+](Cc1cc(I)cc([N+](=O)[O-])c1)C1CCCC1 ZINC000562033587 935532345 /nfs/dbraw/zinc/53/23/45/935532345.db2.gz BTRJHOOFOCMGCL-UHFFFAOYSA-N 1 1 360.195 3.574 20 5 FHBDMO O=C(c1cc2ccccc2c2cccnc12)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000684845804 935604898 /nfs/dbraw/zinc/60/48/98/935604898.db2.gz UVYSQBASXGBMCP-VQTJNVASSA-N 1 1 363.436 3.646 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC=C(c2ccco2)C1 ZINC000511118920 935669886 /nfs/dbraw/zinc/66/98/86/935669886.db2.gz CCSXHMAHLSCADZ-UHFFFAOYSA-N 1 1 355.394 3.614 20 5 FHBDMO Cc1ccc([C@H](C)NC(=O)C[N@H+](C)CCc2ccccc2[N+](=O)[O-])cc1C ZINC000511125857 935701100 /nfs/dbraw/zinc/70/11/00/935701100.db2.gz NLPRZBREMCLBAQ-KRWDZBQOSA-N 1 1 369.465 3.563 20 5 FHBDMO Cc1ccc([C@H](C)NC(=O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1C ZINC000511125857 935701102 /nfs/dbraw/zinc/70/11/02/935701102.db2.gz NLPRZBREMCLBAQ-KRWDZBQOSA-N 1 1 369.465 3.563 20 5 FHBDMO Cc1[nH+]ccn1-c1ccc(CNc2nc(C)cc(C)c2[N+](=O)[O-])cc1F ZINC000611616653 935813822 /nfs/dbraw/zinc/81/38/22/935813822.db2.gz JYKORKYRUKTYOI-UHFFFAOYSA-N 1 1 355.373 3.852 20 5 FHBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CCC[C@@H]2COC)cc1OC ZINC000611668875 935891733 /nfs/dbraw/zinc/89/17/33/935891733.db2.gz UTCYMVVILXLYCA-GDBMZVCRSA-N 1 1 366.458 3.639 20 5 FHBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H]2COC)cc1OC ZINC000611668875 935891738 /nfs/dbraw/zinc/89/17/38/935891738.db2.gz UTCYMVVILXLYCA-GDBMZVCRSA-N 1 1 366.458 3.639 20 5 FHBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](Nc2ncnc3ccc([N+](=O)[O-])cc32)C1 ZINC000611709384 935957566 /nfs/dbraw/zinc/95/75/66/935957566.db2.gz PLNJUMQHRJNUBS-HOCLYGCPSA-N 1 1 363.421 3.785 20 5 FHBDMO CC[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@@H](C)Cc1ccsc1 ZINC000187792754 936000979 /nfs/dbraw/zinc/00/09/79/936000979.db2.gz ZDBKCUIEDPVSOV-AWEZNQCLSA-N 1 1 361.467 3.572 20 5 FHBDMO COc1cccc(OC)c1OC1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000076709744 936037751 /nfs/dbraw/zinc/03/77/51/936037751.db2.gz AECNPGIDSSIWTQ-UHFFFAOYSA-N 1 1 372.421 3.655 20 5 FHBDMO CCOc1c(C[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)c(C)nn1CC(C)C ZINC000582836400 936195056 /nfs/dbraw/zinc/19/50/56/936195056.db2.gz GCVRANFUNWPRDW-UHFFFAOYSA-N 1 1 372.469 3.713 20 5 FHBDMO CCOc1c(C[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)c(C)nn1CC(C)C ZINC000582836400 936195059 /nfs/dbraw/zinc/19/50/59/936195059.db2.gz GCVRANFUNWPRDW-UHFFFAOYSA-N 1 1 372.469 3.713 20 5 FHBDMO C[C@@H](NC(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000458638184 938359670 /nfs/dbraw/zinc/35/96/70/938359670.db2.gz SVNRFKGNYGMUOA-UXLLHSPISA-N 1 1 374.485 3.608 20 5 FHBDMO COc1ccc(C[N@H+]2CCCC[C@@H]2[C@@H]2C[C@H](C)CC[C@H]2O)cc1[N+](=O)[O-] ZINC000573263486 938908589 /nfs/dbraw/zinc/90/85/89/938908589.db2.gz UQGUQHWZQKPEQV-NOCIGQNYSA-N 1 1 362.470 3.755 20 5 FHBDMO CCOC[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)C1 ZINC000093839058 938930440 /nfs/dbraw/zinc/93/04/40/938930440.db2.gz WEFBPKIFMBPHMC-CQSZACIVSA-N 1 1 360.410 3.722 20 5 FHBDMO Cn1cccc1[C@H]1CCC[N@@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000179219378 938991150 /nfs/dbraw/zinc/99/11/50/938991150.db2.gz FDSOFXGCFRQETO-GOSISDBHSA-N 1 1 352.394 3.925 20 5 FHBDMO Cn1cccc1[C@H]1CCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000179219378 938991151 /nfs/dbraw/zinc/99/11/51/938991151.db2.gz FDSOFXGCFRQETO-GOSISDBHSA-N 1 1 352.394 3.925 20 5 FHBDMO C[C@@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@H]1c1cccc(F)c1 ZINC000472351501 939014394 /nfs/dbraw/zinc/01/43/94/939014394.db2.gz SQDWFAGQFRISGH-HEFCMCLBSA-N 1 1 374.412 3.557 20 5 FHBDMO CN(C)Cc1cc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)ccc1F ZINC000120833607 945221377 /nfs/dbraw/zinc/22/13/77/945221377.db2.gz CNTDORXHEXCDQS-FQEVSTJZSA-N 1 1 371.456 3.906 20 5 FHBDMO CS[C@@H]1CCCC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000092063984 945234033 /nfs/dbraw/zinc/23/40/33/945234033.db2.gz DCQZFVDBMKXQGU-QGZVFWFLSA-N 1 1 360.483 3.713 20 5 FHBDMO CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@H](C)c1cccc(O)c1 ZINC000411336557 940028124 /nfs/dbraw/zinc/02/81/24/940028124.db2.gz SWHWSILRDKTYSH-CQSZACIVSA-N 1 1 357.410 3.712 20 5 FHBDMO Cc1ccc2ncc(C[N@H+]3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)cc2c1 ZINC000411375496 940033293 /nfs/dbraw/zinc/03/32/93/940033293.db2.gz QESHCFIEIUHNHM-QGZVFWFLSA-N 1 1 363.421 3.533 20 5 FHBDMO CC(C)[N@@H+](C)CCNCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000236652605 940122784 /nfs/dbraw/zinc/12/27/84/940122784.db2.gz NRENFKGZUADXEC-UHFFFAOYSA-N 1 1 351.834 3.938 20 5 FHBDMO CC(C)N(C)CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000236652605 940122787 /nfs/dbraw/zinc/12/27/87/940122787.db2.gz NRENFKGZUADXEC-UHFFFAOYSA-N 1 1 351.834 3.938 20 5 FHBDMO CC(=O)c1cc(NC2CCN(c3cccc(C)[nH+]3)CC2)ccc1[N+](=O)[O-] ZINC000376222933 940484594 /nfs/dbraw/zinc/48/45/94/940484594.db2.gz SOMDLMOMLURZCY-UHFFFAOYSA-N 1 1 354.410 3.582 20 5 FHBDMO CC(C)(C)OC(=O)NC[C@@H]1CC[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000178012414 940506500 /nfs/dbraw/zinc/50/65/00/940506500.db2.gz YQRCIVCURDKBSB-ZDUSSCGKSA-N 1 1 369.849 3.595 20 5 FHBDMO CC(C)(C)OC(=O)NC[C@@H]1CC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000178012414 940506503 /nfs/dbraw/zinc/50/65/03/940506503.db2.gz YQRCIVCURDKBSB-ZDUSSCGKSA-N 1 1 369.849 3.595 20 5 FHBDMO CCOC(=O)C1CCC([N@@H+](CC)Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000581733186 940510912 /nfs/dbraw/zinc/51/09/12/940510912.db2.gz RKQYOOHDPLTVFD-UHFFFAOYSA-N 1 1 352.406 3.678 20 5 FHBDMO CC[C@H]1CCC[N@H+]1Cc1cc(OC)c(OCC(F)(F)F)cc1[N+](=O)[O-] ZINC000511479153 940593468 /nfs/dbraw/zinc/59/34/68/940593468.db2.gz PXYOFXMLKVOYBN-LBPRGKRZSA-N 1 1 362.348 3.919 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H](C)[N@H+](Cc3ccccc3)CC2)c1 ZINC000173508236 940632683 /nfs/dbraw/zinc/63/26/83/940632683.db2.gz SWGFWOWNTWHPAS-QGZVFWFLSA-N 1 1 367.449 3.640 20 5 FHBDMO CCc1ccc([C@@H]([NH2+]CCc2nnc(C)s2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000582127957 940648598 /nfs/dbraw/zinc/64/85/98/940648598.db2.gz QPTSHHHAOVGCQG-SFHVURJKSA-N 1 1 372.450 3.832 20 5 FHBDMO COc1cc(C[NH+]2CCC3(CC2)OCc2ccccc23)c([N+](=O)[O-])cc1F ZINC000613380845 940651812 /nfs/dbraw/zinc/65/18/12/940651812.db2.gz RHVHGKHQYLWHFT-UHFFFAOYSA-N 1 1 372.396 3.764 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](c2ccccc2F)C1 ZINC000582374088 940661704 /nfs/dbraw/zinc/66/17/04/940661704.db2.gz ZDTXFOJQQPXUDR-HNNXBMFYSA-N 1 1 371.412 3.860 20 5 FHBDMO C[C@@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2F)CC[N@H+]1Cc1ccccc1 ZINC000176583774 941060263 /nfs/dbraw/zinc/06/02/63/941060263.db2.gz HMNCLZXOQFCYQK-ZBFHGGJFSA-N 1 1 371.412 3.517 20 5 FHBDMO CO[C@@H]1CC[C@H]2OCC[N@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)[C@@H]2C1 ZINC000180813645 941080640 /nfs/dbraw/zinc/08/06/40/941080640.db2.gz OQDPGHFAPPXYBZ-YVWKXTFCSA-N 1 1 372.421 3.623 20 5 FHBDMO CO[C@@H]1CC[C@H]2OCC[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)[C@@H]2C1 ZINC000180813645 941080642 /nfs/dbraw/zinc/08/06/42/941080642.db2.gz OQDPGHFAPPXYBZ-YVWKXTFCSA-N 1 1 372.421 3.623 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](CCC(F)(F)F)CC1CC1 ZINC000177172257 941107233 /nfs/dbraw/zinc/10/72/33/941107233.db2.gz DOKGSHQYKGBEND-UHFFFAOYSA-N 1 1 373.375 3.896 20 5 FHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)CC1(c2ccccc2)CC1 ZINC000189319541 941156076 /nfs/dbraw/zinc/15/60/76/941156076.db2.gz HLUQAALEUIDMHL-UHFFFAOYSA-N 1 1 354.406 3.625 20 5 FHBDMO COc1ccc([N+](=O)[O-])c(NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000311412196 941284276 /nfs/dbraw/zinc/28/42/76/941284276.db2.gz CGEAPPOZZFOWGZ-QGZVFWFLSA-N 1 1 355.438 3.928 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C/CNC[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1 ZINC000414996456 941533967 /nfs/dbraw/zinc/53/39/67/941533967.db2.gz GIWNKDPFSGBDCU-GFLQFSHBSA-N 1 1 369.440 3.730 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC000377185972 941542281 /nfs/dbraw/zinc/54/22/81/941542281.db2.gz UWGQXEHJZIMHDZ-WMZOPIPTSA-N 1 1 367.449 3.544 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(CN3CCCC[C@H]3[C@H]3CC[NH2+]C3)o2)cc1 ZINC000415036618 941552550 /nfs/dbraw/zinc/55/25/50/941552550.db2.gz FPYALCNMILFWHJ-LPHOPBHVSA-N 1 1 355.438 3.819 20 5 FHBDMO CN(C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)[C@@H]1CCC[N@@H+](C)C1 ZINC000151156744 941764240 /nfs/dbraw/zinc/76/42/40/941764240.db2.gz RZZVCHOATCGUHW-MRXNPFEDSA-N 1 1 369.421 3.553 20 5 FHBDMO C[C@@H]1C[C@H](c2ccccc2)[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000513227763 941798192 /nfs/dbraw/zinc/79/81/92/941798192.db2.gz GCJYSBJXAKLWDX-FOIQADDNSA-N 1 1 365.433 3.567 20 5 FHBDMO C[C@H]1C[C@@H](c2ccccc2)[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000513227391 941798692 /nfs/dbraw/zinc/79/86/92/941798692.db2.gz BYBSRTRTCGJIOF-KXBFYZLASA-N 1 1 353.422 3.641 20 5 FHBDMO CCOc1cc(C[N@@H+]2CCCN(c3ccccc3F)CC2)ccc1[N+](=O)[O-] ZINC000513360590 941869012 /nfs/dbraw/zinc/86/90/12/941869012.db2.gz CMUAPUPPMBYEBP-UHFFFAOYSA-N 1 1 373.428 3.845 20 5 FHBDMO CCOc1cc(C[N@H+]2CCCN(c3ccccc3F)CC2)ccc1[N+](=O)[O-] ZINC000513360590 941869016 /nfs/dbraw/zinc/86/90/16/941869016.db2.gz CMUAPUPPMBYEBP-UHFFFAOYSA-N 1 1 373.428 3.845 20 5 FHBDMO Cc1ccc(OC[C@H](O)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(C)c1 ZINC000513395831 941890816 /nfs/dbraw/zinc/89/08/16/941890816.db2.gz AFCMTHMLLJTLES-HXUWFJFHSA-N 1 1 372.465 3.862 20 5 FHBDMO CCOc1cc(N(C)C[C@@H]2CC[N@@H+](C)[C@H]2c2cccnc2)ccc1[N+](=O)[O-] ZINC000433775703 941893454 /nfs/dbraw/zinc/89/34/54/941893454.db2.gz SQTKBWDWFBCKKN-JXFKEZNVSA-N 1 1 370.453 3.518 20 5 FHBDMO CC(C)[N@H+](CC(=O)N1CCC[C@H]2CCCC[C@@H]21)Cc1ccc([N+](=O)[O-])cc1 ZINC000513405271 941898941 /nfs/dbraw/zinc/89/89/41/941898941.db2.gz FVVMCOACRVHKQX-QUCCMNQESA-N 1 1 373.497 3.986 20 5 FHBDMO CC(C)[N@@H+](CC(=O)N1CCC[C@H]2CCCC[C@@H]21)Cc1ccc([N+](=O)[O-])cc1 ZINC000513405271 941898944 /nfs/dbraw/zinc/89/89/44/941898944.db2.gz FVVMCOACRVHKQX-QUCCMNQESA-N 1 1 373.497 3.986 20 5 FHBDMO CC[N@H+](CC(=O)Nc1ccccc1OC)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000182606129 941946877 /nfs/dbraw/zinc/94/68/77/941946877.db2.gz DGFGGPYGMWJYCC-HNNXBMFYSA-N 1 1 371.437 3.933 20 5 FHBDMO CC[N@@H+](CC(=O)Nc1ccccc1OC)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000182606129 941946882 /nfs/dbraw/zinc/94/68/82/941946882.db2.gz DGFGGPYGMWJYCC-HNNXBMFYSA-N 1 1 371.437 3.933 20 5 FHBDMO C[N@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H](c1ccc(Cl)cc1)c1ccccn1 ZINC000377931858 942075627 /nfs/dbraw/zinc/07/56/27/942075627.db2.gz LMTAPLBLXPXSFP-SFHVURJKSA-N 1 1 371.828 3.561 20 5 FHBDMO C[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H](c1ccc(Cl)cc1)c1ccccn1 ZINC000377931858 942075632 /nfs/dbraw/zinc/07/56/32/942075632.db2.gz LMTAPLBLXPXSFP-SFHVURJKSA-N 1 1 371.828 3.561 20 5 FHBDMO Cc1cc(C)c2c(c1)C[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CC2 ZINC000501977211 942158308 /nfs/dbraw/zinc/15/83/08/942158308.db2.gz RGJFSUOWCDFIQC-UHFFFAOYSA-N 1 1 353.422 3.599 20 5 FHBDMO C[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccccc1-n1cccn1 ZINC000183152587 942185105 /nfs/dbraw/zinc/18/51/05/942185105.db2.gz PQYCCMVIQYVDHA-ZDUSSCGKSA-N 1 1 363.377 3.773 20 5 FHBDMO CO[C@]1(C)CCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000280636418 942223898 /nfs/dbraw/zinc/22/38/98/942223898.db2.gz XUCHGMNWIOCNKL-LJQANCHMSA-N 1 1 359.426 3.683 20 5 FHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(c2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000413075100 942260491 /nfs/dbraw/zinc/26/04/91/942260491.db2.gz KEQCRHXGWCFCEW-RVKKMQEKSA-N 1 1 354.454 3.985 20 5 FHBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000420954709 942274306 /nfs/dbraw/zinc/27/43/06/942274306.db2.gz VAWFFWXMWIXFBK-STQMWFEESA-N 1 1 373.375 3.895 20 5 FHBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@@H](CC(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000420954709 942274310 /nfs/dbraw/zinc/27/43/10/942274310.db2.gz VAWFFWXMWIXFBK-STQMWFEESA-N 1 1 373.375 3.895 20 5 FHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CC[C@@](O)(Cc2ccc(F)cc2)C1 ZINC000421010448 942290627 /nfs/dbraw/zinc/29/06/27/942290627.db2.gz IDDGCHHCNKBFBS-GOSISDBHSA-N 1 1 364.804 3.567 20 5 FHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CC[C@@](O)(Cc2ccc(F)cc2)C1 ZINC000421010448 942290629 /nfs/dbraw/zinc/29/06/29/942290629.db2.gz IDDGCHHCNKBFBS-GOSISDBHSA-N 1 1 364.804 3.567 20 5 FHBDMO CC(C)(C)c1ccc(NC(=O)N[C@H]2CC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000501086742 942291391 /nfs/dbraw/zinc/29/13/91/942291391.db2.gz XAGXIHZBJFVAKI-GJZGRUSLSA-N 1 1 360.458 3.641 20 5 FHBDMO COc1ccccc1[C@H]1CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000501117100 942317316 /nfs/dbraw/zinc/31/73/16/942317316.db2.gz MTONYWAJAHRAAC-QGZVFWFLSA-N 1 1 369.421 3.769 20 5 FHBDMO C[N@H+]1CCC[C@@H](CNc2ncc([N+](=O)[O-])cc2F)[C@H]1c1cccs1 ZINC000413157587 942353181 /nfs/dbraw/zinc/35/31/81/942353181.db2.gz IAIATGJJXBPDMH-NHYWBVRUSA-N 1 1 350.419 3.685 20 5 FHBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000366804108 942384838 /nfs/dbraw/zinc/38/48/38/942384838.db2.gz IJLFGDNUIGQSEW-IBGZPJMESA-N 1 1 367.449 3.722 20 5 FHBDMO O=[N+]([O-])c1ccc2ccnc(N3CC[C@H]4[C@H](CCC[N@H+]4C4CC4)C3)c2c1 ZINC000413199103 942456777 /nfs/dbraw/zinc/45/67/77/942456777.db2.gz IRTKPKAKPFSSCB-BEFAXECRSA-N 1 1 352.438 3.596 20 5 FHBDMO O=[N+]([O-])c1ccc(N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c2cccnc21 ZINC000413199964 942472233 /nfs/dbraw/zinc/47/22/33/942472233.db2.gz JTKMKTVQBCDUCK-WMLDXEAASA-N 1 1 352.438 3.596 20 5 FHBDMO COc1cc(C[N@H+]2CCC[C@@H](C)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000505318938 942474773 /nfs/dbraw/zinc/47/47/73/942474773.db2.gz DRSGPRQMYKMBJW-LLVKDONJSA-N 1 1 362.348 3.776 20 5 FHBDMO C[C@@H](CCc1cccc(F)c1)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000541223764 942494956 /nfs/dbraw/zinc/49/49/56/942494956.db2.gz KLKICPQGEFLQCJ-WMLDXEAASA-N 1 1 358.417 3.636 20 5 FHBDMO COc1cc(C[N@@H+](C)[C@H]2CC[C@@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000429590658 942567097 /nfs/dbraw/zinc/56/70/97/942567097.db2.gz PHZWKFLHWGATMX-YPMHNXCESA-N 1 1 358.385 3.868 20 5 FHBDMO O=[N+]([O-])c1ccc(N2CC[C@@H](n3c[nH+]c4c3CCCC4)C2)c2cccnc21 ZINC000413253688 942567950 /nfs/dbraw/zinc/56/79/50/942567950.db2.gz WAPKFJCBBSFPAR-CQSZACIVSA-N 1 1 363.421 3.670 20 5 FHBDMO C[N@H+](CCOc1cccc(Br)c1)Cc1ccccc1[N+](=O)[O-] ZINC000501822529 942689596 /nfs/dbraw/zinc/68/95/96/942689596.db2.gz CPKXXOQAUXEWGS-UHFFFAOYSA-N 1 1 365.227 3.868 20 5 FHBDMO C[N@@H+](CCOc1cccc(Br)c1)Cc1ccccc1[N+](=O)[O-] ZINC000501822529 942689599 /nfs/dbraw/zinc/68/95/99/942689599.db2.gz CPKXXOQAUXEWGS-UHFFFAOYSA-N 1 1 365.227 3.868 20 5 FHBDMO O=[N+]([O-])c1cnc2c(c1)C[N@H+](CCc1cccc(Cl)c1Cl)CC2 ZINC000434472577 942692077 /nfs/dbraw/zinc/69/20/77/942692077.db2.gz ASWUUIZCUHYSOI-UHFFFAOYSA-N 1 1 352.221 3.897 20 5 FHBDMO CCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc(C)c2[nH+]ccn2c1 ZINC000502777008 942739173 /nfs/dbraw/zinc/73/91/73/942739173.db2.gz KJHODUVIOXXROU-UHFFFAOYSA-N 1 1 356.407 3.915 20 5 FHBDMO CC[N@H+](Cc1ccc2ccccc2c1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000514089707 942740305 /nfs/dbraw/zinc/74/03/05/942740305.db2.gz REBXVQXAZSPKCZ-UHFFFAOYSA-N 1 1 363.417 3.869 20 5 FHBDMO CC[N@@H+](Cc1ccc2ccccc2c1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000514089707 942740308 /nfs/dbraw/zinc/74/03/08/942740308.db2.gz REBXVQXAZSPKCZ-UHFFFAOYSA-N 1 1 363.417 3.869 20 5 FHBDMO CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@H]1CCC[N@H+]1C ZINC000421710394 942763838 /nfs/dbraw/zinc/76/38/38/942763838.db2.gz KITKEZZZVKZVSW-OAHLLOKOSA-N 1 1 365.499 3.509 20 5 FHBDMO Cc1cc(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cn2cc[nH+]c12 ZINC000502830120 942783349 /nfs/dbraw/zinc/78/33/49/942783349.db2.gz KPNOVWWXBOCROY-LBPRGKRZSA-N 1 1 356.407 3.670 20 5 FHBDMO NC(=O)c1ccc(C[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C2CC2)c(F)c1 ZINC000430092111 942903946 /nfs/dbraw/zinc/90/39/46/942903946.db2.gz WWLPNIXJCGEXCB-HYXAFXHYSA-N 1 1 369.396 3.511 20 5 FHBDMO NC(=O)c1ccc(C[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C2CC2)c(F)c1 ZINC000430092111 942903949 /nfs/dbraw/zinc/90/39/49/942903949.db2.gz WWLPNIXJCGEXCB-HYXAFXHYSA-N 1 1 369.396 3.511 20 5 FHBDMO Cn1ccnc1[C@H]([NH2+]CCc1cccc(Cl)c1)c1ccc([N+](=O)[O-])cc1 ZINC000513762057 942918723 /nfs/dbraw/zinc/91/87/23/942918723.db2.gz PNWKEJJNMOATSD-GOSISDBHSA-N 1 1 370.840 3.903 20 5 FHBDMO Cn1ccnc1[C@@H]([NH2+]CCc1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000513761779 942934603 /nfs/dbraw/zinc/93/46/03/942934603.db2.gz OKUUZIGXGKSBRY-SFHVURJKSA-N 1 1 370.840 3.903 20 5 FHBDMO Cc1ccc([C@@]2(C)CC[N@@H+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)C2)cc1 ZINC000434744331 942936701 /nfs/dbraw/zinc/93/67/01/942936701.db2.gz HXDQZBFMPBYTNY-NRFANRHFSA-N 1 1 368.433 3.933 20 5 FHBDMO Cc1ccc([C@@]2(C)CC[N@H+](CC(=O)N(C)c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000434747003 942937865 /nfs/dbraw/zinc/93/78/65/942937865.db2.gz NSYBFJNVMRGYGS-NRFANRHFSA-N 1 1 367.449 3.530 20 5 FHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(c3nc(-c4ccccc4)n[nH]3)CC2)cs1 ZINC000066831269 943030208 /nfs/dbraw/zinc/03/02/08/943030208.db2.gz AHAFGIJWWYOMBM-UHFFFAOYSA-N 1 1 369.450 3.821 20 5 FHBDMO Cc1c(NC(=O)N2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000416740636 943073965 /nfs/dbraw/zinc/07/39/65/943073965.db2.gz UVCPCVIXGFLEEZ-HNNXBMFYSA-N 1 1 368.437 3.641 20 5 FHBDMO Cc1c(NC(=O)N2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000416740636 943073972 /nfs/dbraw/zinc/07/39/72/943073972.db2.gz UVCPCVIXGFLEEZ-HNNXBMFYSA-N 1 1 368.437 3.641 20 5 FHBDMO O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC(N2CCc3ccccc32)CC1 ZINC000503403194 943163481 /nfs/dbraw/zinc/16/34/81/943163481.db2.gz CPPFSIIDXOOSGW-UHFFFAOYSA-N 1 1 355.413 3.761 20 5 FHBDMO COc1ccc(-c2n[nH]cc2C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000183805483 943205023 /nfs/dbraw/zinc/20/50/23/943205023.db2.gz KLAYCZHYXWKYEL-UHFFFAOYSA-N 1 1 372.812 3.937 20 5 FHBDMO CN(CC[C@@H]1CCCC[N@H+]1C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549464843 943393181 /nfs/dbraw/zinc/39/31/81/943393181.db2.gz IAOINPZMXWPODT-AWEZNQCLSA-N 1 1 359.392 3.920 20 5 FHBDMO CCC[N@@H+](C)C[C@H]1CCN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000549466343 943406505 /nfs/dbraw/zinc/40/65/05/943406505.db2.gz BTKKMPJLHOWQPY-CYBMUJFWSA-N 1 1 359.392 3.777 20 5 FHBDMO C[C@@H](NC[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000423478687 943526946 /nfs/dbraw/zinc/52/69/46/943526946.db2.gz UJNJSPFYJIFZNE-CFLQYTFWSA-N 1 1 357.429 3.778 20 5 FHBDMO CCOC[C@@H]1CCC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425409487 943762356 /nfs/dbraw/zinc/76/23/56/943762356.db2.gz WDVJVHXBTQPKSE-GFCCVEGCSA-N 1 1 357.248 3.606 20 5 FHBDMO CCOC[C@@H]1CCC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425409487 943762360 /nfs/dbraw/zinc/76/23/60/943762360.db2.gz WDVJVHXBTQPKSE-GFCCVEGCSA-N 1 1 357.248 3.606 20 5 FHBDMO CCn1c(C)nc([N+](=O)[O-])c1N(C)[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000515325161 943789278 /nfs/dbraw/zinc/78/92/78/943789278.db2.gz MMGVPBQDTNAKJA-MAUKXSAKSA-N 1 1 371.485 3.609 20 5 FHBDMO CCn1c(C)nc([N+](=O)[O-])c1N(C)[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000515325162 943789370 /nfs/dbraw/zinc/78/93/70/943789370.db2.gz MMGVPBQDTNAKJA-QAPCUYQASA-N 1 1 371.485 3.609 20 5 FHBDMO CCOc1ccc([C@@H](C)N[C@H](Cc2ccccc2)C[NH+](C)C)cc1[N+](=O)[O-] ZINC000504899065 943877392 /nfs/dbraw/zinc/87/73/92/943877392.db2.gz AEKGFAIVYCDIEL-VQIMIIECSA-N 1 1 371.481 3.817 20 5 FHBDMO CC[N@H+]1CC[C@H](N(C)Cc2ccc(Br)cc2[N+](=O)[O-])C[C@@H]1C ZINC000425422345 943880490 /nfs/dbraw/zinc/88/04/90/943880490.db2.gz NASWEWKOUNNZGK-WFASDCNBSA-N 1 1 370.291 3.662 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21 ZINC000566529107 943965655 /nfs/dbraw/zinc/96/56/55/943965655.db2.gz IDORLWGSONJFMJ-NJDAHSKKSA-N 1 1 352.434 3.908 20 5 FHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC(C[N@H+](C)C(C)C)CC1 ZINC000517134283 944035635 /nfs/dbraw/zinc/03/56/35/944035635.db2.gz VNRXOVLYBMXKAE-UHFFFAOYSA-N 1 1 363.502 3.934 20 5 FHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000517134283 944035644 /nfs/dbraw/zinc/03/56/44/944035644.db2.gz VNRXOVLYBMXKAE-UHFFFAOYSA-N 1 1 363.502 3.934 20 5 FHBDMO COc1c(C)cc(C[N@H+](C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1C ZINC000110295786 944079088 /nfs/dbraw/zinc/07/90/88/944079088.db2.gz ATQBDTDLBKYSJT-UHFFFAOYSA-N 1 1 371.437 3.599 20 5 FHBDMO COc1c(C)cc(C[N@@H+](C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1C ZINC000110295786 944079096 /nfs/dbraw/zinc/07/90/96/944079096.db2.gz ATQBDTDLBKYSJT-UHFFFAOYSA-N 1 1 371.437 3.599 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[N@@H+](C)C[C@@H]1c1ccccc1 ZINC000517214668 944095591 /nfs/dbraw/zinc/09/55/91/944095591.db2.gz AMFOFAWJVRNIBM-GOSISDBHSA-N 1 1 368.437 3.732 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[N@H+](C)C[C@@H]1c1ccccc1 ZINC000517214668 944095595 /nfs/dbraw/zinc/09/55/95/944095595.db2.gz AMFOFAWJVRNIBM-GOSISDBHSA-N 1 1 368.437 3.732 20 5 FHBDMO CCO[C@H]1CC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C[C@@H]1C ZINC000425492137 944111237 /nfs/dbraw/zinc/11/12/37/944111237.db2.gz MVVFCPBCZXGOCK-NHYWBVRUSA-N 1 1 357.248 3.604 20 5 FHBDMO CCO[C@H]1CC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C[C@@H]1C ZINC000425492137 944111240 /nfs/dbraw/zinc/11/12/40/944111240.db2.gz MVVFCPBCZXGOCK-NHYWBVRUSA-N 1 1 357.248 3.604 20 5 FHBDMO O=C(NC[C@@H]1CCC[N@H+]1C1CCCCC1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000436227214 944117129 /nfs/dbraw/zinc/11/71/29/944117129.db2.gz KRXQMISMJHRQNC-INIZCTEOSA-N 1 1 370.453 3.603 20 5 FHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000500116437 944124580 /nfs/dbraw/zinc/12/45/80/944124580.db2.gz OCYKLPUKLDXYNB-KBPBESRZSA-N 1 1 351.472 3.529 20 5 FHBDMO C[C@@H]1[C@@H](Cc2ccccc2)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500113231 944128247 /nfs/dbraw/zinc/12/82/47/944128247.db2.gz FPNQWWITSFDMRB-SJLPKXTDSA-N 1 1 367.449 3.877 20 5 FHBDMO CC[C@@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])c1nnc2n1CCCCC2 ZINC000517245745 944138217 /nfs/dbraw/zinc/13/82/17/944138217.db2.gz AJHVUWNNHZYEBY-HZPDHXFCSA-N 1 1 355.442 3.641 20 5 FHBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCC[N@@H+](C)C(C)C ZINC000505783016 944141546 /nfs/dbraw/zinc/14/15/46/944141546.db2.gz PSWVIZPHXCAJID-UHFFFAOYSA-N 1 1 353.488 3.557 20 5 FHBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1Nc1c2c(ccc1[N+](=O)[O-])NCC2 ZINC000436415096 944288638 /nfs/dbraw/zinc/28/86/38/944288638.db2.gz WKRWDBYMOZTQNV-MAUKXSAKSA-N 1 1 366.465 3.885 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000506474868 944289208 /nfs/dbraw/zinc/28/92/08/944289208.db2.gz QFVABSOISYKOPI-MSOLQXFVSA-N 1 1 361.486 3.560 20 5 FHBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000506478390 944308775 /nfs/dbraw/zinc/30/87/75/944308775.db2.gz GIRFPCVQJXGIHT-ZWKOTPCHSA-N 1 1 361.486 3.560 20 5 FHBDMO C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCC[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000133871800 944314729 /nfs/dbraw/zinc/31/47/29/944314729.db2.gz SQPVYKJCBVAKGR-GXTWGEPZSA-N 1 1 369.487 3.782 20 5 FHBDMO C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000133871800 944314738 /nfs/dbraw/zinc/31/47/38/944314738.db2.gz SQPVYKJCBVAKGR-GXTWGEPZSA-N 1 1 369.487 3.782 20 5 FHBDMO CN(C/C=C\c1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000506482495 944332682 /nfs/dbraw/zinc/33/26/82/944332682.db2.gz TVHHDXYCVYMAON-RVPHRTOXSA-N 1 1 351.450 3.814 20 5 FHBDMO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@@H]1CCN(Cc2ccccc2)C1 ZINC000506482495 944332689 /nfs/dbraw/zinc/33/26/89/944332689.db2.gz TVHHDXYCVYMAON-RVPHRTOXSA-N 1 1 351.450 3.814 20 5 FHBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@@H]1CCN(Cc2ccccc2)C1 ZINC000506482495 944332696 /nfs/dbraw/zinc/33/26/96/944332696.db2.gz TVHHDXYCVYMAON-RVPHRTOXSA-N 1 1 351.450 3.814 20 5 FHBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NC[C@H](C)[N@H+]1CCCC[C@H]1C ZINC000439119345 944355750 /nfs/dbraw/zinc/35/57/50/944355750.db2.gz YYCLEHCXJYGURD-OLZOCXBDSA-N 1 1 353.850 3.549 20 5 FHBDMO CN(CC[N@@H+](C)C1CCCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000518450742 944389289 /nfs/dbraw/zinc/38/92/89/944389289.db2.gz SALUYNPSZZLXMJ-UHFFFAOYSA-N 1 1 368.865 3.976 20 5 FHBDMO C[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000518474001 944413706 /nfs/dbraw/zinc/41/37/06/944413706.db2.gz QZVGDWRBCGVSRC-IAGOWNOFSA-N 1 1 367.232 3.992 20 5 FHBDMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000518474001 944413710 /nfs/dbraw/zinc/41/37/10/944413710.db2.gz QZVGDWRBCGVSRC-IAGOWNOFSA-N 1 1 367.232 3.992 20 5 FHBDMO Cn1cc(C[N@@H+]2CCc3c(F)cccc3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000123787426 944424030 /nfs/dbraw/zinc/42/40/30/944424030.db2.gz LOOIPJPLILZDMN-UHFFFAOYSA-N 1 1 366.396 3.693 20 5 FHBDMO Cn1cc(C[N@H+]2CCc3c(F)cccc3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000123787426 944424031 /nfs/dbraw/zinc/42/40/31/944424031.db2.gz LOOIPJPLILZDMN-UHFFFAOYSA-N 1 1 366.396 3.693 20 5 FHBDMO Cc1cc(NC(=O)N2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000473781711 944452135 /nfs/dbraw/zinc/45/21/35/944452135.db2.gz ZQPHGAMBXYJCOO-INIZCTEOSA-N 1 1 368.437 3.641 20 5 FHBDMO Cc1cc(NC(=O)N2CC[N@H+](Cc3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000473781711 944452141 /nfs/dbraw/zinc/45/21/41/944452141.db2.gz ZQPHGAMBXYJCOO-INIZCTEOSA-N 1 1 368.437 3.641 20 5 FHBDMO C[C@@H]1[C@@H](CO)CC[N@H+]1Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000425993013 944557373 /nfs/dbraw/zinc/55/73/73/944557373.db2.gz JDNBEOJUGHGDJQ-NVXWUHKLSA-N 1 1 355.438 3.565 20 5 FHBDMO C[C@H]1[C@H](CO)CC[N@H+]1Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000425993014 944557454 /nfs/dbraw/zinc/55/74/54/944557454.db2.gz JDNBEOJUGHGDJQ-RDJZCZTQSA-N 1 1 355.438 3.565 20 5 FHBDMO O=c1[nH]ccc2c1C[N@@H+](Cc1ccc(-c3ccccc3[N+](=O)[O-])s1)CC2 ZINC000426373482 944583690 /nfs/dbraw/zinc/58/36/90/944583690.db2.gz SMTXWCRZAAANGK-UHFFFAOYSA-N 1 1 367.430 3.982 20 5 FHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+][C@@H]2CCOc3c(F)cccc32)c1 ZINC000438468043 944653396 /nfs/dbraw/zinc/65/33/96/944653396.db2.gz VXKMWWVNCNRHJC-CQSZACIVSA-N 1 1 368.311 3.949 20 5 FHBDMO CC[C@@H]1CC[N@H+]([C@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)C1 ZINC000438485020 944668138 /nfs/dbraw/zinc/66/81/38/944668138.db2.gz CKSOVYSFEMKRKB-CHWSQXEVSA-N 1 1 374.466 3.777 20 5 FHBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000516332746 944732162 /nfs/dbraw/zinc/73/21/62/944732162.db2.gz FAIRQVHOJYTWHA-UHFFFAOYSA-N 1 1 361.829 3.630 20 5 FHBDMO O=C(NC[C@H]1CCC[N@H+]1C1CCCCC1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000437835902 944938974 /nfs/dbraw/zinc/93/89/74/944938974.db2.gz CTGXQUULDLWABF-MRXNPFEDSA-N 1 1 370.453 3.603 20 5 FHBDMO CN(C(=O)c1cccc([N+](=O)[O-])c1Cl)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311465244 945052305 /nfs/dbraw/zinc/05/23/05/945052305.db2.gz MYSRKQCZIKBVSM-OAHLLOKOSA-N 1 1 373.840 3.595 20 5 FHBDMO C[NH+](C)[C@H](CNC(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1Cl ZINC000018180700 945445363 /nfs/dbraw/zinc/44/53/63/945445363.db2.gz NFXQCFGHWUKWSU-MRXNPFEDSA-N 1 1 362.817 3.673 20 5 FHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])[C@@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000507685641 945449905 /nfs/dbraw/zinc/44/99/05/945449905.db2.gz DIXXVTUYCGMBIX-IAGOWNOFSA-N 1 1 367.232 3.992 20 5 FHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000507685641 945449914 /nfs/dbraw/zinc/44/99/14/945449914.db2.gz DIXXVTUYCGMBIX-IAGOWNOFSA-N 1 1 367.232 3.992 20 5 FHBDMO CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000729479934 945665812 /nfs/dbraw/zinc/66/58/12/945665812.db2.gz JINNMFYFSOQMPU-KRWDZBQOSA-N 1 1 363.458 3.816 20 5 FHBDMO C[N@@H+](Cc1cc([O-])ccc1[N+](=O)[O-])[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000519749613 945715545 /nfs/dbraw/zinc/71/55/45/945715545.db2.gz XJLXQNVITAPNQQ-QFBILLFUSA-N 1 1 360.385 3.792 20 5 FHBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)NCCC[N@@H+](C)Cc1ccccc1 ZINC000519788245 945765749 /nfs/dbraw/zinc/76/57/49/945765749.db2.gz FBESULXWQQSGFQ-UHFFFAOYSA-N 1 1 370.453 3.801 20 5 FHBDMO CC(C)c1ccc(-c2nc([C@H]3C[N@H+]4CCC[C@@]4(C)CO3)no2)cc1[N+](=O)[O-] ZINC000574440077 945801095 /nfs/dbraw/zinc/80/10/95/945801095.db2.gz NJCNYTDTSREOAG-APWZRJJASA-N 1 1 372.425 3.694 20 5 FHBDMO C[C@H]([NH2+]Cc1ccncc1OCC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000281817925 945876758 /nfs/dbraw/zinc/87/67/58/945876758.db2.gz ZLYMRQJHIMOEMV-NSHDSACASA-N 1 1 355.316 3.782 20 5 FHBDMO CCOc1ccc(NC(=O)C[N@H+]2[C@H](C)C[C@H]3CCCC[C@H]32)c([N+](=O)[O-])c1 ZINC000444240751 946117096 /nfs/dbraw/zinc/11/70/96/946117096.db2.gz DGGAWPPBKJCSDC-CKEIUWERSA-N 1 1 361.442 3.585 20 5 FHBDMO C[N@@H+](CCc1cnccn1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000546255933 946192220 /nfs/dbraw/zinc/19/22/20/946192220.db2.gz WLSGLZUSCMIAGX-UHFFFAOYSA-N 1 1 372.812 3.973 20 5 FHBDMO COc1ccc(NC(=O)C[N@H+](C)[C@H](C)c2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000052907251 946195306 /nfs/dbraw/zinc/19/53/06/946195306.db2.gz JMFPYYTXLNSPHS-CQSZACIVSA-N 1 1 357.410 3.543 20 5 FHBDMO COc1ccc(NC(=O)C[N@@H+](C)[C@H](C)c2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000052907251 946195314 /nfs/dbraw/zinc/19/53/14/946195314.db2.gz JMFPYYTXLNSPHS-CQSZACIVSA-N 1 1 357.410 3.543 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@](C)(c2ccccc2)C1 ZINC000438489752 946284611 /nfs/dbraw/zinc/28/46/11/946284611.db2.gz JXIDBIMBVGLWMZ-HXUWFJFHSA-N 1 1 353.422 3.505 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@](C)(c2ccccc2)C1 ZINC000438489752 946284617 /nfs/dbraw/zinc/28/46/17/946284617.db2.gz JXIDBIMBVGLWMZ-HXUWFJFHSA-N 1 1 353.422 3.505 20 5 FHBDMO COc1ccc(OCC[N@H+](C)Cc2ccc(F)cc2Cl)c([N+](=O)[O-])c1 ZINC000441317388 946430511 /nfs/dbraw/zinc/43/05/11/946430511.db2.gz XGMJATNLWVZGLY-UHFFFAOYSA-N 1 1 368.792 3.907 20 5 FHBDMO COc1ccc(OCC[N@@H+](C)Cc2ccc(F)cc2Cl)c([N+](=O)[O-])c1 ZINC000441317388 946430516 /nfs/dbraw/zinc/43/05/16/946430516.db2.gz XGMJATNLWVZGLY-UHFFFAOYSA-N 1 1 368.792 3.907 20 5 FHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@@H](COCc3ccccc3)C2)cc1 ZINC000441328009 946458455 /nfs/dbraw/zinc/45/84/55/946458455.db2.gz AOZXAHGTBLDIEL-LJQANCHMSA-N 1 1 370.449 3.902 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(N2CCC3(C[C@@H]3[N@@H+](C)Cc3nccs3)CC2)c1 ZINC000614776077 946685130 /nfs/dbraw/zinc/68/51/30/946685130.db2.gz HTBIMWRLWWKRHC-KRWDZBQOSA-N 1 1 372.494 3.851 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(N2CCC3(C[C@@H]3[N@H+](C)Cc3nccs3)CC2)c1 ZINC000614776077 946685125 /nfs/dbraw/zinc/68/51/25/946685125.db2.gz HTBIMWRLWWKRHC-KRWDZBQOSA-N 1 1 372.494 3.851 20 5 FHBDMO C[C@@H]([NH2+][C@@H](c1cnn(C)c1)c1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000186647556 946781123 /nfs/dbraw/zinc/78/11/23/946781123.db2.gz GZWUPFUERLATHP-BFUOFWGJSA-N 1 1 354.385 3.908 20 5 FHBDMO CCc1ccc([C@@H](NCC2=CC[N@@H+](C)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544380642 946867982 /nfs/dbraw/zinc/86/79/82/946867982.db2.gz QYQOUIWOJHVYPJ-FQEVSTJZSA-N 1 1 355.438 3.691 20 5 FHBDMO Cc1cc(N(C(N)=[NH2+])c2ccc(F)cc2)c([N+](=O)[O-])cc1Br ZINC001167995172 946892361 /nfs/dbraw/zinc/89/23/61/946892361.db2.gz VHHJQZSTGVSVLT-UHFFFAOYSA-N 1 1 367.178 3.836 20 5 FHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@@H]3Cc3ccc(F)cc3)nc2c1 ZINC000444595986 947020599 /nfs/dbraw/zinc/02/05/99/947020599.db2.gz KOFGXMQKHLAEAA-OAHLLOKOSA-N 1 1 354.385 3.817 20 5 FHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@@H](Cc4ccc(F)cc4)C3)nc2c1 ZINC000444644206 947067108 /nfs/dbraw/zinc/06/71/08/947067108.db2.gz VGQDYUWPLAXIDX-AWEZNQCLSA-N 1 1 354.385 3.675 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)CC1(c2ccccc2)CC1 ZINC000444670932 947095495 /nfs/dbraw/zinc/09/54/95/947095495.db2.gz BTKCOHTYEBREJZ-UHFFFAOYSA-N 1 1 353.422 3.505 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)CC1(c2ccccc2)CC1 ZINC000444670932 947095499 /nfs/dbraw/zinc/09/54/99/947095499.db2.gz BTKCOHTYEBREJZ-UHFFFAOYSA-N 1 1 353.422 3.505 20 5 FHBDMO CC[N@@H+](CCCn1c2cc([N+](=O)[O-])ccc2oc1=O)[C@H]1CCCC[C@H]1C ZINC000444675380 947100240 /nfs/dbraw/zinc/10/02/40/947100240.db2.gz LXEPIGKOAFYVTH-ZBFHGGJFSA-N 1 1 361.442 3.793 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+](C)Cc1cc(C)cc(C)c1 ZINC000444708335 947136570 /nfs/dbraw/zinc/13/65/70/947136570.db2.gz ZXYMDCANYAXOSG-HNNXBMFYSA-N 1 1 371.437 3.679 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+](C)Cc1cc(C)cc(C)c1 ZINC000444708335 947136578 /nfs/dbraw/zinc/13/65/78/947136578.db2.gz ZXYMDCANYAXOSG-HNNXBMFYSA-N 1 1 371.437 3.679 20 5 FHBDMO C[C@@H]1C[C@H](c2ccc(F)cc2)C[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000121491222 947140459 /nfs/dbraw/zinc/14/04/59/947140459.db2.gz QPXBQDMTZUEKOS-HIFRSBDPSA-N 1 1 372.396 3.978 20 5 FHBDMO CC(C)O[C@@H](C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000428387523 947440603 /nfs/dbraw/zinc/44/06/03/947440603.db2.gz YLJQXMYMCMJZTK-MJGOQNOKSA-N 1 1 370.453 3.642 20 5 FHBDMO CC(C)Cn1cc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cn1 ZINC000278858399 947546796 /nfs/dbraw/zinc/54/67/96/947546796.db2.gz XQNICQWZBAOKBP-UHFFFAOYSA-N 1 1 356.348 3.756 20 5 FHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000072837720 947569989 /nfs/dbraw/zinc/56/99/89/947569989.db2.gz FUGNIRBMROGDQI-GJZGRUSLSA-N 1 1 365.499 3.838 20 5 FHBDMO C[C@@H](c1ccc2c(c1)CCC2)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000445292575 947683945 /nfs/dbraw/zinc/68/39/45/947683945.db2.gz HOVLXBFNAUDHTA-KSSFIOAISA-N 1 1 352.438 3.726 20 5 FHBDMO Cc1cc(C(=O)N[C@H]2CC[N@@H+](C)[C@@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000536370130 947796002 /nfs/dbraw/zinc/79/60/02/947796002.db2.gz JKKJPKQHTFZVEQ-FUHWJXTLSA-N 1 1 373.840 3.732 20 5 FHBDMO Cc1cc(C(=O)N[C@H]2CC[N@H+](C)[C@@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000536370130 947796006 /nfs/dbraw/zinc/79/60/06/947796006.db2.gz JKKJPKQHTFZVEQ-FUHWJXTLSA-N 1 1 373.840 3.732 20 5 FHBDMO CCC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H](C)c1cc2ccccc2o1 ZINC000536378132 947847691 /nfs/dbraw/zinc/84/76/91/947847691.db2.gz KLFHAAJIVWTNHX-HNNXBMFYSA-N 1 1 369.421 3.976 20 5 FHBDMO COc1ccc(OCC[N@H+]2CCC[C@H]2c2ccccc2OC)c([N+](=O)[O-])c1 ZINC000441489923 947972470 /nfs/dbraw/zinc/97/24/70/947972470.db2.gz PIHOQWLOWCZDEU-KRWDZBQOSA-N 1 1 372.421 3.828 20 5 FHBDMO O=C(CC[N@H+]1CCc2ccc(Cl)cc2C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000536428032 948074559 /nfs/dbraw/zinc/07/45/59/948074559.db2.gz LYFLGPDHULRANN-UHFFFAOYSA-N 1 1 359.813 3.635 20 5 FHBDMO CCn1c(C)nc([N+](=O)[O-])c1N1CC[NH+](Cc2ccc(C(C)C)cc2)CC1 ZINC000549616911 948086982 /nfs/dbraw/zinc/08/69/82/948086982.db2.gz KKGANDXUEZHIMN-UHFFFAOYSA-N 1 1 371.485 3.565 20 5 FHBDMO CC(C)c1ccc(C[N@H+]2CC[C@@]3(C2)c2ccccc2NC3=O)cc1[N+](=O)[O-] ZINC000614660612 948689986 /nfs/dbraw/zinc/68/99/86/948689986.db2.gz NVYCKLCEOJVCHB-OAQYLSRUSA-N 1 1 365.433 3.814 20 5 FHBDMO COc1ccc([C@H]2CCC[N@H+]2CCc2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000108081891 209282777 /nfs/dbraw/zinc/28/27/77/209282777.db2.gz CQSMCKALSXHMSD-LJQANCHMSA-N 1 1 356.422 3.992 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C\CN1CC[NH+](C/C=C\c2ccccc2)CC1 ZINC000033324101 208084994 /nfs/dbraw/zinc/08/49/94/208084994.db2.gz NRGYNZQRBTVEKK-XDPIJNQUSA-N 1 1 363.461 3.939 20 5 FHBDMO COc1cc(C[N@H+]2CC[C@@H](C(C)C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000490341104 568031846 /nfs/dbraw/zinc/03/18/46/568031846.db2.gz OYQGUCWWXNAGET-GFCCVEGCSA-N 1 1 358.385 3.725 20 5 FHBDMO CCSCC[C@@H](C)[N@@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000072901159 568056809 /nfs/dbraw/zinc/05/68/09/568056809.db2.gz IAMQHCKCUBIYBG-LLVKDONJSA-N 1 1 359.879 3.650 20 5 FHBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])[C@@H](C)C1 ZINC000291237310 568086166 /nfs/dbraw/zinc/08/61/66/568086166.db2.gz APLDQUXLDWCIIM-HZMBPMFUSA-N 1 1 374.268 3.704 20 5 FHBDMO C[C@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000481738695 568100186 /nfs/dbraw/zinc/10/01/86/568100186.db2.gz FGOMTDQPCFBJCX-HZMBPMFUSA-N 1 1 360.332 3.624 20 5 FHBDMO C[C@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000481738695 568100187 /nfs/dbraw/zinc/10/01/87/568100187.db2.gz FGOMTDQPCFBJCX-HZMBPMFUSA-N 1 1 360.332 3.624 20 5 FHBDMO CC(C)[N@H+](CC(=O)N[C@H]1CCC[C@@H](C)[C@@H]1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000604411541 568272080 /nfs/dbraw/zinc/27/20/80/568272080.db2.gz HNCGMOULNALHPG-GJYPPUQNSA-N 1 1 361.486 3.746 20 5 FHBDMO CC(C)[N@@H+](CC(=O)N[C@H]1CCC[C@@H](C)[C@@H]1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000604411541 568272082 /nfs/dbraw/zinc/27/20/82/568272082.db2.gz HNCGMOULNALHPG-GJYPPUQNSA-N 1 1 361.486 3.746 20 5 FHBDMO CC(C)[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000181984231 568343570 /nfs/dbraw/zinc/34/35/70/568343570.db2.gz WJXXOMPMUXAPEZ-LJQANCHMSA-N 1 1 360.385 3.992 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CC[C@@H](COC(F)F)C3)cs2)c1 ZINC000569769424 568422903 /nfs/dbraw/zinc/42/29/03/568422903.db2.gz VLUFEWMYWUQOSE-LLVKDONJSA-N 1 1 369.393 3.779 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CC[C@@H](COC(F)F)C3)cs2)c1 ZINC000569769424 568422904 /nfs/dbraw/zinc/42/29/04/568422904.db2.gz VLUFEWMYWUQOSE-LLVKDONJSA-N 1 1 369.393 3.779 20 5 FHBDMO O=C(NC[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1csc([N+](=O)[O-])c1 ZINC000570092824 568458528 /nfs/dbraw/zinc/45/85/28/568458528.db2.gz JPXSYKKEBOLIKN-INIZCTEOSA-N 1 1 373.478 3.688 20 5 FHBDMO CC[C@H](c1cccc(OC)c1)[N@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000570192494 568460292 /nfs/dbraw/zinc/46/02/92/568460292.db2.gz SNJLKGAGKYPSBV-QGZVFWFLSA-N 1 1 371.437 3.933 20 5 FHBDMO CC[C@H](c1cccc(OC)c1)[N@@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000570192494 568460293 /nfs/dbraw/zinc/46/02/93/568460293.db2.gz SNJLKGAGKYPSBV-QGZVFWFLSA-N 1 1 371.437 3.933 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)cc(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)n1 ZINC001164626757 719072238 /nfs/dbraw/zinc/07/22/38/719072238.db2.gz PHEDDXDEBNGHOS-NVXWUHKLSA-N 1 1 372.856 3.744 20 5 FHBDMO O=[N+]([O-])c1c(Cl)c2ccccc2nc1N1CC2(C1)CC[N@@H+](CC1CC1)C2 ZINC001164774183 721285911 /nfs/dbraw/zinc/28/59/11/721285911.db2.gz XTNMCANSDOOTND-UHFFFAOYSA-N 1 1 372.856 3.719 20 5 FHBDMO CC(C)([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cccc(Cl)c1F ZINC000186888257 927458946 /nfs/dbraw/zinc/45/89/46/927458946.db2.gz WKKOVXWRLGREQB-UHFFFAOYSA-N 1 1 365.792 3.511 20 5 FHBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3cccc(C(F)(F)F)c3)nc2c1 ZINC000510079470 927842099 /nfs/dbraw/zinc/84/20/99/927842099.db2.gz NKTOIZJOBNGQKR-UHFFFAOYSA-N 1 1 350.300 3.780 20 5 FHBDMO Cc1ccc(NC(=O)[C@@H]2CCC[N@H+]([C@H](C)c3ccccc3[N+](=O)[O-])C2)nc1 ZINC000471156277 928147142 /nfs/dbraw/zinc/14/71/42/928147142.db2.gz JUCISHOOFRCQDG-HZPDHXFCSA-N 1 1 368.437 3.710 20 5 FHBDMO C[C@H]1C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@H](c2ccc(F)cc2)O1 ZINC000610217628 928221358 /nfs/dbraw/zinc/22/13/58/928221358.db2.gz QUFLTCKGPOTFCY-MGPUTAFESA-N 1 1 374.412 3.965 20 5 FHBDMO C[C@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@H](c2ccc(F)cc2)O1 ZINC000610217628 928221379 /nfs/dbraw/zinc/22/13/79/928221379.db2.gz QUFLTCKGPOTFCY-MGPUTAFESA-N 1 1 374.412 3.965 20 5 FHBDMO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2OC)c(OC)c1 ZINC000430217049 928228338 /nfs/dbraw/zinc/22/83/38/928228338.db2.gz GFOJLZUVBMQLCJ-SFHVURJKSA-N 1 1 372.421 3.958 20 5 FHBDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2OC)c(OC)c1 ZINC000430217049 928228370 /nfs/dbraw/zinc/22/83/70/928228370.db2.gz GFOJLZUVBMQLCJ-SFHVURJKSA-N 1 1 372.421 3.958 20 5 FHBDMO COc1cc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc2c1OCCO2 ZINC000127057881 928454682 /nfs/dbraw/zinc/45/46/82/928454682.db2.gz RXTWYVFWHFVJDE-UHFFFAOYSA-N 1 1 370.405 3.539 20 5 FHBDMO COc1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc2c1OCCO2 ZINC000127057881 928454693 /nfs/dbraw/zinc/45/46/93/928454693.db2.gz RXTWYVFWHFVJDE-UHFFFAOYSA-N 1 1 370.405 3.539 20 5 FHBDMO Cc1ccccc1OCCC[N@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001167083753 928754789 /nfs/dbraw/zinc/75/47/89/928754789.db2.gz IREQVARTFDEODZ-MRXNPFEDSA-N 1 1 371.437 3.631 20 5 FHBDMO O=[N+]([O-])c1ccc(CC[N@@H+]2CCC[C@@H]2C[C@H](O)c2ccc(F)cc2)cc1 ZINC000134810102 929300189 /nfs/dbraw/zinc/30/01/89/929300189.db2.gz BQRJOJJIJLEVKR-UXHICEINSA-N 1 1 358.413 3.865 20 5 FHBDMO C[C@H]1CCCC[N@H+]1CCCCNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000609792401 929497888 /nfs/dbraw/zinc/49/78/88/929497888.db2.gz LDCCYGBARKRWPN-AWEZNQCLSA-N 1 1 367.877 3.562 20 5 FHBDMO CN(C(=O)[C@H]1CC[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1)c1ccccc1 ZINC000430303307 929616206 /nfs/dbraw/zinc/61/62/06/929616206.db2.gz MVNNUAGSIIDWOD-AWEZNQCLSA-N 1 1 373.840 3.733 20 5 FHBDMO Cc1ccc(NC(=O)N2CCC(Oc3cc[nH+]cc3C)CC2)cc1[N+](=O)[O-] ZINC000278215514 937374786 /nfs/dbraw/zinc/37/47/86/937374786.db2.gz TYMAMCZESWCWST-UHFFFAOYSA-N 1 1 370.409 3.682 20 5 FHBDMO Cc1ccc(CN2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)cc1[N+](=O)[O-] ZINC001167346410 930139263 /nfs/dbraw/zinc/13/92/63/930139263.db2.gz ABIPOCIVAREJDM-UHFFFAOYSA-N 1 1 353.466 4.000 20 5 FHBDMO CCn1c(C)nc([N+](=O)[O-])c1NC[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC000583402568 937411025 /nfs/dbraw/zinc/41/10/25/937411025.db2.gz KWAFPMFCSPQQAB-HIFRSBDPSA-N 1 1 363.487 3.676 20 5 FHBDMO CCn1c(C)nc([N+](=O)[O-])c1NC[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC000583402567 937411197 /nfs/dbraw/zinc/41/11/97/937411197.db2.gz KWAFPMFCSPQQAB-DZGCQCFKSA-N 1 1 363.487 3.676 20 5 FHBDMO O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1C[C@@H]2CCC[N@H+]2Cc2ccccc21 ZINC000118986639 930498601 /nfs/dbraw/zinc/49/86/01/930498601.db2.gz BGWSCYZPVPLWNP-INIZCTEOSA-N 1 1 371.824 3.873 20 5 FHBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C1 ZINC000275830899 930504187 /nfs/dbraw/zinc/50/41/87/930504187.db2.gz UHSPUMZYDGNXPH-HNNXBMFYSA-N 1 1 363.461 3.507 20 5 FHBDMO COc1ccc(CNC(C)(C)C[N@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000379671056 930517551 /nfs/dbraw/zinc/51/75/51/930517551.db2.gz KLYDWQJPVBNLNN-UHFFFAOYSA-N 1 1 357.454 3.604 20 5 FHBDMO COc1ccc(CNC(C)(C)C[N@@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000379671056 930517564 /nfs/dbraw/zinc/51/75/64/930517564.db2.gz KLYDWQJPVBNLNN-UHFFFAOYSA-N 1 1 357.454 3.604 20 5 FHBDMO Cc1[nH+]ccn1-c1ccc([C@@H](C)NC(=O)c2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000119310052 931068811 /nfs/dbraw/zinc/06/88/11/931068811.db2.gz XDIOCNYITSMVIG-GFCCVEGCSA-N 1 1 368.368 3.719 20 5 FHBDMO Cc1ccc(C[N@@H+](C)C2CCN(Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000119314626 931208189 /nfs/dbraw/zinc/20/81/89/931208189.db2.gz MEZCQEXYLASNJO-UHFFFAOYSA-N 1 1 353.466 4.000 20 5 FHBDMO Cc1ccc(C[N@H+](C)C2CCN(Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000119314626 931208197 /nfs/dbraw/zinc/20/81/97/931208197.db2.gz MEZCQEXYLASNJO-UHFFFAOYSA-N 1 1 353.466 4.000 20 5 FHBDMO Cc1ccc([C@@H](C)NC(=O)[C@H](C)[N@@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000177875739 931431050 /nfs/dbraw/zinc/43/10/50/931431050.db2.gz GKGJUHOISQKZEI-CVEARBPZSA-N 1 1 367.449 3.527 20 5 FHBDMO Cc1ccc([C@@H](C)NC(=O)[C@H](C)[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000177875739 931431056 /nfs/dbraw/zinc/43/10/56/931431056.db2.gz GKGJUHOISQKZEI-CVEARBPZSA-N 1 1 367.449 3.527 20 5 FHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CCc3c(F)cccc3Cl)C2)nc1 ZINC000477061658 931788002 /nfs/dbraw/zinc/78/80/02/931788002.db2.gz ADNWBODTPNYEKL-GFCCVEGCSA-N 1 1 364.808 3.511 20 5 FHBDMO CCCC[N@@H+](C)CC1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000077221557 931835478 /nfs/dbraw/zinc/83/54/78/931835478.db2.gz SEDZREAXKJCUKP-UHFFFAOYSA-N 1 1 362.474 3.879 20 5 FHBDMO CC[C@@H](O)C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccccc1 ZINC000134501906 932141423 /nfs/dbraw/zinc/14/14/23/932141423.db2.gz ULKCRZXYMYXPHS-MRXNPFEDSA-N 1 1 355.394 3.509 20 5 FHBDMO CC[C@@H](O)C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccccc1 ZINC000134501906 932141427 /nfs/dbraw/zinc/14/14/27/932141427.db2.gz ULKCRZXYMYXPHS-MRXNPFEDSA-N 1 1 355.394 3.509 20 5 FHBDMO COC[C@H](C)[N@@H+](C)Cc1ccc(OC)c(OCc2ccc([N+](=O)[O-])cc2)c1 ZINC000510441715 932388910 /nfs/dbraw/zinc/38/89/10/932388910.db2.gz GVURKDFNYLNYLT-HNNXBMFYSA-N 1 1 374.437 3.649 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CC[C@H](c4ccccc4)C3)n2)c1 ZINC000477291103 932453323 /nfs/dbraw/zinc/45/33/23/932453323.db2.gz QEZYPABNCYASDY-INIZCTEOSA-N 1 1 350.378 3.634 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](C1CC1)[N@@H+](C)Cc1ccccc1 ZINC000477286948 932453814 /nfs/dbraw/zinc/45/38/14/932453814.db2.gz LUBLKKVNIQIQKS-FQEVSTJZSA-N 1 1 367.449 3.544 20 5 FHBDMO C[C@@H]1C[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000430659817 932683507 /nfs/dbraw/zinc/68/35/07/932683507.db2.gz CATYOHAGYVHAFG-RDTXWAMCSA-N 1 1 371.412 3.517 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]2Cc2ccc(F)cc2)c2c(c1)COCO2 ZINC000055908754 932735811 /nfs/dbraw/zinc/73/58/11/932735811.db2.gz NJDLNQOQUOLPLY-GOSISDBHSA-N 1 1 372.396 3.808 20 5 FHBDMO CCCC[N@@H+](CC)Cc1cccc(CNc2c([N+](=O)[O-])c(C)nn2C)c1 ZINC000471751322 932793402 /nfs/dbraw/zinc/79/34/02/932793402.db2.gz YTEMBYONHUMBCK-UHFFFAOYSA-N 1 1 359.474 3.871 20 5 FHBDMO Cc1ccc(C[NH+]2CCN(c3ccc4ccccc4n3)CC2)cc1[N+](=O)[O-] ZINC000510471584 932835294 /nfs/dbraw/zinc/83/52/94/932835294.db2.gz JGYSBAIOBPSFDA-UHFFFAOYSA-N 1 1 362.433 3.774 20 5 FHBDMO C[C@H]1C[C@H](NC(=O)OC(C)(C)C)CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000134664347 932897173 /nfs/dbraw/zinc/89/71/73/932897173.db2.gz GRKIKEOHDTUWGB-GXTWGEPZSA-N 1 1 367.421 3.612 20 5 FHBDMO C[C@H]1C[C@H](NC(=O)OC(C)(C)C)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000134664347 932897175 /nfs/dbraw/zinc/89/71/75/932897175.db2.gz GRKIKEOHDTUWGB-GXTWGEPZSA-N 1 1 367.421 3.612 20 5 FHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCc3c(ncn3-c3ccc(F)cc3)C2)cc1 ZINC000510484810 932899427 /nfs/dbraw/zinc/89/94/27/932899427.db2.gz YEJNGQZWNDFRMB-UHFFFAOYSA-N 1 1 366.396 3.520 20 5 FHBDMO C[C@H]1C[C@H](O)C[N@H+]1Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000471803359 932974471 /nfs/dbraw/zinc/97/44/71/932974471.db2.gz GUHWYHCHUYCQOV-JSGCOSHPSA-N 1 1 362.813 3.996 20 5 FHBDMO C[C@@H]([NH2+][C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1)c1ncnn1C ZINC000276709298 933010005 /nfs/dbraw/zinc/01/00/05/933010005.db2.gz WMILFGDCMQDGFB-NWDGAFQWSA-N 1 1 357.439 3.864 20 5 FHBDMO Cc1cccc(C(=O)NC[C@@H](C2CC2)[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000187608493 933021443 /nfs/dbraw/zinc/02/14/43/933021443.db2.gz GGSMXTKXULZSOL-IBGZPJMESA-N 1 1 367.449 3.544 20 5 FHBDMO COc1ccc(COCC[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000610995206 933086081 /nfs/dbraw/zinc/08/60/81/933086081.db2.gz DALMQLOXEJTDMY-UHFFFAOYSA-N 1 1 356.422 3.785 20 5 FHBDMO COc1ccc(COCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000610995206 933086087 /nfs/dbraw/zinc/08/60/87/933086087.db2.gz DALMQLOXEJTDMY-UHFFFAOYSA-N 1 1 356.422 3.785 20 5 FHBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCSC2(CCCCC2)C1 ZINC000430759753 933212532 /nfs/dbraw/zinc/21/25/32/933212532.db2.gz FTFXHUUECVJQMO-AWEZNQCLSA-N 1 1 363.483 3.674 20 5 FHBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCSC2(CCCCC2)C1 ZINC000430759753 933212537 /nfs/dbraw/zinc/21/25/37/933212537.db2.gz FTFXHUUECVJQMO-AWEZNQCLSA-N 1 1 363.483 3.674 20 5 FHBDMO CCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000610582660 933334903 /nfs/dbraw/zinc/33/49/03/933334903.db2.gz ILRJHZUTSFKOMY-XWIAVFTESA-N 1 1 359.426 3.762 20 5 FHBDMO Cn1nccc1[C@H]1CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000510641967 933347810 /nfs/dbraw/zinc/34/78/10/933347810.db2.gz XEBAXKOJOBGFSY-INIZCTEOSA-N 1 1 366.421 3.968 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](CCc1ccccn1)Cc1cccnc1 ZINC000430873066 933348878 /nfs/dbraw/zinc/34/88/78/933348878.db2.gz ORZWYJIJWJNHSH-UHFFFAOYSA-N 1 1 362.433 3.938 20 5 FHBDMO COc1ccc(C[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C2CC2)cc1 ZINC000510765680 933675342 /nfs/dbraw/zinc/67/53/42/933675342.db2.gz OLOKBKSRZHZDJK-UHFFFAOYSA-N 1 1 352.394 3.644 20 5 FHBDMO COc1ccc(C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C2CC2)cc1 ZINC000510765680 933675344 /nfs/dbraw/zinc/67/53/44/933675344.db2.gz OLOKBKSRZHZDJK-UHFFFAOYSA-N 1 1 352.394 3.644 20 5 FHBDMO C[C@H]([NH2+]Cc1ccnn1CCc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000610676126 933749050 /nfs/dbraw/zinc/74/90/50/933749050.db2.gz NCFLWLMVAFLUJU-INIZCTEOSA-N 1 1 350.422 3.885 20 5 FHBDMO CCOc1cc(C[N@H+]2CCC[C@H](c3nncn3C(C)C)C2)ccc1[N+](=O)[O-] ZINC000276919208 933979586 /nfs/dbraw/zinc/97/95/86/933979586.db2.gz OWBQPBHXTPSPHZ-INIZCTEOSA-N 1 1 373.457 3.546 20 5 FHBDMO COc1ccc(-c2ccc(C[NH2+]Cc3ccc(F)cn3)o2)c([N+](=O)[O-])c1 ZINC000610787722 934190017 /nfs/dbraw/zinc/19/00/17/934190017.db2.gz GGSYMQSMFNKJES-UHFFFAOYSA-N 1 1 357.341 3.687 20 5 FHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H]2C[C@@H](O)c2ccc(F)cc2)c(F)c1 ZINC000134812868 934338428 /nfs/dbraw/zinc/33/84/28/934338428.db2.gz JCYFSBAJHLSNBO-VQIMIIECSA-N 1 1 362.376 3.961 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCC[C@H]4COCC[C@H]43)cs2)c1 ZINC000535800473 934395718 /nfs/dbraw/zinc/39/57/18/934395718.db2.gz BNIDSJCXZLGQNH-WMLDXEAASA-N 1 1 359.451 3.719 20 5 FHBDMO Cc1noc(C[C@@H]([NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c2ccccc2)n1 ZINC000277040793 934463280 /nfs/dbraw/zinc/46/32/80/934463280.db2.gz GCXLRILENNXCIL-SUMWQHHRSA-N 1 1 352.394 3.921 20 5 FHBDMO Cn1ccnc1[C@@H]([NH2+]CC(C)(C)[C@H]1CCCCO1)c1ccc([N+](=O)[O-])cc1 ZINC000611560791 934849358 /nfs/dbraw/zinc/84/93/58/934849358.db2.gz XMNJMNCOYKUTFO-MSOLQXFVSA-N 1 1 372.469 3.603 20 5 FHBDMO Cn1ccnc1[C@H]([NH2+]CC(C)(C)[C@H]1CCCCO1)c1cccc([N+](=O)[O-])c1 ZINC000611560716 934849415 /nfs/dbraw/zinc/84/94/15/934849415.db2.gz BMFAJZSPEPSWSK-QZTJIDSGSA-N 1 1 372.469 3.603 20 5 FHBDMO CC1(C)C[C@@H]([N@@H+](CCn2cc([N+](=O)[O-])cn2)Cc2ccccc2)C(C)(C)O1 ZINC000538665374 934883631 /nfs/dbraw/zinc/88/36/31/934883631.db2.gz FYKGIIZLKXOZPL-GOSISDBHSA-N 1 1 372.469 3.640 20 5 FHBDMO COc1cc(C[N@H+]2CCC(C)(C)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000538736557 934898847 /nfs/dbraw/zinc/89/88/47/934898847.db2.gz NHZOFWIZQAPCNA-UHFFFAOYSA-N 1 1 362.348 3.776 20 5 FHBDMO Cc1sc(C(=O)N[C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)cc1[N+](=O)[O-] ZINC000176304600 935025700 /nfs/dbraw/zinc/02/57/00/935025700.db2.gz OHPWTLWQCHKGAF-LLVKDONJSA-N 1 1 370.434 3.950 20 5 FHBDMO C[C@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1 ZINC000119683987 935036564 /nfs/dbraw/zinc/03/65/64/935036564.db2.gz PFXLPZLDVZOHGJ-JTQLQIEISA-N 1 1 367.327 3.563 20 5 FHBDMO CC(C)N(C(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000511059285 935175292 /nfs/dbraw/zinc/17/52/92/935175292.db2.gz LEAIMPXDGVIPBQ-UHFFFAOYSA-N 1 1 355.438 3.511 20 5 FHBDMO CC(C)N(C(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000511059285 935175296 /nfs/dbraw/zinc/17/52/96/935175296.db2.gz LEAIMPXDGVIPBQ-UHFFFAOYSA-N 1 1 355.438 3.511 20 5 FHBDMO C[N@H+]1CCC[C@]2(CCN(c3ccc([N+](=O)[O-])c(-c4ccc(F)cc4)n3)C2)C1 ZINC000582075256 935216094 /nfs/dbraw/zinc/21/60/94/935216094.db2.gz PDXRDTYNGMFPDE-FQEVSTJZSA-N 1 1 370.428 3.718 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1CCCNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000437164707 945088936 /nfs/dbraw/zinc/08/89/36/945088936.db2.gz JUYBONZZLFKSID-GFCCVEGCSA-N 1 1 373.375 3.608 20 5 FHBDMO Cc1ccc(CNC(=O)Nc2cc([N+](=O)[O-])ccc2C)c(N2CCCC2)[nH+]1 ZINC000611582694 935452958 /nfs/dbraw/zinc/45/29/58/935452958.db2.gz SZSYDSFYLAWUHS-UHFFFAOYSA-N 1 1 369.425 3.529 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCOCC34CCCCC4)o2)c1 ZINC000451810422 935522329 /nfs/dbraw/zinc/52/23/29/935522329.db2.gz CNVHRPBCLDJUDU-UHFFFAOYSA-N 1 1 371.437 3.827 20 5 FHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1nc(-c2ccc(F)c(F)c2)no1 ZINC000511104752 935577816 /nfs/dbraw/zinc/57/78/16/935577816.db2.gz CQORJHVRGCIDTR-UHFFFAOYSA-N 1 1 374.347 3.598 20 5 FHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1nc(-c2ccc(F)c(F)c2)no1 ZINC000511104752 935577824 /nfs/dbraw/zinc/57/78/24/935577824.db2.gz CQORJHVRGCIDTR-UHFFFAOYSA-N 1 1 374.347 3.598 20 5 FHBDMO Cc1cccc(NC(=O)[C@@H](C)[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1C ZINC000511134822 935760254 /nfs/dbraw/zinc/76/02/54/935760254.db2.gz CEUXMUQNVOSUNX-MRXNPFEDSA-N 1 1 355.438 3.713 20 5 FHBDMO Cc1cccc(NC(=O)[C@@H](C)[N@H+](C)CCc2ccccc2[N+](=O)[O-])c1C ZINC000511134822 935760253 /nfs/dbraw/zinc/76/02/53/935760253.db2.gz CEUXMUQNVOSUNX-MRXNPFEDSA-N 1 1 355.438 3.713 20 5 FHBDMO CCc1ccccc1NC(=O)[C@@H](C)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511137078 935770741 /nfs/dbraw/zinc/77/07/41/935770741.db2.gz BMPWQOLGDBIEIU-OAHLLOKOSA-N 1 1 355.438 3.659 20 5 FHBDMO CCc1ccccc1NC(=O)[C@@H](C)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511137078 935770743 /nfs/dbraw/zinc/77/07/43/935770743.db2.gz BMPWQOLGDBIEIU-OAHLLOKOSA-N 1 1 355.438 3.659 20 5 FHBDMO O=[N+]([O-])c1ccn(CC[N@H+](Cc2ccccc2C(F)(F)F)CC2CC2)n1 ZINC000511136765 935771277 /nfs/dbraw/zinc/77/12/77/935771277.db2.gz KMESSUCAEUXDBX-UHFFFAOYSA-N 1 1 368.359 3.722 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])c(N[C@H](Cc2[nH+]ccn2C)c2ccccc2)n1 ZINC000611616735 935815063 /nfs/dbraw/zinc/81/50/63/935815063.db2.gz AOUODFZRNZJJED-MRXNPFEDSA-N 1 1 351.410 3.736 20 5 FHBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000511790407 945131086 /nfs/dbraw/zinc/13/10/86/945131086.db2.gz YSMYZWZZOCUWTB-LJQANCHMSA-N 1 1 367.449 3.625 20 5 FHBDMO COc1ccc([C@@H]2CC[N@@H+](Cc3cc(OC)c(OC)cc3[N+](=O)[O-])C2)cc1 ZINC000092783359 935896296 /nfs/dbraw/zinc/89/62/96/935896296.db2.gz HDLXTKXRKWEYSJ-OAHLLOKOSA-N 1 1 372.421 3.610 20 5 FHBDMO Cn1cc[nH+]c1C[C@H](Nc1ncnc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000611708872 935959370 /nfs/dbraw/zinc/95/93/70/935959370.db2.gz RUACTOUTQIIREM-SFHVURJKSA-N 1 1 374.404 3.667 20 5 FHBDMO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000161541907 936266438 /nfs/dbraw/zinc/26/64/38/936266438.db2.gz XWNQAXLIHUSQKA-ZDUSSCGKSA-N 1 1 358.394 3.629 20 5 FHBDMO COc1cc(C[N@@H+](C)CCc2ccccc2)c([N+](=O)[O-])cc1OC(F)F ZINC000051999671 936306245 /nfs/dbraw/zinc/30/62/45/936306245.db2.gz QAMHHJKLNLIPLT-UHFFFAOYSA-N 1 1 366.364 3.879 20 5 FHBDMO COc1ccc(C[N@H+]2C[C@H](c3ccccc3)[C@@H]3COCC[C@H]32)cc1[N+](=O)[O-] ZINC000511798327 945157015 /nfs/dbraw/zinc/15/70/15/945157015.db2.gz SAPFUESCHKBZPN-CEXWTWQISA-N 1 1 368.433 3.608 20 5 FHBDMO CN1CC[N@H+](C)C[C@@H]1c1nc(-c2cc3ccccc3c3ccccc23)no1 ZINC001211584988 938284269 /nfs/dbraw/zinc/28/42/69/938284269.db2.gz JNHGDGILWMCZJG-HXUWFJFHSA-N 1 1 358.445 3.961 20 5 FHBDMO CN1CC[N@@H+](C)C[C@@H]1c1nc(-c2cc3ccccc3c3ccccc23)no1 ZINC001211584988 938284271 /nfs/dbraw/zinc/28/42/71/938284271.db2.gz JNHGDGILWMCZJG-HXUWFJFHSA-N 1 1 358.445 3.961 20 5 FHBDMO CCOCCO[C@H]1CC[N@@H+](Cc2cc(=O)oc3ccc4ccccc4c23)C1 ZINC000157881184 938434925 /nfs/dbraw/zinc/43/49/25/938434925.db2.gz UOVIDJCFEUITQG-SFHVURJKSA-N 1 1 367.445 3.574 20 5 FHBDMO CCOc1ccc([C@H](C)[NH2+]C2(C(=O)Nc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000427954160 938527795 /nfs/dbraw/zinc/52/77/95/938527795.db2.gz AHHMZKLNBOKOHD-AWEZNQCLSA-N 1 1 369.421 3.815 20 5 FHBDMO Cn1cc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c(C2CCCCC2)n1 ZINC000278579951 938551989 /nfs/dbraw/zinc/55/19/89/938551989.db2.gz DAUQWZLCYSNDRD-UHFFFAOYSA-N 1 1 368.441 3.542 20 5 FHBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H](C)[N@@H+](C)Cc1ccccc1 ZINC000584143115 938616139 /nfs/dbraw/zinc/61/61/39/938616139.db2.gz KJRIEHRGCGKKCU-HNNXBMFYSA-N 1 1 370.453 3.799 20 5 FHBDMO CC[N@@H+](Cc1ccc(C(=O)NCc2ccc([N+](=O)[O-])cc2)cc1)C(C)C ZINC000511816922 945197410 /nfs/dbraw/zinc/19/74/10/945197410.db2.gz KSQIFUQUEJXVHH-UHFFFAOYSA-N 1 1 355.438 3.755 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC(n2cc(Cl)cn2)CC1 ZINC000506016711 945202478 /nfs/dbraw/zinc/20/24/78/945202478.db2.gz FTSWNQVROSGDPB-UHFFFAOYSA-N 1 1 355.225 3.935 20 5 FHBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000074772975 945203411 /nfs/dbraw/zinc/20/34/11/945203411.db2.gz YVFUTDOCQOMTJH-ZDUSSCGKSA-N 1 1 368.275 3.525 20 5 FHBDMO CCC[N@@H+](CC)Cc1ccc(C(=O)NCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000511820966 945214839 /nfs/dbraw/zinc/21/48/39/945214839.db2.gz HVFKNPUQQWQBNA-UHFFFAOYSA-N 1 1 355.438 3.757 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH+]3CCN(c4ccccn4)CC3)o2)c1 ZINC000158894570 938967649 /nfs/dbraw/zinc/96/76/49/938967649.db2.gz FKQSBMBAHRHDGR-UHFFFAOYSA-N 1 1 364.405 3.572 20 5 FHBDMO C[C@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000511294228 938991785 /nfs/dbraw/zinc/99/17/85/938991785.db2.gz QNCNZNKKYUVMKH-KBPBESRZSA-N 1 1 371.437 3.724 20 5 FHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+]([C@@H]3CCc4ccc(Cl)cc43)C2)nc1 ZINC000544071895 938994014 /nfs/dbraw/zinc/99/40/14/938994014.db2.gz YZXWJGKMJQALHY-WMLDXEAASA-N 1 1 358.829 3.817 20 5 FHBDMO C[C@@H]1[C@@H](Cc2ccccc2)CC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000472336992 938995387 /nfs/dbraw/zinc/99/53/87/938995387.db2.gz GPBZOEUJODAIBE-SJLPKXTDSA-N 1 1 367.449 3.511 20 5 FHBDMO C[C@@H]1c2c(F)cccc2CC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000548844610 938998392 /nfs/dbraw/zinc/99/83/92/938998392.db2.gz PHGPKSGAVSGSCN-CYBMUJFWSA-N 1 1 357.385 3.682 20 5 FHBDMO C[C@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@@H]1c1cccc(F)c1 ZINC000472344993 939006203 /nfs/dbraw/zinc/00/62/03/939006203.db2.gz BNTUFKKTUDHFKZ-XOBRGWDASA-N 1 1 371.412 3.780 20 5 FHBDMO C[C@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@@H]1c1cccc(F)c1 ZINC000472344993 939006204 /nfs/dbraw/zinc/00/62/04/939006204.db2.gz BNTUFKKTUDHFKZ-XOBRGWDASA-N 1 1 371.412 3.780 20 5 FHBDMO O=[N+]([O-])c1ncccc1N[C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000612101926 939050679 /nfs/dbraw/zinc/05/06/79/939050679.db2.gz YRCYXRUGRZHCDR-FGTMMUONSA-N 1 1 352.438 3.702 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000139964594 945224428 /nfs/dbraw/zinc/22/44/28/945224428.db2.gz UMNZEPYBGHVBDY-OAHLLOKOSA-N 1 1 373.478 3.607 20 5 FHBDMO COC[C@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@@H](C)O1 ZINC000188352931 939209374 /nfs/dbraw/zinc/20/93/74/939209374.db2.gz YJGNQVCQENLLNK-ZIAGYGMSSA-N 1 1 362.451 3.559 20 5 FHBDMO COC[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@@H](C)O1 ZINC000188352931 939209377 /nfs/dbraw/zinc/20/93/77/939209377.db2.gz YJGNQVCQENLLNK-ZIAGYGMSSA-N 1 1 362.451 3.559 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@H](C)C[N@@H+](C)Cc1ccccc1 ZINC000518254481 945256671 /nfs/dbraw/zinc/25/66/71/945256671.db2.gz VHAKFGJGGNOMEX-MRXNPFEDSA-N 1 1 369.465 3.770 20 5 FHBDMO CC(=O)Nc1cccc2c1CC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])C2 ZINC000179529758 939879239 /nfs/dbraw/zinc/87/92/39/939879239.db2.gz XTXJJTLVLFYZKU-VMPITWQZSA-N 1 1 351.406 3.625 20 5 FHBDMO CC(=O)Nc1cccc2c1CC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C2 ZINC000179529758 939879243 /nfs/dbraw/zinc/87/92/43/939879243.db2.gz XTXJJTLVLFYZKU-VMPITWQZSA-N 1 1 351.406 3.625 20 5 FHBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1C(F)(F)F)C[C@@H]1CCc2nccn2C1 ZINC000364669903 939984743 /nfs/dbraw/zinc/98/47/43/939984743.db2.gz FRRWQOWFNBLOLQ-LBPRGKRZSA-N 1 1 368.359 3.505 20 5 FHBDMO CCC[N@@H+](C[C@@H]1CCCCO1)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000411371161 940032950 /nfs/dbraw/zinc/03/29/50/940032950.db2.gz WUVHWDXLQGNFBQ-PBHICJAKSA-N 1 1 374.441 3.987 20 5 FHBDMO Cc1ccc2ncc(C[N@H+]3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)cc2c1 ZINC000411375495 940033374 /nfs/dbraw/zinc/03/33/74/940033374.db2.gz QESHCFIEIUHNHM-KRWDZBQOSA-N 1 1 363.421 3.533 20 5 FHBDMO CC[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@@H]1CCCc2cccnc21 ZINC000364999312 940041484 /nfs/dbraw/zinc/04/14/84/940041484.db2.gz HILMITSEZXTWFP-GOSISDBHSA-N 1 1 369.421 3.756 20 5 FHBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@@H]1CCCc2cccnc21 ZINC000364999312 940041487 /nfs/dbraw/zinc/04/14/87/940041487.db2.gz HILMITSEZXTWFP-GOSISDBHSA-N 1 1 369.421 3.756 20 5 FHBDMO C[C@H](Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1 ZINC000511349014 940049716 /nfs/dbraw/zinc/04/97/16/940049716.db2.gz BKYPCOVYRTYDGP-HNNXBMFYSA-N 1 1 365.433 3.888 20 5 FHBDMO CC(C)[C@H](CNCc1csc([N+](=O)[O-])c1)[N@@H+]1CCc2ccccc2C1 ZINC000236686610 940146383 /nfs/dbraw/zinc/14/63/83/940146383.db2.gz GBTPPYFIJCHUKK-SFHVURJKSA-N 1 1 359.495 3.829 20 5 FHBDMO CC(C)[C@H](CNCc1csc([N+](=O)[O-])c1)[N@H+]1CCc2ccccc2C1 ZINC000236686610 940146384 /nfs/dbraw/zinc/14/63/84/940146384.db2.gz GBTPPYFIJCHUKK-SFHVURJKSA-N 1 1 359.495 3.829 20 5 FHBDMO C[C@@H]1C[C@H](c2ccc(F)cc2)C[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000580602027 940482180 /nfs/dbraw/zinc/48/21/80/940482180.db2.gz ZMPHSBQYXSGUAR-ZBFHGGJFSA-N 1 1 371.412 3.941 20 5 FHBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc2cncn2c1 ZINC000414178319 940713403 /nfs/dbraw/zinc/71/34/03/940713403.db2.gz JIMNCRUZNRVANO-HNNXBMFYSA-N 1 1 356.451 3.903 20 5 FHBDMO COC(=O)[C@@H]1C[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C[C@@H]1c1ccccc1 ZINC000452008152 940720593 /nfs/dbraw/zinc/72/05/93/940720593.db2.gz SFTZCTDCUDZEJF-BMGDILEWSA-N 1 1 354.406 3.544 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)CCC1CCCCC1 ZINC000507591562 945346453 /nfs/dbraw/zinc/34/64/53/945346453.db2.gz SEIYNACBFWBUEW-UHFFFAOYSA-N 1 1 363.458 3.834 20 5 FHBDMO CCN(C(=O)c1cc([N+](=O)[O-])ccc1C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000186302219 940971967 /nfs/dbraw/zinc/97/19/67/940971967.db2.gz XDBIGIYKYNIBPQ-IBGZPJMESA-N 1 1 367.449 3.640 20 5 FHBDMO Cc1ccc2nc(NC(=O)C[NH2+][C@@H](C)c3cccc([N+](=O)[O-])c3)sc2c1 ZINC000180457675 941022292 /nfs/dbraw/zinc/02/22/92/941022292.db2.gz IGLGCMUUKWJMLO-LBPRGKRZSA-N 1 1 370.434 3.802 20 5 FHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCO[C@@H]([C@@H]3CCCO3)C2)s1 ZINC000180563010 941048133 /nfs/dbraw/zinc/04/81/33/941048133.db2.gz UQMZYXBWAZHTMM-ZWKOTPCHSA-N 1 1 374.462 3.703 20 5 FHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCO[C@@H]([C@@H]3CCCO3)C2)s1 ZINC000180563010 941048137 /nfs/dbraw/zinc/04/81/37/941048137.db2.gz UQMZYXBWAZHTMM-ZWKOTPCHSA-N 1 1 374.462 3.703 20 5 FHBDMO CC(=O)N1CC[C@@H](C[N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000180823872 941081849 /nfs/dbraw/zinc/08/18/49/941081849.db2.gz BINYBPADMCFHGK-HNNXBMFYSA-N 1 1 373.478 3.624 20 5 FHBDMO O=C(N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000311251174 941151600 /nfs/dbraw/zinc/15/16/00/941151600.db2.gz JHNCHAYJEGTPDL-MRXNPFEDSA-N 1 1 373.840 3.643 20 5 FHBDMO CC[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@H](O)C(F)(F)F ZINC000189874851 941292798 /nfs/dbraw/zinc/29/27/98/941292798.db2.gz FSXMICDXFGEQHV-HNNXBMFYSA-N 1 1 358.316 3.600 20 5 FHBDMO CC[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@H](O)C(F)(F)F ZINC000189874851 941292800 /nfs/dbraw/zinc/29/28/00/941292800.db2.gz FSXMICDXFGEQHV-HNNXBMFYSA-N 1 1 358.316 3.600 20 5 FHBDMO NC(=O)c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](c2ccccc2)C3)c([N+](=O)[O-])c1 ZINC000549156235 941549830 /nfs/dbraw/zinc/54/98/30/941549830.db2.gz APBWMVRPJPCVOG-REPLKXPHSA-N 1 1 365.433 3.604 20 5 FHBDMO CC1=C(c2ccco2)C[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000549159519 941557768 /nfs/dbraw/zinc/55/77/68/941557768.db2.gz WNDMCVVBFOZYDD-UHFFFAOYSA-N 1 1 356.378 3.734 20 5 FHBDMO CC1=C(c2ccco2)C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000549159519 941557770 /nfs/dbraw/zinc/55/77/70/941557770.db2.gz WNDMCVVBFOZYDD-UHFFFAOYSA-N 1 1 356.378 3.734 20 5 FHBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)o1 ZINC000415060574 941579218 /nfs/dbraw/zinc/57/92/18/941579218.db2.gz YSJWFXXJSRQBEC-CRAIPNDOSA-N 1 1 355.438 3.819 20 5 FHBDMO CCN(CC)C(=O)[C@H](c1ccccc1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000549172638 941584206 /nfs/dbraw/zinc/58/42/06/941584206.db2.gz NFTZJDWBOGROOH-FQEVSTJZSA-N 1 1 369.465 3.679 20 5 FHBDMO Cc1cc(N2CCC[C@@H](c3[nH+]ccn3C)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000365547156 941587353 /nfs/dbraw/zinc/58/73/53/941587353.db2.gz ODISLKAOMAVDPP-CQSZACIVSA-N 1 1 351.410 3.569 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NCC[C@H](C)[N@@H+](C)Cc1ccccc1 ZINC000472761586 941695413 /nfs/dbraw/zinc/69/54/13/941695413.db2.gz GBLUUWCLRDEDRD-INIZCTEOSA-N 1 1 370.453 3.935 20 5 FHBDMO CSCC[N@H+](C)[C@@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000151142727 941761829 /nfs/dbraw/zinc/76/18/29/941761829.db2.gz QLBGNJLUTBYTIG-GOSISDBHSA-N 1 1 373.478 3.878 20 5 FHBDMO CSCC[N@@H+](C)[C@@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000151142727 941761831 /nfs/dbraw/zinc/76/18/31/941761831.db2.gz QLBGNJLUTBYTIG-GOSISDBHSA-N 1 1 373.478 3.878 20 5 FHBDMO COc1ccccc1O[C@@H]1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000513392649 941888601 /nfs/dbraw/zinc/88/86/01/941888601.db2.gz VLELKPSRABAXHO-GOSISDBHSA-N 1 1 356.422 3.689 20 5 FHBDMO C[N@@H+](CCc1cccc2ccccc21)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000101556366 941986521 /nfs/dbraw/zinc/98/65/21/941986521.db2.gz MVLLOXZFEQHPEI-UHFFFAOYSA-N 1 1 363.417 3.521 20 5 FHBDMO Cc1cccc(CC[NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000513655071 942057829 /nfs/dbraw/zinc/05/78/29/942057829.db2.gz KVCSALYZQQXOGA-IBGZPJMESA-N 1 1 350.422 3.558 20 5 FHBDMO Cn1ccnc1[C@H]([NH2+]C1CC(c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000513673375 942067450 /nfs/dbraw/zinc/06/74/50/942067450.db2.gz QCQPHZFNAKONFE-AFMYVXGZSA-N 1 1 362.433 3.954 20 5 FHBDMO CC1(C)C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])Cc2ccccc21 ZINC000500983576 942081834 /nfs/dbraw/zinc/08/18/34/942081834.db2.gz KQZWVBHZGQRTTN-UHFFFAOYSA-N 1 1 353.422 3.717 20 5 FHBDMO O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC(n2ccc(C(F)(F)F)n2)CC1 ZINC000183145202 942183695 /nfs/dbraw/zinc/18/36/95/942183695.db2.gz YXPOZTRPLMUQLI-UHFFFAOYSA-N 1 1 372.322 3.786 20 5 FHBDMO COc1ccc(C[N@H+](C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1C ZINC000103144765 942223723 /nfs/dbraw/zinc/22/37/23/942223723.db2.gz UPVNHXRHGKRBAV-HNNXBMFYSA-N 1 1 371.437 3.679 20 5 FHBDMO COc1ccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1C ZINC000103144765 942223728 /nfs/dbraw/zinc/22/37/28/942223728.db2.gz UPVNHXRHGKRBAV-HNNXBMFYSA-N 1 1 371.437 3.679 20 5 FHBDMO COc1ccc(C[N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1C ZINC000103145442 942224164 /nfs/dbraw/zinc/22/41/64/942224164.db2.gz BGQBOVBZXNGRGL-UHFFFAOYSA-N 1 1 371.437 3.681 20 5 FHBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420955960 942275297 /nfs/dbraw/zinc/27/52/97/942275297.db2.gz XJDGOGFKXLZOMN-NEPJUHHUSA-N 1 1 359.348 3.586 20 5 FHBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420955960 942275299 /nfs/dbraw/zinc/27/52/99/942275299.db2.gz XJDGOGFKXLZOMN-NEPJUHHUSA-N 1 1 359.348 3.586 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CC[C@@H](N4CCCCC4)C3)o2)c1 ZINC000513733762 942286021 /nfs/dbraw/zinc/28/60/21/942286021.db2.gz VXTQGEWPCZTQQS-GOSISDBHSA-N 1 1 355.438 3.915 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@@H](N4CCCCC4)C3)o2)c1 ZINC000513733762 942286026 /nfs/dbraw/zinc/28/60/26/942286026.db2.gz VXTQGEWPCZTQQS-GOSISDBHSA-N 1 1 355.438 3.915 20 5 FHBDMO COc1ccc2c(c1OC)CC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C2 ZINC000501122578 942320116 /nfs/dbraw/zinc/32/01/16/942320116.db2.gz RMFVCWNKXJKCDN-FNORWQNLSA-N 1 1 354.406 3.684 20 5 FHBDMO COc1ccc2c(c1OC)CC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])C2 ZINC000501122578 942320119 /nfs/dbraw/zinc/32/01/19/942320119.db2.gz RMFVCWNKXJKCDN-FNORWQNLSA-N 1 1 354.406 3.684 20 5 FHBDMO O=[N+]([O-])c1cccc(Cl)c1OCc1ccc(C[NH+]2CCOCC2)cc1 ZINC000421220086 942434095 /nfs/dbraw/zinc/43/40/95/942434095.db2.gz WAZQCOXUEAAFEU-UHFFFAOYSA-N 1 1 362.813 3.659 20 5 FHBDMO Cc1c(NC(=O)[C@@H](C)[NH+]2CCC(c3ccccn3)CC2)cccc1[N+](=O)[O-] ZINC000378262234 942478416 /nfs/dbraw/zinc/47/84/16/942478416.db2.gz WCJYWQWXSADTBC-OAHLLOKOSA-N 1 1 368.437 3.505 20 5 FHBDMO COc1ccc(C[N@@H+](C)CCOc2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000501476253 942501718 /nfs/dbraw/zinc/50/17/18/942501718.db2.gz HSPKGUOITVXPTI-UHFFFAOYSA-N 1 1 350.802 3.768 20 5 FHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCO)Cc2ccc(Cl)c(Cl)c2)cc1 ZINC000502535415 942511945 /nfs/dbraw/zinc/51/19/45/942511945.db2.gz ZAMQGQKRAXWFQK-UHFFFAOYSA-N 1 1 355.221 3.896 20 5 FHBDMO O=[N+]([O-])c1ccc(C[N@H+](CCO)Cc2ccc(Cl)c(Cl)c2)cc1 ZINC000502535415 942511953 /nfs/dbraw/zinc/51/19/53/942511953.db2.gz ZAMQGQKRAXWFQK-UHFFFAOYSA-N 1 1 355.221 3.896 20 5 FHBDMO Cc1c[nH+]ccc1OC1CCN(c2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413257012 942568889 /nfs/dbraw/zinc/56/88/89/942568889.db2.gz ACTJICYATPMARL-UHFFFAOYSA-N 1 1 364.405 3.894 20 5 FHBDMO Cn1cc(Cl)cc1C[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000120239116 942606645 /nfs/dbraw/zinc/60/66/45/942606645.db2.gz NSZOZRRILSCXMZ-UHFFFAOYSA-N 1 1 374.828 3.916 20 5 FHBDMO COc1cc(C[N@H+]2CCC[C@@H]2Cc2ccc(F)cc2)c([N+](=O)[O-])cc1OC ZINC000511542100 942620290 /nfs/dbraw/zinc/62/02/90/942620290.db2.gz NNVFEXMJJOCKOR-QGZVFWFLSA-N 1 1 374.412 3.958 20 5 FHBDMO CCCC[N@@H+](C)CC1CCN(C(=O)c2cc([N+](=O)[O-])c(C)cc2C)CC1 ZINC000421768659 942813838 /nfs/dbraw/zinc/81/38/38/942813838.db2.gz OYWAWRMDLGTAKX-UHFFFAOYSA-N 1 1 361.486 3.796 20 5 FHBDMO Cc1cc(NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])cn2cc[nH+]c12 ZINC000502927459 942847990 /nfs/dbraw/zinc/84/79/90/942847990.db2.gz XRTMRTPPSNYUEY-UHFFFAOYSA-N 1 1 374.784 3.612 20 5 FHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)C1CCN(Cc2ccncc2)CC1 ZINC000367116326 942862969 /nfs/dbraw/zinc/86/29/69/942862969.db2.gz AWVLGFFWBVAQRI-INIZCTEOSA-N 1 1 354.454 3.647 20 5 FHBDMO CCc1ccc([C@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3Cl)CC[NH2+]2)cc1 ZINC000505483773 942890344 /nfs/dbraw/zinc/89/03/44/942890344.db2.gz MBLSICSDVXPVJT-GOSISDBHSA-N 1 1 373.840 3.597 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](c2ccccc2)[C@@H]1C ZINC000434891421 943022371 /nfs/dbraw/zinc/02/23/71/943022371.db2.gz HRZYOCSGFYNSJP-YJBOKZPZSA-N 1 1 353.422 3.720 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1CNC[C@@H](c1ccc(C)o1)[NH+]1CCCC1 ZINC000236850506 943118068 /nfs/dbraw/zinc/11/80/68/943118068.db2.gz QACKTULCPDNPOR-SFHVURJKSA-N 1 1 373.453 3.822 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@H](Oc4ccncc4)C3)o2)cc1 ZINC000435057977 943130258 /nfs/dbraw/zinc/13/02/58/943130258.db2.gz RDJDPTAOMNFNIH-LJQANCHMSA-N 1 1 365.389 3.903 20 5 FHBDMO COCC[N@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000505612864 943204334 /nfs/dbraw/zinc/20/43/34/943204334.db2.gz UMEFEECHUJZIIC-UHFFFAOYSA-N 1 1 366.364 3.845 20 5 FHBDMO COCC[N@@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000505612864 943204337 /nfs/dbraw/zinc/20/43/37/943204337.db2.gz UMEFEECHUJZIIC-UHFFFAOYSA-N 1 1 366.364 3.845 20 5 FHBDMO C[C@H]1C[C@@H](O)CC[N@@H+]1Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000430122235 943217892 /nfs/dbraw/zinc/21/78/92/943217892.db2.gz JSFKRNVFGIJIBS-BBRMVZONSA-N 1 1 360.385 3.871 20 5 FHBDMO C[C@H]1C[C@@H](O)CC[N@H+]1Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000430122235 943217895 /nfs/dbraw/zinc/21/78/95/943217895.db2.gz JSFKRNVFGIJIBS-BBRMVZONSA-N 1 1 360.385 3.871 20 5 FHBDMO C[C@H](N[C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000422934573 943337126 /nfs/dbraw/zinc/33/71/26/943337126.db2.gz CPKAYDNBBHSTLQ-DCPHZVHLSA-N 1 1 353.422 3.501 20 5 FHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@@H](n3ccnn3)C2)s1 ZINC000425355114 943361470 /nfs/dbraw/zinc/36/14/70/943361470.db2.gz UGYFXBCZEVQPTQ-CQSZACIVSA-N 1 1 369.450 3.752 20 5 FHBDMO Cc1nc(C[NH3+])ccc1[C@@H](C)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000423085799 943388741 /nfs/dbraw/zinc/38/87/41/943388741.db2.gz KQBBNRUJNMOMLW-SNVBAGLBSA-N 1 1 368.359 3.627 20 5 FHBDMO CCc1ccc([C@H](NCC2(C)CC[NH2+]CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423315743 943473474 /nfs/dbraw/zinc/47/34/74/943473474.db2.gz ADWNSZFYEUOHSR-LJQANCHMSA-N 1 1 357.454 3.819 20 5 FHBDMO CCCCO[C@@H]1C[C@@H]([N@@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1(C)C ZINC001167960081 943935980 /nfs/dbraw/zinc/93/59/80/943935980.db2.gz RXWDNEDQBXIXKS-KZNAEPCWSA-N 1 1 350.459 3.544 20 5 FHBDMO Cc1cc(CNC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc(N2CCCC2)[nH+]1 ZINC000517058418 943957571 /nfs/dbraw/zinc/95/75/71/943957571.db2.gz BTECHVVDJPUILP-UHFFFAOYSA-N 1 1 369.425 3.529 20 5 FHBDMO COc1cccc(C[C@@H]2CCC[N@H+]2CCOc2cccc([N+](=O)[O-])c2)c1 ZINC000515552707 943988393 /nfs/dbraw/zinc/98/83/93/943988393.db2.gz WIHXDDNYWDGVAW-KRWDZBQOSA-N 1 1 356.422 3.689 20 5 FHBDMO O=C(CC[N@H+]1CC[C@@H](c2ccc(F)cc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000500078225 944065566 /nfs/dbraw/zinc/06/55/66/944065566.db2.gz XQMSBRJAMABKJK-OAHLLOKOSA-N 1 1 357.385 3.552 20 5 FHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCCNCc2cccnc2)o1 ZINC000414880147 944086676 /nfs/dbraw/zinc/08/66/76/944086676.db2.gz QEQWMJXXZYHJND-UHFFFAOYSA-N 1 1 366.421 3.519 20 5 FHBDMO COc1cc2c(cc1C[N@@H+](C)CCc1ccccc1[N+](=O)[O-])O[C@@H](C)C2 ZINC000517202980 944100087 /nfs/dbraw/zinc/10/00/87/944100087.db2.gz HDSIGOOGELNIPN-AWEZNQCLSA-N 1 1 356.422 3.601 20 5 FHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+][C@@H]2COCc3ccccc32)c1 ZINC000418093421 944147138 /nfs/dbraw/zinc/14/71/38/944147138.db2.gz BWENMRYMGKDCOJ-OAHLLOKOSA-N 1 1 350.321 3.557 20 5 FHBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CCC[C@@H](C)C1 ZINC000505786569 944171764 /nfs/dbraw/zinc/17/17/64/944171764.db2.gz CBDJXEPUHMOBMF-CQSZACIVSA-N 1 1 365.499 3.559 20 5 FHBDMO Cc1ccc(C[C@@H]2CCC[N@H+]2CC(=O)Nc2c(C)cccc2[N+](=O)[O-])cc1 ZINC000500182104 944223479 /nfs/dbraw/zinc/22/34/79/944223479.db2.gz QMIMHPHMVDCGTK-SFHVURJKSA-N 1 1 367.449 3.857 20 5 FHBDMO CC(C)(C(=O)NC[C@@H]1CCC[N@H+]1C1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000437878847 944246455 /nfs/dbraw/zinc/24/64/55/944246455.db2.gz VMFPYDCAGGHODU-IBGZPJMESA-N 1 1 373.497 3.786 20 5 FHBDMO C[N@@H+](CCNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])Cc1ccc(F)cc1 ZINC000436398254 944274128 /nfs/dbraw/zinc/27/41/28/944274128.db2.gz DBOCNORMQWSDOW-UHFFFAOYSA-N 1 1 372.322 3.692 20 5 FHBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000506474870 944288798 /nfs/dbraw/zinc/28/87/98/944288798.db2.gz QFVABSOISYKOPI-ROUUACIJSA-N 1 1 361.486 3.560 20 5 FHBDMO COc1cc(C[N@H+](CCC(F)(F)F)CC2CC2)c([N+](=O)[O-])cc1F ZINC000184233545 944289087 /nfs/dbraw/zinc/28/90/87/944289087.db2.gz DASLGVCKUBWXLK-UHFFFAOYSA-N 1 1 350.312 3.907 20 5 FHBDMO COc1cc(C[N@@H+](CCC(F)(F)F)CC2CC2)c([N+](=O)[O-])cc1F ZINC000184233545 944289096 /nfs/dbraw/zinc/28/90/96/944289096.db2.gz DASLGVCKUBWXLK-UHFFFAOYSA-N 1 1 350.312 3.907 20 5 FHBDMO C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCC[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000133871979 944319029 /nfs/dbraw/zinc/31/90/29/944319029.db2.gz SQPVYKJCBVAKGR-TZMCWYRMSA-N 1 1 369.487 3.782 20 5 FHBDMO C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000133871979 944319033 /nfs/dbraw/zinc/31/90/33/944319033.db2.gz SQPVYKJCBVAKGR-TZMCWYRMSA-N 1 1 369.487 3.782 20 5 FHBDMO CCCC[N@@H+](C)CC1CCN(Cc2cc(OC)c(F)cc2[N+](=O)[O-])CC1 ZINC000184248004 944336667 /nfs/dbraw/zinc/33/66/67/944336667.db2.gz NXHQSEUQDZCBAG-UHFFFAOYSA-N 1 1 367.465 3.686 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1CCCNc1nc2cc([N+](=O)[O-])ccc2nc1Cl ZINC001167752443 944363714 /nfs/dbraw/zinc/36/37/14/944363714.db2.gz VXLXZHUWEPFSKY-GFCCVEGCSA-N 1 1 363.849 3.868 20 5 FHBDMO CC(C)c1ccc(CN[C@@H](Cc2ccccc2)C[NH+](C)C)cc1[N+](=O)[O-] ZINC000517536428 944381985 /nfs/dbraw/zinc/38/19/85/944381985.db2.gz HMLYXHJEWDDZDL-IBGZPJMESA-N 1 1 355.482 3.981 20 5 FHBDMO Cc1cc(NC(=O)N[C@H](C)C[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000473785427 944480144 /nfs/dbraw/zinc/48/01/44/944480144.db2.gz IIEHKJHXOJOZRK-OAHLLOKOSA-N 1 1 356.426 3.545 20 5 FHBDMO CC[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C(C)C ZINC000110420423 944482873 /nfs/dbraw/zinc/48/28/73/944482873.db2.gz AHMSGCHWWQQVRA-UHFFFAOYSA-N 1 1 371.437 3.847 20 5 FHBDMO Cc1cc(NC(=O)N(C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000473787769 944485390 /nfs/dbraw/zinc/48/53/90/944485390.db2.gz POFWPCWZSJMEJY-SFHVURJKSA-N 1 1 368.437 3.641 20 5 FHBDMO COc1cc(C[N@H+](Cc2ccccc2)[C@H](C)CCO)c([N+](=O)[O-])cc1F ZINC000184296082 944532539 /nfs/dbraw/zinc/53/25/39/944532539.db2.gz LWRPGIXQJFDGQV-CQSZACIVSA-N 1 1 362.401 3.516 20 5 FHBDMO COc1cc(C[N@@H+](Cc2ccccc2)[C@H](C)CCO)c([N+](=O)[O-])cc1F ZINC000184296082 944532544 /nfs/dbraw/zinc/53/25/44/944532544.db2.gz LWRPGIXQJFDGQV-CQSZACIVSA-N 1 1 362.401 3.516 20 5 FHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+](CCO)Cc2cccc(F)c2)o1 ZINC000426372579 944578191 /nfs/dbraw/zinc/57/81/91/944578191.db2.gz OPNLHPAGMJJCMR-UHFFFAOYSA-N 1 1 370.380 3.988 20 5 FHBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C[C@@H](C)C1 ZINC000516190647 944579454 /nfs/dbraw/zinc/57/94/54/944579454.db2.gz BZIKNDVROHFMCM-XNJGSVPQSA-N 1 1 371.403 3.776 20 5 FHBDMO Cc1nc2ccc(C[NH+]3CCN(c4cccc([N+](=O)[O-])c4)CC3)cc2s1 ZINC000426395619 944653825 /nfs/dbraw/zinc/65/38/25/944653825.db2.gz JWTNHVRKEMCZGS-UHFFFAOYSA-N 1 1 368.462 3.835 20 5 FHBDMO COC(=O)[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000506306715 944865036 /nfs/dbraw/zinc/86/50/36/944865036.db2.gz BNWZRPSLUJGMPU-ZDUSSCGKSA-N 1 1 360.435 3.708 20 5 FHBDMO COc1ccc(-c2ccc(C[N@@H+](C)C[C@H]3CCCCO3)o2)c([N+](=O)[O-])c1 ZINC000511664844 944893184 /nfs/dbraw/zinc/89/31/84/944893184.db2.gz HQGJJOIKUZJPSA-OAHLLOKOSA-N 1 1 360.410 3.864 20 5 FHBDMO CN(c1ccccc1)c1ccc(C[N@@H+](CCO)C2CCC2)cc1[N+](=O)[O-] ZINC000439769226 944972414 /nfs/dbraw/zinc/97/24/14/944972414.db2.gz UDCQYGRIHGVGRH-UHFFFAOYSA-N 1 1 355.438 3.710 20 5 FHBDMO CC(C)(C)[C@H]1CCC[N@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000543207058 944993026 /nfs/dbraw/zinc/99/30/26/944993026.db2.gz KEARUJSNMQRSDZ-HNNXBMFYSA-N 1 1 368.499 3.517 20 5 FHBDMO CC(C)(C)[C@H]1CCC[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000543207058 944993032 /nfs/dbraw/zinc/99/30/32/944993032.db2.gz KEARUJSNMQRSDZ-HNNXBMFYSA-N 1 1 368.499 3.517 20 5 FHBDMO O=C(NC[C@@H]1CCC[N@H+]1C1CCCCC1)c1ccc([N+](=O)[O-])cc1Cl ZINC000437848302 945023519 /nfs/dbraw/zinc/02/35/19/945023519.db2.gz WFGYJVPTXRLRFV-HNNXBMFYSA-N 1 1 365.861 3.775 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@](O)(C3CC3)C2)ccc1Oc1ccc(F)cc1 ZINC000426509181 945025896 /nfs/dbraw/zinc/02/58/96/945025896.db2.gz RXHPUJLCHPURDI-HXUWFJFHSA-N 1 1 372.396 3.873 20 5 FHBDMO Cc1ccccc1[C@H]1CC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000507210879 945042676 /nfs/dbraw/zinc/04/26/76/945042676.db2.gz UFAGOBYCBWQGQJ-AWEZNQCLSA-N 1 1 373.840 3.985 20 5 FHBDMO Cc1ccccc1[C@H]1CC[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000507210879 945042688 /nfs/dbraw/zinc/04/26/88/945042688.db2.gz UFAGOBYCBWQGQJ-AWEZNQCLSA-N 1 1 373.840 3.985 20 5 FHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21 ZINC000511762756 945052542 /nfs/dbraw/zinc/05/25/42/945052542.db2.gz OITFDMSKMRHOTP-SZVBFZGTSA-N 1 1 356.397 3.738 20 5 FHBDMO COc1cc(C[N@H+]2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)ccc1[N+](=O)[O-] ZINC000511764168 945059572 /nfs/dbraw/zinc/05/95/72/945059572.db2.gz CTZRCGASKIFJDI-QRVBRYPASA-N 1 1 368.433 3.608 20 5 FHBDMO COc1cc(C[N@H+]2CC[C@@H](Cc3ccccc3)C2)c([N+](=O)[O-])cc1OC ZINC000507671368 945422286 /nfs/dbraw/zinc/42/22/86/945422286.db2.gz ZRSBEUNRXGFOHA-INIZCTEOSA-N 1 1 356.422 3.677 20 5 FHBDMO Cc1cccc2c1CC[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C2 ZINC000729480232 945580601 /nfs/dbraw/zinc/58/06/01/945580601.db2.gz QCAMVULWVWKIJD-UHFFFAOYSA-N 1 1 353.422 3.599 20 5 FHBDMO COc1ccc(Br)c(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000111158682 945936233 /nfs/dbraw/zinc/93/62/33/945936233.db2.gz XMLNBSZVFFVAGT-UHFFFAOYSA-N 1 1 351.200 3.656 20 5 FHBDMO C[C@@H]1C[C@H](c2cccc(F)c2)[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000444167889 946015252 /nfs/dbraw/zinc/01/52/52/946015252.db2.gz MRPPAOZORPMQEM-AUUYWEPGSA-N 1 1 371.412 3.780 20 5 FHBDMO C[C@@H]1C[C@H](c2cccc(F)c2)[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000444167889 946015259 /nfs/dbraw/zinc/01/52/59/946015259.db2.gz MRPPAOZORPMQEM-AUUYWEPGSA-N 1 1 371.412 3.780 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](CCc1ccc(F)cc1)C1CC1 ZINC000444243678 946118351 /nfs/dbraw/zinc/11/83/51/946118351.db2.gz HWCFLFHXOZZUFA-UHFFFAOYSA-N 1 1 371.412 3.688 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](CCc1ccc(F)cc1)C1CC1 ZINC000444243678 946118355 /nfs/dbraw/zinc/11/83/55/946118355.db2.gz HWCFLFHXOZZUFA-UHFFFAOYSA-N 1 1 371.412 3.688 20 5 FHBDMO Cc1cccc(C)c1OC[C@H](O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000064350117 946220605 /nfs/dbraw/zinc/22/06/05/946220605.db2.gz KIOQCDQIFIZIFE-HXUWFJFHSA-N 1 1 372.465 3.862 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+](CCO)[C@@H]3CCCSC3)o2)c1 ZINC000475488810 946418386 /nfs/dbraw/zinc/41/83/86/946418386.db2.gz RNEWMWHTHYORND-MRXNPFEDSA-N 1 1 362.451 3.545 20 5 FHBDMO COc1ccc(-c2ccc(CN[C@@H]3CC[N@H+]4CCCC[C@@H]34)o2)c([N+](=O)[O-])c1 ZINC000237424774 946453765 /nfs/dbraw/zinc/45/37/65/946453765.db2.gz JBUOSOUNIXBILC-MSOLQXFVSA-N 1 1 371.437 3.580 20 5 FHBDMO COc1ccc(-c2ccc(C[NH2+][C@@H]3CCN4CCCC[C@@H]34)o2)c([N+](=O)[O-])c1 ZINC000237424774 946453770 /nfs/dbraw/zinc/45/37/70/946453770.db2.gz JBUOSOUNIXBILC-MSOLQXFVSA-N 1 1 371.437 3.580 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C)c1ccc(Br)cn1 ZINC000475500980 946502087 /nfs/dbraw/zinc/50/20/87/946502087.db2.gz IFAHDIBJSKNGNX-NSHDSACASA-N 1 1 350.216 3.912 20 5 FHBDMO COc1ccc(OCC[N@@H+](C)[C@@H](C)Cc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000441392903 946548836 /nfs/dbraw/zinc/54/88/36/946548836.db2.gz DZOIMOBQMSMYKJ-INIZCTEOSA-N 1 1 358.438 3.854 20 5 FHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000441395417 946550393 /nfs/dbraw/zinc/55/03/93/946550393.db2.gz MLQQQZSJKVFQJN-UZLBHIALSA-N 1 1 373.497 3.831 20 5 FHBDMO Cc1ccc2[nH]c(C[N@H+]3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)cc2c1C ZINC000473141739 946580509 /nfs/dbraw/zinc/58/05/09/946580509.db2.gz AYBFOBAPEKIXNU-HNNXBMFYSA-N 1 1 365.437 3.774 20 5 FHBDMO Cc1c(NC(=O)CC[N@H+]2Cc3ccccc3C3(CC3)C2)cccc1[N+](=O)[O-] ZINC000186219435 946629367 /nfs/dbraw/zinc/62/93/67/946629367.db2.gz LLRDODOIUDWGAI-UHFFFAOYSA-N 1 1 365.433 3.779 20 5 FHBDMO CC[N@H+](Cc1ccc(Cl)cc1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000519908723 946774731 /nfs/dbraw/zinc/77/47/31/946774731.db2.gz LYFGQXWOQMCDKO-QGZVFWFLSA-N 1 1 364.829 3.510 20 5 FHBDMO C[C@H]1OCC[C@]12C[N@@H+](Cc1ccc(-c3ccccc3[N+](=O)[O-])s1)CCO2 ZINC000475290046 946828827 /nfs/dbraw/zinc/82/88/27/946828827.db2.gz DZDOLGIFHGLJRA-KUHUBIRLSA-N 1 1 374.462 3.703 20 5 FHBDMO O=[N+]([O-])c1ccc(OCC[NH2+][C@@H](c2ccc(F)cc2)c2ccccn2)cc1 ZINC000544380411 946897864 /nfs/dbraw/zinc/89/78/64/946897864.db2.gz KKSZUMKEESPFNX-FQEVSTJZSA-N 1 1 367.380 3.887 20 5 FHBDMO O=[N+]([O-])c1ccc(OCC[NH2+][C@H](c2ccc(F)cc2)c2ccccn2)cc1 ZINC000544380412 946898180 /nfs/dbraw/zinc/89/81/80/946898180.db2.gz KKSZUMKEESPFNX-HXUWFJFHSA-N 1 1 367.380 3.887 20 5 FHBDMO CC[C@@H](C)[C@@H](C)[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC)C1CC1 ZINC000112600071 946917617 /nfs/dbraw/zinc/91/76/17/946917617.db2.gz MZIKSXRJCUJWAU-ZIAGYGMSSA-N 1 1 363.458 3.831 20 5 FHBDMO CCC[N@@H+](CCc1cccs1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000184511931 946922847 /nfs/dbraw/zinc/92/28/47/946922847.db2.gz RBDMYZFKXHVJCD-UHFFFAOYSA-N 1 1 362.451 3.978 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC[C@]1(CO)Cc1ccccc1 ZINC000475376100 946986445 /nfs/dbraw/zinc/98/64/45/946986445.db2.gz RLZNLEHCLVWMFD-VWMRQFFHSA-N 1 1 352.434 3.678 20 5 FHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@H](Cc4ccccc4)C3)nc2c1 ZINC000444602551 947028991 /nfs/dbraw/zinc/02/89/91/947028991.db2.gz KJASWTOZKNASNC-MRXNPFEDSA-N 1 1 350.422 3.926 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](Cc1cccnc1)C(C)C ZINC000125624567 947057264 /nfs/dbraw/zinc/05/72/64/947057264.db2.gz TWVVTYHMWKRZHK-UHFFFAOYSA-N 1 1 356.426 3.537 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)CC1(c2ccccc2)CC1 ZINC000444690327 947115097 /nfs/dbraw/zinc/11/50/97/947115097.db2.gz RZJNVYHUZBUOSH-UHFFFAOYSA-N 1 1 367.449 3.895 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+](C)Cc1cc(C)cc(C)c1 ZINC000444708336 947136381 /nfs/dbraw/zinc/13/63/81/947136381.db2.gz ZXYMDCANYAXOSG-OAHLLOKOSA-N 1 1 371.437 3.679 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+](C)Cc1cc(C)cc(C)c1 ZINC000444708336 947136386 /nfs/dbraw/zinc/13/63/86/947136386.db2.gz ZXYMDCANYAXOSG-OAHLLOKOSA-N 1 1 371.437 3.679 20 5 FHBDMO Cc1cc(C[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)ccc1F ZINC000444733195 947148086 /nfs/dbraw/zinc/14/80/86/947148086.db2.gz JOVNEICBYYSWKE-UHFFFAOYSA-N 1 1 359.401 3.811 20 5 FHBDMO Cc1cc(C[N@@H+](C)CCC(=O)Nc2cccc([N+](=O)[O-])c2C)ccc1F ZINC000444739487 947175393 /nfs/dbraw/zinc/17/53/93/947175393.db2.gz RUHRZRTUCPEXJB-UHFFFAOYSA-N 1 1 359.401 3.811 20 5 FHBDMO C[C@H](c1ccccc1Cl)[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248373053 947214964 /nfs/dbraw/zinc/21/49/64/947214964.db2.gz FXBRHKKUBRXHOS-ZIAGYGMSSA-N 1 1 364.829 3.681 20 5 FHBDMO C[N@@H+](CCCNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000523486638 947305246 /nfs/dbraw/zinc/30/52/46/947305246.db2.gz AFFXEJHCYKYNSX-UHFFFAOYSA-N 1 1 369.465 3.511 20 5 FHBDMO Cc1cc(N2CC[NH+]([C@H](C)c3ccccc3Cl)CC2)ncc1[N+](=O)[O-] ZINC000301449235 947347270 /nfs/dbraw/zinc/34/72/70/947347270.db2.gz SGDVGHZVLRIVKA-CQSZACIVSA-N 1 1 360.845 3.835 20 5 FHBDMO C[N@@H+](Cc1ccccc1)C1(CNc2ccncc2[N+](=O)[O-])CCCCC1 ZINC000714229256 947458016 /nfs/dbraw/zinc/45/80/16/947458016.db2.gz YYDIYCVEIDBFBR-UHFFFAOYSA-N 1 1 354.454 3.659 20 5 FHBDMO CC[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CCc1nccs1 ZINC000159164183 947622002 /nfs/dbraw/zinc/62/20/02/947622002.db2.gz WWZPWFNAYPPSQW-UHFFFAOYSA-N 1 1 372.450 3.813 20 5 FHBDMO C[C@@H](c1ccncc1)[N@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000273450060 947636516 /nfs/dbraw/zinc/63/65/16/947636516.db2.gz YPMAHGWMTVSUOW-NSHDSACASA-N 1 1 350.216 3.945 20 5 FHBDMO C[C@@H](c1ccncc1)[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000273450060 947636519 /nfs/dbraw/zinc/63/65/19/947636519.db2.gz YPMAHGWMTVSUOW-NSHDSACASA-N 1 1 350.216 3.945 20 5 FHBDMO CCO[C@H]1C[C@@H]([N@@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1(C)C ZINC000536363700 947770776 /nfs/dbraw/zinc/77/07/76/947770776.db2.gz QUUZHSTYCIFTSX-SJORKVTESA-N 1 1 359.426 3.885 20 5 FHBDMO C/C(=C/C(=O)Nc1cccnc1-n1cc[nH+]c1C)c1ccc([N+](=O)[O-])cc1 ZINC000785340023 947804479 /nfs/dbraw/zinc/80/44/79/947804479.db2.gz HOZCMJISMZJCMC-SEYXRHQNSA-N 1 1 363.377 3.526 20 5 FHBDMO CC[N@@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])CCc1cccs1 ZINC000441519904 948191148 /nfs/dbraw/zinc/19/11/48/948191148.db2.gz AFUZOWKRZNVYFB-UHFFFAOYSA-N 1 1 350.440 3.608 20 5 FHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCCN(c2ccc(F)c(F)c2)CC1 ZINC000585753802 948264471 /nfs/dbraw/zinc/26/44/71/948264471.db2.gz VQKPVKDVBRYRGD-UHFFFAOYSA-N 1 1 365.355 3.724 20 5 FHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCCN(c2ccc(F)c(F)c2)CC1 ZINC000585753802 948264475 /nfs/dbraw/zinc/26/44/75/948264475.db2.gz VQKPVKDVBRYRGD-UHFFFAOYSA-N 1 1 365.355 3.724 20 5 FHBDMO CCC[N@@H+](C)C[C@@H]1CCN(Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC000839506090 948507484 /nfs/dbraw/zinc/50/74/84/948507484.db2.gz WNMGFAPYNSKKLW-ZDUSSCGKSA-N 1 1 370.291 3.521 20 5 FHBDMO COc1cc2c(cc1OC)C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])CC2 ZINC000033324017 208085570 /nfs/dbraw/zinc/08/55/70/208085570.db2.gz CCWIMBIGBIRCFQ-ALCCZGGFSA-N 1 1 354.406 3.684 20 5 FHBDMO COc1cc2c(cc1OC)C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])CC2 ZINC000033324017 208085575 /nfs/dbraw/zinc/08/55/75/208085575.db2.gz CCWIMBIGBIRCFQ-ALCCZGGFSA-N 1 1 354.406 3.684 20 5 FHBDMO Cc1c(C[N@@H+](C)[C@@H]2CCCN(c3ccccc3)C2=O)cccc1[N+](=O)[O-] ZINC000078736883 132191487 /nfs/dbraw/zinc/19/14/87/132191487.db2.gz JFWCZQIYKAJPTQ-LJQANCHMSA-N 1 1 353.422 3.531 20 5 FHBDMO Cc1c(C[N@H+](C)[C@@H]2CCCN(c3ccccc3)C2=O)cccc1[N+](=O)[O-] ZINC000078736883 132191489 /nfs/dbraw/zinc/19/14/89/132191489.db2.gz JFWCZQIYKAJPTQ-LJQANCHMSA-N 1 1 353.422 3.531 20 5 FHBDMO CC[C@@](C)([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1nc(C)cs1 ZINC000072863053 567840876 /nfs/dbraw/zinc/84/08/76/567840876.db2.gz GKFMDGHFNYNRBA-QGZVFWFLSA-N 1 1 362.455 3.522 20 5 FHBDMO CN(C)c1ccccc1C[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602591411 567995059 /nfs/dbraw/zinc/99/50/59/567995059.db2.gz ASDCLNQMOYIWQO-UHFFFAOYSA-N 1 1 370.272 3.775 20 5 FHBDMO COCC[C@@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1ccc(Cl)c(Cl)c1 ZINC000568304859 568049235 /nfs/dbraw/zinc/04/92/35/568049235.db2.gz AMRJAMNNNWZEAK-CYBMUJFWSA-N 1 1 373.240 3.503 20 5 FHBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3ccc([O-])c([N+](=O)[O-])c3)cc2)C1 ZINC000436629923 568102585 /nfs/dbraw/zinc/10/25/85/568102585.db2.gz YBFXCBWAXGGZIF-CQSZACIVSA-N 1 1 369.421 3.785 20 5 FHBDMO COCc1ccc([C@H]2CCC[N@H+]2CCCOc2ccc([N+](=O)[O-])cc2)o1 ZINC000131113087 568119733 /nfs/dbraw/zinc/11/97/33/568119733.db2.gz ZNBDANYQRBLHQS-GOSISDBHSA-N 1 1 360.410 3.940 20 5 FHBDMO Cc1cnc(N2CC[C@@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000481995505 568221761 /nfs/dbraw/zinc/22/17/61/568221761.db2.gz YKIWXKAQSRLQMO-RTBURBONSA-N 1 1 366.465 3.789 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CC[C@H](COC(F)F)C3)cs2)c1 ZINC000569769432 568422910 /nfs/dbraw/zinc/42/29/10/568422910.db2.gz VLUFEWMYWUQOSE-NSHDSACASA-N 1 1 369.393 3.779 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CC[C@H](COC(F)F)C3)cs2)c1 ZINC000569769432 568422911 /nfs/dbraw/zinc/42/29/11/568422911.db2.gz VLUFEWMYWUQOSE-NSHDSACASA-N 1 1 369.393 3.779 20 5 FHBDMO COc1ccc(C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)c(OC)n1 ZINC000570012270 568449618 /nfs/dbraw/zinc/44/96/18/568449618.db2.gz UXLCPBYRURPOCZ-UHFFFAOYSA-N 1 1 369.377 3.557 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)cnc1N1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001164621409 719055987 /nfs/dbraw/zinc/05/59/87/719055987.db2.gz JCYADDNBEWNBEU-MAUKXSAKSA-N 1 1 372.856 3.744 20 5 FHBDMO COc1ccc(C[N@H+]2C[C@@H]3C[C@@H]3C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000600187367 927150886 /nfs/dbraw/zinc/15/08/86/927150886.db2.gz XQZFMFGNMJHKEN-CALCHBBNSA-N 1 1 354.406 3.634 20 5 FHBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000610178082 927288650 /nfs/dbraw/zinc/28/86/50/927288650.db2.gz NSAFHZMLFRLZLJ-YOEHRIQHSA-N 1 1 361.486 3.695 20 5 FHBDMO Cn1ccnc1[C@H]([NH2+]CCc1ccc(F)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000577638441 927366076 /nfs/dbraw/zinc/36/60/76/927366076.db2.gz RKAPAGQOEFXVSS-GOSISDBHSA-N 1 1 372.375 3.528 20 5 FHBDMO C[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C1c2ccccc2-c2ccccc21 ZINC000176435031 937166552 /nfs/dbraw/zinc/16/65/52/937166552.db2.gz RLKJQQBFHXNUPY-UHFFFAOYSA-N 1 1 373.412 3.896 20 5 FHBDMO C[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C1c2ccccc2-c2ccccc21 ZINC000176435031 937166554 /nfs/dbraw/zinc/16/65/54/937166554.db2.gz RLKJQQBFHXNUPY-UHFFFAOYSA-N 1 1 373.412 3.896 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH+]1CCC(c2ccsc2)CC1 ZINC000186920585 927576891 /nfs/dbraw/zinc/57/68/91/927576891.db2.gz PUQFHVVPOMJAQP-UHFFFAOYSA-N 1 1 359.451 3.783 20 5 FHBDMO CC[N@H+]1CCC[C@H]1CN(Cc1csc([N+](=O)[O-])c1)Cc1ccncc1 ZINC000583170476 937205580 /nfs/dbraw/zinc/20/55/80/937205580.db2.gz ACZKCCMXDFKFJE-KRWDZBQOSA-N 1 1 360.483 3.538 20 5 FHBDMO C[C@H]1C[C@@H](CCNC(=O)c2ccc([N+](=O)[O-])cc2)C[N@H+]1Cc1ccccc1 ZINC000510084871 927945730 /nfs/dbraw/zinc/94/57/30/927945730.db2.gz GQYJLGVIELKJPQ-FUHWJXTLSA-N 1 1 367.449 3.625 20 5 FHBDMO C[C@]1(c2ccccc2)CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1 ZINC000510092932 928129908 /nfs/dbraw/zinc/12/99/08/928129908.db2.gz VPZBZMQFWCLNGT-NRFANRHFSA-N 1 1 367.449 3.638 20 5 FHBDMO Cc1ccc(NC(=O)[C@@H]2CCC[N@H+]([C@@H](C)c3ccccc3[N+](=O)[O-])C2)nc1 ZINC000471156278 928157506 /nfs/dbraw/zinc/15/75/06/928157506.db2.gz JUCISHOOFRCQDG-JKSUJKDBSA-N 1 1 368.437 3.710 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H]1CCCN(c2ccccc2)C1 ZINC000471169451 928445555 /nfs/dbraw/zinc/44/55/55/928445555.db2.gz OFWFZDIOLFBZCY-LJQANCHMSA-N 1 1 355.438 3.704 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H]1CCCN(c2ccccc2)C1 ZINC000430247451 928520815 /nfs/dbraw/zinc/52/08/15/928520815.db2.gz ZDULDKXNVVBOOK-IBGZPJMESA-N 1 1 355.438 3.704 20 5 FHBDMO C[C@H]([NH2+][C@H]1CCCN(c2ccccc2F)C1=O)c1ccccc1[N+](=O)[O-] ZINC000090069544 929036671 /nfs/dbraw/zinc/03/66/71/929036671.db2.gz FRAMGBJICLKHSI-BBRMVZONSA-N 1 1 357.385 3.580 20 5 FHBDMO C[N@@H+](CCC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)C1CCCCC1 ZINC000547738134 929146817 /nfs/dbraw/zinc/14/68/17/929146817.db2.gz CXRKMVCJOBUWQD-UHFFFAOYSA-N 1 1 359.470 3.740 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](C(=O)N(C)c2ccccc2)C1 ZINC000430301013 929545980 /nfs/dbraw/zinc/54/59/80/929545980.db2.gz PNOPZOWHSMIXRL-DLBZAZTESA-N 1 1 367.449 3.949 20 5 FHBDMO Cn1ccnc1[C@H]([NH2+][C@@H]1CCO[C@H](C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000560546565 929879921 /nfs/dbraw/zinc/87/99/21/929879921.db2.gz VWMNBTPUYDWKEO-BPQIPLTHSA-N 1 1 372.469 3.601 20 5 FHBDMO CCc1cc(NC[C@H]2CCC[N@@H+]2CC)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000064904664 930196967 /nfs/dbraw/zinc/19/69/67/930196967.db2.gz RUIIGSXRZURPMQ-QGZVFWFLSA-N 1 1 355.442 3.510 20 5 FHBDMO Cc1ccc2cc(C[N@H+]3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)ccc2n1 ZINC000187341507 930282764 /nfs/dbraw/zinc/28/27/64/930282764.db2.gz QZNGVMKMEFOIAC-QGZVFWFLSA-N 1 1 363.421 3.533 20 5 FHBDMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1CCCn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000610391302 930306548 /nfs/dbraw/zinc/30/65/48/930306548.db2.gz ROVFNMWXUOUCOX-IIAWOOMASA-N 1 1 359.426 3.546 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1CN[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379654501 930497821 /nfs/dbraw/zinc/49/78/21/930497821.db2.gz IRFPXDDDBBKQJM-LPHOPBHVSA-N 1 1 369.465 3.746 20 5 FHBDMO Cc1c(C(=O)N2CC[N@H+](Cc3ccccc3)CC[C@H]2C)cccc1[N+](=O)[O-] ZINC000610445999 930789560 /nfs/dbraw/zinc/78/95/60/930789560.db2.gz NJCPGUBJACJDCO-MRXNPFEDSA-N 1 1 367.449 3.640 20 5 FHBDMO Cc1sc(C(=O)N2CC[N@@H+](Cc3ccccc3)CC[C@H]2C)cc1[N+](=O)[O-] ZINC000610445911 930793493 /nfs/dbraw/zinc/79/34/93/930793493.db2.gz JUJFLAWIWSDCQA-CQSZACIVSA-N 1 1 373.478 3.701 20 5 FHBDMO Cc1sc(C(=O)N2CC[N@H+](Cc3ccccc3)CC[C@H]2C)cc1[N+](=O)[O-] ZINC000610445911 930793497 /nfs/dbraw/zinc/79/34/97/930793497.db2.gz JUJFLAWIWSDCQA-CQSZACIVSA-N 1 1 373.478 3.701 20 5 FHBDMO Cc1cc(C(=O)N2CC[N@H+](Cc3ccccc3)CC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000610446397 930816949 /nfs/dbraw/zinc/81/69/49/930816949.db2.gz WYKOXPAGNXCNGG-KRWDZBQOSA-N 1 1 367.449 3.640 20 5 FHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H](c2ccccc2F)C1 ZINC000580577040 930872687 /nfs/dbraw/zinc/87/26/87/930872687.db2.gz DXZPMVJAUGOLPG-KBPBESRZSA-N 1 1 357.385 3.550 20 5 FHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](c2ccccc2F)C1 ZINC000580577040 930872695 /nfs/dbraw/zinc/87/26/95/930872695.db2.gz DXZPMVJAUGOLPG-KBPBESRZSA-N 1 1 357.385 3.550 20 5 FHBDMO CC(=O)c1ccc([N+](=O)[O-])cc1N1CC[C@H](C)[N@H+](Cc2ccccc2)CC1 ZINC000580706799 931035081 /nfs/dbraw/zinc/03/50/81/931035081.db2.gz QOJDTBYMXUJWOZ-INIZCTEOSA-N 1 1 367.449 3.898 20 5 FHBDMO Cc1ccc([C@H](C)NC(=O)[C@H]2CC[N@H+](C3CCCCC3)C2)cc1[N+](=O)[O-] ZINC000177837344 931266369 /nfs/dbraw/zinc/26/63/69/931266369.db2.gz JTFKNMDEOHLRBD-RDJZCZTQSA-N 1 1 359.470 3.735 20 5 FHBDMO Cc1ccc([C@@H](C)NC(=O)[C@@H](C)[N@@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000177875716 931430977 /nfs/dbraw/zinc/43/09/77/931430977.db2.gz GKGJUHOISQKZEI-HZPDHXFCSA-N 1 1 367.449 3.527 20 5 FHBDMO Cc1ccc([C@@H](C)NC(=O)[C@@H](C)[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000177875716 931430982 /nfs/dbraw/zinc/43/09/82/931430982.db2.gz GKGJUHOISQKZEI-HZPDHXFCSA-N 1 1 367.449 3.527 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000581131983 931600500 /nfs/dbraw/zinc/60/05/00/931600500.db2.gz CZGXGPNYBLBZRB-VQIMIIECSA-N 1 1 367.449 3.544 20 5 FHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+]([C@@H]3CCCc4ccc(F)cc43)C2)nc1 ZINC000510383285 931811619 /nfs/dbraw/zinc/81/16/19/931811619.db2.gz ZYVBGQMUKDZMQA-MAUKXSAKSA-N 1 1 356.401 3.693 20 5 FHBDMO Cc1c(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000247340892 932009672 /nfs/dbraw/zinc/00/96/72/932009672.db2.gz ZWWFQPCVWABJCX-YJBOKZPZSA-N 1 1 367.449 3.686 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H]1c1cccc(F)c1 ZINC000610505443 932012839 /nfs/dbraw/zinc/01/28/39/932012839.db2.gz LPOYFHYXXNZMHJ-QGZVFWFLSA-N 1 1 373.384 3.518 20 5 FHBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2cc(=O)oc3ccc4ccccc4c23)C[C@@H]1C ZINC000276398096 932339378 /nfs/dbraw/zinc/33/93/78/932339378.db2.gz JZKZWJXQYJKLLN-WMLDXEAASA-N 1 1 365.429 3.577 20 5 FHBDMO C[C@@H]1CN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC[N@H+](C2CCC2)C1 ZINC000561533071 932429032 /nfs/dbraw/zinc/42/90/32/932429032.db2.gz CDXHYECYEZPGQO-ZDUSSCGKSA-N 1 1 373.478 3.756 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CC[C@@H](c4ccccc4)C3)n2)c1 ZINC000477291105 932453106 /nfs/dbraw/zinc/45/31/06/932453106.db2.gz QEZYPABNCYASDY-MRXNPFEDSA-N 1 1 350.378 3.634 20 5 FHBDMO C[C@H]1C[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000430659814 932683678 /nfs/dbraw/zinc/68/36/78/932683678.db2.gz CATYOHAGYVHAFG-KBXCAEBGSA-N 1 1 371.412 3.517 20 5 FHBDMO C[C@@H]1C[C@@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000430659815 932683860 /nfs/dbraw/zinc/68/38/60/932683860.db2.gz CATYOHAGYVHAFG-KDOFPFPSSA-N 1 1 371.412 3.517 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H]2Cc2ccc(F)cc2)c2c(c1)COCO2 ZINC000055908753 932735966 /nfs/dbraw/zinc/73/59/66/932735966.db2.gz NJDLNQOQUOLPLY-SFHVURJKSA-N 1 1 372.396 3.808 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000247372811 932800406 /nfs/dbraw/zinc/80/04/06/932800406.db2.gz KYEKPQLJRBBRKE-RDTXWAMCSA-N 1 1 373.478 3.778 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000430670345 932853564 /nfs/dbraw/zinc/85/35/64/932853564.db2.gz UJWGOGGQRDSHBE-WMZOPIPTSA-N 1 1 367.449 3.686 20 5 FHBDMO C[C@@H]1C[C@H](O)C[N@H+]1Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000471803360 932974328 /nfs/dbraw/zinc/97/43/28/932974328.db2.gz GUHWYHCHUYCQOV-OCCSQVGLSA-N 1 1 362.813 3.996 20 5 FHBDMO C[C@@H]1C[C@@H](O)C[N@H+]1Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000471809713 932992412 /nfs/dbraw/zinc/99/24/12/932992412.db2.gz MKRIFOFYFKHGOI-IUODEOHRSA-N 1 1 362.813 3.996 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCSC2(CCCCC2)C1 ZINC000430772682 933225133 /nfs/dbraw/zinc/22/51/33/933225133.db2.gz CWEQPEBXJAIVBE-UHFFFAOYSA-N 1 1 363.483 3.593 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCSC2(CCCCC2)C1 ZINC000430772682 933225144 /nfs/dbraw/zinc/22/51/44/933225144.db2.gz CWEQPEBXJAIVBE-UHFFFAOYSA-N 1 1 363.483 3.593 20 5 FHBDMO Cn1nccc1[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000510628309 933321398 /nfs/dbraw/zinc/32/13/98/933321398.db2.gz HJLLOXJGHPZPCN-OAHLLOKOSA-N 1 1 366.421 3.968 20 5 FHBDMO C[C@@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)[N@@H+]1CCC[C@H](C)C1 ZINC000610655869 933659023 /nfs/dbraw/zinc/65/90/23/933659023.db2.gz VWUAOZQHJJUGGR-STQMWFEESA-N 1 1 374.466 3.777 20 5 FHBDMO C[C@@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)[N@H+]1CCC[C@H](C)C1 ZINC000610655869 933659027 /nfs/dbraw/zinc/65/90/27/933659027.db2.gz VWUAOZQHJJUGGR-STQMWFEESA-N 1 1 374.466 3.777 20 5 FHBDMO O=[N+]([O-])c1ccc(N2CCC[N@@H+](Cc3ccccc3)CC2)c2ncccc12 ZINC000024060014 934461643 /nfs/dbraw/zinc/46/16/43/934461643.db2.gz MYNOIKZZZZQDDE-UHFFFAOYSA-N 1 1 362.433 3.855 20 5 FHBDMO COC(=O)[C@H](C)[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccccc1 ZINC000176225420 934647332 /nfs/dbraw/zinc/64/73/32/934647332.db2.gz MBMNHNKDVJRYEF-PXAZEXFGSA-N 1 1 362.813 3.888 20 5 FHBDMO O=[N+]([O-])c1ccccc1C[N@H+](CCOc1ccccc1[N+](=O)[O-])C1CC1 ZINC000749528901 934770906 /nfs/dbraw/zinc/77/09/06/934770906.db2.gz NYJASQULCJRPOS-UHFFFAOYSA-N 1 1 357.366 3.546 20 5 FHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CCOc1ccccc1[N+](=O)[O-])C1CC1 ZINC000749528901 934770910 /nfs/dbraw/zinc/77/09/10/934770910.db2.gz NYJASQULCJRPOS-UHFFFAOYSA-N 1 1 357.366 3.546 20 5 FHBDMO O=C(c1ccc(O)cc1)C1CC[NH+](CC=Cc2ccccc2[N+](=O)[O-])CC1 ZINC000611253561 934809023 /nfs/dbraw/zinc/80/90/23/934809023.db2.gz QCFGCFCHPAUNOV-HYXAFXHYSA-N 1 1 366.417 3.909 20 5 FHBDMO CCn1nc(C)c([N+](=O)[O-])c1NC[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000380543576 934826697 /nfs/dbraw/zinc/82/66/97/934826697.db2.gz NPVRETBFBROJOQ-SFHVURJKSA-N 1 1 371.485 3.834 20 5 FHBDMO Cn1ccnc1[C@H]([NH2+]CC(C)(C)[C@@H]1CCCCO1)c1ccc([N+](=O)[O-])cc1 ZINC000611560794 934849595 /nfs/dbraw/zinc/84/95/95/934849595.db2.gz XMNJMNCOYKUTFO-ZWKOTPCHSA-N 1 1 372.469 3.603 20 5 FHBDMO CCO[C@H]1C[C@@H]([N@@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1(C)C ZINC000538716964 934897178 /nfs/dbraw/zinc/89/71/78/934897178.db2.gz SDDFNXZNGWDGAP-MSOLQXFVSA-N 1 1 372.469 3.631 20 5 FHBDMO O=[N+]([O-])c1ccc(OC2CC[NH+](Cc3n[nH]c4ccccc43)CC2)cc1 ZINC000611273892 934923610 /nfs/dbraw/zinc/92/36/10/934923610.db2.gz IXXHUHHNDPUKKX-UHFFFAOYSA-N 1 1 352.394 3.515 20 5 FHBDMO Cc1c(CN2C[C@H]3CC[N@@H+](Cc4ccccc4)C[C@@H]3C2)cccc1[N+](=O)[O-] ZINC000380853493 934939100 /nfs/dbraw/zinc/93/91/00/934939100.db2.gz CXMVGKZTZZCPDC-NHCUHLMSSA-N 1 1 365.477 3.857 20 5 FHBDMO Cc1c(CN2C[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@H]3C2)cccc1[N+](=O)[O-] ZINC000380853495 934939289 /nfs/dbraw/zinc/93/92/89/934939289.db2.gz CXMVGKZTZZCPDC-SFTDATJTSA-N 1 1 365.477 3.857 20 5 FHBDMO Cc1sc(C(=O)N[C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)cc1[N+](=O)[O-] ZINC000176304589 935029139 /nfs/dbraw/zinc/02/91/39/935029139.db2.gz OHPWTLWQCHKGAF-NSHDSACASA-N 1 1 370.434 3.950 20 5 FHBDMO CC(=O)c1cc(N2CCC[N@H+](Cc3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000383089974 945074479 /nfs/dbraw/zinc/07/44/79/945074479.db2.gz QTNQCEBWRVTNRN-INIZCTEOSA-N 1 1 367.449 3.898 20 5 FHBDMO CC[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccc(OC)c(OC)c1 ZINC000051377126 935135482 /nfs/dbraw/zinc/13/54/82/935135482.db2.gz YCSBYJYUFCDABG-UHFFFAOYSA-N 1 1 360.410 3.513 20 5 FHBDMO COc1ccc(-c2nc(C[N@H+](C)CCc3ccccc3[N+](=O)[O-])co2)cc1 ZINC000511059830 935173459 /nfs/dbraw/zinc/17/34/59/935173459.db2.gz OSTNQNGFONGASK-UHFFFAOYSA-N 1 1 367.405 3.933 20 5 FHBDMO COc1ccc(-c2nc(C[N@@H+](C)CCc3ccccc3[N+](=O)[O-])co2)cc1 ZINC000511059830 935173464 /nfs/dbraw/zinc/17/34/64/935173464.db2.gz OSTNQNGFONGASK-UHFFFAOYSA-N 1 1 367.405 3.933 20 5 FHBDMO C[C@@H]([NH2+][C@H](CO)c1ccc(Br)cc1)c1ccccc1[N+](=O)[O-] ZINC000611337576 935200124 /nfs/dbraw/zinc/20/01/24/935200124.db2.gz LUDFVEOTAHEROK-IAQYHMDHSA-N 1 1 365.227 3.742 20 5 FHBDMO Cc1ccc(NC(=O)[C@@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)cc1[N+](=O)[O-] ZINC000072035424 935229065 /nfs/dbraw/zinc/22/90/65/935229065.db2.gz OINVLCLGDJKHMH-MRXNPFEDSA-N 1 1 371.412 3.893 20 5 FHBDMO C[N@@H+](CCC(=O)Nc1ccccc1Cl)CCc1ccccc1[N+](=O)[O-] ZINC000511074154 935274986 /nfs/dbraw/zinc/27/49/86/935274986.db2.gz TUYOWXDSUGXKFB-UHFFFAOYSA-N 1 1 361.829 3.751 20 5 FHBDMO CC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000478051621 935393857 /nfs/dbraw/zinc/39/38/57/935393857.db2.gz CIIKNOXXMAKCGK-GFCCVEGCSA-N 1 1 356.348 3.893 20 5 FHBDMO Cc1ccc(NC(=O)C[N@H+](C)CCc2ccccc2[N+](=O)[O-])c(Cl)c1 ZINC000511096134 935473977 /nfs/dbraw/zinc/47/39/77/935473977.db2.gz YUOBBDRMSWINNR-UHFFFAOYSA-N 1 1 361.829 3.670 20 5 FHBDMO Cc1ccc(NC(=O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c(Cl)c1 ZINC000511096134 935473982 /nfs/dbraw/zinc/47/39/82/935473982.db2.gz YUOBBDRMSWINNR-UHFFFAOYSA-N 1 1 361.829 3.670 20 5 FHBDMO COc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc3c2C[N@@H+](CC(C)C)C3)c1 ZINC000158275719 935485156 /nfs/dbraw/zinc/48/51/56/935485156.db2.gz YDYWHKJAAMEIMW-UHFFFAOYSA-N 1 1 369.421 3.827 20 5 FHBDMO CC(C)C[N@H+]1Cc2cccc(NC(=O)CNc3ccccc3[N+](=O)[O-])c2C1 ZINC000158262467 935665410 /nfs/dbraw/zinc/66/54/10/935665410.db2.gz RQYZPQWRWOUPKK-UHFFFAOYSA-N 1 1 368.437 3.617 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc2c1C[N@@H+](CC(C)C)C2 ZINC000158284006 935683005 /nfs/dbraw/zinc/68/30/05/935683005.db2.gz GEKKPIAHXNFNCT-UHFFFAOYSA-N 1 1 369.421 3.827 20 5 FHBDMO Cc1cc(C(=O)C[N@H+](C)CCc2ccccc2[N+](=O)[O-])c(C)n1C1CC1 ZINC000511140793 935776839 /nfs/dbraw/zinc/77/68/39/935776839.db2.gz KDARGLIOKBSSAN-UHFFFAOYSA-N 1 1 355.438 3.705 20 5 FHBDMO Cc1cc(C(=O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c(C)n1C1CC1 ZINC000511140793 935776841 /nfs/dbraw/zinc/77/68/41/935776841.db2.gz KDARGLIOKBSSAN-UHFFFAOYSA-N 1 1 355.438 3.705 20 5 FHBDMO Cc1ccc(C)c(NC(=O)[C@H](C)[N@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511146014 935786126 /nfs/dbraw/zinc/78/61/26/935786126.db2.gz XPLBKCWZVCFFIS-INIZCTEOSA-N 1 1 355.438 3.713 20 5 FHBDMO Cc1ccc(C)c(NC(=O)[C@H](C)[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511146014 935786129 /nfs/dbraw/zinc/78/61/29/935786129.db2.gz XPLBKCWZVCFFIS-INIZCTEOSA-N 1 1 355.438 3.713 20 5 FHBDMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000277733907 935865935 /nfs/dbraw/zinc/86/59/35/935865935.db2.gz OKRNNNOABYUILK-HNNXBMFYSA-N 1 1 363.461 3.507 20 5 FHBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 ZINC000176350260 935919785 /nfs/dbraw/zinc/91/97/85/935919785.db2.gz GVWGOUNRCPPTIP-ZDUSSCGKSA-N 1 1 361.467 3.517 20 5 FHBDMO CCn1c(C)nc([N+](=O)[O-])c1NCC[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000582747009 936071894 /nfs/dbraw/zinc/07/18/94/936071894.db2.gz ZQTXPXJYHILSSX-YJBOKZPZSA-N 1 1 371.485 3.832 20 5 FHBDMO C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1cc2ccccc2o1 ZINC000472286830 938260807 /nfs/dbraw/zinc/26/08/07/938260807.db2.gz NZUMNKLZDIHFCD-UHFFFAOYSA-N 1 1 353.378 3.802 20 5 FHBDMO Cc1cc(F)cc(C(=O)NCC(C)(C)[N@H+]2C[C@H](C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000176785072 938302838 /nfs/dbraw/zinc/30/28/38/938302838.db2.gz DKSGUFZGCJVXMV-BETUJISGSA-N 1 1 365.449 3.529 20 5 FHBDMO CCCC[N@@H+](C)C[C@H](C)NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000583775547 938401260 /nfs/dbraw/zinc/40/12/60/938401260.db2.gz SAPGWRIKHCAQCC-AWEZNQCLSA-N 1 1 362.499 3.928 20 5 FHBDMO CC[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@@H](C)c1cccc(OC)c1 ZINC000052706031 938504332 /nfs/dbraw/zinc/50/43/32/938504332.db2.gz MKJKKBOCEZINNG-HNNXBMFYSA-N 1 1 371.437 3.649 20 5 FHBDMO CC[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@@H](C)c1cccc(OC)c1 ZINC000052706031 938504333 /nfs/dbraw/zinc/50/43/33/938504333.db2.gz MKJKKBOCEZINNG-HNNXBMFYSA-N 1 1 371.437 3.649 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)[C@H](C)c1ccc(C)cc1 ZINC000052907684 938654912 /nfs/dbraw/zinc/65/49/12/938654912.db2.gz YLUYITNUYBCEPZ-OAHLLOKOSA-N 1 1 371.437 3.933 20 5 FHBDMO C[N@H+]1CCC[C@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000108428817 945196226 /nfs/dbraw/zinc/19/62/26/945196226.db2.gz HVHDAZPAAQOLRW-CYBMUJFWSA-N 1 1 363.845 3.940 20 5 FHBDMO CN1CCC[C@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000108428817 945196247 /nfs/dbraw/zinc/19/62/47/945196247.db2.gz HVHDAZPAAQOLRW-CYBMUJFWSA-N 1 1 363.845 3.940 20 5 FHBDMO CC(C)[N@H+]1CCC[C@H](NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)C1 ZINC000278712982 938678613 /nfs/dbraw/zinc/67/86/13/938678613.db2.gz QXZPEBLBGGTLSS-HNNXBMFYSA-N 1 1 363.461 3.696 20 5 FHBDMO Cc1ccc([C@H](C)[N@@H+](C)C[C@@H](O)COc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000544069376 938991653 /nfs/dbraw/zinc/99/16/53/938991653.db2.gz NXIDUXNVQMOSMT-DLBZAZTESA-N 1 1 358.438 3.644 20 5 FHBDMO Cc1ccc([C@H](C)[N@@H+](C)C[C@H](O)COc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000544069378 938991659 /nfs/dbraw/zinc/99/16/59/938991659.db2.gz NXIDUXNVQMOSMT-IRXDYDNUSA-N 1 1 358.438 3.644 20 5 FHBDMO C[C@@H]1[C@H](Cc2ccccc2)CC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000472336990 938995406 /nfs/dbraw/zinc/99/54/06/938995406.db2.gz GPBZOEUJODAIBE-AEFFLSMTSA-N 1 1 367.449 3.511 20 5 FHBDMO C[C@@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H]1c1cccc(F)c1 ZINC000472351500 939014441 /nfs/dbraw/zinc/01/44/41/939014441.db2.gz SQDWFAGQFRISGH-DJKXOVBDSA-N 1 1 374.412 3.557 20 5 FHBDMO Cc1nc(CC[NH2+][C@@H](C)c2ccc(-c3ccccc3[N+](=O)[O-])s2)n[nH]1 ZINC000507442864 945238742 /nfs/dbraw/zinc/23/87/42/945238742.db2.gz PBGKPHKEPBBHGT-NSHDSACASA-N 1 1 357.439 3.643 20 5 FHBDMO Cc1nnc(CC[NH2+][C@@H](C)c2ccc(-c3ccccc3[N+](=O)[O-])s2)[nH]1 ZINC000507442864 945238748 /nfs/dbraw/zinc/23/87/48/945238748.db2.gz PBGKPHKEPBBHGT-NSHDSACASA-N 1 1 357.439 3.643 20 5 FHBDMO CC(=O)c1cc(N2CC[C@H](C)[N@H+](Cc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000383102673 945245466 /nfs/dbraw/zinc/24/54/66/945245466.db2.gz CARDLVGZNILVID-INIZCTEOSA-N 1 1 367.449 3.898 20 5 FHBDMO COc1ccc(-c2ccc(CN[C@@H](C)C[NH+]3CCCCC3)o2)c([N+](=O)[O-])c1 ZINC000518268721 945274121 /nfs/dbraw/zinc/27/41/21/945274121.db2.gz SHPXZGSXQLMZJV-HNNXBMFYSA-N 1 1 373.453 3.827 20 5 FHBDMO CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)C1 ZINC000179551832 939884236 /nfs/dbraw/zinc/88/42/36/939884236.db2.gz FGYRKUVHYYDHLV-MRXNPFEDSA-N 1 1 370.453 3.756 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCC2(CCCC2)C1 ZINC000615000538 939984672 /nfs/dbraw/zinc/98/46/72/939984672.db2.gz RIFFJWRYWFCNKY-UHFFFAOYSA-N 1 1 361.442 3.588 20 5 FHBDMO CC[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H]1CCCc2cccnc21 ZINC000364999313 940041652 /nfs/dbraw/zinc/04/16/52/940041652.db2.gz HILMITSEZXTWFP-SFHVURJKSA-N 1 1 369.421 3.756 20 5 FHBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H]1CCCc2cccnc21 ZINC000364999313 940041655 /nfs/dbraw/zinc/04/16/55/940041655.db2.gz HILMITSEZXTWFP-SFHVURJKSA-N 1 1 369.421 3.756 20 5 FHBDMO Cc1ccccc1C[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccccc1 ZINC000472441159 940142629 /nfs/dbraw/zinc/14/26/29/940142629.db2.gz URGODRNGHPDBIX-UHFFFAOYSA-N 1 1 350.422 3.802 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCSC4(CCC4)CC3)o2)cc1 ZINC000411869353 940148329 /nfs/dbraw/zinc/14/83/29/940148329.db2.gz MPARMZFYOWSWBH-UHFFFAOYSA-N 1 1 360.439 3.506 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCSC4(CCC4)CC3)n2)c1 ZINC000411870523 940148359 /nfs/dbraw/zinc/14/83/59/940148359.db2.gz PAIQDCDLFAWEBD-UHFFFAOYSA-N 1 1 360.439 3.506 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3C[C@H](O)C[C@H]3c3ccccc3)co2)cc1 ZINC000411919073 940156670 /nfs/dbraw/zinc/15/66/70/940156670.db2.gz DSBBPKQLTBTBGY-MOPGFXCFSA-N 1 1 365.389 3.558 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3C[C@H](O)C[C@H]3c3ccccc3)co2)cc1 ZINC000411919073 940156672 /nfs/dbraw/zinc/15/66/72/940156672.db2.gz DSBBPKQLTBTBGY-MOPGFXCFSA-N 1 1 365.389 3.558 20 5 FHBDMO NC(=O)c1cccc(C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)c1 ZINC000180039009 940305924 /nfs/dbraw/zinc/30/59/24/940305924.db2.gz YZNBNLCNDRGPJQ-FQEVSTJZSA-N 1 1 361.401 3.573 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2noc(C[NH2+][C@@H]3CCCC[C@@H]3C(F)(F)F)n2)c1 ZINC000580832250 940486674 /nfs/dbraw/zinc/48/66/74/940486674.db2.gz UDOWKXSEWBOQKM-QWHCGFSZSA-N 1 1 370.331 3.856 20 5 FHBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000580798507 940487671 /nfs/dbraw/zinc/48/76/71/940487671.db2.gz CFXXNSFALJBRJN-MRXNPFEDSA-N 1 1 369.465 3.509 20 5 FHBDMO COc1ccc2c(c1)C1(CC1)C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)C2 ZINC000581040817 940493819 /nfs/dbraw/zinc/49/38/19/940493819.db2.gz SKLUOMAJHQZLDF-UHFFFAOYSA-N 1 1 354.406 3.530 20 5 FHBDMO C[NH+]1CCC2(CCCN(Cc3coc(-c4ccc([N+](=O)[O-])cc4)n3)C2)CC1 ZINC000376386644 940892134 /nfs/dbraw/zinc/89/21/34/940892134.db2.gz ORYGGVVKTPOLBG-UHFFFAOYSA-N 1 1 370.453 3.558 20 5 FHBDMO CCCNC(=O)c1cccc(C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000892602865 940916985 /nfs/dbraw/zinc/91/69/85/940916985.db2.gz GNSLFAWEPRBFSJ-UHFFFAOYSA-N 1 1 361.829 3.678 20 5 FHBDMO CC[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 ZINC000186338910 940987064 /nfs/dbraw/zinc/98/70/64/940987064.db2.gz ZEXIYHAMNGSFJQ-UHFFFAOYSA-N 1 1 365.499 3.559 20 5 FHBDMO O=[N+]([O-])c1cnc(NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c(Cl)c1 ZINC000310926897 941008800 /nfs/dbraw/zinc/00/88/00/941008800.db2.gz SGRZLXNSQHMCPS-OAHLLOKOSA-N 1 1 360.845 3.967 20 5 FHBDMO CCc1ccc(C(=O)N[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1[N+](=O)[O-] ZINC000181480931 941330805 /nfs/dbraw/zinc/33/08/05/941330805.db2.gz GWUZLWIVVRXCMB-WMLDXEAASA-N 1 1 359.470 3.540 20 5 FHBDMO CCSc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@@H+](C)C1CCCCC1 ZINC000136137359 941494910 /nfs/dbraw/zinc/49/49/10/941494910.db2.gz BAQZTHTYVVLJIM-UHFFFAOYSA-N 1 1 365.499 3.701 20 5 FHBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2cc(Br)cc3c2OCC3)cs1 ZINC000122331392 941528506 /nfs/dbraw/zinc/52/85/06/941528506.db2.gz IEWSCBKSAPUDAT-UHFFFAOYSA-N 1 1 369.240 3.644 20 5 FHBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN2CCCC[C@H]2[C@@H]2CC[NH2+]C2)o1 ZINC000415060576 941579007 /nfs/dbraw/zinc/57/90/07/941579007.db2.gz YSJWFXXJSRQBEC-QAPCUYQASA-N 1 1 355.438 3.819 20 5 FHBDMO CC(C)(C)OC(=O)CC[C@H]1CCC[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000412069195 941621423 /nfs/dbraw/zinc/62/14/23/941621423.db2.gz NGXJZYKQRQFAJR-CYBMUJFWSA-N 1 1 354.472 3.990 20 5 FHBDMO CC(C)(C)OC(=O)CC[C@H]1CCC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000412069195 941621424 /nfs/dbraw/zinc/62/14/24/941621424.db2.gz NGXJZYKQRQFAJR-CYBMUJFWSA-N 1 1 354.472 3.990 20 5 FHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(n3cc(Cl)cn3)CC2)c(Cl)c1 ZINC000541122974 941640994 /nfs/dbraw/zinc/64/09/94/941640994.db2.gz KORVKXGFNYNABG-UHFFFAOYSA-N 1 1 355.225 3.935 20 5 FHBDMO COc1ccc([C@H](C)[N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000072559302 941786219 /nfs/dbraw/zinc/78/62/19/941786219.db2.gz KLDTWGSKAMLWFL-AWEZNQCLSA-N 1 1 357.410 3.543 20 5 FHBDMO COc1ccc([C@H](C)[N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000072559302 941786223 /nfs/dbraw/zinc/78/62/23/941786223.db2.gz KLDTWGSKAMLWFL-AWEZNQCLSA-N 1 1 357.410 3.543 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@@H](C)C[C@H]1c1ccccc1 ZINC000513233529 941790449 /nfs/dbraw/zinc/79/04/49/941790449.db2.gz YPHSHKNPZDKDCX-KSSFIOAISA-N 1 1 353.422 3.925 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@@H](C)C[C@H]1c1ccccc1 ZINC000513233529 941790452 /nfs/dbraw/zinc/79/04/52/941790452.db2.gz YPHSHKNPZDKDCX-KSSFIOAISA-N 1 1 353.422 3.925 20 5 FHBDMO CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@@H+](C)[C@@H](C)C1 ZINC000513237852 941810043 /nfs/dbraw/zinc/81/00/43/941810043.db2.gz GHJDGQNEJWARJN-OKILXGFUSA-N 1 1 365.499 3.652 20 5 FHBDMO CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@H+](C)[C@@H](C)C1 ZINC000513237852 941810045 /nfs/dbraw/zinc/81/00/45/941810045.db2.gz GHJDGQNEJWARJN-OKILXGFUSA-N 1 1 365.499 3.652 20 5 FHBDMO COC(=O)[C@@H](C)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000182348158 941813621 /nfs/dbraw/zinc/81/36/21/941813621.db2.gz WTRCOSTVWJYSQT-YVEFUNNKSA-N 1 1 362.813 3.888 20 5 FHBDMO Cn1cc[nH+]c1[C@H]1CCN(c2c3cccc(Cl)c3ncc2[N+](=O)[O-])C1 ZINC000892986007 941841867 /nfs/dbraw/zinc/84/18/67/941841867.db2.gz SPNLOEIYCURRGX-NSHDSACASA-N 1 1 357.801 3.524 20 5 FHBDMO CC(C)[N@@H+](C)CCNCc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000517550552 941952703 /nfs/dbraw/zinc/95/27/03/941952703.db2.gz BWZLUXILDJFIEL-UHFFFAOYSA-N 1 1 356.470 3.793 20 5 FHBDMO CC(C)N(C)CC[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000517550552 941952707 /nfs/dbraw/zinc/95/27/07/941952707.db2.gz BWZLUXILDJFIEL-UHFFFAOYSA-N 1 1 356.470 3.793 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCN([C@@H](C)c2cccnc2)CC1 ZINC000182807545 941970276 /nfs/dbraw/zinc/97/02/76/941970276.db2.gz YOJBYJLPGUSXRF-DLBZAZTESA-N 1 1 354.454 3.738 20 5 FHBDMO Cc1c(NC(=O)NC[C@H]2CC[N@H+](C)[C@H]2c2cccs2)cccc1[N+](=O)[O-] ZINC000377772852 941980640 /nfs/dbraw/zinc/98/06/40/941980640.db2.gz QNLGXDZECLWOHJ-CXAGYDPISA-N 1 1 374.466 3.779 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182931308 942009735 /nfs/dbraw/zinc/00/97/35/942009735.db2.gz WDROLWPSPLLOIP-GJZGRUSLSA-N 1 1 360.458 3.678 20 5 FHBDMO CCS(=O)(=O)c1ccc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000280014725 942086287 /nfs/dbraw/zinc/08/62/87/942086287.db2.gz GXQQHIJKLCLJIG-GFCCVEGCSA-N 1 1 368.480 3.609 20 5 FHBDMO CC[C@@H](NCc1ccncc1OCCC[NH+](C)C)c1cccc([N+](=O)[O-])c1 ZINC000290408321 942098630 /nfs/dbraw/zinc/09/86/30/942098630.db2.gz UAGRVFBEYTXQCJ-LJQANCHMSA-N 1 1 372.469 3.561 20 5 FHBDMO CC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)Cc1ccsc1 ZINC000501971020 942145478 /nfs/dbraw/zinc/14/54/78/942145478.db2.gz BJAGKTILQDHLKR-AWEZNQCLSA-N 1 1 361.467 3.938 20 5 FHBDMO Cc1c(C[NH2+][C@H](C)c2ccc(Br)cn2)cccc1[N+](=O)[O-] ZINC000280272525 942147919 /nfs/dbraw/zinc/14/79/19/942147919.db2.gz XZFVDYBIVGRARD-LLVKDONJSA-N 1 1 350.216 3.912 20 5 FHBDMO COc1ccc(C[N@@H+](C)CCC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1C ZINC000103145453 942223792 /nfs/dbraw/zinc/22/37/92/942223792.db2.gz ROCRSASTTFQSKB-UHFFFAOYSA-N 1 1 371.437 3.681 20 5 FHBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@H](CC(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000420954707 942274236 /nfs/dbraw/zinc/27/42/36/942274236.db2.gz VAWFFWXMWIXFBK-QWHCGFSZSA-N 1 1 373.375 3.895 20 5 FHBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@H](CC(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000420954707 942274239 /nfs/dbraw/zinc/27/42/39/942274239.db2.gz VAWFFWXMWIXFBK-QWHCGFSZSA-N 1 1 373.375 3.895 20 5 FHBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000420954705 942274528 /nfs/dbraw/zinc/27/45/28/942274528.db2.gz VAWFFWXMWIXFBK-OLZOCXBDSA-N 1 1 373.375 3.895 20 5 FHBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@@H](CC(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000420954705 942274535 /nfs/dbraw/zinc/27/45/35/942274535.db2.gz VAWFFWXMWIXFBK-OLZOCXBDSA-N 1 1 373.375 3.895 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)C1CC(OC(C)(C)C)C1 ZINC000421020590 942308237 /nfs/dbraw/zinc/30/82/37/942308237.db2.gz ZPWZTIQXJQKHQS-UHFFFAOYSA-N 1 1 363.458 3.510 20 5 FHBDMO COc1ccccc1[C@@H]1CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000501117099 942317229 /nfs/dbraw/zinc/31/72/29/942317229.db2.gz MTONYWAJAHRAAC-KRWDZBQOSA-N 1 1 369.421 3.769 20 5 FHBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@@H](O)CC34CCC4)o2)c([N+](=O)[O-])c1 ZINC000421370532 942522142 /nfs/dbraw/zinc/52/21/42/942522142.db2.gz JRAFISIWYXOTAN-CQSZACIVSA-N 1 1 372.421 3.743 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CCCC[C@@H]3Cn3cccn3)co2)cc1 ZINC000378307063 942563436 /nfs/dbraw/zinc/56/34/36/942563436.db2.gz BOFBGRYBMWAGMD-GOSISDBHSA-N 1 1 367.409 3.501 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCCC[C@@H]3Cn3cccn3)co2)cc1 ZINC000378307063 942563442 /nfs/dbraw/zinc/56/34/42/942563442.db2.gz BOFBGRYBMWAGMD-GOSISDBHSA-N 1 1 367.409 3.501 20 5 FHBDMO O=[N+]([O-])c1ccc2ccnc(N3C[C@@H]4C[N@H+](Cc5ccccc5)C[C@@H]4C3)c2c1 ZINC000413277403 942586574 /nfs/dbraw/zinc/58/65/74/942586574.db2.gz ZPBDDOHYDBPIJW-KDURUIRLSA-N 1 1 374.444 3.711 20 5 FHBDMO Cc1cc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c2ccccc2n1 ZINC000072664930 942630660 /nfs/dbraw/zinc/63/06/60/942630660.db2.gz XGKDZWOHTYSFSL-INIZCTEOSA-N 1 1 363.421 3.533 20 5 FHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)C1CCN(Cc2ccncc2)CC1 ZINC000367116327 942863241 /nfs/dbraw/zinc/86/32/41/942863241.db2.gz AWVLGFFWBVAQRI-MRXNPFEDSA-N 1 1 354.454 3.647 20 5 FHBDMO Cc1cccc([C@H]2CCC[N@@H+]2CC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1 ZINC000434707983 942873919 /nfs/dbraw/zinc/87/39/19/942873919.db2.gz BCDJDAVLLALDCF-LJQANCHMSA-N 1 1 353.422 3.987 20 5 FHBDMO Cc1cccc([C@H]2CCC[N@H+]2CC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1 ZINC000434707983 942873920 /nfs/dbraw/zinc/87/39/20/942873920.db2.gz BCDJDAVLLALDCF-LJQANCHMSA-N 1 1 353.422 3.987 20 5 FHBDMO O=[N+]([O-])c1ccc2[nH]c(NC[C@@H]3CCC[N@@H+](Cc4ccccc4)C3)nc2c1 ZINC000312233388 942897458 /nfs/dbraw/zinc/89/74/58/942897458.db2.gz AWBUBIVXIJWJBN-INIZCTEOSA-N 1 1 365.437 3.795 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H](c2ccccc2)[C@@H]1C ZINC000434891419 943022326 /nfs/dbraw/zinc/02/23/26/943022326.db2.gz HRZYOCSGFYNSJP-MAUKXSAKSA-N 1 1 353.422 3.720 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@H](c2ccccc2)[C@@H]1C ZINC000434901217 943037739 /nfs/dbraw/zinc/03/77/39/943037739.db2.gz TUVNFSYFENRJME-DOTOQJQBSA-N 1 1 353.422 3.720 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@H](c2ccccc2)[C@@H]1C ZINC000434901217 943037748 /nfs/dbraw/zinc/03/77/48/943037748.db2.gz TUVNFSYFENRJME-DOTOQJQBSA-N 1 1 353.422 3.720 20 5 FHBDMO CC(C)c1ccc(C(=O)N2CCC(Cc3[nH+]ccn3C)CC2)cc1[N+](=O)[O-] ZINC000190231985 943059388 /nfs/dbraw/zinc/05/93/88/943059388.db2.gz ZOPBIZOHSPSXBJ-UHFFFAOYSA-N 1 1 370.453 3.547 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000416728344 943059662 /nfs/dbraw/zinc/05/96/62/943059662.db2.gz LPSUNSJLGPWQFG-INIZCTEOSA-N 1 1 368.437 3.641 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000416728344 943059669 /nfs/dbraw/zinc/05/96/69/943059669.db2.gz LPSUNSJLGPWQFG-INIZCTEOSA-N 1 1 368.437 3.641 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(N2CCc3ccccc32)CC1 ZINC000503382946 943158362 /nfs/dbraw/zinc/15/83/62/943158362.db2.gz KRNYNJSJKFZHPA-UHFFFAOYSA-N 1 1 367.449 3.631 20 5 FHBDMO Cc1ccccc1C[N@H+]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000047970960 943230141 /nfs/dbraw/zinc/23/01/41/943230141.db2.gz XVGWRABLNARCIW-UHFFFAOYSA-N 1 1 368.437 3.643 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@@H](n4ccnn4)C3)s2)cc1 ZINC000425349007 943351896 /nfs/dbraw/zinc/35/18/96/943351896.db2.gz KAWXFSDBCAMHSY-MRXNPFEDSA-N 1 1 369.450 3.752 20 5 FHBDMO C[C@H]([NH2+][C@H](Cn1ccccc1=O)c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000503926906 943412117 /nfs/dbraw/zinc/41/21/17/943412117.db2.gz IAHQFCOQDAWMSL-QFBILLFUSA-N 1 1 363.417 3.849 20 5 FHBDMO COc1cccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C[C@H]2CCCO2)c1 ZINC000053232653 943417419 /nfs/dbraw/zinc/41/74/19/943417419.db2.gz ZOGJZUDEWYEEHJ-HXUWFJFHSA-N 1 1 356.422 3.785 20 5 FHBDMO CCOc1ccc([C@@H](C)[NH2+]C[C@H]2NCCc3ccccc32)cc1[N+](=O)[O-] ZINC000423446945 943513694 /nfs/dbraw/zinc/51/36/94/943513694.db2.gz ZMFAAWHZXQBFDB-RDTXWAMCSA-N 1 1 355.438 3.531 20 5 FHBDMO CS(=O)(=O)c1ccccc1C[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417385916 943563015 /nfs/dbraw/zinc/56/30/15/943563015.db2.gz YDXPLKYSTLTMNQ-GOSISDBHSA-N 1 1 374.462 3.556 20 5 FHBDMO C[N@H+]1CCC[C@@H]2CN(Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)CC[C@@H]21 ZINC000549470554 943579842 /nfs/dbraw/zinc/57/98/42/943579842.db2.gz AAIQPXGRUGGXCN-WBMJQRKESA-N 1 1 357.376 3.530 20 5 FHBDMO O=C(NC[C@@H]1CCC[N@H+]1C1CCCCC1)Nc1ccc([N+](=O)[O-])cc1F ZINC000435773633 943602716 /nfs/dbraw/zinc/60/27/16/943602716.db2.gz WOYDRQAQIQPNBR-HNNXBMFYSA-N 1 1 364.421 3.653 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N(C)CCC[N@@H+](C)Cc1ccco1 ZINC000566518864 943931189 /nfs/dbraw/zinc/93/11/89/943931189.db2.gz CJPHKKWKQSKRIA-UHFFFAOYSA-N 1 1 373.453 3.707 20 5 FHBDMO COc1cc(C[N@@H+](C[C@H](C)c2ccccc2)[C@@H](C)CO)ccc1[N+](=O)[O-] ZINC000566520328 943934649 /nfs/dbraw/zinc/93/46/49/943934649.db2.gz PHAVNILQCHXOJZ-HOTGVXAUSA-N 1 1 358.438 3.590 20 5 FHBDMO O=C(CC[N@H+]1CCSC[C@H]1c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000500115842 944121222 /nfs/dbraw/zinc/12/12/22/944121222.db2.gz MNNHBRDUEMABEX-SFHVURJKSA-N 1 1 371.462 3.714 20 5 FHBDMO Cc1ccccc1C[C@H]1CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500143128 944164018 /nfs/dbraw/zinc/16/40/18/944164018.db2.gz XPJGFLCQVAKCAK-GOSISDBHSA-N 1 1 367.449 3.939 20 5 FHBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(CCOc2ccccc2[N+](=O)[O-])C1 ZINC000506474083 944300678 /nfs/dbraw/zinc/30/06/78/944300678.db2.gz LAXOAUKUYWJTCY-ZWKOTPCHSA-N 1 1 361.486 3.560 20 5 FHBDMO COc1cc(C[N@H+]2CC3(CCC3)[C@@H]2C2CCOCC2)c([N+](=O)[O-])cc1F ZINC000425554374 944326199 /nfs/dbraw/zinc/32/61/99/944326199.db2.gz ONTNGBZNYUROAD-SFHVURJKSA-N 1 1 364.417 3.524 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1CCCNc1ccc(-c2cccc([N+](=O)[O-])c2)nn1 ZINC001167751824 944347435 /nfs/dbraw/zinc/34/74/35/944347435.db2.gz NYRGUZXLJULABJ-OAHLLOKOSA-N 1 1 355.442 3.728 20 5 FHBDMO CC[C@@H](O)C[N@H+](Cc1ccccc1)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000184267235 944371244 /nfs/dbraw/zinc/37/12/44/944371244.db2.gz XKEQRKLAQALTPB-MRXNPFEDSA-N 1 1 362.401 3.516 20 5 FHBDMO CC[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000184267235 944371252 /nfs/dbraw/zinc/37/12/52/944371252.db2.gz XKEQRKLAQALTPB-MRXNPFEDSA-N 1 1 362.401 3.516 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@@H]3[C@H](O)C(F)(F)F)o2)cc1 ZINC000123686817 944396974 /nfs/dbraw/zinc/39/69/74/944396974.db2.gz GIHUJPOMCNXVGJ-ZBFHGGJFSA-N 1 1 370.327 3.742 20 5 FHBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@@H]2/C=C/c2ccccc2)c1 ZINC000505844003 944411911 /nfs/dbraw/zinc/41/19/11/944411911.db2.gz CRPOKQMRXVUZMK-KALAYHLKSA-N 1 1 368.433 3.512 20 5 FHBDMO CC[N@@H+](CCO)Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000505847659 944431915 /nfs/dbraw/zinc/43/19/15/944431915.db2.gz DGMYSVYXMZYPFY-UHFFFAOYSA-N 1 1 350.802 3.855 20 5 FHBDMO C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000518525634 944471990 /nfs/dbraw/zinc/47/19/90/944471990.db2.gz YHTPDPXKTNSJCL-LBPRGKRZSA-N 1 1 368.865 3.880 20 5 FHBDMO CC[C@](C)(O)C[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000439262064 944479391 /nfs/dbraw/zinc/47/93/91/944479391.db2.gz TWYCUHDNENGSPL-FQEVSTJZSA-N 1 1 358.438 3.767 20 5 FHBDMO CCS[C@@H]1CCCC[N@@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000112088934 944480926 /nfs/dbraw/zinc/48/09/26/944480926.db2.gz UBNDPAJCNWGPFM-OAHLLOKOSA-N 1 1 365.499 3.839 20 5 FHBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3ccc(C(F)(F)F)s3)CC2)n1 ZINC000425997420 944562523 /nfs/dbraw/zinc/56/25/23/944562523.db2.gz XHVFHTWIUWXDFO-UHFFFAOYSA-N 1 1 360.361 3.709 20 5 FHBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000507599323 944663554 /nfs/dbraw/zinc/66/35/54/944663554.db2.gz XBEGFPOATQHMPL-DZGCQCFKSA-N 1 1 373.840 3.814 20 5 FHBDMO Cc1ccc(NC(=O)N[C@@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000506278901 944774707 /nfs/dbraw/zinc/77/47/07/944774707.db2.gz CKSLUBVUUINLSC-CRAIPNDOSA-N 1 1 368.437 3.860 20 5 FHBDMO O=C(C[N@H+]1CC[C@H]2CCC[C@H]21)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000426455517 944841340 /nfs/dbraw/zinc/84/13/40/944841340.db2.gz TWROVJBEYWOWGE-MLGOLLRUSA-N 1 1 372.450 3.531 20 5 FHBDMO Cc1c(NC(=O)N[C@@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000506306334 944888901 /nfs/dbraw/zinc/88/89/01/944888901.db2.gz BDVFHDQJYIONRQ-NVXWUHKLSA-N 1 1 368.437 3.860 20 5 FHBDMO Cc1c(NC(=O)N[C@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000506306335 944889345 /nfs/dbraw/zinc/88/93/45/944889345.db2.gz BDVFHDQJYIONRQ-WBVHZDCISA-N 1 1 368.437 3.860 20 5 FHBDMO Cc1c(C(=O)N[C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000487340941 944907120 /nfs/dbraw/zinc/90/71/20/944907120.db2.gz CJXJFPBNBNRDIU-AEFFLSMTSA-N 1 1 367.449 3.544 20 5 FHBDMO CC(C)c1ccc(C(=O)N[C@@H]2C[N@@H+](C)C[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000439742338 944938048 /nfs/dbraw/zinc/93/80/48/944938048.db2.gz UBXNBYOCJRHXHP-RTBURBONSA-N 1 1 367.449 3.546 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C1CC1)[C@H]1CCc2ccccc21 ZINC000438733510 944962866 /nfs/dbraw/zinc/96/28/66/944962866.db2.gz PKPAEGZMBVIXDC-FQEVSTJZSA-N 1 1 365.433 3.994 20 5 FHBDMO Cc1ccccc1[C@@H]1CC[N@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000507179751 945010888 /nfs/dbraw/zinc/01/08/88/945010888.db2.gz HTKCHEOATPUHGB-JKSUJKDBSA-N 1 1 353.422 3.720 20 5 FHBDMO O=C(NC[C@@H](c1cccc(Cl)c1)[NH+]1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000106167852 945039835 /nfs/dbraw/zinc/03/98/35/945039835.db2.gz CWTNRSRNWSLYBC-SFHVURJKSA-N 1 1 373.840 3.815 20 5 FHBDMO C[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)[N@@H+](C)C1CC1 ZINC000110695563 945053229 /nfs/dbraw/zinc/05/32/29/945053229.db2.gz CMXARDAVZIPTBL-AWEZNQCLSA-N 1 1 369.421 3.600 20 5 FHBDMO C[C@@H](O)[C@H]1CC[N@@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000507706891 945480344 /nfs/dbraw/zinc/48/03/44/945480344.db2.gz ZXTWIPIRONIZAH-WBVHZDCISA-N 1 1 355.438 3.565 20 5 FHBDMO Cc1nc(C(C)C)ccc1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000549526912 945663578 /nfs/dbraw/zinc/66/35/78/945663578.db2.gz DSCCXEFGTWIWGU-INIZCTEOSA-N 1 1 355.442 3.503 20 5 FHBDMO COc1ccc(C2([NH2+]Cc3csc([N+](=O)[O-])c3)CCOCC2)cc1F ZINC000444011673 945722444 /nfs/dbraw/zinc/72/24/44/945722444.db2.gz JDSSGXCQCLOFCJ-UHFFFAOYSA-N 1 1 366.414 3.600 20 5 FHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CC[C@H](COC(F)F)C2)c1 ZINC000550097544 945833219 /nfs/dbraw/zinc/83/32/19/945833219.db2.gz RSEPGPRTCXTMKC-VIFPVBQESA-N 1 1 354.275 3.675 20 5 FHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@H](COC(F)F)C2)c1 ZINC000550097544 945833224 /nfs/dbraw/zinc/83/32/24/945833224.db2.gz RSEPGPRTCXTMKC-VIFPVBQESA-N 1 1 354.275 3.675 20 5 FHBDMO CCCO[C@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000108397140 945945254 /nfs/dbraw/zinc/94/52/54/945945254.db2.gz FZQRJNRHBNTPQY-KRWDZBQOSA-N 1 1 363.458 3.513 20 5 FHBDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)c1ccc(SC)c([N+](=O)[O-])c1 ZINC000522887460 946060588 /nfs/dbraw/zinc/06/05/88/946060588.db2.gz KTDXJOCHLFQINX-OAHLLOKOSA-N 1 1 365.499 3.701 20 5 FHBDMO O=[N+]([O-])c1ccccc1N1CC[NH+](CCSc2ccccc2F)CC1 ZINC000025786749 946363488 /nfs/dbraw/zinc/36/34/88/946363488.db2.gz UALGTJJZWJRGHD-UHFFFAOYSA-N 1 1 361.442 3.648 20 5 FHBDMO COc1ccc(-c2ccc(CN[C@H]3C[C@H](C)[N@@H+](C4CC4)C3)o2)c([N+](=O)[O-])c1 ZINC000237427339 946457005 /nfs/dbraw/zinc/45/70/05/946457005.db2.gz MUEVCUFEIXJUBX-KBPBESRZSA-N 1 1 371.437 3.578 20 5 FHBDMO COc1ccc(-c2ccc(CN[C@H]3C[C@H](C)[N@H+](C4CC4)C3)o2)c([N+](=O)[O-])c1 ZINC000237427339 946457014 /nfs/dbraw/zinc/45/70/14/946457014.db2.gz MUEVCUFEIXJUBX-KBPBESRZSA-N 1 1 371.437 3.578 20 5 FHBDMO Cc1ccc(C(C)(C)C[N@@H+](C)C[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC000441346566 946497745 /nfs/dbraw/zinc/49/77/45/946497745.db2.gz NMQJQBDUSSCPCK-IBGZPJMESA-N 1 1 372.465 3.553 20 5 FHBDMO Cc1c(NC(=O)NC[C@@H](C)[N@@H+](C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000111707234 946514736 /nfs/dbraw/zinc/51/47/36/946514736.db2.gz PNYUTUKRYMXARM-CQSZACIVSA-N 1 1 356.426 3.545 20 5 FHBDMO COc1ncc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)cc1Cl ZINC000294985042 946612837 /nfs/dbraw/zinc/61/28/37/946612837.db2.gz KCKHLSQLINPVNP-UHFFFAOYSA-N 1 1 373.743 3.543 20 5 FHBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCCCC[N@@H+]1CCCC[C@@H]1C ZINC000475551975 946622257 /nfs/dbraw/zinc/62/22/57/946622257.db2.gz VXKBXUYXGIQFCL-INIZCTEOSA-N 1 1 362.474 3.988 20 5 FHBDMO CC(=O)c1cc(N2CC[N@@H+](Cc3ccccc3)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000323980180 946749478 /nfs/dbraw/zinc/74/94/78/946749478.db2.gz DZPJGXLPJUNCAO-INIZCTEOSA-N 1 1 367.449 3.756 20 5 FHBDMO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000475278423 946796806 /nfs/dbraw/zinc/79/68/06/946796806.db2.gz WARHBNODKHYXQT-NHYWBVRUSA-N 1 1 368.359 3.768 20 5 FHBDMO C[C@H]1OCC[C@]12C[N@@H+](Cc1ccc(-c3ccc([N+](=O)[O-])cc3)s1)CCO2 ZINC000475289423 946828295 /nfs/dbraw/zinc/82/82/95/946828295.db2.gz AHKCWLUQTIXERJ-KUHUBIRLSA-N 1 1 374.462 3.703 20 5 FHBDMO CCCC[N@H+]1CCCC[C@H]1CNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000523178706 946969781 /nfs/dbraw/zinc/96/97/81/946969781.db2.gz GRRBKFCEOSPLEU-HNNXBMFYSA-N 1 1 360.458 3.546 20 5 FHBDMO C[N@H+](CCCOc1ccc(F)cc1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444591919 947016674 /nfs/dbraw/zinc/01/66/74/947016674.db2.gz ORCYNFSWJNBRSJ-UHFFFAOYSA-N 1 1 358.373 3.511 20 5 FHBDMO C[N@@H+](CCCOc1ccc(F)cc1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444591919 947016681 /nfs/dbraw/zinc/01/66/81/947016681.db2.gz ORCYNFSWJNBRSJ-UHFFFAOYSA-N 1 1 358.373 3.511 20 5 FHBDMO COc1ccccc1C[C@H](C)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444646189 947067827 /nfs/dbraw/zinc/06/78/27/947067827.db2.gz AWVCVCRYKZQICB-ZDUSSCGKSA-N 1 1 354.410 3.543 20 5 FHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CC1(c2ccccc2)CC1 ZINC000444668712 947094397 /nfs/dbraw/zinc/09/43/97/947094397.db2.gz CXSZLWDEAJFJKM-HNNXBMFYSA-N 1 1 353.422 3.585 20 5 FHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CC1(c2ccccc2)CC1 ZINC000444668715 947094552 /nfs/dbraw/zinc/09/45/52/947094552.db2.gz CXSZLWDEAJFJKM-OAHLLOKOSA-N 1 1 353.422 3.585 20 5 FHBDMO CCn1nc(C)c([N+](=O)[O-])c1NC[C@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC000248676281 947101620 /nfs/dbraw/zinc/10/16/20/947101620.db2.gz YXVZQBJEPQYMQJ-CZUORRHYSA-N 1 1 363.487 3.676 20 5 FHBDMO CC[C@@H]1CCCC[C@@H]1[N@@H+](C)CCCn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000444679914 947103873 /nfs/dbraw/zinc/10/38/73/947103873.db2.gz WFIWHDUPFITDOU-ZBFHGGJFSA-N 1 1 361.442 3.793 20 5 FHBDMO CC[C@H]1CCCC[C@@H]1[N@@H+](C)CCCn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000444679912 947104197 /nfs/dbraw/zinc/10/41/97/947104197.db2.gz WFIWHDUPFITDOU-HOCLYGCPSA-N 1 1 361.442 3.793 20 5 FHBDMO CCOc1ccc([C@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1OC ZINC000444682938 947107151 /nfs/dbraw/zinc/10/71/51/947107151.db2.gz CAKPFQCKXRSSRO-LBPRGKRZSA-N 1 1 370.409 3.729 20 5 FHBDMO Cc1ccc(F)c(C[N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC000444736866 947151933 /nfs/dbraw/zinc/15/19/33/947151933.db2.gz PPPVEEUGYKJDNE-UHFFFAOYSA-N 1 1 359.401 3.811 20 5 FHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000523531474 947339934 /nfs/dbraw/zinc/33/99/34/947339934.db2.gz DTFVYHXIJKAAFJ-JTDSTZFVSA-N 1 1 373.497 3.736 20 5 FHBDMO CC(C)c1ccccc1OC[C@@H](O)C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088616536 947631536 /nfs/dbraw/zinc/63/15/36/947631536.db2.gz AOQCYHVZYVYCRG-IBGZPJMESA-N 1 1 370.449 3.516 20 5 FHBDMO CC(C)c1ccccc1OC[C@@H](O)C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088616536 947631527 /nfs/dbraw/zinc/63/15/27/947631527.db2.gz AOQCYHVZYVYCRG-IBGZPJMESA-N 1 1 370.449 3.516 20 5 FHBDMO Cc1ccc([C@@H]2[C@H](C)CCC[N@H+]2CCn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC000536378808 947851664 /nfs/dbraw/zinc/85/16/64/947851664.db2.gz MUSQUASIQSIDTH-UZLBHIALSA-N 1 1 355.438 3.538 20 5 FHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000278870518 947899228 /nfs/dbraw/zinc/89/92/28/947899228.db2.gz SOFUDTVCHFJJDT-WDEREUQCSA-N 1 1 370.331 3.980 20 5 FHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000278870518 947899237 /nfs/dbraw/zinc/89/92/37/947899237.db2.gz SOFUDTVCHFJJDT-WDEREUQCSA-N 1 1 370.331 3.980 20 5 FHBDMO CCc1ccc(C(=O)NC[C@@H]2CCC[N@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC001126286500 948059596 /nfs/dbraw/zinc/05/95/96/948059596.db2.gz QKZAEHDHAMHWNN-IBGZPJMESA-N 1 1 367.449 3.552 20 5 FHBDMO O=[N+]([O-])c1cccc2c(NCC[N@H+]3CCc4sccc4C3)ccnc21 ZINC000432339448 948155305 /nfs/dbraw/zinc/15/53/05/948155305.db2.gz IMQCJJGTGDRZMS-UHFFFAOYSA-N 1 1 354.435 3.675 20 5 FHBDMO C[N@@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)C(C)(C)c1ccccc1 ZINC000585754417 948265828 /nfs/dbraw/zinc/26/58/28/948265828.db2.gz NTSSTWWLWBCUDQ-UHFFFAOYSA-N 1 1 369.421 3.760 20 5 FHBDMO CCN(CC)C(=O)[C@H]1CCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000512067101 948351065 /nfs/dbraw/zinc/35/10/65/948351065.db2.gz KOAYHMMKCYRLLJ-GOSISDBHSA-N 1 1 371.437 3.688 20 5 FHBDMO Cn1ncc2c1CCC[C@@H]2[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000264975832 567946251 /nfs/dbraw/zinc/94/62/51/567946251.db2.gz RZAOBWLJLBJODV-INIZCTEOSA-N 1 1 369.450 3.619 20 5 FHBDMO C[N@H+](CCc1nccs1)Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602484589 567985200 /nfs/dbraw/zinc/98/52/00/567985200.db2.gz PCVIMFKJIURORJ-UHFFFAOYSA-N 1 1 362.274 3.550 20 5 FHBDMO C[N@@H+](CCc1nccs1)Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602484589 567985201 /nfs/dbraw/zinc/98/52/01/567985201.db2.gz PCVIMFKJIURORJ-UHFFFAOYSA-N 1 1 362.274 3.550 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](c2ccc3cccnc3n2)C1 ZINC000602887570 568006230 /nfs/dbraw/zinc/00/62/30/568006230.db2.gz OCNMMDGVVIOHOT-HNNXBMFYSA-N 1 1 364.405 3.536 20 5 FHBDMO COc1cc(C[N@H+]2CC[C@H](C(C)C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000490341105 568031976 /nfs/dbraw/zinc/03/19/76/568031976.db2.gz OYQGUCWWXNAGET-LBPRGKRZSA-N 1 1 358.385 3.725 20 5 FHBDMO CC(=O)NCC[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000568448370 568039328 /nfs/dbraw/zinc/03/93/28/568039328.db2.gz IOWMYBMINORMKJ-MRXNPFEDSA-N 1 1 371.437 3.593 20 5 FHBDMO COc1ccc(C[N@H+]2CCC[C@@]3(C2)OCc2ccccc23)cc1[N+](=O)[O-] ZINC000481725567 568098220 /nfs/dbraw/zinc/09/82/20/568098220.db2.gz KSTKHAFSFFMFQJ-FQEVSTJZSA-N 1 1 354.406 3.625 20 5 FHBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCCN(c3ccccc3)CC2)cc1 ZINC000302926170 568243955 /nfs/dbraw/zinc/24/39/55/568243955.db2.gz AOFCPZQHGZQMSY-UHFFFAOYSA-N 1 1 355.438 3.576 20 5 FHBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC3(CCC3)[C@H]2c2ccccc2)c1 ZINC000453023916 568255529 /nfs/dbraw/zinc/25/55/29/568255529.db2.gz SBTLSFZKNYHGDU-AZUAARDMSA-N 1 1 368.433 3.562 20 5 FHBDMO Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)[NH2+]Cc1cc([O-])ccc1[N+](=O)[O-] ZINC000569128259 568285419 /nfs/dbraw/zinc/28/54/19/568285419.db2.gz HSPWLPGELKPJRW-SECBINFHSA-N 1 1 372.347 3.527 20 5 FHBDMO O=[N+]([O-])c1cnc(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c(Cl)c1 ZINC001164624676 719055004 /nfs/dbraw/zinc/05/50/04/719055004.db2.gz OUGUICJUVQIIQE-MAUKXSAKSA-N 1 1 372.856 3.744 20 5 FHBDMO O=[N+]([O-])c1ccc2nc(Cl)cc(N3CC4(C3)CC[N@@H+](CC3CC3)C4)c2c1 ZINC001164769620 721299096 /nfs/dbraw/zinc/29/90/96/721299096.db2.gz KDONBXXAEIJDAD-UHFFFAOYSA-N 1 1 372.856 3.719 20 5 FHBDMO CC[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@@H](C)c1ccc(F)cc1 ZINC000516616599 945069148 /nfs/dbraw/zinc/06/91/48/945069148.db2.gz LQVAQCMVKHBZPY-KSSFIOAISA-N 1 1 362.401 3.557 20 5 FHBDMO CSC[C@H]1CCC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000430191573 927732687 /nfs/dbraw/zinc/73/26/87/927732687.db2.gz GUJGFEQEJMRRDX-AWEZNQCLSA-N 1 1 360.483 3.570 20 5 FHBDMO CSC[C@@H]1CCC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000430191575 927733107 /nfs/dbraw/zinc/73/31/07/927733107.db2.gz GUJGFEQEJMRRDX-CQSZACIVSA-N 1 1 360.483 3.570 20 5 FHBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+](C)[C@@H]2CCCOC2)cc1OC ZINC000510077270 927791104 /nfs/dbraw/zinc/79/11/04/927791104.db2.gz BORDWRQBNTWHSO-GOEBONIOSA-N 1 1 366.458 3.639 20 5 FHBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+](C)[C@@H]2CCCOC2)cc1OC ZINC000510077270 927791110 /nfs/dbraw/zinc/79/11/10/927791110.db2.gz BORDWRQBNTWHSO-GOEBONIOSA-N 1 1 366.458 3.639 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1CN[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000430203834 928002527 /nfs/dbraw/zinc/00/25/27/928002527.db2.gz JJGUYZPJHUEQEO-OXJNMPFZSA-N 1 1 369.465 3.604 20 5 FHBDMO C[C@@]1(c2ccccc2)CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1 ZINC000510092933 928129432 /nfs/dbraw/zinc/12/94/32/928129432.db2.gz VPZBZMQFWCLNGT-OAQYLSRUSA-N 1 1 367.449 3.638 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]1CC(=O)c1ccc(F)cc1 ZINC000430216446 928200926 /nfs/dbraw/zinc/20/09/26/928200926.db2.gz HMQPDCRNAVCFBB-QGZVFWFLSA-N 1 1 372.396 3.980 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1CC(=O)c1ccc(F)cc1 ZINC000430216446 928200948 /nfs/dbraw/zinc/20/09/48/928200948.db2.gz HMQPDCRNAVCFBB-QGZVFWFLSA-N 1 1 372.396 3.980 20 5 FHBDMO COC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1OC)c1ccc(Cl)cc1 ZINC000430238397 928393125 /nfs/dbraw/zinc/39/31/25/928393125.db2.gz HQPHIBRPRKBKJL-MRXNPFEDSA-N 1 1 350.802 3.734 20 5 FHBDMO COc1ccc(C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C(C)(C)C)cc1 ZINC000583227635 937257742 /nfs/dbraw/zinc/25/77/42/937257742.db2.gz XAYAWPWNAXAOHG-UHFFFAOYSA-N 1 1 371.437 3.503 20 5 FHBDMO COc1cc(C[N@H+]2CC(C)=C[C@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000430261652 928853934 /nfs/dbraw/zinc/85/39/34/928853934.db2.gz JXUBOZKQGYFHOU-NSHDSACASA-N 1 1 356.369 3.645 20 5 FHBDMO COc1cc(C[N@@H+]2CC(C)=C[C@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000430261652 928853938 /nfs/dbraw/zinc/85/39/38/928853938.db2.gz JXUBOZKQGYFHOU-NSHDSACASA-N 1 1 356.369 3.645 20 5 FHBDMO C[C@H](c1ccc(-n2cncn2)cc1)[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000127133817 929788228 /nfs/dbraw/zinc/78/82/28/929788228.db2.gz GDGRIAQDNBQUPH-BIENSFFJSA-N 1 1 363.421 3.882 20 5 FHBDMO CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000579993621 929789302 /nfs/dbraw/zinc/78/93/02/929789302.db2.gz OIEGOSUAZBJCEV-HNNXBMFYSA-N 1 1 361.467 3.756 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1C[C@H](O)c1cccs1 ZINC000175833441 929843255 /nfs/dbraw/zinc/84/32/55/929843255.db2.gz OUEYXTLQKNLQAR-ZBFHGGJFSA-N 1 1 362.451 3.753 20 5 FHBDMO CC(C)O[C@@H]1C[C@H]([NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C1(C)C ZINC000560547781 929885331 /nfs/dbraw/zinc/88/53/31/929885331.db2.gz BEAFBEXVBSYZGR-KSZLIROESA-N 1 1 372.469 3.599 20 5 FHBDMO Cc1ccc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c(-c2cnn(C)c2)c1 ZINC000580050225 930179586 /nfs/dbraw/zinc/17/95/86/930179586.db2.gz TWEFWPJGOCRUAK-UHFFFAOYSA-N 1 1 364.449 3.978 20 5 FHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](Cc1c(F)cccc1F)C1CCCC1 ZINC001167355928 930267945 /nfs/dbraw/zinc/26/79/45/930267945.db2.gz FAJRYJNDZLIWET-UHFFFAOYSA-N 1 1 364.396 3.823 20 5 FHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](Cc1c(F)cccc1F)C1CCCC1 ZINC001167355928 930267950 /nfs/dbraw/zinc/26/79/50/930267950.db2.gz FAJRYJNDZLIWET-UHFFFAOYSA-N 1 1 364.396 3.823 20 5 FHBDMO CCn1c(C)nc([N+](=O)[O-])c1NC[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC000583402570 937411101 /nfs/dbraw/zinc/41/11/01/937411101.db2.gz KWAFPMFCSPQQAB-ZFWWWQNUSA-N 1 1 363.487 3.676 20 5 FHBDMO COC1CCC([N@@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000265218177 930443898 /nfs/dbraw/zinc/44/38/98/930443898.db2.gz NOUUMMSLWCOOCL-UHFFFAOYSA-N 1 1 359.426 3.682 20 5 FHBDMO C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000109921603 930745831 /nfs/dbraw/zinc/74/58/31/930745831.db2.gz AKSUHWDNSHZBCD-OKILXGFUSA-N 1 1 372.469 3.562 20 5 FHBDMO Cc1ccc([C@@H](C)[NH2+][C@H](C)C(=O)c2c[nH]c3ncccc23)cc1[N+](=O)[O-] ZINC000537175672 930853964 /nfs/dbraw/zinc/85/39/64/930853964.db2.gz VJDNNGDJTPUSNW-CHWSQXEVSA-N 1 1 352.394 3.702 20 5 FHBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)CCN1Cc1c(F)cccc1[N+](=O)[O-] ZINC000610451892 931018569 /nfs/dbraw/zinc/01/85/69/931018569.db2.gz MIRKFRUFWVOAGO-INIZCTEOSA-N 1 1 357.429 3.830 20 5 FHBDMO Cc1[nH+]ccn1-c1ccc([C@H](C)NC(=O)c2ccc([N+](=O)[O-])s2)cc1 ZINC000119302215 931068345 /nfs/dbraw/zinc/06/83/45/931068345.db2.gz KXWBZMJBNZWYMX-NSHDSACASA-N 1 1 356.407 3.641 20 5 FHBDMO C[C@H](Nc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000312973113 931074526 /nfs/dbraw/zinc/07/45/26/931074526.db2.gz KQTWZENKQROESQ-GOEBONIOSA-N 1 1 365.437 3.794 20 5 FHBDMO CCc1ccccc1NC(=O)[C@H](C)[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000580880757 931296383 /nfs/dbraw/zinc/29/63/83/931296383.db2.gz FAIIVIADEJVIPU-HNNXBMFYSA-N 1 1 355.438 3.659 20 5 FHBDMO CCc1ccccc1NC(=O)[C@H](C)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000580880757 931296391 /nfs/dbraw/zinc/29/63/91/931296391.db2.gz FAIIVIADEJVIPU-HNNXBMFYSA-N 1 1 355.438 3.659 20 5 FHBDMO CC[N@@H+](C)[C@H](C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccccc1 ZINC000177875416 931431140 /nfs/dbraw/zinc/43/11/40/931431140.db2.gz AOXBFOXNXIWJGZ-KXBFYZLASA-N 1 1 355.438 3.773 20 5 FHBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000610475820 931545570 /nfs/dbraw/zinc/54/55/70/931545570.db2.gz VFRDQDONWGTXLJ-MRXNPFEDSA-N 1 1 368.437 3.723 20 5 FHBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC1(O)CCCCCC1 ZINC000187367014 931568825 /nfs/dbraw/zinc/56/88/25/931568825.db2.gz CVPFCPABJBPKFO-UHFFFAOYSA-N 1 1 373.453 3.809 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCN(c2nccc3sccc32)CC1 ZINC000581123878 931586129 /nfs/dbraw/zinc/58/61/29/931586129.db2.gz OCYDVMATHOSIKB-UHFFFAOYSA-N 1 1 368.462 3.835 20 5 FHBDMO CC[N@H+](Cc1ccncc1)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000157800105 931601616 /nfs/dbraw/zinc/60/16/16/931601616.db2.gz GIBCGECYURYGHK-UHFFFAOYSA-N 1 1 350.216 3.774 20 5 FHBDMO CC[N@@H+](Cc1ccncc1)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000157800105 931601620 /nfs/dbraw/zinc/60/16/20/931601620.db2.gz GIBCGECYURYGHK-UHFFFAOYSA-N 1 1 350.216 3.774 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H]1c1cccc(F)c1 ZINC000610505498 932026887 /nfs/dbraw/zinc/02/68/87/932026887.db2.gz MRBMEFNETYRKEY-KRWDZBQOSA-N 1 1 373.384 3.518 20 5 FHBDMO CCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000610582658 932072929 /nfs/dbraw/zinc/07/29/29/932072929.db2.gz ILRJHZUTSFKOMY-FSPWUOQZSA-N 1 1 359.426 3.762 20 5 FHBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1csc(Br)c1 ZINC000064994436 932343747 /nfs/dbraw/zinc/34/37/47/932343747.db2.gz GYBHCBKJFJYMSS-UHFFFAOYSA-N 1 1 371.256 3.930 20 5 FHBDMO C[C@H]1CCCC[N@H+]1CCCCNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000134610310 932534620 /nfs/dbraw/zinc/53/46/20/932534620.db2.gz GHIYAWCFECMRRA-ZDUSSCGKSA-N 1 1 353.850 3.633 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(NC2CC[NH+](Cc3ccc(F)c(F)c3)CC2)n1 ZINC000178179191 932762665 /nfs/dbraw/zinc/76/26/65/932762665.db2.gz XSTXSHWYTQOXBU-UHFFFAOYSA-N 1 1 362.380 3.653 20 5 FHBDMO C[C@@H]1CC[C@H](C)C[N@@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001167487428 932850058 /nfs/dbraw/zinc/85/00/58/932850058.db2.gz LXSWMKFFXKYXNH-WDEREUQCSA-N 1 1 350.806 3.919 20 5 FHBDMO Cc1cc(C(=O)NC[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000247382375 932856305 /nfs/dbraw/zinc/85/63/05/932856305.db2.gz LNBHZBMWFZWFBW-MAUKXSAKSA-N 1 1 373.478 3.778 20 5 FHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCSC2(CCCCC2)C1 ZINC000430759754 933212482 /nfs/dbraw/zinc/21/24/82/933212482.db2.gz FTFXHUUECVJQMO-CQSZACIVSA-N 1 1 363.483 3.674 20 5 FHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCSC2(CCCCC2)C1 ZINC000430759754 933212485 /nfs/dbraw/zinc/21/24/85/933212485.db2.gz FTFXHUUECVJQMO-CQSZACIVSA-N 1 1 363.483 3.674 20 5 FHBDMO Cn1nccc1[C@@H]1CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000510641968 933347559 /nfs/dbraw/zinc/34/75/59/933347559.db2.gz XEBAXKOJOBGFSY-MRXNPFEDSA-N 1 1 366.421 3.968 20 5 FHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@@H](OCCCc2ccccc2)C1 ZINC000430932136 933427418 /nfs/dbraw/zinc/42/74/18/933427418.db2.gz YCXSLQZOGIQKIN-LJQANCHMSA-N 1 1 370.449 3.697 20 5 FHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC[C@@H](OCCCc2ccccc2)C1 ZINC000430936167 933441546 /nfs/dbraw/zinc/44/15/46/933441546.db2.gz STNDURIPYSHWEQ-QGZVFWFLSA-N 1 1 358.413 3.958 20 5 FHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@@H](OCCCc2ccccc2)C1 ZINC000430936167 933441549 /nfs/dbraw/zinc/44/15/49/933441549.db2.gz STNDURIPYSHWEQ-QGZVFWFLSA-N 1 1 358.413 3.958 20 5 FHBDMO O=C(C[C@@H]1CCC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1)c1cccs1 ZINC000430988927 933626950 /nfs/dbraw/zinc/62/69/50/933626950.db2.gz NICXZEBOBVEROQ-AWEZNQCLSA-N 1 1 360.435 3.773 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH+]1CCC(C)(c2ccccc2)CC1 ZINC000510748577 933638153 /nfs/dbraw/zinc/63/81/53/933638153.db2.gz ISHUDGXROGXESV-UHFFFAOYSA-N 1 1 367.449 3.895 20 5 FHBDMO C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000065142441 934219296 /nfs/dbraw/zinc/21/92/96/934219296.db2.gz IZRCDGJDZPWMEP-BETUJISGSA-N 1 1 367.877 3.735 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@@H](C)Cc1ccc(O)cc1 ZINC000119424483 934508072 /nfs/dbraw/zinc/50/80/72/934508072.db2.gz CNBNLCWQFCPILC-HNNXBMFYSA-N 1 1 371.437 3.500 20 5 FHBDMO COc1ccc(COCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000610864862 934540138 /nfs/dbraw/zinc/54/01/38/934540138.db2.gz IKUINIVSDVEBQB-UHFFFAOYSA-N 1 1 356.422 3.785 20 5 FHBDMO Cc1c(C[N@@H+](Cc2cccs2)[C@@H]2C=C[C@H](CO)C2)cccc1[N+](=O)[O-] ZINC000561903867 934809738 /nfs/dbraw/zinc/80/97/38/934809738.db2.gz BQPOXENZHCWCCU-DOTOQJQBSA-N 1 1 358.463 3.904 20 5 FHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cnc(CC(F)(F)F)s1 ZINC000894391252 945071120 /nfs/dbraw/zinc/07/11/20/945071120.db2.gz OHSKYJLILIXGCM-UHFFFAOYSA-N 1 1 359.373 3.831 20 5 FHBDMO C[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[S@@]1=O ZINC000277445662 935184139 /nfs/dbraw/zinc/18/41/39/935184139.db2.gz JPJVZOKIGICMLC-OZAJXLCCSA-N 1 1 364.492 3.666 20 5 FHBDMO C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[S@@]1=O ZINC000277445662 935184141 /nfs/dbraw/zinc/18/41/41/935184141.db2.gz JPJVZOKIGICMLC-OZAJXLCCSA-N 1 1 364.492 3.666 20 5 FHBDMO Cc1ccc(NC(=O)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000072035427 935229725 /nfs/dbraw/zinc/22/97/25/935229725.db2.gz FYAMYCKZVHPYLM-KRWDZBQOSA-N 1 1 353.422 3.754 20 5 FHBDMO Cc1ccc([C@H](C)[NH2+]Cc2csc(-c3cnn(C)c3)n2)cc1[N+](=O)[O-] ZINC000611404298 935399496 /nfs/dbraw/zinc/39/94/96/935399496.db2.gz POVBZPOROKIWPW-LBPRGKRZSA-N 1 1 357.439 3.611 20 5 FHBDMO Cn1nccc1C1=CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000582293360 935498174 /nfs/dbraw/zinc/49/81/74/935498174.db2.gz CYBPVJQJBXDBHX-UHFFFAOYSA-N 1 1 364.405 3.878 20 5 FHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])[C@H]1CCN(c2ccccc2Cl)C1=O ZINC000511107721 935593510 /nfs/dbraw/zinc/59/35/10/935593510.db2.gz OIWPWJPFEJWCRR-SFHVURJKSA-N 1 1 373.840 3.528 20 5 FHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])[C@H]1CCN(c2ccccc2Cl)C1=O ZINC000511107721 935593513 /nfs/dbraw/zinc/59/35/13/935593513.db2.gz OIWPWJPFEJWCRR-SFHVURJKSA-N 1 1 373.840 3.528 20 5 FHBDMO CCN(C(=O)[C@@H](C)[N@H+](C)CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000511118646 935665624 /nfs/dbraw/zinc/66/56/24/935665624.db2.gz BCCNQXMGVGAPND-MRXNPFEDSA-N 1 1 355.438 3.511 20 5 FHBDMO CCN(C(=O)[C@@H](C)[N@@H+](C)CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000511118646 935665626 /nfs/dbraw/zinc/66/56/26/935665626.db2.gz BCCNQXMGVGAPND-MRXNPFEDSA-N 1 1 355.438 3.511 20 5 FHBDMO Cc1c(F)cccc1NC(=O)CC[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511124962 935699854 /nfs/dbraw/zinc/69/98/54/935699854.db2.gz NAJSOYKDDVRZNF-UHFFFAOYSA-N 1 1 359.401 3.545 20 5 FHBDMO C[C@H](c1nnc(-c2cccs2)o1)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511140781 935776746 /nfs/dbraw/zinc/77/67/46/935776746.db2.gz URHGFOJRYHMFJO-GFCCVEGCSA-N 1 1 358.423 3.942 20 5 FHBDMO C[C@H](c1nnc(-c2cccs2)o1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511140781 935776747 /nfs/dbraw/zinc/77/67/47/935776747.db2.gz URHGFOJRYHMFJO-GFCCVEGCSA-N 1 1 358.423 3.942 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])c(N2CC[N@H+](Cc3ccccc3)CC[C@@H]2C)n1 ZINC000611617006 935815700 /nfs/dbraw/zinc/81/57/00/935815700.db2.gz VPJDULBQNBHEMB-KRWDZBQOSA-N 1 1 354.454 3.707 20 5 FHBDMO C[N@@H+](Cc1ccccc1)[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000480022365 935941881 /nfs/dbraw/zinc/94/18/81/935941881.db2.gz WUDRHZXVLYENBQ-LJQANCHMSA-N 1 1 368.437 3.627 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](O)C2)ccc1Oc1ccccc1Cl ZINC000158746687 935954017 /nfs/dbraw/zinc/95/40/17/935954017.db2.gz IHNNVSUTMSSNHK-AWEZNQCLSA-N 1 1 362.813 3.997 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](O)C2)ccc1Oc1ccccc1Cl ZINC000158746687 935954019 /nfs/dbraw/zinc/95/40/19/935954019.db2.gz IHNNVSUTMSSNHK-AWEZNQCLSA-N 1 1 362.813 3.997 20 5 FHBDMO CC[C@@H](C)[N@@H+](C)CCNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000277801272 935960766 /nfs/dbraw/zinc/96/07/66/935960766.db2.gz WHTFALAZNJIKHQ-CQSZACIVSA-N 1 1 351.450 3.554 20 5 FHBDMO C[C@H]1C[C@H](N(C)C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CC[N@H+]1C ZINC000277876558 936076396 /nfs/dbraw/zinc/07/63/96/936076396.db2.gz CEMMSPXKJWZFNY-LSDHHAIUSA-N 1 1 363.461 3.648 20 5 FHBDMO C[C@@H]1C[N@@H+](CC(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)C(C)(C)C1 ZINC000472269354 936206332 /nfs/dbraw/zinc/20/63/32/936206332.db2.gz VCCBZBPDCASUDE-LBPRGKRZSA-N 1 1 374.466 3.777 20 5 FHBDMO COc1ccc(-n2ccc(C[NH2+][C@H](C)c3cccc([N+](=O)[O-])c3C)n2)cc1 ZINC000178711989 936276103 /nfs/dbraw/zinc/27/61/03/936276103.db2.gz YWIMWCTXGBOWCJ-OAHLLOKOSA-N 1 1 366.421 3.948 20 5 FHBDMO C[C@]1(O)CC[N@@H+](Cc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)C1 ZINC000583456609 938261134 /nfs/dbraw/zinc/26/11/34/938261134.db2.gz NZTCETDFFXVZBK-SFHVURJKSA-N 1 1 362.813 3.997 20 5 FHBDMO CN1CC[N@H+](C)C[C@H]1c1nc(-c2cc3ccccc3c3ccccc23)no1 ZINC001211584987 938284177 /nfs/dbraw/zinc/28/41/77/938284177.db2.gz JNHGDGILWMCZJG-FQEVSTJZSA-N 1 1 358.445 3.961 20 5 FHBDMO CN1CC[N@@H+](C)C[C@H]1c1nc(-c2cc3ccccc3c3ccccc23)no1 ZINC001211584987 938284178 /nfs/dbraw/zinc/28/41/78/938284178.db2.gz JNHGDGILWMCZJG-FQEVSTJZSA-N 1 1 358.445 3.961 20 5 FHBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C[C@@H]1C ZINC000437260265 945174568 /nfs/dbraw/zinc/17/45/68/945174568.db2.gz SXLIOFPPOQULSH-FZMZJTMJSA-N 1 1 373.375 3.558 20 5 FHBDMO O=C(NC[C@@H]1CCC[N@H+]1C1CCCCC1)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000437864168 945204435 /nfs/dbraw/zinc/20/44/35/945204435.db2.gz AAFRNRUMWJMGHV-HNNXBMFYSA-N 1 1 370.453 3.603 20 5 FHBDMO Cc1noc(C)c1[C@@H](C)[NH2+]Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000162199682 938800565 /nfs/dbraw/zinc/80/05/65/938800565.db2.gz JGFCXFMFPBCMLN-MRVPVSSYSA-N 1 1 354.204 3.813 20 5 FHBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CC[C@H](CC(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000278781164 938995110 /nfs/dbraw/zinc/99/51/10/938995110.db2.gz NOZWZAULEFEUJS-VXGBXAGGSA-N 1 1 359.348 3.505 20 5 FHBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@H](CC(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000278781164 938995111 /nfs/dbraw/zinc/99/51/11/938995111.db2.gz NOZWZAULEFEUJS-VXGBXAGGSA-N 1 1 359.348 3.505 20 5 FHBDMO NC(=O)[C@@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1ccccc1 ZINC000102420875 939018544 /nfs/dbraw/zinc/01/85/44/939018544.db2.gz ZJFWIDOCFIXHAV-SFHVURJKSA-N 1 1 367.430 3.640 20 5 FHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccccc1N1CCOCC1 ZINC000179320530 939079985 /nfs/dbraw/zinc/07/99/85/939079985.db2.gz QRLPFCHCSRHDDM-UHFFFAOYSA-N 1 1 369.465 3.842 20 5 FHBDMO C[N@H+](Cc1ccc(OC[C@H]2CCCO2)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000179315940 939080053 /nfs/dbraw/zinc/08/00/53/939080053.db2.gz PWWUPYOQBDNKAV-LJQANCHMSA-N 1 1 356.422 3.785 20 5 FHBDMO C[N@@H+](Cc1ccc(OC[C@H]2CCCO2)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000179315940 939080054 /nfs/dbraw/zinc/08/00/54/939080054.db2.gz PWWUPYOQBDNKAV-LJQANCHMSA-N 1 1 356.422 3.785 20 5 FHBDMO C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000507464971 945253230 /nfs/dbraw/zinc/25/32/30/945253230.db2.gz DBIDSOFITGYWFV-ZDUSSCGKSA-N 1 1 359.426 3.581 20 5 FHBDMO COc1cc(C[N@H+]2CCC[C@H]3CCC[C@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000511844852 945261478 /nfs/dbraw/zinc/26/14/78/945261478.db2.gz TVUGWBPCKSFLNP-DGCLKSJQSA-N 1 1 356.369 3.969 20 5 FHBDMO COc1cc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000511844853 945261714 /nfs/dbraw/zinc/26/17/14/945261714.db2.gz TVUGWBPCKSFLNP-WCQYABFASA-N 1 1 356.369 3.969 20 5 FHBDMO CC[C@H]([NH2+]Cc1cccnc1OCC(F)F)c1cccc([N+](=O)[O-])c1 ZINC000179522789 939877245 /nfs/dbraw/zinc/87/72/45/939877245.db2.gz PQMULBURQNOVRQ-HNNXBMFYSA-N 1 1 351.353 3.875 20 5 FHBDMO O=C1O[C@H](C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)CN1c1ccccc1 ZINC000179520535 939881138 /nfs/dbraw/zinc/88/11/38/939881138.db2.gz UXGDNDQMTSEDAV-LJQANCHMSA-N 1 1 367.405 3.585 20 5 FHBDMO C[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc(NC(=O)C2CC2)cc1 ZINC000179774522 939933822 /nfs/dbraw/zinc/93/38/22/939933822.db2.gz XZBALHXYHMWQIB-GFCCVEGCSA-N 1 1 357.385 3.933 20 5 FHBDMO Cc1c(NC(=O)[C@@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)cccc1[N+](=O)[O-] ZINC000065857544 939988174 /nfs/dbraw/zinc/98/81/74/939988174.db2.gz QZBISWFGVKUWKX-MRXNPFEDSA-N 1 1 371.412 3.893 20 5 FHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC3(CC2)OCc2ccccc23)c([N+](=O)[O-])c1 ZINC000364761406 939995614 /nfs/dbraw/zinc/99/56/14/939995614.db2.gz VMKUORXSKWUATB-UHFFFAOYSA-N 1 1 369.377 3.525 20 5 FHBDMO C[C@@](O)(C1CC[NH+](C/C=C/c2ccccc2[N+](=O)[O-])CC1)C(F)(F)F ZINC000545244333 940032230 /nfs/dbraw/zinc/03/22/30/940032230.db2.gz NMHAXTXCVYVCFK-MQDFFIGUSA-N 1 1 358.360 3.633 20 5 FHBDMO C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000411742595 940105163 /nfs/dbraw/zinc/10/51/63/940105163.db2.gz DZBOCQBNEYTXIL-CABCVRRESA-N 1 1 373.375 3.976 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC2(CCOCC2)[C@@H]1c1ccccc1 ZINC000411983828 940173283 /nfs/dbraw/zinc/17/32/83/940173283.db2.gz GSEAITACAWFWAR-FQEVSTJZSA-N 1 1 368.433 3.957 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC2(CCOCC2)[C@@H]1c1ccccc1 ZINC000411983828 940173284 /nfs/dbraw/zinc/17/32/84/940173284.db2.gz GSEAITACAWFWAR-FQEVSTJZSA-N 1 1 368.433 3.957 20 5 FHBDMO COc1c(O)ccc(C[NH2+][C@@H]2CCSc3c(F)cccc32)c1[N+](=O)[O-] ZINC000892508019 940205884 /nfs/dbraw/zinc/20/58/84/940205884.db2.gz IKLRQRBUVOCNHW-CYBMUJFWSA-N 1 1 364.398 3.775 20 5 FHBDMO Cc1ccc(C[NH+]2CCC(c3noc(C(F)F)n3)CC2)cc1[N+](=O)[O-] ZINC000376048258 940239899 /nfs/dbraw/zinc/23/98/99/940239899.db2.gz YEPLHLUSFSLKKW-UHFFFAOYSA-N 1 1 352.341 3.603 20 5 FHBDMO Cc1cc(NC[C@@H]2CC[N@H+](C3CC3)C2)c(Br)cc1[N+](=O)[O-] ZINC000235968735 940336256 /nfs/dbraw/zinc/33/62/56/940336256.db2.gz FBRKGBBCXMXHGW-NSHDSACASA-N 1 1 354.248 3.562 20 5 FHBDMO CC(=O)c1cc([N+](=O)[O-])ccc1N1CCC[C@H](n2cc[nH+]c2C(C)C)C1 ZINC000376189242 940441565 /nfs/dbraw/zinc/44/15/65/940441565.db2.gz UQEZQIIRLUUQKI-INIZCTEOSA-N 1 1 356.426 3.959 20 5 FHBDMO COc1ccc([C@@H](CN(C)C)[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000580459158 940478258 /nfs/dbraw/zinc/47/82/58/940478258.db2.gz FDHPIHWMFOVECZ-HNAYVOBHSA-N 1 1 357.454 3.865 20 5 FHBDMO O=[N+]([O-])c1cc(F)ccc1N1CCC[N@@H+](CCCc2ccccc2)CC1 ZINC000506798162 945335480 /nfs/dbraw/zinc/33/54/80/945335480.db2.gz MFJHMGHYYAXMSI-UHFFFAOYSA-N 1 1 357.429 3.879 20 5 FHBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc2cncn2c1 ZINC000414178321 940713393 /nfs/dbraw/zinc/71/33/93/940713393.db2.gz JIMNCRUZNRVANO-OAHLLOKOSA-N 1 1 356.451 3.903 20 5 FHBDMO Cn1cc([C@@H]([NH2+]Cc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)cn1 ZINC000376352018 940822201 /nfs/dbraw/zinc/82/22/01/940822201.db2.gz OBUQHKJJTMMASE-SFHVURJKSA-N 1 1 356.813 3.861 20 5 FHBDMO CC(=O)N1CC[C@@H](C[N@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000180825833 941082040 /nfs/dbraw/zinc/08/20/40/941082040.db2.gz SFYYZPZBIQUAJK-HNNXBMFYSA-N 1 1 373.478 3.624 20 5 FHBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)CC1(c2ccccc2)CC1 ZINC000189287027 941155354 /nfs/dbraw/zinc/15/53/54/941155354.db2.gz JQDQCXLKCMJQKT-HNNXBMFYSA-N 1 1 353.422 3.585 20 5 FHBDMO COc1ccc([N+](=O)[O-])c(NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000311412195 941281841 /nfs/dbraw/zinc/28/18/41/941281841.db2.gz CGEAPPOZZFOWGZ-KRWDZBQOSA-N 1 1 355.438 3.928 20 5 FHBDMO CN(C(=O)c1ccc([N+](=O)[O-])c(Cl)c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311495633 941314636 /nfs/dbraw/zinc/31/46/36/941314636.db2.gz VQJTXPATTIQGEI-INIZCTEOSA-N 1 1 373.840 3.595 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(CNC2CC[NH2+]CC2)cc1 ZINC000414789078 941467755 /nfs/dbraw/zinc/46/77/55/941467755.db2.gz NSGMISUWGYLMBT-UHFFFAOYSA-N 1 1 361.829 3.882 20 5 FHBDMO Cc1cc(N2CCC3(CCC[N@@H+]3C)CC2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549138601 941511264 /nfs/dbraw/zinc/51/12/64/941511264.db2.gz YYQXQCWGXSVZJZ-UHFFFAOYSA-N 1 1 357.376 3.987 20 5 FHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccc(OC[C@@H]2CCCO2)cc1 ZINC000549157845 941551022 /nfs/dbraw/zinc/55/10/22/941551022.db2.gz QKYWUQSNWJEHFF-NRFANRHFSA-N 1 1 370.449 3.827 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CC(C)(C)Oc2ccc(N)cc21 ZINC000415035214 941558208 /nfs/dbraw/zinc/55/82/08/941558208.db2.gz LVYZOENMWMMQQT-KRWDZBQOSA-N 1 1 371.437 3.968 20 5 FHBDMO Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)N1CCC([N@@H+]2CCC[C@@H]2C)CC1 ZINC000377282688 941617157 /nfs/dbraw/zinc/61/71/57/941617157.db2.gz IERZFERVAUQGMB-LBPRGKRZSA-N 1 1 364.421 3.523 20 5 FHBDMO Cc1csc([C@@H](C)[NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)n1 ZINC000892854301 941621774 /nfs/dbraw/zinc/62/17/74/941621774.db2.gz BJOOLVXWYGCSRY-GFCCVEGCSA-N 1 1 357.439 3.611 20 5 FHBDMO CCc1ccc(C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000549195063 941624519 /nfs/dbraw/zinc/62/45/19/941624519.db2.gz ROACTSKKQXARNA-HXUWFJFHSA-N 1 1 370.449 3.562 20 5 FHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCS[C@@H]3COCC[C@@H]32)o1 ZINC000091856041 941793639 /nfs/dbraw/zinc/79/36/39/941793639.db2.gz GVBFRMSTRKDSHX-FUHWJXTLSA-N 1 1 360.435 3.561 20 5 FHBDMO C[C@@H]1C[C@@H](c2ccccc2)[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000513227388 941798667 /nfs/dbraw/zinc/79/86/67/941798667.db2.gz BYBSRTRTCGJIOF-BEFAXECRSA-N 1 1 353.422 3.641 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H]1C1CCCCC1 ZINC000513407096 941901381 /nfs/dbraw/zinc/90/13/81/941901381.db2.gz BDWXEXCWBMMSJP-QGZVFWFLSA-N 1 1 361.442 3.587 20 5 FHBDMO COc1ccc(-c2ccc(CN(C)[C@@H]3CC[N@H+](C4CC4)C3)o2)c([N+](=O)[O-])c1 ZINC000513441782 941928115 /nfs/dbraw/zinc/92/81/15/941928115.db2.gz AYUDLBLDQRXHBX-OAHLLOKOSA-N 1 1 371.437 3.532 20 5 FHBDMO COc1ccc(-c2ccc(C[N@H+](C)[C@@H]3CCN(C4CC4)C3)o2)c([N+](=O)[O-])c1 ZINC000513441782 941928119 /nfs/dbraw/zinc/92/81/19/941928119.db2.gz AYUDLBLDQRXHBX-OAHLLOKOSA-N 1 1 371.437 3.532 20 5 FHBDMO COc1ccc(-c2ccc(C[N@@H+](C)[C@@H]3CCN(C4CC4)C3)o2)c([N+](=O)[O-])c1 ZINC000513441782 941928123 /nfs/dbraw/zinc/92/81/23/941928123.db2.gz AYUDLBLDQRXHBX-OAHLLOKOSA-N 1 1 371.437 3.532 20 5 FHBDMO Cc1ccc(NC(=O)N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1[N+](=O)[O-] ZINC000182929736 942008575 /nfs/dbraw/zinc/00/85/75/942008575.db2.gz XAJJOZPHXUGESF-CABCVRRESA-N 1 1 360.458 3.678 20 5 FHBDMO Cc1cnn([C@H]2CC[N@H+](Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)C2)c1 ZINC000293713856 942064406 /nfs/dbraw/zinc/06/44/06/942064406.db2.gz XZPCWZPVXGNAGD-AWEZNQCLSA-N 1 1 354.332 3.566 20 5 FHBDMO Cc1cnn([C@H]2CC[N@@H+](Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)C2)c1 ZINC000293713856 942064410 /nfs/dbraw/zinc/06/44/10/942064410.db2.gz XZPCWZPVXGNAGD-AWEZNQCLSA-N 1 1 354.332 3.566 20 5 FHBDMO Cc1ccccc1C[C@@H](C)[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000501850434 942077572 /nfs/dbraw/zinc/07/75/72/942077572.db2.gz JVQOZGQOEYRTGO-MRXNPFEDSA-N 1 1 355.438 3.795 20 5 FHBDMO Cn1cc(C[N@H+]2CCCc3ccccc3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000513723792 942115159 /nfs/dbraw/zinc/11/51/59/942115159.db2.gz ANRHUJGMARXRBB-UHFFFAOYSA-N 1 1 362.433 3.944 20 5 FHBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000501938223 942135746 /nfs/dbraw/zinc/13/57/46/942135746.db2.gz KWGKHAMELJRCTM-ZDUSSCGKSA-N 1 1 359.348 3.586 20 5 FHBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccc(OC(F)F)cc1 ZINC000051212838 942257875 /nfs/dbraw/zinc/25/78/75/942257875.db2.gz QKEUKDNXIIUOFA-UHFFFAOYSA-N 1 1 352.337 3.707 20 5 FHBDMO CC[C@@H]1C[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H](CC)O1 ZINC000420950075 942271674 /nfs/dbraw/zinc/27/16/74/942271674.db2.gz FZYPQPPBGZONMT-CALCHBBNSA-N 1 1 359.426 3.682 20 5 FHBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420955963 942275218 /nfs/dbraw/zinc/27/52/18/942275218.db2.gz XJDGOGFKXLZOMN-NWDGAFQWSA-N 1 1 359.348 3.586 20 5 FHBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420955963 942275222 /nfs/dbraw/zinc/27/52/22/942275222.db2.gz XJDGOGFKXLZOMN-NWDGAFQWSA-N 1 1 359.348 3.586 20 5 FHBDMO CC(C)[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1F ZINC000501102949 942308570 /nfs/dbraw/zinc/30/85/70/942308570.db2.gz VCQUQLSWSZPRSJ-UHFFFAOYSA-N 1 1 359.401 3.973 20 5 FHBDMO CC(C)(C)C1=CC[N@@H+](CCNC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])CC1 ZINC000501140481 942326397 /nfs/dbraw/zinc/32/63/97/942326397.db2.gz QHYDNHZEZBEKKO-UHFFFAOYSA-N 1 1 373.497 3.667 20 5 FHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1c[nH]nc1-c1c(F)cccc1F ZINC000549407155 942465219 /nfs/dbraw/zinc/46/52/19/942465219.db2.gz BHXOPAYSINHAIP-UHFFFAOYSA-N 1 1 372.375 3.938 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(Oc2cc(C)ccn2)CC1 ZINC000541214258 942494931 /nfs/dbraw/zinc/49/49/31/942494931.db2.gz MCDAGFGVLJLZKW-UHFFFAOYSA-N 1 1 371.437 3.740 20 5 FHBDMO Cn1ccnc1[C@H]([NH2+]C[C@@H]1CC12CCSCC2)c1cccc([N+](=O)[O-])c1 ZINC000421375363 942526534 /nfs/dbraw/zinc/52/65/34/942526534.db2.gz IMHQIFUOUCTJCP-DOTOQJQBSA-N 1 1 372.494 3.541 20 5 FHBDMO Cc1c[nH+]ccc1OC1CCN(C(=O)c2cc([N+](=O)[O-])c(C)cc2C)CC1 ZINC000421565928 942650443 /nfs/dbraw/zinc/65/04/43/942650443.db2.gz WDYWTXUGGWDMAX-UHFFFAOYSA-N 1 1 369.421 3.599 20 5 FHBDMO Cc1cc(C(=O)Nc2nc3c(s2)C[N@H+](C(C)(C)C)CC3)ccc1[N+](=O)[O-] ZINC000425082187 942675379 /nfs/dbraw/zinc/67/53/79/942675379.db2.gz OIRKTEVJMFYMJU-UHFFFAOYSA-N 1 1 374.466 3.769 20 5 FHBDMO Cc1ccn(C2CC[NH+](Cc3cc([N+](=O)[O-])ccc3OC(C)C)CC2)n1 ZINC000434498751 942724263 /nfs/dbraw/zinc/72/42/63/942724263.db2.gz UXNNKEXYJOVPFI-UHFFFAOYSA-N 1 1 358.442 3.724 20 5 FHBDMO Cc1cc(NC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cn2cc[nH+]c12 ZINC000502800043 942753149 /nfs/dbraw/zinc/75/31/49/942753149.db2.gz VOQQFSGKUQSROD-NSHDSACASA-N 1 1 374.784 3.610 20 5 FHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000434733739 942900541 /nfs/dbraw/zinc/90/05/41/942900541.db2.gz CVOBMNWWNQFKRI-SYNHAJSKSA-N 1 1 354.454 3.676 20 5 FHBDMO C[C@H](c1ccccc1[N+](=O)[O-])N(C)C[C@@H]1CC[N@H+](C)[C@H]1c1cccnc1 ZINC000434733739 942900543 /nfs/dbraw/zinc/90/05/43/942900543.db2.gz CVOBMNWWNQFKRI-SYNHAJSKSA-N 1 1 354.454 3.676 20 5 FHBDMO C[C@H](c1ccccc1[N+](=O)[O-])N(C)C[C@@H]1CC[N@@H+](C)[C@H]1c1cccnc1 ZINC000434733739 942900547 /nfs/dbraw/zinc/90/05/47/942900547.db2.gz CVOBMNWWNQFKRI-SYNHAJSKSA-N 1 1 354.454 3.676 20 5 FHBDMO COC(=O)[C@@H]1CC[C@@H](c2ccccc2)[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000434792979 942970841 /nfs/dbraw/zinc/97/08/41/942970841.db2.gz GNJFRRJAVMMPRI-OALUTQOASA-N 1 1 354.406 3.516 20 5 FHBDMO C[N@H+](CCOc1ccc(Cl)cc1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000434835492 942993780 /nfs/dbraw/zinc/99/37/80/942993780.db2.gz CSLSRYFRMCFABF-UHFFFAOYSA-N 1 1 361.785 3.900 20 5 FHBDMO C[N@@H+](CCOc1ccc(Cl)cc1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000434835492 942993783 /nfs/dbraw/zinc/99/37/83/942993783.db2.gz CSLSRYFRMCFABF-UHFFFAOYSA-N 1 1 361.785 3.900 20 5 FHBDMO COc1cc(N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000312298647 943121985 /nfs/dbraw/zinc/12/19/85/943121985.db2.gz NGPRZZAERKTZGE-HOCLYGCPSA-N 1 1 371.437 3.687 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@@H](Oc4ccncc4)C3)o2)c1 ZINC000435055204 943127440 /nfs/dbraw/zinc/12/74/40/943127440.db2.gz GXDKWXCKKYIMDN-LJQANCHMSA-N 1 1 365.389 3.903 20 5 FHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000503380814 943157509 /nfs/dbraw/zinc/15/75/09/943157509.db2.gz WJBFINNJOUQVBT-CQSZACIVSA-N 1 1 358.417 3.646 20 5 FHBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000503401472 943163489 /nfs/dbraw/zinc/16/34/89/943163489.db2.gz CKRQPCNFKYHUQA-KBPBESRZSA-N 1 1 365.499 3.652 20 5 FHBDMO CC[C@H](N[C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000422832882 943299820 /nfs/dbraw/zinc/29/98/20/943299820.db2.gz GMQHECFODFTOOD-ZVDOUQERSA-N 1 1 367.449 3.891 20 5 FHBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)c3cc4ccccc4c4cccnc34)C2)C1 ZINC000505681184 943368294 /nfs/dbraw/zinc/36/82/94/943368294.db2.gz IKEFCVQDKQQXLW-QHCPKHFHSA-N 1 1 359.473 3.946 20 5 FHBDMO COc1cccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C[C@H]2CCCO2)c1 ZINC000053221430 943382328 /nfs/dbraw/zinc/38/23/28/943382328.db2.gz OBCXHWRKWYIPLZ-HXUWFJFHSA-N 1 1 356.422 3.785 20 5 FHBDMO O=[N+]([O-])c1ccc(CN(Cc2ccsc2)[C@@H]2CC23CC[NH2+]CC3)cc1 ZINC000435427391 943407451 /nfs/dbraw/zinc/40/74/51/943407451.db2.gz LQWSZFQOWGIAKT-GOSISDBHSA-N 1 1 357.479 3.801 20 5 FHBDMO O=C1CCc2cc([N+](=O)[O-])c(NC[C@H]3CCC[N@H+]3C3CCCCC3)cc2N1 ZINC000435600784 943519966 /nfs/dbraw/zinc/51/99/66/943519966.db2.gz GDKFYRSHKOUJNH-MRXNPFEDSA-N 1 1 372.469 3.689 20 5 FHBDMO CCc1ccc([C@H](NCCC[C@H]2CCC[NH2+]2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423490365 943535071 /nfs/dbraw/zinc/53/50/71/943535071.db2.gz XOAXGCOROPBCFH-OXQOHEQNSA-N 1 1 357.454 3.961 20 5 FHBDMO Cn1cc(C[NH2+][C@H]2C[C@@]2(F)c2ccccc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000424203734 943786948 /nfs/dbraw/zinc/78/69/48/943786948.db2.gz UTJNCOJBPHFRBU-AZUAARDMSA-N 1 1 366.396 3.722 20 5 FHBDMO CCOc1ccc([C@H](C)N[C@H](Cc2ccccc2)C[NH+](C)C)cc1[N+](=O)[O-] ZINC000504899064 943877140 /nfs/dbraw/zinc/87/71/40/943877140.db2.gz AEKGFAIVYCDIEL-QFBILLFUSA-N 1 1 371.481 3.817 20 5 FHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)cc1 ZINC000511645232 943991918 /nfs/dbraw/zinc/99/19/18/943991918.db2.gz FXOAJAGLMSSOBW-NJYVYQBISA-N 1 1 352.434 3.642 20 5 FHBDMO C[NH2+]CC1CCN(Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CC1 ZINC000517145137 944044243 /nfs/dbraw/zinc/04/42/43/944044243.db2.gz KFLYNCLQBWNTAD-UHFFFAOYSA-N 1 1 373.428 3.958 20 5 FHBDMO C[C@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H](c2ccco2)C1 ZINC000500069613 944052610 /nfs/dbraw/zinc/05/26/10/944052610.db2.gz ISDZTBXJDGBVPP-YOEHRIQHSA-N 1 1 357.410 3.990 20 5 FHBDMO O=C(CC[N@@H+](CCC(F)(F)F)CC1CC1)Nc1ccccc1[N+](=O)[O-] ZINC000500115865 944121559 /nfs/dbraw/zinc/12/15/59/944121559.db2.gz MWMKYYBVDIYQLT-UHFFFAOYSA-N 1 1 359.348 3.588 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC000436261786 944153860 /nfs/dbraw/zinc/15/38/60/944153860.db2.gz KRGOXLYGZIVXOR-KRWDZBQOSA-N 1 1 360.458 3.822 20 5 FHBDMO Cc1ccccc1C[C@@H]1CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500143130 944163743 /nfs/dbraw/zinc/16/37/43/944163743.db2.gz XPJGFLCQVAKCAK-SFHVURJKSA-N 1 1 367.449 3.939 20 5 FHBDMO C[NH+](C)C1(CNCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CC1 ZINC000418118182 944166786 /nfs/dbraw/zinc/16/67/86/944166786.db2.gz VPAPKKSRBJLLLA-UHFFFAOYSA-N 1 1 359.401 3.710 20 5 FHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1Nc1c2c(ccc1[N+](=O)[O-])NCC2 ZINC000436415095 944288514 /nfs/dbraw/zinc/28/85/14/944288514.db2.gz WKRWDBYMOZTQNV-CRAIPNDOSA-N 1 1 366.465 3.885 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000506474869 944288906 /nfs/dbraw/zinc/28/89/06/944288906.db2.gz QFVABSOISYKOPI-QZTJIDSGSA-N 1 1 361.486 3.560 20 5 FHBDMO CC(C)c1ccccc1OC[C@H](O)C[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000046835980 944455706 /nfs/dbraw/zinc/45/57/06/944455706.db2.gz JAEXDSXYKGEENZ-QGZVFWFLSA-N 1 1 358.438 3.590 20 5 FHBDMO CC(C)c1ccccc1OC[C@H](O)C[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000046835980 944455708 /nfs/dbraw/zinc/45/57/08/944455708.db2.gz JAEXDSXYKGEENZ-QGZVFWFLSA-N 1 1 358.438 3.590 20 5 FHBDMO Cc1cc(NC(=O)NC[C@H](C)[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000473788360 944467070 /nfs/dbraw/zinc/46/70/70/944467070.db2.gz QQGYHWSXYWUJKR-HNNXBMFYSA-N 1 1 356.426 3.545 20 5 FHBDMO Cn1cnc([N+](=O)[O-])c1C[NH+]1CCC(Sc2ccc(Cl)cc2)CC1 ZINC000366647245 944491384 /nfs/dbraw/zinc/49/13/84/944491384.db2.gz YIXSNBYHGFMQLM-UHFFFAOYSA-N 1 1 366.874 3.738 20 5 FHBDMO CC(C)(C)[N@H+]1CCCN(c2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000110455289 944501730 /nfs/dbraw/zinc/50/17/30/944501730.db2.gz ZWDBCPCYOMXEDR-UHFFFAOYSA-N 1 1 356.264 3.668 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)Cc1ccc(F)cc1F ZINC000025071186 944545433 /nfs/dbraw/zinc/54/54/33/944545433.db2.gz HXNPFHLIRMPYAO-UHFFFAOYSA-N 1 1 363.364 3.642 20 5 FHBDMO CC[N@@H+](CCO)Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000505868210 944549824 /nfs/dbraw/zinc/54/98/24/944549824.db2.gz LFFIRRSCAIEUFX-UHFFFAOYSA-N 1 1 350.802 3.855 20 5 FHBDMO COc1cc(C[N@@H+](C)CCCOCc2ccccc2)c([N+](=O)[O-])cc1F ZINC000439467409 944645256 /nfs/dbraw/zinc/64/52/56/944645256.db2.gz IWHOGPKMDGIIIS-UHFFFAOYSA-N 1 1 362.401 3.781 20 5 FHBDMO CC[C@@H]1CC[N@H+]([C@@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)C1 ZINC000438485022 944667955 /nfs/dbraw/zinc/66/79/55/944667955.db2.gz CKSOVYSFEMKRKB-QWHCGFSZSA-N 1 1 374.466 3.777 20 5 FHBDMO C[N@@H+](CCCOCc1ccccc1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000439483972 944686297 /nfs/dbraw/zinc/68/62/97/944686297.db2.gz BNISPBGNWGZJBH-UHFFFAOYSA-N 1 1 354.410 3.510 20 5 FHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+][C@@H]2C[C@@H](CO)c3ccccc32)c1 ZINC000364431096 944692795 /nfs/dbraw/zinc/69/27/95/944692795.db2.gz DJSKUDMKVDQKSE-BLLLJJGKSA-N 1 1 364.348 3.507 20 5 FHBDMO Cn1ccnc1[C@@H]([NH2+][C@@H]1CCCC(F)(F)C1)c1cccc([N+](=O)[O-])c1 ZINC000518805897 944786133 /nfs/dbraw/zinc/78/61/33/944786133.db2.gz BWNVPACGIGYGHO-HIFRSBDPSA-N 1 1 350.369 3.585 20 5 FHBDMO CC[C@H]1CCCC[N@H+]1CCNc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000500426353 944876916 /nfs/dbraw/zinc/87/69/16/944876916.db2.gz VVRKCAKPQWQDAD-KRWDZBQOSA-N 1 1 374.485 3.507 20 5 FHBDMO CC[N@@H+](Cc1ccc(C(=O)NCc2ccccc2[N+](=O)[O-])cc1)C1CC1 ZINC000511730355 944956295 /nfs/dbraw/zinc/95/62/95/944956295.db2.gz OGRYSJHVLNSFOT-UHFFFAOYSA-N 1 1 353.422 3.509 20 5 FHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2C[C@H](c3ccccc3)[C@@H]3COCC[C@H]32)c(F)c1 ZINC000511754838 945024103 /nfs/dbraw/zinc/02/41/03/945024103.db2.gz JMEAFVSQKQVWJK-OXFYSEKESA-N 1 1 374.387 3.878 20 5 FHBDMO CC(=O)N1CC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC12CCCCC2 ZINC000408144127 945425921 /nfs/dbraw/zinc/42/59/21/945425921.db2.gz GVZMOUWJBDUDGW-INIZCTEOSA-N 1 1 359.470 3.831 20 5 FHBDMO Cc1nc(C2([NH2+]CCCOc3ccc([N+](=O)[O-])cc3)CCCCCC2)no1 ZINC000507714404 945488119 /nfs/dbraw/zinc/48/81/19/945488119.db2.gz PGMOQBAEZNRINJ-UHFFFAOYSA-N 1 1 374.441 3.894 20 5 FHBDMO C[C@H]1C[C@@H](c2cccc(F)c2)[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000444167892 946016042 /nfs/dbraw/zinc/01/60/42/946016042.db2.gz MRPPAOZORPMQEM-LIRRHRJNSA-N 1 1 371.412 3.780 20 5 FHBDMO C[C@H]1C[C@@H](c2cccc(F)c2)[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000444167892 946016050 /nfs/dbraw/zinc/01/60/50/946016050.db2.gz MRPPAOZORPMQEM-LIRRHRJNSA-N 1 1 371.412 3.780 20 5 FHBDMO Cc1ccc(C(C)(C)C[N@H+](C)CC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000444176864 946034950 /nfs/dbraw/zinc/03/49/50/946034950.db2.gz RMPCGFRZNDJKFM-UHFFFAOYSA-N 1 1 355.438 3.751 20 5 FHBDMO Cc1ccc(C(C)(C)C[N@@H+](C)CC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000444176864 946034963 /nfs/dbraw/zinc/03/49/63/946034963.db2.gz RMPCGFRZNDJKFM-UHFFFAOYSA-N 1 1 355.438 3.751 20 5 FHBDMO COc1ccc(NC(=O)C[N@H+](C)[C@@H](C)c2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000052907253 946195690 /nfs/dbraw/zinc/19/56/90/946195690.db2.gz JMFPYYTXLNSPHS-AWEZNQCLSA-N 1 1 357.410 3.543 20 5 FHBDMO COc1ccc(NC(=O)C[N@@H+](C)[C@@H](C)c2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000052907253 946195693 /nfs/dbraw/zinc/19/56/93/946195693.db2.gz JMFPYYTXLNSPHS-AWEZNQCLSA-N 1 1 357.410 3.543 20 5 FHBDMO Cc1cc(Cl)c([N+](=O)[O-])cc1OC(=O)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001126120532 946397863 /nfs/dbraw/zinc/39/78/63/946397863.db2.gz FUNMFFJKIHHYEW-HNNXBMFYSA-N 1 1 374.824 3.984 20 5 FHBDMO COc1ccc(-c2ccc(CN[C@@H]3C[C@H](C)[N@@H+](C4CC4)C3)o2)c([N+](=O)[O-])c1 ZINC000237425528 946455146 /nfs/dbraw/zinc/45/51/46/946455146.db2.gz MUEVCUFEIXJUBX-UONOGXRCSA-N 1 1 371.437 3.578 20 5 FHBDMO COc1ccc(-c2ccc(CN[C@@H]3C[C@H](C)[N@H+](C4CC4)C3)o2)c([N+](=O)[O-])c1 ZINC000237425528 946455157 /nfs/dbraw/zinc/45/51/57/946455157.db2.gz MUEVCUFEIXJUBX-UONOGXRCSA-N 1 1 371.437 3.578 20 5 FHBDMO COc1ccc(-c2ccc(CN[C@H]3CC[N@H+]4CCCC[C@@H]34)o2)c([N+](=O)[O-])c1 ZINC000237426769 946456848 /nfs/dbraw/zinc/45/68/48/946456848.db2.gz JBUOSOUNIXBILC-ROUUACIJSA-N 1 1 371.437 3.580 20 5 FHBDMO COc1ccc(-c2ccc(C[NH2+][C@H]3CCN4CCCC[C@@H]34)o2)c([N+](=O)[O-])c1 ZINC000237426769 946456853 /nfs/dbraw/zinc/45/68/53/946456853.db2.gz JBUOSOUNIXBILC-ROUUACIJSA-N 1 1 371.437 3.580 20 5 FHBDMO CC(C)c1ccc(C(=O)NC[C@@H](C)[N@@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC001126133069 946566186 /nfs/dbraw/zinc/56/61/86/946566186.db2.gz BMQBCQZGRNONGE-MRXNPFEDSA-N 1 1 369.465 3.969 20 5 FHBDMO CN(C(=O)c1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475544917 946628660 /nfs/dbraw/zinc/62/86/60/946628660.db2.gz WVIKEPPRPMBOTR-INIZCTEOSA-N 1 1 373.840 3.595 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(N2CCC3(C[C@H]3[N@H+](C)Cc3nccs3)CC2)c1 ZINC000614776078 946684992 /nfs/dbraw/zinc/68/49/92/946684992.db2.gz HTBIMWRLWWKRHC-QGZVFWFLSA-N 1 1 372.494 3.851 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(N2CCC3(C[C@H]3[N@@H+](C)Cc3nccs3)CC2)c1 ZINC000614776078 946684996 /nfs/dbraw/zinc/68/49/96/946684996.db2.gz HTBIMWRLWWKRHC-QGZVFWFLSA-N 1 1 372.494 3.851 20 5 FHBDMO C[C@@H]([NH2+][C@@H](c1cnn(C)c1)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000186639465 946768146 /nfs/dbraw/zinc/76/81/46/946768146.db2.gz CBHHWXXEPLYFDR-BFUOFWGJSA-N 1 1 354.385 3.908 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C\CNC[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475285431 946822425 /nfs/dbraw/zinc/82/24/25/946822425.db2.gz LZXLIFPLZDEULR-SMTIMMHKSA-N 1 1 351.450 3.720 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C\CNC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475285431 946822439 /nfs/dbraw/zinc/82/24/39/946822439.db2.gz LZXLIFPLZDEULR-SMTIMMHKSA-N 1 1 351.450 3.720 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@@H]1CCN(Cc2ccccc2)C1 ZINC000475285431 946822445 /nfs/dbraw/zinc/82/24/45/946822445.db2.gz LZXLIFPLZDEULR-SMTIMMHKSA-N 1 1 351.450 3.720 20 5 FHBDMO C[C@@H]1OCC[C@@]12C[N@@H+](Cc1ccc(-c3ccc([N+](=O)[O-])cc3)s1)CCO2 ZINC000475289421 946827584 /nfs/dbraw/zinc/82/75/84/946827584.db2.gz AHKCWLUQTIXERJ-IFXJQAMLSA-N 1 1 374.462 3.703 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000074808351 947022181 /nfs/dbraw/zinc/02/21/81/947022181.db2.gz WLCKZBSDDJILPN-GOSISDBHSA-N 1 1 367.449 3.640 20 5 FHBDMO C[C@@H]1[C@@H](Cc2ccccc2)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444649436 947070205 /nfs/dbraw/zinc/07/02/05/947070205.db2.gz JLRMIIOHTFVTFX-GDBMZVCRSA-N 1 1 350.422 3.924 20 5 FHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CC[C@@H](COCc4ccccc4)C3)nc2c1 ZINC000444650136 947071054 /nfs/dbraw/zinc/07/10/54/947071054.db2.gz NMUVDDQCZXMFAS-MRXNPFEDSA-N 1 1 366.421 3.510 20 5 FHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@@H](COCc4ccccc4)C3)nc2c1 ZINC000444650136 947071066 /nfs/dbraw/zinc/07/10/66/947071066.db2.gz NMUVDDQCZXMFAS-MRXNPFEDSA-N 1 1 366.421 3.510 20 5 FHBDMO CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC)[C@@H]1CCCC[C@H]1C ZINC000444679482 947104025 /nfs/dbraw/zinc/10/40/25/947104025.db2.gz VBVGKNGKXOVCGB-RHSMWYFYSA-N 1 1 363.458 3.833 20 5 FHBDMO Cc1cc(C)cc(C[N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC000444689691 947115004 /nfs/dbraw/zinc/11/50/04/947115004.db2.gz GZEZSTZISWNTGZ-UHFFFAOYSA-N 1 1 355.438 3.981 20 5 FHBDMO Cc1cc(C)cc(C[N@@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c1 ZINC000444712373 947140712 /nfs/dbraw/zinc/14/07/12/947140712.db2.gz ZEKWDBHCOZGJAO-UHFFFAOYSA-N 1 1 352.394 3.894 20 5 FHBDMO Cc1cc(C)cc(C[N@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c1 ZINC000444712373 947140707 /nfs/dbraw/zinc/14/07/07/947140707.db2.gz ZEKWDBHCOZGJAO-UHFFFAOYSA-N 1 1 352.394 3.894 20 5 FHBDMO CC[C@@H](Cc1ccccc1)[N@@H+](C)CCOc1ccc(OC)cc1[N+](=O)[O-] ZINC000441434112 947237367 /nfs/dbraw/zinc/23/73/67/947237367.db2.gz IXNJGNKVGQVMBP-KRWDZBQOSA-N 1 1 358.438 3.935 20 5 FHBDMO C[C@@H](O)C[C@@H]1CCCCC[N@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000567965796 947541948 /nfs/dbraw/zinc/54/19/48/947541948.db2.gz CBLIXRRLSGWJGE-BEFAXECRSA-N 1 1 372.469 3.511 20 5 FHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000072838450 947570665 /nfs/dbraw/zinc/57/06/65/947570665.db2.gz LSBYVGKCKREIAS-GJZGRUSLSA-N 1 1 362.455 3.751 20 5 FHBDMO Cc1[nH+]ccn1-c1ccc(NC(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)cn1 ZINC000094014492 947696741 /nfs/dbraw/zinc/69/67/41/947696741.db2.gz UHUOKWKUEPOUNI-UHFFFAOYSA-N 1 1 365.393 3.661 20 5 FHBDMO Cc1c(C[NH2+][C@H](c2cnn(C)c2)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000184606620 947838592 /nfs/dbraw/zinc/83/85/92/947838592.db2.gz IJJFYJCJROIGJM-IBGZPJMESA-N 1 1 354.385 3.655 20 5 FHBDMO C[C@@H]1C[N@H+](CC2CCN(c3c(Cl)cccc3[N+](=O)[O-])CC2)C[C@H](C)O1 ZINC000432336349 948148797 /nfs/dbraw/zinc/14/87/97/948148797.db2.gz MYNLSPBYBLWDQS-OKILXGFUSA-N 1 1 367.877 3.574 20 5 FHBDMO CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@H+](C)C[C@@H]1C ZINC000512122397 948479087 /nfs/dbraw/zinc/47/90/87/948479087.db2.gz LMRHMHBXTGSWSA-KGLIPLIRSA-N 1 1 365.499 3.508 20 5 FHBDMO CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@@H+](C)C[C@@H]1C ZINC000512122397 948479092 /nfs/dbraw/zinc/47/90/92/948479092.db2.gz LMRHMHBXTGSWSA-KGLIPLIRSA-N 1 1 365.499 3.508 20 5 FHBDMO COc1cc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)c([N+](=O)[O-])cc1F ZINC000574854959 948634077 /nfs/dbraw/zinc/63/40/77/948634077.db2.gz FYDUTTBXXQFIJC-LESCRADOSA-N 1 1 366.433 3.648 20 5 FHBDMO C[N@H+](CCOc1ccc(F)cc1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728897752 948634359 /nfs/dbraw/zinc/63/43/59/948634359.db2.gz NUTABOQHRAMKJH-UHFFFAOYSA-N 1 1 370.384 3.566 20 5 FHBDMO C[N@@H+](CCOc1ccc(F)cc1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728897752 948634362 /nfs/dbraw/zinc/63/43/62/948634362.db2.gz NUTABOQHRAMKJH-UHFFFAOYSA-N 1 1 370.384 3.566 20 5 FHBDMO NC(=O)c1ccc(C[N@H+]2CCC[C@H](c3ccc(F)cc3)CC2)c([N+](=O)[O-])c1 ZINC000481361472 567818605 /nfs/dbraw/zinc/81/86/05/567818605.db2.gz RQJXIWDVESCCBX-AWEZNQCLSA-N 1 1 371.412 3.603 20 5 FHBDMO COc1cc(C[N@H+]2C[C@@H](C)CC[C@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000490341113 568032809 /nfs/dbraw/zinc/03/28/09/568032809.db2.gz PCKVXQAMYRZHMU-NWDGAFQWSA-N 1 1 358.385 3.868 20 5 FHBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1SC(C)C ZINC000568455740 568039789 /nfs/dbraw/zinc/03/97/89/568039789.db2.gz XJPIXSFZOHHDGD-CQSZACIVSA-N 1 1 367.515 3.946 20 5 FHBDMO COc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] ZINC000051560135 568079961 /nfs/dbraw/zinc/07/99/61/568079961.db2.gz GQXHOLCGHXYDEM-MRXNPFEDSA-N 1 1 370.405 3.712 20 5 FHBDMO COc1ccc(C[N@H+]2CCC[C@@H]2c2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] ZINC000051560135 568079962 /nfs/dbraw/zinc/07/99/62/568079962.db2.gz GQXHOLCGHXYDEM-MRXNPFEDSA-N 1 1 370.405 3.712 20 5 FHBDMO COc1cc(C[N@@H+]2CCC[C@@]3(C2)OCc2ccccc23)c([N+](=O)[O-])cc1F ZINC000481703596 568091523 /nfs/dbraw/zinc/09/15/23/568091523.db2.gz RXYLYCZFYUZWCW-FQEVSTJZSA-N 1 1 372.396 3.764 20 5 FHBDMO COc1cc(C[N@H+]2CCC[C@@]3(C2)OCc2ccccc23)c([N+](=O)[O-])cc1F ZINC000481703596 568091524 /nfs/dbraw/zinc/09/15/24/568091524.db2.gz RXYLYCZFYUZWCW-FQEVSTJZSA-N 1 1 372.396 3.764 20 5 FHBDMO COc1cc(C[N@H+]2CCC[C@@]3(C2)OCc2ccccc23)ccc1[N+](=O)[O-] ZINC000481698410 568092112 /nfs/dbraw/zinc/09/21/12/568092112.db2.gz YASCKWFPYAUOQS-FQEVSTJZSA-N 1 1 354.406 3.625 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(N2CCC[N@H+](Cc3ccc(Cl)cc3)CC2)n1 ZINC000481708339 568095018 /nfs/dbraw/zinc/09/50/18/568095018.db2.gz ASVOSUOKLDUINQ-UHFFFAOYSA-N 1 1 360.845 3.664 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(N2CCC[N@@H+](Cc3ccc(Cl)cc3)CC2)n1 ZINC000481708339 568095019 /nfs/dbraw/zinc/09/50/19/568095019.db2.gz ASVOSUOKLDUINQ-UHFFFAOYSA-N 1 1 360.845 3.664 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(N2CC[C@@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)n1 ZINC000481990157 568215840 /nfs/dbraw/zinc/21/58/40/568215840.db2.gz IMRIFKHGDOQNAD-RBUKOAKNSA-N 1 1 366.465 3.789 20 5 FHBDMO COc1cc(C)c(C[N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000302935507 568244930 /nfs/dbraw/zinc/24/49/30/568244930.db2.gz GBSISQOQLXMLBA-UHFFFAOYSA-N 1 1 374.437 3.821 20 5 FHBDMO CC(C)S(=O)(=O)c1ccc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000541952854 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934907965 /nfs/dbraw/zinc/90/79/65/934907965.db2.gz HGYTWIUVBHAGIK-UHFFFAOYSA-N 1 1 374.384 3.594 20 5 FHBDMO Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CCc2ccccc2[C@@H]1Cc1ccccc1 ZINC000536394497 934950890 /nfs/dbraw/zinc/95/08/90/934950890.db2.gz JDSKDYDEPSTYAH-IBGZPJMESA-N 1 1 362.433 3.670 20 5 FHBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCc2ccccc2[C@@H]1Cc1ccccc1 ZINC000536394497 934950894 /nfs/dbraw/zinc/95/08/94/934950894.db2.gz JDSKDYDEPSTYAH-IBGZPJMESA-N 1 1 362.433 3.670 20 5 FHBDMO O=[N+]([O-])c1ccc2nc(N3CC[C@H](n4c[nH+]c5c4CCCC5)C3)ccc2c1 ZINC000548662133 935202495 /nfs/dbraw/zinc/20/24/95/935202495.db2.gz RLYNXDCFIGMHFL-INIZCTEOSA-N 1 1 363.421 3.670 20 5 FHBDMO Cc1sc(C(=O)Nc2ccc(C[NH+](C)C)c(Cl)c2)cc1[N+](=O)[O-] ZINC000478040027 935249933 /nfs/dbraw/zinc/24/99/33/935249933.db2.gz ZWPNRNVSLMXHDA-UHFFFAOYSA-N 1 1 353.831 3.932 20 5 FHBDMO CCN(CC)C(=O)[C@@H](c1ccccc1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511074538 935266874 /nfs/dbraw/zinc/26/68/74/935266874.db2.gz VHAHWHOQIQMTPZ-HXUWFJFHSA-N 1 1 369.465 3.679 20 5 FHBDMO C[C@H]1CCCC[N@H+]1CCCNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000437164709 945089057 /nfs/dbraw/zinc/08/90/57/945089057.db2.gz JUYBONZZLFKSID-LBPRGKRZSA-N 1 1 373.375 3.608 20 5 FHBDMO CCOc1cc(C[NH+]2CCC(F)(c3cccnc3)CC2)ccc1[N+](=O)[O-] ZINC000551464179 935287899 /nfs/dbraw/zinc/28/78/99/935287899.db2.gz WXBZQTSJLRCCDO-UHFFFAOYSA-N 1 1 359.401 3.849 20 5 FHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1csc(-c2ccccn2)n1 ZINC000511094442 935449997 /nfs/dbraw/zinc/44/99/97/935449997.db2.gz HAQLFDSGPGNXQC-UHFFFAOYSA-N 1 1 354.435 3.788 20 5 FHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1csc(-c2ccccn2)n1 ZINC000511094442 935450003 /nfs/dbraw/zinc/45/00/03/935450003.db2.gz HAQLFDSGPGNXQC-UHFFFAOYSA-N 1 1 354.435 3.788 20 5 FHBDMO C[C@@H](NCc1ccc([N+](=O)[O-])cc1F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381711584 935544530 /nfs/dbraw/zinc/54/45/30/935544530.db2.gz JIBHNNDYKMFFCG-CRAIPNDOSA-N 1 1 357.429 3.734 20 5 FHBDMO CCOc1ccc(NC(=O)C[N@H+]2CCC[C@H]2C2CCCC2)c([N+](=O)[O-])c1 ZINC000511108527 935601017 /nfs/dbraw/zinc/60/10/17/935601017.db2.gz HUHXEBMVLFMBFZ-KRWDZBQOSA-N 1 1 361.442 3.587 20 5 FHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1nc(-c2cccc(Cl)c2)no1 ZINC000511123355 935696927 /nfs/dbraw/zinc/69/69/27/935696927.db2.gz IPKWOOCREWHDJM-UHFFFAOYSA-N 1 1 372.812 3.973 20 5 FHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1nc(-c2cccc(Cl)c2)no1 ZINC000511123355 935696928 /nfs/dbraw/zinc/69/69/28/935696928.db2.gz IPKWOOCREWHDJM-UHFFFAOYSA-N 1 1 372.812 3.973 20 5 FHBDMO NC(=O)c1ccc(C[N@H+]2CCC[C@H]2Cc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000140531095 945136257 /nfs/dbraw/zinc/13/62/57/945136257.db2.gz JCOFWJLSGPLGGT-INIZCTEOSA-N 1 1 373.840 3.554 20 5 FHBDMO CCn1nc(C)c([N+](=O)[O-])c1Nc1ccc2c(c1)[nH+]c1n2CCCCC1 ZINC000479870835 935909951 /nfs/dbraw/zinc/90/99/51/935909951.db2.gz BTXULQHCYJRVIN-UHFFFAOYSA-N 1 1 354.414 3.939 20 5 FHBDMO COc1ccc(C[N@H+](C)C[C@H](C)OC)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000582693761 935952699 /nfs/dbraw/zinc/95/26/99/935952699.db2.gz WXXAGJPUEMXVGH-HNNXBMFYSA-N 1 1 374.437 3.649 20 5 FHBDMO Cc1ccc(C)n1C1CC[NH+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])CC1 ZINC000507337303 945135780 /nfs/dbraw/zinc/13/57/80/945135780.db2.gz FVWOKMWDOKYETN-UHFFFAOYSA-N 1 1 370.453 3.597 20 5 FHBDMO CC[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@H](C)Cc1ccsc1 ZINC000187792773 936001396 /nfs/dbraw/zinc/00/13/96/936001396.db2.gz ZDBKCUIEDPVSOV-CQSZACIVSA-N 1 1 361.467 3.572 20 5 FHBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H]1CCCc2ccccc21 ZINC000582737689 936045107 /nfs/dbraw/zinc/04/51/07/936045107.db2.gz VMKOOWUFIZAJLE-GOSISDBHSA-N 1 1 353.422 3.933 20 5 FHBDMO C[C@H]1C[C@@H](N(C)C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CC[N@H+]1C ZINC000277876543 936076108 /nfs/dbraw/zinc/07/61/08/936076108.db2.gz CEMMSPXKJWZFNY-GJZGRUSLSA-N 1 1 363.461 3.648 20 5 FHBDMO COc1cc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)ccc1OC(F)F ZINC000582797974 936136445 /nfs/dbraw/zinc/13/64/45/936136445.db2.gz XSXOLORVNBJMNO-UHFFFAOYSA-N 1 1 366.364 3.879 20 5 FHBDMO O=[N+]([O-])c1ccc(NCc2cccc(C[NH+]3CCOCC3)c2)c(Cl)c1 ZINC000052429116 938300092 /nfs/dbraw/zinc/30/00/92/938300092.db2.gz YMJWGCIIBLBKNA-UHFFFAOYSA-N 1 1 361.829 3.693 20 5 FHBDMO CCc1[nH+]ccn1[C@H]1CCCN(c2cc(C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000278445059 938434297 /nfs/dbraw/zinc/43/42/97/938434297.db2.gz QYNWCDLISMQREF-NSHDSACASA-N 1 1 369.347 3.609 20 5 FHBDMO CCOc1cccc(N2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)c1[N+](=O)[O-] ZINC000409640471 938978905 /nfs/dbraw/zinc/97/89/05/938978905.db2.gz UVDVLXGGKBBOCO-OAHLLOKOSA-N 1 1 370.453 3.910 20 5 FHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)cn1 ZINC000612101603 939050403 /nfs/dbraw/zinc/05/04/03/939050403.db2.gz BVSGEGREFYXELJ-BHIYHBOVSA-N 1 1 352.438 3.702 20 5 FHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH+]2CCC([C@H]3CCCO3)CC2)c1 ZINC000188280616 939127703 /nfs/dbraw/zinc/12/77/03/939127703.db2.gz DDQCABWEGMMTHO-OAHLLOKOSA-N 1 1 356.369 3.587 20 5 FHBDMO COc1c(O)ccc(C[NH2+]Cc2cccc(C(F)(F)F)c2)c1[N+](=O)[O-] ZINC000892436330 939135635 /nfs/dbraw/zinc/13/56/35/939135635.db2.gz YSZZQOLUWXFHIE-UHFFFAOYSA-N 1 1 356.300 3.618 20 5 FHBDMO C[C@H]1CCC[N@H+](C(C)(C)CNCc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000518265538 945270091 /nfs/dbraw/zinc/27/00/91/945270091.db2.gz ZFQSXFOYURZMET-ZDUSSCGKSA-N 1 1 371.428 3.796 20 5 FHBDMO C[C@H]1CCCN(C(C)(C)C[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000518265538 945270099 /nfs/dbraw/zinc/27/00/99/945270099.db2.gz ZFQSXFOYURZMET-ZDUSSCGKSA-N 1 1 371.428 3.796 20 5 FHBDMO Cn1cc(C[N@H+]2CCC[C@H]2c2cccn2C)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000179704126 939924150 /nfs/dbraw/zinc/92/41/50/939924150.db2.gz LOBYWDGPYKAEKC-IBGZPJMESA-N 1 1 365.437 3.671 20 5 FHBDMO CNC(=O)c1ccc(C[N@@H+](C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)cc1 ZINC000179757911 939931455 /nfs/dbraw/zinc/93/14/55/939931455.db2.gz FQAHSNBAEQOIJH-UHFFFAOYSA-N 1 1 355.438 3.710 20 5 FHBDMO Cc1c[nH+]cn1C1CCN(C(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)CC1 ZINC000364399297 939940392 /nfs/dbraw/zinc/94/03/92/939940392.db2.gz IJJDOLWEBRMTTL-UHFFFAOYSA-N 1 1 356.426 3.502 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(F)c2)C1 ZINC000065857475 939987174 /nfs/dbraw/zinc/98/71/74/939987174.db2.gz RDSQSOZAXMSCIK-MRXNPFEDSA-N 1 1 371.412 3.893 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCc2ccccc2[C@@H]1C ZINC000411249661 940022194 /nfs/dbraw/zinc/02/21/94/940022194.db2.gz DSGISMPXTZZKJM-AWEZNQCLSA-N 1 1 369.421 3.551 20 5 FHBDMO C[C@](O)(C1CC[NH+](C/C=C\c2ccccc2[N+](=O)[O-])CC1)C(F)(F)F ZINC000545244332 940027833 /nfs/dbraw/zinc/02/78/33/940027833.db2.gz NMHAXTXCVYVCFK-LEXSJLIMSA-N 1 1 358.360 3.633 20 5 FHBDMO COc1c(O)ccc(C[NH2+][C@@H](C)c2ccccc2OC(F)F)c1[N+](=O)[O-] ZINC000892499999 940102692 /nfs/dbraw/zinc/10/26/92/940102692.db2.gz DGGTUTLBYQDZBM-JTQLQIEISA-N 1 1 368.336 3.761 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(N(C)c2ccccc2)CC1 ZINC000065957004 940121684 /nfs/dbraw/zinc/12/16/84/940121684.db2.gz QVRKAEIPUOGNBR-UHFFFAOYSA-N 1 1 355.438 3.704 20 5 FHBDMO C[C@H]1C[C@@H](C(F)(F)F)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411809095 940123806 /nfs/dbraw/zinc/12/38/06/940123806.db2.gz SYTJKRCVKGCSDO-RYUDHWBXSA-N 1 1 359.348 3.586 20 5 FHBDMO CC(C)[N@@H+](C)Cc1cccc(CNC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)c1 ZINC000255870646 940254484 /nfs/dbraw/zinc/25/44/84/940254484.db2.gz SWUOYZAHDYUQJD-XFXZXTDPSA-N 1 1 367.449 3.765 20 5 FHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H](O)c1ccc(F)c(F)c1 ZINC000066434579 940486905 /nfs/dbraw/zinc/48/69/05/940486905.db2.gz XLGXZVVMNOBKEV-GOSISDBHSA-N 1 1 350.365 3.817 20 5 FHBDMO CC1(C)C[C@@H]([NH2+]Cc2ccccc2S(C)(=O)=O)c2cc([N+](=O)[O-])ccc21 ZINC000414268335 940862211 /nfs/dbraw/zinc/86/22/11/940862211.db2.gz XATRSOQZULNSPJ-QGZVFWFLSA-N 1 1 374.462 3.511 20 5 FHBDMO COc1ccc(C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1OC ZINC000892617313 940977353 /nfs/dbraw/zinc/97/73/53/940977353.db2.gz VJMDESDBTVTXMG-UHFFFAOYSA-N 1 1 366.801 3.564 20 5 FHBDMO C[N@H+](Cc1ccccc1)CC1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000066676210 940984762 /nfs/dbraw/zinc/98/47/62/940984762.db2.gz MDPPODTUIUEATA-UHFFFAOYSA-N 1 1 367.449 3.579 20 5 FHBDMO C[C@@H]([NH2+]CC(=O)N(C)c1nc2ccccc2s1)c1cccc([N+](=O)[O-])c1 ZINC000180399200 941004086 /nfs/dbraw/zinc/00/40/86/941004086.db2.gz DDDMFHZRXWIIMD-GFCCVEGCSA-N 1 1 370.434 3.518 20 5 FHBDMO CC(C)c1ccc(C[N@H+]2CCSC3(CCOCC3)C2)cc1[N+](=O)[O-] ZINC000186482949 941008851 /nfs/dbraw/zinc/00/88/51/941008851.db2.gz CNERYNPGAXSJAA-UHFFFAOYSA-N 1 1 350.484 3.816 20 5 FHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H](CCO)c2ccccc2Br)cc1 ZINC000540995202 941085164 /nfs/dbraw/zinc/08/51/64/941085164.db2.gz BELZQAWOJKQUJF-INIZCTEOSA-N 1 1 365.227 3.571 20 5 FHBDMO Cc1cc(C[C@H](C)[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)n[nH]1 ZINC000180963890 941097896 /nfs/dbraw/zinc/09/78/96/941097896.db2.gz BVZWTHIRVUKKME-XOBRGWDASA-N 1 1 350.422 3.937 20 5 FHBDMO CC[N@@H+](Cc1ccc(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)cc1)C1CC1 ZINC000541070660 941159552 /nfs/dbraw/zinc/15/95/52/941159552.db2.gz MOPWWJWCLSJASO-UHFFFAOYSA-N 1 1 369.421 3.840 20 5 FHBDMO CCSc1cc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)ccn1 ZINC000189599579 941214446 /nfs/dbraw/zinc/21/44/46/941214446.db2.gz FNWDXEVTPPDOFK-UHFFFAOYSA-N 1 1 369.393 3.993 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H]1CC[N@H+](C)[C@@H]1c1ccccc1 ZINC000189717937 941267220 /nfs/dbraw/zinc/26/72/20/941267220.db2.gz DVNQTRJCFAOATO-QFBILLFUSA-N 1 1 368.437 3.779 20 5 FHBDMO CC(C)[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@@H]1CCC(=O)N1 ZINC000414556398 941378370 /nfs/dbraw/zinc/37/83/70/941378370.db2.gz KDEVEVHUQDOAPC-AWEZNQCLSA-N 1 1 373.478 3.812 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1ccccc1OCC[NH+](C)C ZINC000122340806 941549553 /nfs/dbraw/zinc/54/95/53/941549553.db2.gz VJLAQNKXMZSRPJ-INIZCTEOSA-N 1 1 357.454 3.694 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CC(C)(C)Oc2ccc(N)cc21 ZINC000415035216 941558168 /nfs/dbraw/zinc/55/81/68/941558168.db2.gz LVYZOENMWMMQQT-QGZVFWFLSA-N 1 1 371.437 3.968 20 5 FHBDMO CC1=C(c2ccco2)C[N@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000549162249 941560422 /nfs/dbraw/zinc/56/04/22/941560422.db2.gz OLVRYFFSJVFEOY-CQSZACIVSA-N 1 1 355.394 3.694 20 5 FHBDMO CC1=C(c2ccco2)C[N@@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000549162249 941560425 /nfs/dbraw/zinc/56/04/25/941560425.db2.gz OLVRYFFSJVFEOY-CQSZACIVSA-N 1 1 355.394 3.694 20 5 FHBDMO C[N@H+](CC(=O)NC(C)(C)C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000120653897 941724337 /nfs/dbraw/zinc/72/43/37/941724337.db2.gz RSQJDVIEORQOKJ-UHFFFAOYSA-N 1 1 361.467 3.670 20 5 FHBDMO C[N@@H+](CC(=O)NC(C)(C)C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000120653897 941724342 /nfs/dbraw/zinc/72/43/42/941724342.db2.gz RSQJDVIEORQOKJ-UHFFFAOYSA-N 1 1 361.467 3.670 20 5 FHBDMO COc1ccc(C[N@H+](C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)cc1 ZINC000103457518 941735637 /nfs/dbraw/zinc/73/56/37/941735637.db2.gz UIWMTMNMEYEJHO-UHFFFAOYSA-N 1 1 352.394 3.556 20 5 FHBDMO COc1ccc(C[N@@H+](C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)cc1 ZINC000103457518 941735641 /nfs/dbraw/zinc/73/56/41/941735641.db2.gz UIWMTMNMEYEJHO-UHFFFAOYSA-N 1 1 352.394 3.556 20 5 FHBDMO C[C@H]([NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc2n[nH]cc2c1 ZINC000513195497 941770667 /nfs/dbraw/zinc/77/06/67/941770667.db2.gz CQNILUPNWYFCRB-LBPRGKRZSA-N 1 1 363.377 3.977 20 5 FHBDMO COc1ccc([C@@H](C)[N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000072559303 941786569 /nfs/dbraw/zinc/78/65/69/941786569.db2.gz KLDTWGSKAMLWFL-CQSZACIVSA-N 1 1 357.410 3.543 20 5 FHBDMO COc1ccc([C@@H](C)[N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000072559303 941786571 /nfs/dbraw/zinc/78/65/71/941786571.db2.gz KLDTWGSKAMLWFL-CQSZACIVSA-N 1 1 357.410 3.543 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@H](C)C[C@H]1c1ccccc1 ZINC000513261190 941814195 /nfs/dbraw/zinc/81/41/95/941814195.db2.gz MCTCQNMHQWPKJF-KUHUBIRLSA-N 1 1 353.422 3.925 20 5 FHBDMO CC(C)[N@H+](CC(=O)N1CCC[C@@H]2CCCC[C@@H]21)Cc1ccc([N+](=O)[O-])cc1 ZINC000513405270 941899170 /nfs/dbraw/zinc/89/91/70/941899170.db2.gz FVVMCOACRVHKQX-ICSRJNTNSA-N 1 1 373.497 3.986 20 5 FHBDMO CC(C)[N@@H+](CC(=O)N1CCC[C@@H]2CCCC[C@@H]21)Cc1ccc([N+](=O)[O-])cc1 ZINC000513405270 941899173 /nfs/dbraw/zinc/89/91/73/941899173.db2.gz FVVMCOACRVHKQX-ICSRJNTNSA-N 1 1 373.497 3.986 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCN([C@H](C)c2cccnc2)CC1 ZINC000182807600 941970400 /nfs/dbraw/zinc/97/04/00/941970400.db2.gz YOJBYJLPGUSXRF-SJORKVTESA-N 1 1 354.454 3.738 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H](c2nnc(C3CC3)[nH]2)C1 ZINC000182975431 942042395 /nfs/dbraw/zinc/04/23/95/942042395.db2.gz SBUNOSYOFSCNMJ-ZFWWWQNUSA-N 1 1 355.442 3.839 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@H](c2nc(C3CC3)n[nH]2)C1 ZINC000182975431 942042402 /nfs/dbraw/zinc/04/24/02/942042402.db2.gz SBUNOSYOFSCNMJ-ZFWWWQNUSA-N 1 1 355.442 3.839 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H](c2nc(C3CC3)n[nH]2)C1 ZINC000182975431 942042407 /nfs/dbraw/zinc/04/24/07/942042407.db2.gz SBUNOSYOFSCNMJ-ZFWWWQNUSA-N 1 1 355.442 3.839 20 5 FHBDMO CCS(=O)(=O)c1ccc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000280014728 942086325 /nfs/dbraw/zinc/08/63/25/942086325.db2.gz GXQQHIJKLCLJIG-LBPRGKRZSA-N 1 1 368.480 3.609 20 5 FHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H](O)COc1ccc(C(C)(C)C)cc1 ZINC000501876644 942098726 /nfs/dbraw/zinc/09/87/26/942098726.db2.gz VEKQQQFFWBSMGA-GOSISDBHSA-N 1 1 372.465 3.764 20 5 FHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H](O)COc1ccc(C(C)(C)C)cc1 ZINC000501876644 942098730 /nfs/dbraw/zinc/09/87/30/942098730.db2.gz VEKQQQFFWBSMGA-GOSISDBHSA-N 1 1 372.465 3.764 20 5 FHBDMO COc1cc(C[N@H+]2CCC[C@@](C)(OC)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000280425240 942180974 /nfs/dbraw/zinc/18/09/74/942180974.db2.gz ZKFURCPEXBXQNO-QGZVFWFLSA-N 1 1 374.384 3.596 20 5 FHBDMO Cn1ccnc1[C@H]([NH2+][C@H]1C[C@H](c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000280618611 942214925 /nfs/dbraw/zinc/21/49/25/942214925.db2.gz FJZMFJNTECXLHU-QWFCFKBJSA-N 1 1 362.433 3.954 20 5 FHBDMO COc1ccc(C[N@H+](C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1C ZINC000103144768 942223747 /nfs/dbraw/zinc/22/37/47/942223747.db2.gz UPVNHXRHGKRBAV-OAHLLOKOSA-N 1 1 371.437 3.679 20 5 FHBDMO COc1ccc(C[N@@H+](C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1C ZINC000103144768 942223752 /nfs/dbraw/zinc/22/37/52/942223752.db2.gz UPVNHXRHGKRBAV-OAHLLOKOSA-N 1 1 371.437 3.679 20 5 FHBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@H](CC(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000420940548 942265557 /nfs/dbraw/zinc/26/55/57/942265557.db2.gz DMTJHZZCJCYZER-CYBMUJFWSA-N 1 1 373.375 3.896 20 5 FHBDMO O=C(CC[N@H+]1CCC[C@H](CC(F)(F)F)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000420943659 942268068 /nfs/dbraw/zinc/26/80/68/942268068.db2.gz IJFYILCRCXAWBB-GFCCVEGCSA-N 1 1 359.348 3.588 20 5 FHBDMO Cc1ccccc1C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000501101969 942308094 /nfs/dbraw/zinc/30/80/94/942308094.db2.gz CJHZYKHIUFQPHW-UHFFFAOYSA-N 1 1 353.422 3.896 20 5 FHBDMO CC[N@H+]1CCc2c(cccc2NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])C1 ZINC000378212188 942398266 /nfs/dbraw/zinc/39/82/66/942398266.db2.gz NWNZVGORRJJOAE-UHFFFAOYSA-N 1 1 361.348 3.503 20 5 FHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccc(OCC(F)F)cc1 ZINC000549407581 942473878 /nfs/dbraw/zinc/47/38/78/942473878.db2.gz GIGHZKSHJJNUNB-UHFFFAOYSA-N 1 1 350.365 3.913 20 5 FHBDMO C[C@H]1C[C@@H](CO)C[N@@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000421361027 942514329 /nfs/dbraw/zinc/51/43/29/942514329.db2.gz KCDPSHXHKFNLCI-GOEBONIOSA-N 1 1 374.412 3.977 20 5 FHBDMO CCOc1ccccc1N1CC[NH+](Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000501529728 942526946 /nfs/dbraw/zinc/52/69/46/942526946.db2.gz HDEQJSXKDFAYQI-UHFFFAOYSA-N 1 1 355.438 3.624 20 5 FHBDMO C[C@@H](O)C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C1CCCCC1 ZINC000104684939 942590042 /nfs/dbraw/zinc/59/00/42/942590042.db2.gz UWCRKYZPOYFOAE-OAHLLOKOSA-N 1 1 373.453 3.808 20 5 FHBDMO Cc1c2ccccc2oc1[C@H](C)[NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000183578488 942634257 /nfs/dbraw/zinc/63/42/57/942634257.db2.gz OCWFYCMKNGAHJA-LBPRGKRZSA-N 1 1 353.378 3.599 20 5 FHBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000514197736 942807968 /nfs/dbraw/zinc/80/79/68/942807968.db2.gz SDDVBLYLWGKVKH-ZDUSSCGKSA-N 1 1 357.376 3.782 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000421770956 942814477 /nfs/dbraw/zinc/81/44/77/942814477.db2.gz LDFSHFZDLGRBKQ-ROUUACIJSA-N 1 1 373.497 3.938 20 5 FHBDMO CC[N@H+](CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)CC(C)C ZINC000434678821 942849419 /nfs/dbraw/zinc/84/94/19/942849419.db2.gz KVVBKYPUWDGOSL-UHFFFAOYSA-N 1 1 362.455 3.635 20 5 FHBDMO CC(C)C[N@@H+](CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)C1CC1 ZINC000434696450 942869376 /nfs/dbraw/zinc/86/93/76/942869376.db2.gz ZCVCLARQEYGJEG-UHFFFAOYSA-N 1 1 374.466 3.777 20 5 FHBDMO Cc1ccc([C@]2(C)CC[N@H+](CC(=O)Nc3c(C)cccc3[N+](=O)[O-])C2)cc1 ZINC000434751848 942943028 /nfs/dbraw/zinc/94/30/28/942943028.db2.gz JDRUIZQVYQUTHA-OAQYLSRUSA-N 1 1 367.449 3.814 20 5 FHBDMO Cc1ccc([C@]2(C)CC[N@@H+](CC(=O)Nc3c(C)cccc3[N+](=O)[O-])C2)cc1 ZINC000434751848 942943036 /nfs/dbraw/zinc/94/30/36/942943036.db2.gz JDRUIZQVYQUTHA-OAQYLSRUSA-N 1 1 367.449 3.814 20 5 FHBDMO CC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccc(OC)c(OC)c1 ZINC000434836490 942994473 /nfs/dbraw/zinc/99/44/73/942994473.db2.gz ADFCZWBYGBAAET-UHFFFAOYSA-N 1 1 371.393 3.775 20 5 FHBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccc(OC)c(OC)c1 ZINC000434836490 942994475 /nfs/dbraw/zinc/99/44/75/942994475.db2.gz ADFCZWBYGBAAET-UHFFFAOYSA-N 1 1 371.393 3.775 20 5 FHBDMO COCC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@@H](C)c1ccccc1 ZINC000434894986 943032018 /nfs/dbraw/zinc/03/20/18/943032018.db2.gz JYRYLXIKEFCPPD-INIZCTEOSA-N 1 1 371.437 3.551 20 5 FHBDMO COCC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@@H](C)c1ccccc1 ZINC000434894986 943032020 /nfs/dbraw/zinc/03/20/20/943032020.db2.gz JYRYLXIKEFCPPD-INIZCTEOSA-N 1 1 371.437 3.551 20 5 FHBDMO O=C(NC[C@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1)Nc1ccccc1 ZINC000058754100 943145984 /nfs/dbraw/zinc/14/59/84/943145984.db2.gz JZQRUSMHLWEGMA-LJQANCHMSA-N 1 1 368.437 3.771 20 5 FHBDMO O=C(NC[C@H]1CCCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1)Nc1ccccc1 ZINC000058754100 943145986 /nfs/dbraw/zinc/14/59/86/943145986.db2.gz JZQRUSMHLWEGMA-LJQANCHMSA-N 1 1 368.437 3.771 20 5 FHBDMO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]C1CCN(C2CCC2)CC1 ZINC000513789025 943192732 /nfs/dbraw/zinc/19/27/32/943192732.db2.gz BGYOBQOOJATQGF-JXFKEZNVSA-N 1 1 357.498 3.913 20 5 FHBDMO COc1cccc(C[N@@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000505642125 943281330 /nfs/dbraw/zinc/28/13/30/943281330.db2.gz YHPIBIWNMOTLSX-UHFFFAOYSA-N 1 1 366.421 3.636 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000417000739 943283695 /nfs/dbraw/zinc/28/36/95/943283695.db2.gz RSJJVMBCTHCHEO-INIZCTEOSA-N 1 1 368.437 3.641 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000417000739 943283700 /nfs/dbraw/zinc/28/37/00/943283700.db2.gz RSJJVMBCTHCHEO-INIZCTEOSA-N 1 1 368.437 3.641 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CC[C@@H](c4ccccc4F)C3)n2)c1 ZINC000503653001 943321223 /nfs/dbraw/zinc/32/12/23/943321223.db2.gz BKSCIRUVBHMPKO-CQSZACIVSA-N 1 1 368.368 3.773 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CC[C@@H](c4ccccc4F)C3)n2)c1 ZINC000503653001 943321233 /nfs/dbraw/zinc/32/12/33/943321233.db2.gz BKSCIRUVBHMPKO-CQSZACIVSA-N 1 1 368.368 3.773 20 5 FHBDMO CC[C@@H]1C[C@H](C)C[N@H+]1CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000467208878 943480620 /nfs/dbraw/zinc/48/06/20/943480620.db2.gz VGAUTCRMPMPBDD-GXTWGEPZSA-N 1 1 374.466 3.777 20 5 FHBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H](NCC1([NH+]3CCCC3)CCOCC1)CCCC2 ZINC000417301378 943495016 /nfs/dbraw/zinc/49/50/16/943495016.db2.gz BJQURLCCXYELDK-FQEVSTJZSA-N 1 1 373.497 3.597 20 5 FHBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2NC[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000584790523 943610733 /nfs/dbraw/zinc/61/07/33/943610733.db2.gz QIFKAYXCBJFSNK-FXAWDEMLSA-N 1 1 351.450 3.694 20 5 FHBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000584790523 943610740 /nfs/dbraw/zinc/61/07/40/943610740.db2.gz QIFKAYXCBJFSNK-FXAWDEMLSA-N 1 1 351.450 3.694 20 5 FHBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C[C@@H]1CCN(Cc2ccccc2)C1 ZINC000584790523 943610745 /nfs/dbraw/zinc/61/07/45/943610745.db2.gz QIFKAYXCBJFSNK-FXAWDEMLSA-N 1 1 351.450 3.694 20 5 FHBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000425416283 943857959 /nfs/dbraw/zinc/85/79/59/943857959.db2.gz GBWAEGAYXHIQSH-JSGCOSHPSA-N 1 1 369.259 3.606 20 5 FHBDMO CCOc1ccc([C@H](C)NC[C@@H](Cc2ccccc2)[NH+](C)C)cc1[N+](=O)[O-] ZINC000504912353 943908551 /nfs/dbraw/zinc/90/85/51/943908551.db2.gz VBRAGELXKYYOQT-QFBILLFUSA-N 1 1 371.481 3.817 20 5 FHBDMO C[C@H](c1ccccc1)[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)C1CCCC1 ZINC000425460831 944004752 /nfs/dbraw/zinc/00/47/52/944004752.db2.gz TZDRJXXMKHXIME-MRXNPFEDSA-N 1 1 355.438 3.762 20 5 FHBDMO COc1cc([C@@H](C)[NH2+]Cc2ccc(Br)cc2[N+](=O)[O-])ccn1 ZINC000425460271 944006490 /nfs/dbraw/zinc/00/64/90/944006490.db2.gz RCBGLILSSLKJAO-SNVBAGLBSA-N 1 1 366.215 3.612 20 5 FHBDMO CN(C(=O)C[N@H+]1CCC[C@H](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000436122963 944037066 /nfs/dbraw/zinc/03/70/66/944037066.db2.gz GPLGWVXFXJWWEV-GOSISDBHSA-N 1 1 367.449 3.512 20 5 FHBDMO COc1c(C)cc(C[N@H+](C)[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cc1C ZINC000110293300 944090348 /nfs/dbraw/zinc/09/03/48/944090348.db2.gz OMOXLWSTHDUECW-HNNXBMFYSA-N 1 1 371.437 3.679 20 5 FHBDMO COc1c(C)cc(C[N@@H+](C)[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cc1C ZINC000110293300 944090357 /nfs/dbraw/zinc/09/03/57/944090357.db2.gz OMOXLWSTHDUECW-HNNXBMFYSA-N 1 1 371.437 3.679 20 5 FHBDMO C[C@@H]1[C@H](Cc2ccccc2)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500113229 944128913 /nfs/dbraw/zinc/12/89/13/944128913.db2.gz FPNQWWITSFDMRB-AEFFLSMTSA-N 1 1 367.449 3.877 20 5 FHBDMO Cc1ccc(C[C@H]2CCC[N@@H+]2CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000500219343 944287109 /nfs/dbraw/zinc/28/71/09/944287109.db2.gz WXCQUPIBLLCWOH-HXUWFJFHSA-N 1 1 367.449 3.573 20 5 FHBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1Nc1c2c(ccc1[N+](=O)[O-])NCC2 ZINC000436415100 944288795 /nfs/dbraw/zinc/28/87/95/944288795.db2.gz WKRWDBYMOZTQNV-YJBOKZPZSA-N 1 1 366.465 3.885 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](CCc1cccc(F)c1)C1CC1 ZINC000506479750 944316499 /nfs/dbraw/zinc/31/64/99/944316499.db2.gz JMEQYSVTOZYNRB-UHFFFAOYSA-N 1 1 371.412 3.688 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](CCc1cccc(F)c1)C1CC1 ZINC000506479750 944316508 /nfs/dbraw/zinc/31/65/08/944316508.db2.gz JMEQYSVTOZYNRB-UHFFFAOYSA-N 1 1 371.412 3.688 20 5 FHBDMO COc1ccc([C@@H]2CC[N@@H+](Cc3cc(OC)c(F)cc3[N+](=O)[O-])C2)cc1 ZINC000184259156 944355647 /nfs/dbraw/zinc/35/56/47/944355647.db2.gz UKGMASHPZDJGSU-CQSZACIVSA-N 1 1 360.385 3.741 20 5 FHBDMO COc1cc(C[N@@H+](C)CC(C)C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000506497135 944381534 /nfs/dbraw/zinc/38/15/34/944381534.db2.gz VBHNABSQUKBQKU-UHFFFAOYSA-N 1 1 350.337 3.632 20 5 FHBDMO O=[N+]([O-])c1cnn([C@H]2CCC[N@H+](Cc3cccn3Cc3cccs3)C2)c1 ZINC000364343581 944402665 /nfs/dbraw/zinc/40/26/65/944402665.db2.gz WXXSTXIELOLBJQ-INIZCTEOSA-N 1 1 371.466 3.540 20 5 FHBDMO O=[N+]([O-])c1cnn([C@H]2CCC[N@@H+](Cc3cccn3Cc3cccs3)C2)c1 ZINC000364343581 944402668 /nfs/dbraw/zinc/40/26/68/944402668.db2.gz WXXSTXIELOLBJQ-INIZCTEOSA-N 1 1 371.466 3.540 20 5 FHBDMO C[C@@H]1[C@H](CO)CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000425960786 944414237 /nfs/dbraw/zinc/41/42/37/944414237.db2.gz YWKAEBMJRIQEJL-NEPJUHHUSA-N 1 1 350.802 3.711 20 5 FHBDMO C[C@H]1[C@H](CO)CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000425960792 944414247 /nfs/dbraw/zinc/41/42/47/944414247.db2.gz YWKAEBMJRIQEJL-RYUDHWBXSA-N 1 1 350.802 3.711 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](c2ccccc2F)C1 ZINC000550208987 944425029 /nfs/dbraw/zinc/42/50/29/944425029.db2.gz DWNSGKFOVYBJPZ-OAHLLOKOSA-N 1 1 371.412 3.860 20 5 FHBDMO CCC[C@@H]([NH2+]Cc1cc(C)nc(N2CCCC2)n1)c1cccc([N+](=O)[O-])c1 ZINC000426325303 944447829 /nfs/dbraw/zinc/44/78/29/944447829.db2.gz IHLXPMJXTIWXFC-LJQANCHMSA-N 1 1 369.469 3.924 20 5 FHBDMO CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](C)[N@@H+](C)Cc2ccccc2)c1 ZINC000110355448 944455758 /nfs/dbraw/zinc/45/57/58/944455758.db2.gz DSVZQHUKULCLRS-AWEZNQCLSA-N 1 1 373.478 3.567 20 5 FHBDMO COc1cc(C[NH2+]Cc2ccccc2N(C)C(C)C)c([N+](=O)[O-])cc1OC ZINC000438334031 944503233 /nfs/dbraw/zinc/50/32/33/944503233.db2.gz JQDUHAQLIKIJAI-UHFFFAOYSA-N 1 1 373.453 3.746 20 5 FHBDMO CN(c1ccccc1)c1ccc(C[N@@H+](C)CC2(CO)CC2)cc1[N+](=O)[O-] ZINC000438339272 944519999 /nfs/dbraw/zinc/51/99/99/944519999.db2.gz NBUCGXOBXJSZKI-UHFFFAOYSA-N 1 1 355.438 3.567 20 5 FHBDMO CN(CCC1CCN(c2cc[nH+]cc2)CC1)Cc1csc([N+](=O)[O-])c1 ZINC000092821661 944520340 /nfs/dbraw/zinc/52/03/40/944520340.db2.gz HCPRCZDWXOMHCX-UHFFFAOYSA-N 1 1 360.483 3.790 20 5 FHBDMO CC(C)c1ccc(C(=O)Nc2c[nH+]ccc2-n2cccn2)cc1[N+](=O)[O-] ZINC000473801699 944539933 /nfs/dbraw/zinc/53/99/33/944539933.db2.gz WBSLZAUBLXGZQZ-UHFFFAOYSA-N 1 1 351.366 3.551 20 5 FHBDMO Cc1nc(N2CC[C@@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000133906359 944543617 /nfs/dbraw/zinc/54/36/17/944543617.db2.gz IHCFALDBXJCEER-UYAOXDASSA-N 1 1 366.465 3.789 20 5 FHBDMO Cn1cc[nH+]c1CC1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000110581106 944579910 /nfs/dbraw/zinc/57/99/10/944579910.db2.gz RJWBWXUHMORXRK-UHFFFAOYSA-N 1 1 368.359 3.806 20 5 FHBDMO C[C@H](C[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000066854645 944642488 /nfs/dbraw/zinc/64/24/88/944642488.db2.gz GAQUJFGEJXJYOC-CYBMUJFWSA-N 1 1 361.829 3.922 20 5 FHBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC000053749270 944853173 /nfs/dbraw/zinc/85/31/73/944853173.db2.gz OGFFDDHMQVIXOR-YOEHRIQHSA-N 1 1 354.410 3.552 20 5 FHBDMO COc1cc(C[N@@H+](C)CCOc2ccccc2[N+](=O)[O-])ccc1SC ZINC000507695143 945458848 /nfs/dbraw/zinc/45/88/48/945458848.db2.gz SJORGUMTSWGCFG-UHFFFAOYSA-N 1 1 362.451 3.836 20 5 FHBDMO CC[C@@H](C(=O)N[C@@H](C)c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000519488684 945461032 /nfs/dbraw/zinc/46/10/32/945461032.db2.gz RXCNQWVYMHQSPN-YJBOKZPZSA-N 1 1 355.438 3.683 20 5 FHBDMO C[C@@H]([NH2+]Cc1ccncc1OCC(F)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000281825177 945872269 /nfs/dbraw/zinc/87/22/69/945872269.db2.gz KKNGYWMLZIGMIZ-LLVKDONJSA-N 1 1 355.316 3.782 20 5 FHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(CO)CC2)ccc1Oc1ccc(F)cc1 ZINC000127079744 945926841 /nfs/dbraw/zinc/92/68/41/945926841.db2.gz QCLNKJQSGHTUSP-UHFFFAOYSA-N 1 1 360.385 3.731 20 5 FHBDMO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000444167891 946015815 /nfs/dbraw/zinc/01/58/15/946015815.db2.gz MRPPAOZORPMQEM-KUHUBIRLSA-N 1 1 371.412 3.780 20 5 FHBDMO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000444167891 946015820 /nfs/dbraw/zinc/01/58/20/946015820.db2.gz MRPPAOZORPMQEM-KUHUBIRLSA-N 1 1 371.412 3.780 20 5 FHBDMO CCC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000729482893 946023359 /nfs/dbraw/zinc/02/33/59/946023359.db2.gz DZGOZWUMADACDW-MRXNPFEDSA-N 1 1 363.458 3.816 20 5 FHBDMO CCOC(=O)[C@@H]1C[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])Cc2ccccc21 ZINC000441140772 946252899 /nfs/dbraw/zinc/25/28/99/946252899.db2.gz QWJRDKJUWKXDDS-KBXCAEBGSA-N 1 1 354.406 3.818 20 5 FHBDMO CCOC(=O)[C@@H]1C[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])Cc2ccccc21 ZINC000441140772 946252902 /nfs/dbraw/zinc/25/29/02/946252902.db2.gz QWJRDKJUWKXDDS-KBXCAEBGSA-N 1 1 354.406 3.818 20 5 FHBDMO C/C(=C/C(=O)NCCCC[N@@H+]1CCCC[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000785284472 946266790 /nfs/dbraw/zinc/26/67/90/946266790.db2.gz XKKLMSMGMBYLLQ-BHWVZIDZSA-N 1 1 359.470 3.769 20 5 FHBDMO O=C(C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)Nc1cccc(F)c1 ZINC000549551055 946312332 /nfs/dbraw/zinc/31/23/32/946312332.db2.gz QAEAYYSFPCEBKR-UHFFFAOYSA-N 1 1 369.352 3.722 20 5 FHBDMO COc1ccc(OCC[N@H+]2CCC[C@@H]2c2cccc(F)c2)c([N+](=O)[O-])c1 ZINC000441205005 946316478 /nfs/dbraw/zinc/31/64/78/946316478.db2.gz IAVOUVYDVODDFI-QGZVFWFLSA-N 1 1 360.385 3.958 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+](CCO)[C@H]3CCCSC3)o2)c1 ZINC000475488809 946418329 /nfs/dbraw/zinc/41/83/29/946418329.db2.gz RNEWMWHTHYORND-INIZCTEOSA-N 1 1 362.451 3.545 20 5 FHBDMO C[C@@H]1C[C@H](c2cccc(F)c2)[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000441344601 946493546 /nfs/dbraw/zinc/49/35/46/946493546.db2.gz IWMLTNZXGFFXHP-LXGCGDOSSA-N 1 1 374.412 3.557 20 5 FHBDMO COc1ccc(OCC[N@@H+](C)[C@H](C)Cc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000441392905 946549021 /nfs/dbraw/zinc/54/90/21/946549021.db2.gz DZOIMOBQMSMYKJ-MRXNPFEDSA-N 1 1 358.438 3.854 20 5 FHBDMO C[C@H]1C[NH+](Cc2ccccc2NCc2ccccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000475174154 946564331 /nfs/dbraw/zinc/56/43/31/946564331.db2.gz MYDXGTMIFFTKEK-HOTGVXAUSA-N 1 1 355.438 3.816 20 5 FHBDMO COc1ccc(C[NH+]2CCC(C(=O)c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000051379374 946690907 /nfs/dbraw/zinc/69/09/07/946690907.db2.gz CQFJWVRDGRZCRY-UHFFFAOYSA-N 1 1 354.406 3.698 20 5 FHBDMO CCSc1cccc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000473148832 946712841 /nfs/dbraw/zinc/71/28/41/946712841.db2.gz RIYAYZXSYCXBDH-OAHLLOKOSA-N 1 1 358.467 3.788 20 5 FHBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@@H](C)[N@@H+](C)Cc1ccccc1 ZINC000475575220 946723891 /nfs/dbraw/zinc/72/38/91/946723891.db2.gz QNJGFUSYSQUCDU-MRXNPFEDSA-N 1 1 370.453 3.854 20 5 FHBDMO C[C@@H]([NH2+][C@H](c1cnn(C)c1)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000186639428 946768981 /nfs/dbraw/zinc/76/89/81/946768981.db2.gz CBHHWXXEPLYFDR-YJYMSZOUSA-N 1 1 354.385 3.908 20 5 FHBDMO CSc1ccc(C(=O)NCCC[N@@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000018232700 947051482 /nfs/dbraw/zinc/05/14/82/947051482.db2.gz UCAHEULXSIROEF-UHFFFAOYSA-N 1 1 373.478 3.569 20 5 FHBDMO Cc1c(NC(=O)CC[N@H+](C)CC2(c3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000444687201 947089282 /nfs/dbraw/zinc/08/92/82/947089282.db2.gz UMLKGOCZWQIQBX-UHFFFAOYSA-N 1 1 367.449 3.895 20 5 FHBDMO CC[C@H]1CCCC[C@H]1[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000444667135 947094114 /nfs/dbraw/zinc/09/41/14/947094114.db2.gz AVMJRXBPSITRKX-WMLDXEAASA-N 1 1 363.458 3.833 20 5 FHBDMO COc1ccc(NC(=O)CC[N@@H+](C)Cc2cc(C)cc(C)c2)c([N+](=O)[O-])c1 ZINC000444701250 947128960 /nfs/dbraw/zinc/12/89/60/947128960.db2.gz GIURZIHLQDIBBT-UHFFFAOYSA-N 1 1 371.437 3.681 20 5 FHBDMO Cc1cc(C)cc(C[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1 ZINC000444704159 947130193 /nfs/dbraw/zinc/13/01/93/947130193.db2.gz LSWIKZMUTHCWCW-UHFFFAOYSA-N 1 1 355.438 3.981 20 5 FHBDMO C[C@H]1C[C@H](c2ccc(F)cc2)C[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000121491311 947140825 /nfs/dbraw/zinc/14/08/25/947140825.db2.gz QPXBQDMTZUEKOS-ZFWWWQNUSA-N 1 1 372.396 3.978 20 5 FHBDMO Cc1cc(C[N@@H+](C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)ccc1F ZINC000444744057 947180215 /nfs/dbraw/zinc/18/02/15/947180215.db2.gz NPWQCQLEKMCPLE-AWEZNQCLSA-N 1 1 359.401 3.810 20 5 FHBDMO Cc1cc(C[N@H+](C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)ccc1F ZINC000444744057 947180222 /nfs/dbraw/zinc/18/02/22/947180222.db2.gz NPWQCQLEKMCPLE-AWEZNQCLSA-N 1 1 359.401 3.810 20 5 FHBDMO O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC(CO)(Cc2ccccc2)CC1 ZINC000444790677 947230340 /nfs/dbraw/zinc/23/03/40/947230340.db2.gz JXBGSSBLRWWNCK-UHFFFAOYSA-N 1 1 358.413 3.551 20 5 FHBDMO Cc1c(C[N@H+](C[C@@H](O)COc2ccccc2)C(C)C)cccc1[N+](=O)[O-] ZINC000444820919 947255786 /nfs/dbraw/zinc/25/57/86/947255786.db2.gz XFXUKHLBKDLJEN-GOSISDBHSA-N 1 1 358.438 3.554 20 5 FHBDMO Cc1[nH+]ccn1-c1ccc([C@@H](C)NC(=O)c2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000150779931 947309189 /nfs/dbraw/zinc/30/91/89/947309189.db2.gz LYMMPHMAAPUZTL-GFCCVEGCSA-N 1 1 368.368 3.719 20 5 FHBDMO Cc1ccc(C(=O)N2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)cc1[N+](=O)[O-] ZINC000072810795 947350078 /nfs/dbraw/zinc/35/00/78/947350078.db2.gz OFNSBWBQFYUOET-DLBZAZTESA-N 1 1 359.470 3.630 20 5 FHBDMO C[N@H+](Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)C[C@H]1CCOC1 ZINC000093840156 947386720 /nfs/dbraw/zinc/38/67/20/947386720.db2.gz KNGZEQHIEFPLAC-OAHLLOKOSA-N 1 1 360.385 3.995 20 5 FHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000072837531 947569149 /nfs/dbraw/zinc/56/91/49/947569149.db2.gz ATLOIUSFRUUKAD-HOCLYGCPSA-N 1 1 365.499 3.838 20 5 FHBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000072837792 947570041 /nfs/dbraw/zinc/57/00/41/947570041.db2.gz UORBXCABYGZWPT-WCQYABFASA-N 1 1 371.890 3.793 20 5 FHBDMO COc1ccc(-c2ccc(C[N@@H+](CC(C)(C)O)C3CC3)o2)c([N+](=O)[O-])c1 ZINC000428399575 947699999 /nfs/dbraw/zinc/69/99/99/947699999.db2.gz LXSAWCWWKUBWDJ-UHFFFAOYSA-N 1 1 360.410 3.599 20 5 FHBDMO O=C([C@H]1CC[N@H+](C2CCCCC2)C1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000129530930 947789851 /nfs/dbraw/zinc/78/98/51/947789851.db2.gz VCLIACOIZKTPEH-KRWDZBQOSA-N 1 1 371.481 3.740 20 5 FHBDMO CC(C)(C)c1ccc([C@H]2CCC[N@H+]2CCn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC000536380339 947852398 /nfs/dbraw/zinc/85/23/98/947852398.db2.gz WWMHNAUKJJYSJW-LJQANCHMSA-N 1 1 369.465 3.891 20 5 FHBDMO COc1ccc(OCC[N@H+]2CCC[C@@H]2c2ccccc2OC)c([N+](=O)[O-])c1 ZINC000441489924 947972296 /nfs/dbraw/zinc/97/22/96/947972296.db2.gz PIHOQWLOWCZDEU-QGZVFWFLSA-N 1 1 372.421 3.828 20 5 FHBDMO Cc1cccc(C(=O)N2CC[N@H+](Cc3ccccc3)C(C)(C)C2)c1[N+](=O)[O-] ZINC000520526655 948226513 /nfs/dbraw/zinc/22/65/13/948226513.db2.gz GKNZDYGMCKTOGB-UHFFFAOYSA-N 1 1 367.449 3.640 20 5 FHBDMO Cc1cccc(C(=O)N2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)c1[N+](=O)[O-] ZINC000520526655 948226517 /nfs/dbraw/zinc/22/65/17/948226517.db2.gz GKNZDYGMCKTOGB-UHFFFAOYSA-N 1 1 367.449 3.640 20 5 FHBDMO CCC(C)(C)[C@H]1CCC[N@H+]1CCCn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000441649201 948454415 /nfs/dbraw/zinc/45/44/15/948454415.db2.gz RGMZYDDWZSRXIK-QGZVFWFLSA-N 1 1 361.442 3.793 20 5 FHBDMO COc1cc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)c([N+](=O)[O-])cc1F ZINC000574854961 948634087 /nfs/dbraw/zinc/63/40/87/948634087.db2.gz FYDUTTBXXQFIJC-YXJHDRRASA-N 1 1 366.433 3.648 20 5 FHBDMO CC(C)c1ccc(C[NH2+][C@@H](C[S@](C)=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000182097249 948662993 /nfs/dbraw/zinc/66/29/93/948662993.db2.gz VUUUCDAXQZDNIS-BVZFJXPGSA-N 1 1 360.479 3.928 20 5 FHBDMO O=[N+]([O-])c1c2cccnc2ccc1N1CC[NH+](Cc2cccs2)CC1 ZINC000051400859 136124205 /nfs/dbraw/zinc/12/42/05/136124205.db2.gz WUJOFCQVLYSEDQ-UHFFFAOYSA-N 1 1 354.435 3.527 20 5 FHBDMO CNC(=O)C[NH2+]Cc1ccc(Oc2cc(C)ccc2C(C)C)c([N+](=O)[O-])c1 ZINC000060842587 567855304 /nfs/dbraw/zinc/85/53/04/567855304.db2.gz AUCMTAXSRWATET-UHFFFAOYSA-N 1 1 371.437 3.655 20 5 FHBDMO Cc1ccncc1[C@@H](C)[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602583250 567994018 /nfs/dbraw/zinc/99/40/18/567994018.db2.gz WAXRBAOPQCGQCH-SECBINFHSA-N 1 1 356.245 3.973 20 5 FHBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@@H](O)Cc1ccccc1 ZINC000568306278 568018182 /nfs/dbraw/zinc/01/81/82/568018182.db2.gz XOKKKODHVOEGFX-KRWDZBQOSA-N 1 1 366.417 3.890 20 5 FHBDMO Cn1ccnc1[C@H]([NH2+][C@H]1C[C@H]1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000568660950 568113123 /nfs/dbraw/zinc/11/31/23/568113123.db2.gz ZALFKGOGCOWKCQ-YZGWKJHDSA-N 1 1 362.433 3.639 20 5 FHBDMO CS[C@H](C[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)C(C)(C)C ZINC000568671652 568116900 /nfs/dbraw/zinc/11/69/00/568116900.db2.gz ITDBALRHUQSPBM-CVEARBPZSA-N 1 1 362.499 3.785 20 5 FHBDMO O=[N+]([O-])c1ccc2ccnc(N3CC[NH+](Cc4ccsc4)CC3)c2c1 ZINC000568725956 568164390 /nfs/dbraw/zinc/16/43/90/568164390.db2.gz CKPQAZAFUOXFTQ-UHFFFAOYSA-N 1 1 354.435 3.527 20 5 FHBDMO Cc1cc2[nH]c(C[N@H+]3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)cc2c(C)c1 ZINC000482006408 568226387 /nfs/dbraw/zinc/22/63/87/568226387.db2.gz HLVGAZIZETYYJT-OAHLLOKOSA-N 1 1 365.437 3.774 20 5 FHBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000568921887 568252483 /nfs/dbraw/zinc/25/24/83/568252483.db2.gz ORSRYEYAVSFUSW-GOEBONIOSA-N 1 1 374.485 3.932 20 5 FHBDMO Cc1cnn([C@@H]2CC[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2)c1 ZINC000569310223 568361636 /nfs/dbraw/zinc/36/16/36/568361636.db2.gz IKCZVYXOZXONMQ-QGZVFWFLSA-N 1 1 352.394 3.807 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H](CC(=O)OC(C)(C)C)C1 ZINC000570232000 568463914 /nfs/dbraw/zinc/46/39/14/568463914.db2.gz MDAIHBSBLXAWFP-AWEZNQCLSA-N 1 1 364.442 3.547 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](CC(=O)OC(C)(C)C)C1 ZINC000570232000 568463915 /nfs/dbraw/zinc/46/39/15/568463915.db2.gz MDAIHBSBLXAWFP-AWEZNQCLSA-N 1 1 364.442 3.547 20 5 FHBDMO CCC[C@@H]([NH2+]Cc1nccn1CC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000482245176 568522664 /nfs/dbraw/zinc/52/26/64/568522664.db2.gz ZOFDUPIKJHIXIZ-CQSZACIVSA-N 1 1 356.348 3.985 20 5 FHBDMO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(-c3nn[nH]n3)cc2F)cc1[N+](=O)[O-] ZINC000826283223 609342735 /nfs/dbraw/zinc/34/27/35/609342735.db2.gz MZIBYNMEWSTVMP-VXGBXAGGSA-N 1 1 370.388 3.634 20 5 FHBDMO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(-c3nn[nH]n3)cc2F)cc1[N+](=O)[O-] ZINC000826283220 609342795 /nfs/dbraw/zinc/34/27/95/609342795.db2.gz MZIBYNMEWSTVMP-NEPJUHHUSA-N 1 1 370.388 3.634 20 5 FHBDMO O=[N+]([O-])c1cc(F)cnc1N1CCC[C@@]2(CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001164995347 722195694 /nfs/dbraw/zinc/19/56/94/722195694.db2.gz UWIKRXLHSPEMNL-LJQANCHMSA-N 1 1 374.391 3.513 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]2Cc2cccc(F)c2)c2c(c1)COCO2 ZINC000052034756 936343825 /nfs/dbraw/zinc/34/38/25/936343825.db2.gz KHPLAWAZHKPCDG-GOSISDBHSA-N 1 1 372.396 3.808 20 5 FHBDMO Cc1ccc(C(=O)NC[C@@H](c2ccccc2Cl)[NH+](C)C)cc1[N+](=O)[O-] ZINC000049409413 927034227 /nfs/dbraw/zinc/03/42/27/927034227.db2.gz DKCYIGRWQFQPEU-KRWDZBQOSA-N 1 1 361.829 3.589 20 5 FHBDMO CC[C@H]1C[N@@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)C[C@@H]1O ZINC000535810285 927769131 /nfs/dbraw/zinc/76/91/31/927769131.db2.gz BOOOBWONVHBRJP-JXFKEZNVSA-N 1 1 355.438 3.565 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1CN1CC[NH+]([C@@H](C)c2ccsc2)CC1 ZINC000430193544 927780852 /nfs/dbraw/zinc/78/08/52/927780852.db2.gz GPNAZDDJGPFVRX-AWEZNQCLSA-N 1 1 361.467 3.544 20 5 FHBDMO COC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1)c1cccc(Cl)c1 ZINC000583170022 937201542 /nfs/dbraw/zinc/20/15/42/937201542.db2.gz IGNLORPVHYTDGS-HNNXBMFYSA-N 1 1 350.802 3.734 20 5 FHBDMO COc1cc(F)c([N+](=O)[O-])c(N[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000302041871 928033360 /nfs/dbraw/zinc/03/33/60/928033360.db2.gz IKUMJLFUBZKHAD-QWHCGFSZSA-N 1 1 351.422 3.807 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](Cc1cccs1)C[C@@H]1CCCO1 ZINC000430211502 928124997 /nfs/dbraw/zinc/12/49/97/928124997.db2.gz AMCMLUKPTFRZRY-INIZCTEOSA-N 1 1 362.451 3.846 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](Cc1cccs1)C[C@@H]1CCCO1 ZINC000430211502 928125004 /nfs/dbraw/zinc/12/50/04/928125004.db2.gz AMCMLUKPTFRZRY-INIZCTEOSA-N 1 1 362.451 3.846 20 5 FHBDMO Cc1ccc([C@@H]2CCCC[N@H+]2C[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC000610215321 928171379 /nfs/dbraw/zinc/17/13/79/928171379.db2.gz ZJWGXJGTPVTHGY-FPOVZHCZSA-N 1 1 370.449 3.870 20 5 FHBDMO CC(C)[N@@H+](Cc1cn(C)nc1-c1cccnc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000154463625 928852829 /nfs/dbraw/zinc/85/28/29/928852829.db2.gz ZPBHYCZNFGQIRR-UHFFFAOYSA-N 1 1 365.437 3.801 20 5 FHBDMO O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000134533802 928989212 /nfs/dbraw/zinc/98/92/12/928989212.db2.gz SPJDTDCJCIAQJC-UHFFFAOYSA-N 1 1 373.840 3.596 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1CNC[C@@H](C)[N@H+](C)Cc1ccccc1 ZINC000609544514 929220431 /nfs/dbraw/zinc/22/04/31/929220431.db2.gz YWGQGUCGOWEPBH-MRXNPFEDSA-N 1 1 357.454 3.604 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1CNC[C@@H](C)[N@@H+](C)Cc1ccccc1 ZINC000609544514 929220444 /nfs/dbraw/zinc/22/04/44/929220444.db2.gz YWGQGUCGOWEPBH-MRXNPFEDSA-N 1 1 357.454 3.604 20 5 FHBDMO Cc1c(NC(=O)N2CC[C@@H]([N@@H+](C)Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000610317616 929885302 /nfs/dbraw/zinc/88/53/02/929885302.db2.gz IXBMBSVSLPMLGY-QGZVFWFLSA-N 1 1 368.437 3.641 20 5 FHBDMO CC[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@H](C)c1ccc(F)cc1 ZINC000516616598 945069679 /nfs/dbraw/zinc/06/96/79/945069679.db2.gz LQVAQCMVKHBZPY-KDOFPFPSSA-N 1 1 362.401 3.557 20 5 FHBDMO CCn1c(C)nc([N+](=O)[O-])c1N[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000379666638 930509881 /nfs/dbraw/zinc/50/98/81/930509881.db2.gz XFMQBKIFRHJLFD-PBHICJAKSA-N 1 1 357.458 3.585 20 5 FHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1Cc1c(F)cccc1[N+](=O)[O-] ZINC000610133900 930796388 /nfs/dbraw/zinc/79/63/88/930796388.db2.gz IRCNBXCMHCJKKL-MRXNPFEDSA-N 1 1 357.429 3.830 20 5 FHBDMO CC[C@@H]1c2ccccc2CC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC001167417103 930821551 /nfs/dbraw/zinc/82/15/51/930821551.db2.gz PSVMODGREIAJBY-LJQANCHMSA-N 1 1 353.422 3.851 20 5 FHBDMO CC[C@@H]1c2ccccc2CC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC001167417103 930821565 /nfs/dbraw/zinc/82/15/65/930821565.db2.gz PSVMODGREIAJBY-LJQANCHMSA-N 1 1 353.422 3.851 20 5 FHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H](c2ccccc2F)C1 ZINC000580577041 930872371 /nfs/dbraw/zinc/87/23/71/930872371.db2.gz DXZPMVJAUGOLPG-KGLIPLIRSA-N 1 1 357.385 3.550 20 5 FHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](c2ccccc2F)C1 ZINC000580577041 930872376 /nfs/dbraw/zinc/87/23/76/930872376.db2.gz DXZPMVJAUGOLPG-KGLIPLIRSA-N 1 1 357.385 3.550 20 5 FHBDMO CN(C)C(=O)C[C@@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000557479838 931061313 /nfs/dbraw/zinc/06/13/13/931061313.db2.gz QFVYRMPKRNWOMG-MRXNPFEDSA-N 1 1 361.829 3.557 20 5 FHBDMO Cn1cc(Br)cc1C[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000537724461 931218517 /nfs/dbraw/zinc/21/85/17/931218517.db2.gz DPGFFLSNYWKTID-ALCCZGGFSA-N 1 1 364.243 3.841 20 5 FHBDMO Cc1ccc([C@H](C)NC(=O)[C@@H](C)[N@@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000177875731 931430729 /nfs/dbraw/zinc/43/07/29/931430729.db2.gz GKGJUHOISQKZEI-JKSUJKDBSA-N 1 1 367.449 3.527 20 5 FHBDMO Cc1ccc([C@H](C)NC(=O)[C@@H](C)[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000177875731 931430733 /nfs/dbraw/zinc/43/07/33/931430733.db2.gz GKGJUHOISQKZEI-JKSUJKDBSA-N 1 1 367.449 3.527 20 5 FHBDMO COc1ccc(NC(=O)CC[N@H+]2CC[C@H]2c2cccc(F)c2)c([N+](=O)[O-])c1 ZINC000610505259 932014508 /nfs/dbraw/zinc/01/45/08/932014508.db2.gz DPJTZCGYGZTYMQ-KRWDZBQOSA-N 1 1 373.384 3.518 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H]1c1cccc(F)c1 ZINC000610505244 932016496 /nfs/dbraw/zinc/01/64/96/932016496.db2.gz DFVKIPBUGDFNBC-SFHVURJKSA-N 1 1 357.385 3.818 20 5 FHBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@@H]2c2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000610505303 932016789 /nfs/dbraw/zinc/01/67/89/932016789.db2.gz GGSVIAMMQYCXEP-GOSISDBHSA-N 1 1 357.385 3.818 20 5 FHBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000276237950 932118793 /nfs/dbraw/zinc/11/87/93/932118793.db2.gz LPFVXKCLWAISER-ZDUSSCGKSA-N 1 1 360.332 3.624 20 5 FHBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000276237950 932118797 /nfs/dbraw/zinc/11/87/97/932118797.db2.gz LPFVXKCLWAISER-ZDUSSCGKSA-N 1 1 360.332 3.624 20 5 FHBDMO Cc1sc(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000430654454 932614260 /nfs/dbraw/zinc/61/42/60/932614260.db2.gz RTIMHEDBONVMBG-CJNGLKHVSA-N 1 1 373.478 3.748 20 5 FHBDMO COCC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@@H](C)c1ccccc1 ZINC000610581526 933309154 /nfs/dbraw/zinc/30/91/54/933309154.db2.gz PDTCYVNIFJTDPV-AWEZNQCLSA-N 1 1 355.394 3.946 20 5 FHBDMO COCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@@H](C)c1ccccc1 ZINC000610581526 933309163 /nfs/dbraw/zinc/30/91/63/933309163.db2.gz PDTCYVNIFJTDPV-AWEZNQCLSA-N 1 1 355.394 3.946 20 5 FHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000610581384 933318997 /nfs/dbraw/zinc/31/89/97/933318997.db2.gz NLFRLRPULJWYBJ-LZWOXQAQSA-N 1 1 358.442 3.573 20 5 FHBDMO Cc1ccc(C[N@H+](CCc2ccccn2)Cc2cccnc2)cc1[N+](=O)[O-] ZINC000430863274 933336332 /nfs/dbraw/zinc/33/63/32/933336332.db2.gz GYNVDLAUTMHWFO-UHFFFAOYSA-N 1 1 362.433 3.938 20 5 FHBDMO Cc1ccc(C[N@@H+](CCc2ccccn2)Cc2cccnc2)cc1[N+](=O)[O-] ZINC000430863274 933336342 /nfs/dbraw/zinc/33/63/42/933336342.db2.gz GYNVDLAUTMHWFO-UHFFFAOYSA-N 1 1 362.433 3.938 20 5 FHBDMO O=[N+]([O-])c1cccc(OCC[N@@H+]2C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C2)c1 ZINC000610604852 933514428 /nfs/dbraw/zinc/51/44/28/933514428.db2.gz PQEMNZLUYLFBRK-TXEJJXNPSA-N 1 1 372.265 3.646 20 5 FHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C2)c1 ZINC000610604852 933514434 /nfs/dbraw/zinc/51/44/34/933514434.db2.gz PQEMNZLUYLFBRK-TXEJJXNPSA-N 1 1 372.265 3.646 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)NCc1ccccc1C[N@H+](C)C(C)C ZINC000510852497 933867409 /nfs/dbraw/zinc/86/74/09/933867409.db2.gz WIMOFNIKECFNKZ-UHFFFAOYSA-N 1 1 355.438 3.673 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H](CC(=O)OC(C)(C)C)C1 ZINC000610763274 934122550 /nfs/dbraw/zinc/12/25/50/934122550.db2.gz OIDZSYNJBYZXPD-CQSZACIVSA-N 1 1 364.442 3.547 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](CC(=O)OC(C)(C)C)C1 ZINC000610763274 934122552 /nfs/dbraw/zinc/12/25/52/934122552.db2.gz OIDZSYNJBYZXPD-CQSZACIVSA-N 1 1 364.442 3.547 20 5 FHBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+](Cc2ccccc2)CC2CCC2)c1 ZINC000065161298 934509409 /nfs/dbraw/zinc/50/94/09/934509409.db2.gz LCSWQBYMLXPBGO-FQEVSTJZSA-N 1 1 370.449 3.637 20 5 FHBDMO Cn1ccnc1[C@H]([NH2+]CC(C)(C)[C@@H]1CCCCO1)c1cccc([N+](=O)[O-])c1 ZINC000611560718 934851118 /nfs/dbraw/zinc/85/11/18/934851118.db2.gz BMFAJZSPEPSWSK-ZWKOTPCHSA-N 1 1 372.469 3.603 20 5 FHBDMO CC[N@H+]1CCC[C@H]1CNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000071808897 934875796 /nfs/dbraw/zinc/87/57/96/934875796.db2.gz FCGMEGINDMJUPG-KRWDZBQOSA-N 1 1 368.437 3.553 20 5 FHBDMO Cc1c(CN2C[C@@H]3C[N@H+](Cc4ccccc4)CC[C@@H]3C2)cccc1[N+](=O)[O-] ZINC000380853494 934938988 /nfs/dbraw/zinc/93/89/88/934938988.db2.gz CXMVGKZTZZCPDC-RTWAWAEBSA-N 1 1 365.477 3.857 20 5 FHBDMO Cn1cc(C[N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)cn1 ZINC000119660899 934979287 /nfs/dbraw/zinc/97/92/87/934979287.db2.gz NCEPNROKYGGWSQ-UHFFFAOYSA-N 1 1 360.801 3.874 20 5 FHBDMO Cn1cc(C[N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)cn1 ZINC000119660899 934979293 /nfs/dbraw/zinc/97/92/93/934979293.db2.gz NCEPNROKYGGWSQ-UHFFFAOYSA-N 1 1 360.801 3.874 20 5 FHBDMO CCO[C@@H]1C[C@H]([N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)C12CCCCC2 ZINC001167539096 935151546 /nfs/dbraw/zinc/15/15/46/935151546.db2.gz IUHPBQRTNYQEAQ-GBESFXJTSA-N 1 1 362.470 3.688 20 5 FHBDMO CC[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)Cc1ccccn1 ZINC000119857723 935298472 /nfs/dbraw/zinc/29/84/72/935298472.db2.gz MFNSFKJVDVLGLU-UHFFFAOYSA-N 1 1 352.394 3.709 20 5 FHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CC[C@@H](n2cnc3c2CCCC3)C1 ZINC000432113157 945102029 /nfs/dbraw/zinc/10/20/29/945102029.db2.gz FTFUZLLFSHEHBL-CYBMUJFWSA-N 1 1 360.845 3.771 20 5 FHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CC[C@@H](n2cnc3c2CCCC3)C1 ZINC000432113157 945102035 /nfs/dbraw/zinc/10/20/35/945102035.db2.gz FTFUZLLFSHEHBL-CYBMUJFWSA-N 1 1 360.845 3.771 20 5 FHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc(OCC(F)(F)F)nc1 ZINC000511104125 935581141 /nfs/dbraw/zinc/58/11/41/935581141.db2.gz GNHLGBBNPDOCRI-UHFFFAOYSA-N 1 1 369.343 3.605 20 5 FHBDMO CCc1ccc(NC(=O)[C@H](C)[N@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000511128533 935729084 /nfs/dbraw/zinc/72/90/84/935729084.db2.gz XGSZNLVBJIYJKZ-HNNXBMFYSA-N 1 1 355.438 3.659 20 5 FHBDMO CCc1ccc(NC(=O)[C@H](C)[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000511128533 935729087 /nfs/dbraw/zinc/72/90/87/935729087.db2.gz XGSZNLVBJIYJKZ-HNNXBMFYSA-N 1 1 355.438 3.659 20 5 FHBDMO CC(C)C[N@H+]1Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)c2C1 ZINC000158364500 935754701 /nfs/dbraw/zinc/75/47/01/935754701.db2.gz FNRBLGDEAXFTDX-UHFFFAOYSA-N 1 1 357.385 3.958 20 5 FHBDMO C[C@@H]([NH2+][C@@H](CO)c1ccccc1OC(F)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000479511250 935847738 /nfs/dbraw/zinc/84/77/38/935847738.db2.gz IJCFECHCWCCGGO-ABAIWWIYSA-N 1 1 370.327 3.878 20 5 FHBDMO COc1ccccc1C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C[C@H]1CCCO1 ZINC000051799266 935890104 /nfs/dbraw/zinc/89/01/04/935890104.db2.gz PRLKVPNJEZRBTM-LJQANCHMSA-N 1 1 356.422 3.785 20 5 FHBDMO COc1ccccc1C[N@H+](Cc1cccc([N+](=O)[O-])c1)C[C@H]1CCCO1 ZINC000051799266 935890108 /nfs/dbraw/zinc/89/01/08/935890108.db2.gz PRLKVPNJEZRBTM-LJQANCHMSA-N 1 1 356.422 3.785 20 5 FHBDMO CC[C@@H](c1ccccc1)[C@@H]1CCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000480107521 935964226 /nfs/dbraw/zinc/96/42/26/935964226.db2.gz XDRTZACMIPVMTB-OALUTQOASA-N 1 1 367.449 3.852 20 5 FHBDMO CCOC(=O)CC[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000611792892 936050017 /nfs/dbraw/zinc/05/00/17/936050017.db2.gz VGXZQMPUTSWXQD-CYBMUJFWSA-N 1 1 354.834 3.804 20 5 FHBDMO Cc1cc(C(=O)Nc2nc(C[NH+]3CCCCCC3)cs2)cc([N+](=O)[O-])c1 ZINC000121928746 936120915 /nfs/dbraw/zinc/12/09/15/936120915.db2.gz DRAGFEQNDVHJDP-UHFFFAOYSA-N 1 1 374.466 3.988 20 5 FHBDMO Cc1c(C[N@H+](C)CC(C)(C)CNC(=O)OC(C)(C)C)cccc1[N+](=O)[O-] ZINC001167618852 936140074 /nfs/dbraw/zinc/14/00/74/936140074.db2.gz HJFGLUYGSBSLQA-UHFFFAOYSA-N 1 1 365.474 3.886 20 5 FHBDMO CC(C)(C)[N@H+](Cc1ccccc1)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000612092590 936161698 /nfs/dbraw/zinc/16/16/98/936161698.db2.gz ALPUREZYWUFDHP-QGZVFWFLSA-N 1 1 358.438 3.635 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)cnc1NCCc1[nH+]ccn1Cc1ccccc1 ZINC000153559111 936268270 /nfs/dbraw/zinc/26/82/70/936268270.db2.gz VHRKWPNICNWZRE-UHFFFAOYSA-N 1 1 357.801 3.543 20 5 FHBDMO Cc1ccc(C[N@@H+]2CC[C@@H](CN(C)Cc3ccccc3[N+](=O)[O-])C2)s1 ZINC000582931545 936302627 /nfs/dbraw/zinc/30/26/27/936302627.db2.gz YIPHLEAVGAHIED-INIZCTEOSA-N 1 1 359.495 3.919 20 5 FHBDMO Cc1noc([C@@H]2CCC[N@H+](Cc3ccc([N+](=O)[O-])cc3C(F)(F)F)C2)n1 ZINC000178921637 938300413 /nfs/dbraw/zinc/30/04/13/938300413.db2.gz WMGFEWGIZNLJHM-GFCCVEGCSA-N 1 1 370.331 3.685 20 5 FHBDMO Cc1noc([C@@H]2CCC[N@@H+](Cc3ccc([N+](=O)[O-])cc3C(F)(F)F)C2)n1 ZINC000178921637 938300414 /nfs/dbraw/zinc/30/04/14/938300414.db2.gz WMGFEWGIZNLJHM-GFCCVEGCSA-N 1 1 370.331 3.685 20 5 FHBDMO C[N@H+](Cc1cc2ccccc2o1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000472293561 938305643 /nfs/dbraw/zinc/30/56/43/938305643.db2.gz KTYQZKABJLNNQA-GOSISDBHSA-N 1 1 365.389 3.578 20 5 FHBDMO C[N@@H+](Cc1cc2ccccc2o1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000472293561 938305645 /nfs/dbraw/zinc/30/56/45/938305645.db2.gz KTYQZKABJLNNQA-GOSISDBHSA-N 1 1 365.389 3.578 20 5 FHBDMO Cc1c(NC(=O)CC[N@@H+](C)CCCc2ccccc2)cccc1[N+](=O)[O-] ZINC000052802808 938597008 /nfs/dbraw/zinc/59/70/08/938597008.db2.gz FDQZLJFYMYVBGX-UHFFFAOYSA-N 1 1 355.438 3.796 20 5 FHBDMO C[N@H+](Cc1csc2ccccc12)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000052805977 938605026 /nfs/dbraw/zinc/60/50/26/938605026.db2.gz OALGMAUFVXDHFZ-UHFFFAOYSA-N 1 1 355.419 3.540 20 5 FHBDMO C[N@@H+](Cc1csc2ccccc12)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000052805977 938605030 /nfs/dbraw/zinc/60/50/30/938605030.db2.gz OALGMAUFVXDHFZ-UHFFFAOYSA-N 1 1 355.419 3.540 20 5 FHBDMO Cc1cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)cc(N2CCCC2)n1 ZINC000289895455 938873490 /nfs/dbraw/zinc/87/34/90/938873490.db2.gz SXQRCKYMTXRWHH-UHFFFAOYSA-N 1 1 360.845 3.842 20 5 FHBDMO Cc1c(C(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)cccc1[N+](=O)[O-] ZINC000140194141 938945318 /nfs/dbraw/zinc/94/53/18/938945318.db2.gz GZEYNYUEIGEPPT-OAHLLOKOSA-N 1 1 373.478 3.607 20 5 FHBDMO C[C@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000511294230 938991758 /nfs/dbraw/zinc/99/17/58/938991758.db2.gz QNCNZNKKYUVMKH-UONOGXRCSA-N 1 1 371.437 3.724 20 5 FHBDMO COc1cc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])ccc1OC(F)F ZINC000061761101 939003641 /nfs/dbraw/zinc/00/36/41/939003641.db2.gz YLXFXCNMWXQXFF-UHFFFAOYSA-N 1 1 352.337 3.837 20 5 FHBDMO COc1cc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])ccc1OC(F)F ZINC000061761101 939003642 /nfs/dbraw/zinc/00/36/42/939003642.db2.gz YLXFXCNMWXQXFF-UHFFFAOYSA-N 1 1 352.337 3.837 20 5 FHBDMO C[C@@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H]1c1cccc(F)c1 ZINC000472351504 939014419 /nfs/dbraw/zinc/01/44/19/939014419.db2.gz SQDWFAGQFRISGH-WNYOCNMUSA-N 1 1 374.412 3.557 20 5 FHBDMO O=[N+]([O-])c1cccc2c(N3C[C@@H]4C[N@H+](Cc5ccccc5)C[C@@H]4C3)ccnc21 ZINC000432172685 945263498 /nfs/dbraw/zinc/26/34/98/945263498.db2.gz QDVWUSAFEVEIDC-HDICACEKSA-N 1 1 374.444 3.711 20 5 FHBDMO O=C(C[N@H+]1C[C@H](c2ccccc2)[C@@H]2CCC[C@@H]21)Nc1ccccc1[N+](=O)[O-] ZINC000511845872 945266387 /nfs/dbraw/zinc/26/63/87/945266387.db2.gz XUFOPIZIRRQYCI-SCTDSRPQSA-N 1 1 365.433 3.801 20 5 FHBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNCc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000518265535 945269890 /nfs/dbraw/zinc/26/98/90/945269890.db2.gz ZFQSXFOYURZMET-CYBMUJFWSA-N 1 1 371.428 3.796 20 5 FHBDMO C[C@@H]1CCCN(C(C)(C)C[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000518265535 945269900 /nfs/dbraw/zinc/26/99/00/945269900.db2.gz ZFQSXFOYURZMET-CYBMUJFWSA-N 1 1 371.428 3.796 20 5 FHBDMO Cc1cccc(C(=O)Nc2ccc([C@H](C)[NH+]3CCOCC3)cc2)c1[N+](=O)[O-] ZINC000106405428 945271629 /nfs/dbraw/zinc/27/16/29/945271629.db2.gz DMJCJHPMFGVKLG-HNNXBMFYSA-N 1 1 369.421 3.549 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@H](c2nnc(C3CC3)[nH]2)C1 ZINC000179518462 939876463 /nfs/dbraw/zinc/87/64/63/939876463.db2.gz YTSSKPGYOMZYJG-ZDUSSCGKSA-N 1 1 361.833 3.623 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@H](c2nnc(C3CC3)[nH]2)C1 ZINC000179518462 939876468 /nfs/dbraw/zinc/87/64/68/939876468.db2.gz YTSSKPGYOMZYJG-ZDUSSCGKSA-N 1 1 361.833 3.623 20 5 FHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2cncc(Br)c2)C2CC2)cc1 ZINC000179521663 939877197 /nfs/dbraw/zinc/87/71/97/939877197.db2.gz BLNWZFRTSJWBCB-UHFFFAOYSA-N 1 1 362.227 3.917 20 5 FHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cncc(Br)c2)C2CC2)cc1 ZINC000179521663 939877199 /nfs/dbraw/zinc/87/71/99/939877199.db2.gz BLNWZFRTSJWBCB-UHFFFAOYSA-N 1 1 362.227 3.917 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CCC[N@H+](C2CCCC2)CC1 ZINC000179596289 939896280 /nfs/dbraw/zinc/89/62/80/939896280.db2.gz JLZTTWOFLPSRJW-UHFFFAOYSA-N 1 1 359.470 3.611 20 5 FHBDMO CCc1[nH+]ccn1C[C@H]1CCCN1C(=O)Nc1cc(C)c([N+](=O)[O-])cc1C ZINC000364539655 939961207 /nfs/dbraw/zinc/96/12/07/939961207.db2.gz QBAFGPSLTRLUPO-OAHLLOKOSA-N 1 1 371.441 3.667 20 5 FHBDMO COc1ccc(NC(=O)CC[N@@H+](C)[C@@H]2CCc3ccccc32)c([N+](=O)[O-])c1 ZINC000411156864 940004846 /nfs/dbraw/zinc/00/48/46/940004846.db2.gz RUZDTNDWMQQESY-GOSISDBHSA-N 1 1 369.421 3.551 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH+]3CCC([C@@H]4CCOC4)CC3)cs2)c1 ZINC000612402111 940047914 /nfs/dbraw/zinc/04/79/14/940047914.db2.gz JVQLOOZEHOJLEJ-MRXNPFEDSA-N 1 1 373.478 3.967 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2ncnc3cccc([N+](=O)[O-])c32)C1 ZINC000612444840 940072402 /nfs/dbraw/zinc/07/24/02/940072402.db2.gz WSXNTSGQJGPOAB-CVEARBPZSA-N 1 1 369.469 3.629 20 5 FHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CC3(CCOCC3)[C@@H]2c2ccccc2)cc1 ZINC000411998698 940180298 /nfs/dbraw/zinc/18/02/98/940180298.db2.gz LNHMUUKNOXNRHB-FQEVSTJZSA-N 1 1 368.433 3.827 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCC[C@@H](c4ncc[nH]4)C3)cs2)c1 ZINC000092071448 940317474 /nfs/dbraw/zinc/31/74/74/940317474.db2.gz KVHXUEOIYNNPFI-CQSZACIVSA-N 1 1 369.450 3.821 20 5 FHBDMO C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)no1 ZINC000612955431 940358680 /nfs/dbraw/zinc/35/86/80/940358680.db2.gz ZMEXLEBVZSWZIP-BDHPRHBFSA-N 1 1 354.410 3.879 20 5 FHBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000580017290 940431902 /nfs/dbraw/zinc/43/19/02/940431902.db2.gz YHWKLMJVUPRSDZ-HNAYVOBHSA-N 1 1 372.469 3.638 20 5 FHBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCC[C@H](Cc2csc3ccccc23)C1 ZINC000466923141 940463731 /nfs/dbraw/zinc/46/37/31/940463731.db2.gz AAQILMXUUJMSBF-CQSZACIVSA-N 1 1 370.478 3.998 20 5 FHBDMO C[N@H+]1CCCC12CCN(c1ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n1)CC2 ZINC000580267021 940471429 /nfs/dbraw/zinc/47/14/29/940471429.db2.gz RVIDKFQGHUHBOB-UHFFFAOYSA-N 1 1 370.428 3.861 20 5 FHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@@H](CC2CC2)C1 ZINC000580336088 940473203 /nfs/dbraw/zinc/47/32/03/940473203.db2.gz XPBFGMJTPFNYLR-AAEUAGOBSA-N 1 1 351.834 3.697 20 5 FHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@@H](CC2CC2)C1 ZINC000580336088 940473204 /nfs/dbraw/zinc/47/32/04/940473204.db2.gz XPBFGMJTPFNYLR-AAEUAGOBSA-N 1 1 351.834 3.697 20 5 FHBDMO CCC[N@@H+](CC(=O)N(C)C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000511475079 940506432 /nfs/dbraw/zinc/50/64/32/940506432.db2.gz UAFPJAYYJGCGQH-UHFFFAOYSA-N 1 1 361.467 3.624 20 5 FHBDMO C[N@H+](Cc1ccccc1)CC1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000066676390 940997109 /nfs/dbraw/zinc/99/71/09/940997109.db2.gz NCGOARZNUWKCQU-UHFFFAOYSA-N 1 1 367.449 3.579 20 5 FHBDMO COc1cc(C[NH2+][C@@H]2CCOc3c(C)cccc32)c([N+](=O)[O-])cc1OC ZINC000188878635 941127646 /nfs/dbraw/zinc/12/76/46/941127646.db2.gz LKPPNKUGFTYGKN-OAHLLOKOSA-N 1 1 358.394 3.534 20 5 FHBDMO C[C@H]([NH2+]C1CCN(CCc2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000178643944 941290207 /nfs/dbraw/zinc/29/02/07/941290207.db2.gz SZEDUXMONHQCJS-KRWDZBQOSA-N 1 1 353.466 3.953 20 5 FHBDMO CC(C)NC(=O)[C@@H](C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414548650 941377261 /nfs/dbraw/zinc/37/72/61/941377261.db2.gz YBURQJDYVBWHAX-LLVKDONJSA-N 1 1 365.817 3.511 20 5 FHBDMO O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1Cl ZINC000311785842 941380167 /nfs/dbraw/zinc/38/01/67/941380167.db2.gz LKEJGULTTWRBQR-OAHLLOKOSA-N 1 1 373.840 3.500 20 5 FHBDMO O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1Cl ZINC000311785839 941380344 /nfs/dbraw/zinc/38/03/44/941380344.db2.gz LKEJGULTTWRBQR-HNNXBMFYSA-N 1 1 373.840 3.500 20 5 FHBDMO Cc1c[nH+]cn1C1CCN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000376742602 941410443 /nfs/dbraw/zinc/41/04/43/941410443.db2.gz OUKZYUPHIFXZIQ-UHFFFAOYSA-N 1 1 352.341 3.543 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCCNCc3cccnc3)o2)cc1 ZINC000414879501 941498615 /nfs/dbraw/zinc/49/86/15/941498615.db2.gz OUQMASWKCVPFGQ-UHFFFAOYSA-N 1 1 366.421 3.519 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@@H]1CNCC[C@H]1c1ccc(F)c(F)c1 ZINC000414948945 941524550 /nfs/dbraw/zinc/52/45/50/941524550.db2.gz MXRQDQXRMQCFIA-ISRNJUKQSA-N 1 1 373.403 3.622 20 5 FHBDMO COc1ccc(OCC[N@H+]2CCC(C)=C(c3ccco3)C2)c([N+](=O)[O-])c1 ZINC000549158912 941555289 /nfs/dbraw/zinc/55/52/89/941555289.db2.gz FIVABVSYDDWNMU-UHFFFAOYSA-N 1 1 358.394 3.755 20 5 FHBDMO CC(C)c1cccc(NC(=O)C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000549170906 941577147 /nfs/dbraw/zinc/57/71/47/941577147.db2.gz FPNPTUHKOMYPHV-UHFFFAOYSA-N 1 1 355.438 3.831 20 5 FHBDMO CC(C)c1cccc(NC(=O)C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000549170906 941577151 /nfs/dbraw/zinc/57/71/51/941577151.db2.gz FPNPTUHKOMYPHV-UHFFFAOYSA-N 1 1 355.438 3.831 20 5 FHBDMO CC(C)(C)O[C@@H]1C[C@H]([NH2+]Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1(C)C ZINC000412065098 941619516 /nfs/dbraw/zinc/61/95/16/941619516.db2.gz FNTQETBUEHIDJO-LSDHHAIUSA-N 1 1 374.441 3.717 20 5 FHBDMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@@H](c3ccc(Cl)cc3)[C@H](CO)C2)cc1F ZINC000377647775 941867901 /nfs/dbraw/zinc/86/79/01/941867901.db2.gz SRXHCTHHWYMWKC-HOCLYGCPSA-N 1 1 364.804 3.595 20 5 FHBDMO CC(C)[N@H+](CC(=O)N1c2ccccc2C[C@H]1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000513391484 941887795 /nfs/dbraw/zinc/88/77/95/941887795.db2.gz CLDAGPWSTUWXPD-MRXNPFEDSA-N 1 1 367.449 3.783 20 5 FHBDMO CC(C)[N@@H+](CC(=O)N1c2ccccc2C[C@H]1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000513391484 941887800 /nfs/dbraw/zinc/88/78/00/941887800.db2.gz CLDAGPWSTUWXPD-MRXNPFEDSA-N 1 1 367.449 3.783 20 5 FHBDMO COc1ccccc1O[C@H]1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000513392650 941888622 /nfs/dbraw/zinc/88/86/22/941888622.db2.gz VLELKPSRABAXHO-SFHVURJKSA-N 1 1 356.422 3.689 20 5 FHBDMO CC(C)[N@H+](CC(=O)N([C@@H](C)C1CC1)C1CC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000513397188 941890929 /nfs/dbraw/zinc/89/09/29/941890929.db2.gz JUDRYIQZYJDGQS-HNNXBMFYSA-N 1 1 359.470 3.595 20 5 FHBDMO CC(C)[N@@H+](CC(=O)N([C@@H](C)C1CC1)C1CC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000513397188 941890934 /nfs/dbraw/zinc/89/09/34/941890934.db2.gz JUDRYIQZYJDGQS-HNNXBMFYSA-N 1 1 359.470 3.595 20 5 FHBDMO CC[C@@H]([NH2+]Cc1ccc(O)c(OC)c1[N+](=O)[O-])c1cc(F)ccc1F ZINC000893019866 941894981 /nfs/dbraw/zinc/89/49/81/941894981.db2.gz UBSSVWQUQNQNQV-CQSZACIVSA-N 1 1 352.337 3.828 20 5 FHBDMO CC(C)[N@H+](CC(=O)N(C)CC1CCCCC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000513400890 941896966 /nfs/dbraw/zinc/89/69/66/941896966.db2.gz HBZMPVPDWQTDKS-UHFFFAOYSA-N 1 1 361.486 3.844 20 5 FHBDMO CC(C)[N@@H+](CC(=O)N(C)CC1CCCCC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000513400890 941896968 /nfs/dbraw/zinc/89/69/68/941896968.db2.gz HBZMPVPDWQTDKS-UHFFFAOYSA-N 1 1 361.486 3.844 20 5 FHBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@H]1CCN(C2CC2)C1 ZINC000513503538 941966811 /nfs/dbraw/zinc/96/68/11/941966811.db2.gz SWMKDAXDRQGRLH-HNNXBMFYSA-N 1 1 357.479 3.992 20 5 FHBDMO CN(Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@H]1CC[N@@H+](C2CC2)C1 ZINC000513503538 941966815 /nfs/dbraw/zinc/96/68/15/941966815.db2.gz SWMKDAXDRQGRLH-HNNXBMFYSA-N 1 1 357.479 3.992 20 5 FHBDMO CN(Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000513503538 941966818 /nfs/dbraw/zinc/96/68/18/941966818.db2.gz SWMKDAXDRQGRLH-HNNXBMFYSA-N 1 1 357.479 3.992 20 5 FHBDMO C[C@H](Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182817178 941971722 /nfs/dbraw/zinc/97/17/22/941971722.db2.gz MTLCLZHGEVLJCV-DZGCQCFKSA-N 1 1 372.469 3.544 20 5 FHBDMO C[C@H](Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182817222 941972084 /nfs/dbraw/zinc/97/20/84/941972084.db2.gz MTLCLZHGEVLJCV-ZFWWWQNUSA-N 1 1 372.469 3.544 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)Cc1cn(C)nc1C(F)(F)F ZINC000182920329 941988248 /nfs/dbraw/zinc/98/82/48/941988248.db2.gz OIBACJHXPKQYGF-LLVKDONJSA-N 1 1 356.348 3.849 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)Cc1cn(C)nc1C(F)(F)F ZINC000182920329 941988249 /nfs/dbraw/zinc/98/82/49/941988249.db2.gz OIBACJHXPKQYGF-LLVKDONJSA-N 1 1 356.348 3.849 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)Cc1cn(C)nc1C(F)(F)F ZINC000182920347 941988287 /nfs/dbraw/zinc/98/82/87/941988287.db2.gz OIBACJHXPKQYGF-NSHDSACASA-N 1 1 356.348 3.849 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)Cc1cn(C)nc1C(F)(F)F ZINC000182920347 941988289 /nfs/dbraw/zinc/98/82/89/941988289.db2.gz OIBACJHXPKQYGF-NSHDSACASA-N 1 1 356.348 3.849 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@H]1Cn1cc[nH+]c1C(C)C ZINC000377797560 941994465 /nfs/dbraw/zinc/99/44/65/941994465.db2.gz XLYWLTWIQKFKBO-INIZCTEOSA-N 1 1 356.426 3.528 20 5 FHBDMO C[C@H](C[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000513684655 942075069 /nfs/dbraw/zinc/07/50/69/942075069.db2.gz UAARNEOPDKESJI-KUHUBIRLSA-N 1 1 368.412 3.950 20 5 FHBDMO C/C(=C\c1ccccc1)C[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000501871809 942090823 /nfs/dbraw/zinc/09/08/23/942090823.db2.gz GSODVLRJODLXKJ-JQIJEIRASA-N 1 1 353.422 3.959 20 5 FHBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H](CC(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000420940549 942265848 /nfs/dbraw/zinc/26/58/48/942265848.db2.gz DMTJHZZCJCYZER-ZDUSSCGKSA-N 1 1 373.375 3.896 20 5 FHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420955298 942274378 /nfs/dbraw/zinc/27/43/78/942274378.db2.gz WEWXKOZEMIEEIP-NWDGAFQWSA-N 1 1 359.348 3.586 20 5 FHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420955298 942274381 /nfs/dbraw/zinc/27/43/81/942274381.db2.gz WEWXKOZEMIEEIP-NWDGAFQWSA-N 1 1 359.348 3.586 20 5 FHBDMO O=[N+]([O-])c1cc(C[NH2+][C@@H](CC(F)F)c2ccccc2)c2c(c1)COCO2 ZINC000420987202 942283010 /nfs/dbraw/zinc/28/30/10/942283010.db2.gz ONIAVLITTVEHNS-INIZCTEOSA-N 1 1 364.348 3.947 20 5 FHBDMO CCC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccc(F)cc1 ZINC000501079908 942299173 /nfs/dbraw/zinc/29/91/73/942299173.db2.gz UUUVJHZIRARPLF-UHFFFAOYSA-N 1 1 359.401 3.975 20 5 FHBDMO Cc1ccccc1[C@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000501112609 942315451 /nfs/dbraw/zinc/31/54/51/942315451.db2.gz ZSBDMHAGFGNCKL-INIZCTEOSA-N 1 1 353.422 3.721 20 5 FHBDMO COc1ccc2c(c1OC)CC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])C2 ZINC000501122577 942320448 /nfs/dbraw/zinc/32/04/48/942320448.db2.gz RMFVCWNKXJKCDN-ALCCZGGFSA-N 1 1 354.406 3.684 20 5 FHBDMO COc1ccc2c(c1OC)CC[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])C2 ZINC000501122577 942320454 /nfs/dbraw/zinc/32/04/54/942320454.db2.gz RMFVCWNKXJKCDN-ALCCZGGFSA-N 1 1 354.406 3.684 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CC[C@H](O)CC34CCC4)cs2)c1 ZINC000421377594 942527571 /nfs/dbraw/zinc/52/75/71/942527571.db2.gz TZQYDHXQRNJGOW-INIZCTEOSA-N 1 1 359.451 3.598 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CC[C@H](O)CC34CCC4)cs2)c1 ZINC000421377594 942527576 /nfs/dbraw/zinc/52/75/76/942527576.db2.gz TZQYDHXQRNJGOW-INIZCTEOSA-N 1 1 359.451 3.598 20 5 FHBDMO CCC(=O)c1ccc(NC[C@@H]2CC[N@@H+](C)[C@H]2c2cccnc2)c([N+](=O)[O-])c1 ZINC000366539092 942555199 /nfs/dbraw/zinc/55/51/99/942555199.db2.gz NTBZMSJEOYRFMT-JXFKEZNVSA-N 1 1 368.437 3.687 20 5 FHBDMO CCCn1cc[nH+]c1CCCN(C)c1nccc2ccc([N+](=O)[O-])cc21 ZINC000413273746 942595831 /nfs/dbraw/zinc/59/58/31/942595831.db2.gz ZRPDGLYKVHMKBX-UHFFFAOYSA-N 1 1 353.426 3.819 20 5 FHBDMO Cc1ccc([C@@H]2CC[N@H+]([C@@H](C)C(=O)Nc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000541389608 942671897 /nfs/dbraw/zinc/67/18/97/942671897.db2.gz RNWMDVFYPRLOSL-DOTOQJQBSA-N 1 1 353.422 3.720 20 5 FHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)C1CCN(CCc2ccncc2)CC1 ZINC000378438400 942773213 /nfs/dbraw/zinc/77/32/13/942773213.db2.gz ZFVVLYOBMRSYTM-QGZVFWFLSA-N 1 1 368.481 3.690 20 5 FHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)N(C)C1CC[NH+](CCc2ccncc2)CC1 ZINC000378438400 942773217 /nfs/dbraw/zinc/77/32/17/942773217.db2.gz ZFVVLYOBMRSYTM-QGZVFWFLSA-N 1 1 368.481 3.690 20 5 FHBDMO Cc1ccccc1C[C@@H]1CCC[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000514169910 942796476 /nfs/dbraw/zinc/79/64/76/942796476.db2.gz METVGFAJLONEIP-FQEVSTJZSA-N 1 1 367.449 3.573 20 5 FHBDMO Cc1ccc([C@@H](C[NH+]2CCOCC2)Nc2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000514180890 942805512 /nfs/dbraw/zinc/80/55/12/942805512.db2.gz XIQXMMLXEZCLIB-LJQANCHMSA-N 1 1 355.438 3.697 20 5 FHBDMO O=[N+]([O-])c1cccc(F)c1CN1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000434687859 942865809 /nfs/dbraw/zinc/86/58/09/942865809.db2.gz ZSDBJHYGXFWIGI-UHFFFAOYSA-N 1 1 358.417 3.646 20 5 FHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+](C)Cc1cccs1 ZINC000016586885 942880473 /nfs/dbraw/zinc/88/04/73/942880473.db2.gz BJVXYQNOJMQGQM-SNVBAGLBSA-N 1 1 353.831 3.769 20 5 FHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)Cc1cccs1 ZINC000016586885 942880477 /nfs/dbraw/zinc/88/04/77/942880477.db2.gz BJVXYQNOJMQGQM-SNVBAGLBSA-N 1 1 353.831 3.769 20 5 FHBDMO CN(Cc1c(Cl)cccc1[N+](=O)[O-])C[C@@H]1CC[N@@H+](C)[C@H]1c1cccnc1 ZINC000434743906 942935091 /nfs/dbraw/zinc/93/50/91/942935091.db2.gz GPTVEAXXMDDIGR-KXBFYZLASA-N 1 1 374.872 3.768 20 5 FHBDMO CC[N@@H+]1CCc2nc(NC(=O)c3ccc(C(C)C)c([N+](=O)[O-])c3)sc2C1 ZINC000190392670 943088052 /nfs/dbraw/zinc/08/80/52/943088052.db2.gz GCIQIPBWYFOIKL-UHFFFAOYSA-N 1 1 374.466 3.805 20 5 FHBDMO CC[N@H+]1CCc2nc(NC(=O)c3ccc(C(C)C)c([N+](=O)[O-])c3)sc2C1 ZINC000190392670 943088061 /nfs/dbraw/zinc/08/80/61/943088061.db2.gz GCIQIPBWYFOIKL-UHFFFAOYSA-N 1 1 374.466 3.805 20 5 FHBDMO CCc1nn(C)c(S[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000425276140 943150055 /nfs/dbraw/zinc/15/00/55/943150055.db2.gz CZESELQNPRXDDH-OAHLLOKOSA-N 1 1 360.483 3.647 20 5 FHBDMO C[N@H+](Cc1ccc(Br)cc1[N+](=O)[O-])[C@H](CO)c1ccccc1 ZINC000425394864 943493167 /nfs/dbraw/zinc/49/31/67/943493167.db2.gz LZRCLHBYQHEITE-MRXNPFEDSA-N 1 1 365.227 3.523 20 5 FHBDMO C[N@@H+](Cc1ccc(Br)cc1[N+](=O)[O-])[C@H](CO)c1ccccc1 ZINC000425394864 943493171 /nfs/dbraw/zinc/49/31/71/943493171.db2.gz LZRCLHBYQHEITE-MRXNPFEDSA-N 1 1 365.227 3.523 20 5 FHBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)c1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1 ZINC000515184419 943540435 /nfs/dbraw/zinc/54/04/35/943540435.db2.gz MBLVAIIJEQZNPP-XJKSGUPXSA-N 1 1 358.417 3.572 20 5 FHBDMO C[N@H+]1CCC[C@H]2CN(Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)CC[C@H]21 ZINC000549470551 943579931 /nfs/dbraw/zinc/57/99/31/943579931.db2.gz AAIQPXGRUGGXCN-BLLLJJGKSA-N 1 1 357.376 3.530 20 5 FHBDMO Cn1cc(C[NH2+][C@H]2C[C@]2(F)c2ccccc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000424203736 943787384 /nfs/dbraw/zinc/78/73/84/943787384.db2.gz UTJNCOJBPHFRBU-ICSRJNTNSA-N 1 1 366.396 3.722 20 5 FHBDMO C[C@H](c1nc(-c2cccs2)no1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000517042803 943944850 /nfs/dbraw/zinc/94/48/50/943944850.db2.gz BNQZTTAYYCPOMJ-GFCCVEGCSA-N 1 1 358.423 3.942 20 5 FHBDMO COc1ccc(OC)c([C@H]2CCC[N@H+]2CCOc2ccccc2[N+](=O)[O-])c1 ZINC000515539977 943974359 /nfs/dbraw/zinc/97/43/59/943974359.db2.gz IGVLXZYMJAKZTH-QGZVFWFLSA-N 1 1 372.421 3.828 20 5 FHBDMO COc1c(C)cc(C[N@H+](C)[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cc1C ZINC000110293304 944030855 /nfs/dbraw/zinc/03/08/55/944030855.db2.gz OMOXLWSTHDUECW-OAHLLOKOSA-N 1 1 371.437 3.679 20 5 FHBDMO COc1c(C)cc(C[N@@H+](C)[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cc1C ZINC000110293304 944030861 /nfs/dbraw/zinc/03/08/61/944030861.db2.gz OMOXLWSTHDUECW-OAHLLOKOSA-N 1 1 371.437 3.679 20 5 FHBDMO O=C(CC[N@@H+](CCc1ccc(F)cc1)C1CC1)Nc1ccccc1[N+](=O)[O-] ZINC000500066840 944046241 /nfs/dbraw/zinc/04/62/41/944046241.db2.gz IEMVKCCNDLZZMB-UHFFFAOYSA-N 1 1 371.412 3.770 20 5 FHBDMO O=C(CC[N@H+]1CC[C@H](c2ccccc2F)C1)Nc1ccccc1[N+](=O)[O-] ZINC000500069867 944052267 /nfs/dbraw/zinc/05/22/67/944052267.db2.gz KFAMBVTYNXOMLB-AWEZNQCLSA-N 1 1 357.385 3.552 20 5 FHBDMO CC1(C)CCC[N@@H+]1CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000436251086 944144183 /nfs/dbraw/zinc/14/41/83/944144183.db2.gz IBGMQQPRVLXJHV-UHFFFAOYSA-N 1 1 360.439 3.531 20 5 FHBDMO CC1(C)CCC[N@H+]1CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000436251086 944144186 /nfs/dbraw/zinc/14/41/86/944144186.db2.gz IBGMQQPRVLXJHV-UHFFFAOYSA-N 1 1 360.439 3.531 20 5 FHBDMO Cc1ccc(C[C@H]2CCC[N@H+]2CCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000500139426 944161997 /nfs/dbraw/zinc/16/19/97/944161997.db2.gz NZEABVHGGTXWIV-GOSISDBHSA-N 1 1 367.449 3.939 20 5 FHBDMO CCC[N@@H+](CCc1cccc(F)c1)CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000500215999 944279305 /nfs/dbraw/zinc/27/93/05/944279305.db2.gz PNRCTIXUHFBXPV-UHFFFAOYSA-N 1 1 373.428 3.936 20 5 FHBDMO COc1cc(C[N@H+]2CC3(CCC3)[C@H]2C2CCOCC2)c([N+](=O)[O-])cc1F ZINC000425554371 944326051 /nfs/dbraw/zinc/32/60/51/944326051.db2.gz ONTNGBZNYUROAD-GOSISDBHSA-N 1 1 364.417 3.524 20 5 FHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC4(CCC4)[C@@H]3C3CCOCC3)nc2c1 ZINC000425558227 944338084 /nfs/dbraw/zinc/33/80/84/944338084.db2.gz XJQFGISEOSIIIL-SFHVURJKSA-N 1 1 357.410 3.517 20 5 FHBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000543557972 944353810 /nfs/dbraw/zinc/35/38/10/944353810.db2.gz SKOPLTZRWWWSEK-YLJYHZDGSA-N 1 1 374.412 3.965 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000123593930 944386832 /nfs/dbraw/zinc/38/68/32/944386832.db2.gz GPFOGPXXSFILML-OAHLLOKOSA-N 1 1 370.453 3.527 20 5 FHBDMO COc1cc(C[NH2+]Cc2cscc2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000425970841 944453896 /nfs/dbraw/zinc/45/38/96/944453896.db2.gz JXUYFVUCXSXCSD-UHFFFAOYSA-N 1 1 372.393 3.907 20 5 FHBDMO COc1cc(C[N@@H+](C)CC2(c3ccccc3)CC2)c([N+](=O)[O-])cc1OC ZINC000438270959 944455627 /nfs/dbraw/zinc/45/56/27/944455627.db2.gz BRQRMLGTUJQKMZ-UHFFFAOYSA-N 1 1 356.422 3.776 20 5 FHBDMO Cc1c[nH+]ccc1OC1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000518623004 944552569 /nfs/dbraw/zinc/55/25/69/944552569.db2.gz NTUMGVMGKXQHFH-UHFFFAOYSA-N 1 1 361.829 3.995 20 5 FHBDMO Cc1nc2cc(CNc3ccc([N+](=O)[O-])c4c3CC[N@@H+](C)C4)ccc2o1 ZINC001167759576 944572981 /nfs/dbraw/zinc/57/29/81/944572981.db2.gz CJDKEMDUSCTUHI-UHFFFAOYSA-N 1 1 352.394 3.644 20 5 FHBDMO Cc1nc2cc(CNc3ccc([N+](=O)[O-])c4c3CC[N@H+](C)C4)ccc2o1 ZINC001167759576 944572986 /nfs/dbraw/zinc/57/29/86/944572986.db2.gz CJDKEMDUSCTUHI-UHFFFAOYSA-N 1 1 352.394 3.644 20 5 FHBDMO Cc1nc2ccc(C[N@H+]3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)cc2s1 ZINC000426401936 944679017 /nfs/dbraw/zinc/67/90/17/944679017.db2.gz PWWHKHFNKMZXFJ-CQSZACIVSA-N 1 1 369.450 3.594 20 5 FHBDMO C[C@H]([NH2+]Cc1ccc(OCC(F)(F)F)nc1)c1ccccc1[N+](=O)[O-] ZINC000516304445 944706209 /nfs/dbraw/zinc/70/62/09/944706209.db2.gz DDBBAOUIUZTRGL-NSHDSACASA-N 1 1 355.316 3.782 20 5 FHBDMO CC(=O)c1cc(N(C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000383074615 944708056 /nfs/dbraw/zinc/70/80/56/944708056.db2.gz SWTAUCGJJFQWOJ-SFHVURJKSA-N 1 1 367.449 3.756 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000506281865 944788087 /nfs/dbraw/zinc/78/80/87/944788087.db2.gz MVKUROAMVQSBBP-NVXWUHKLSA-N 1 1 368.437 3.860 20 5 FHBDMO Cc1c(C(=O)N[C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000487340947 944906806 /nfs/dbraw/zinc/90/68/06/944906806.db2.gz CJXJFPBNBNRDIU-WMZOPIPTSA-N 1 1 367.449 3.544 20 5 FHBDMO C[C@@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000518899077 944917432 /nfs/dbraw/zinc/91/74/32/944917432.db2.gz QCBXDCOCWDIFRI-CQSZACIVSA-N 1 1 373.840 3.595 20 5 FHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000518899077 944917439 /nfs/dbraw/zinc/91/74/39/944917439.db2.gz QCBXDCOCWDIFRI-CQSZACIVSA-N 1 1 373.840 3.595 20 5 FHBDMO COc1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc2c1OCO2 ZINC000507152708 945002393 /nfs/dbraw/zinc/00/23/93/945002393.db2.gz YLEWVDFAEOKXAV-UHFFFAOYSA-N 1 1 358.394 3.743 20 5 FHBDMO Cc1ccccc1[C@H]1CC[N@H+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000507179745 945011142 /nfs/dbraw/zinc/01/11/42/945011142.db2.gz HTKCHEOATPUHGB-CVEARBPZSA-N 1 1 353.422 3.720 20 5 FHBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000511746344 945016398 /nfs/dbraw/zinc/01/63/98/945016398.db2.gz YUEOPBBKSSYVBE-LJQANCHMSA-N 1 1 367.449 3.625 20 5 FHBDMO Cc1nn2c(C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C(C)C)c(C)nc2s1 ZINC000507168854 945018467 /nfs/dbraw/zinc/01/84/67/945018467.db2.gz GEIFTJDDULFNAN-UHFFFAOYSA-N 1 1 359.455 3.726 20 5 FHBDMO Cc1nn2c(C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C(C)C)c(C)nc2s1 ZINC000507168854 945018476 /nfs/dbraw/zinc/01/84/76/945018476.db2.gz GEIFTJDDULFNAN-UHFFFAOYSA-N 1 1 359.455 3.726 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@](O)(C3CC3)C2)ccc1Oc1ccc(F)cc1 ZINC000426509180 945025699 /nfs/dbraw/zinc/02/56/99/945025699.db2.gz RXHPUJLCHPURDI-FQEVSTJZSA-N 1 1 372.396 3.873 20 5 FHBDMO O=C(c1ccc(O)cc1)C1CC[NH+](CC=Cc2ccccc2[N+](=O)[O-])CC1 ZINC000124030808 945039158 /nfs/dbraw/zinc/03/91/58/945039158.db2.gz QCFGCFCHPAUNOV-HWKANZROSA-N 1 1 366.417 3.909 20 5 FHBDMO O=C(NC[C@H](c1cccc(Cl)c1)[NH+]1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000106167849 945039650 /nfs/dbraw/zinc/03/96/50/945039650.db2.gz CWTNRSRNWSLYBC-GOSISDBHSA-N 1 1 373.840 3.815 20 5 FHBDMO CC[C@@H](c1cccc(OC)c1)[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000519026231 945039895 /nfs/dbraw/zinc/03/98/95/945039895.db2.gz HSUPFQFLBDPUHZ-IBGZPJMESA-N 1 1 371.437 3.649 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@](O)(C4CC4)C3)o2)c(Cl)c1 ZINC000426524972 945054743 /nfs/dbraw/zinc/05/47/43/945054743.db2.gz QKTQILVVMVCFKS-GOSISDBHSA-N 1 1 362.813 3.855 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[N@@H+](CC2CCCCC2)CC1 ZINC000511866288 945376602 /nfs/dbraw/zinc/37/66/02/945376602.db2.gz XXLUZDYCNCPKCG-UHFFFAOYSA-N 1 1 359.470 3.631 20 5 FHBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000729479708 945732586 /nfs/dbraw/zinc/73/25/86/945732586.db2.gz CHGFDRSHEYQHNN-QGZVFWFLSA-N 1 1 363.458 3.816 20 5 FHBDMO O=[N+]([O-])c1ccccc1OCCN1CCC[N@@H+](CC2CCCCC2)CC1 ZINC000108238161 945894141 /nfs/dbraw/zinc/89/41/41/945894141.db2.gz BRNLXRKQWLPLPD-UHFFFAOYSA-N 1 1 361.486 3.562 20 5 FHBDMO Cc1cc(C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])cc(N2CCCC2)n1 ZINC000894540792 945963444 /nfs/dbraw/zinc/96/34/44/945963444.db2.gz DPNWXFRDCXSDHQ-UHFFFAOYSA-N 1 1 360.845 3.842 20 5 FHBDMO CC[C@@H](Cc1ccc(C)cc1)[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000444243410 946117985 /nfs/dbraw/zinc/11/79/85/946117985.db2.gz PVRAIWVYEYNBFU-KRWDZBQOSA-N 1 1 355.438 3.795 20 5 FHBDMO C[C@@H]1C[N@@H+]2CCCC[C@@H]2CN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000408182666 946301239 /nfs/dbraw/zinc/30/12/39/946301239.db2.gz LIIKEDAYXZGWRK-IUODEOHRSA-N 1 1 359.451 3.508 20 5 FHBDMO C[C@@H]1C[N@H+]2CCCC[C@@H]2CN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000408182666 946301252 /nfs/dbraw/zinc/30/12/52/946301252.db2.gz LIIKEDAYXZGWRK-IUODEOHRSA-N 1 1 359.451 3.508 20 5 FHBDMO Cc1cccc(CC2(O)CC[NH+](Cc3ccc([N+](=O)[O-])cc3F)CC2)c1 ZINC000475487614 946410208 /nfs/dbraw/zinc/41/02/08/946410208.db2.gz PMKJSSUDBSLXIJ-UHFFFAOYSA-N 1 1 358.413 3.612 20 5 FHBDMO O=[N+]([O-])c1cccc(N2CC[NH+](Cc3cc(F)cc4cccnc43)CC2)c1 ZINC000047745679 946418460 /nfs/dbraw/zinc/41/84/60/946418460.db2.gz VTWOOPHODMKZEJ-UHFFFAOYSA-N 1 1 366.396 3.604 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+](CCO)[C@@H]3CCCSC3)o2)cc1 ZINC000475494342 946442153 /nfs/dbraw/zinc/44/21/53/946442153.db2.gz QFFSFKRHUCSTCD-MRXNPFEDSA-N 1 1 362.451 3.545 20 5 FHBDMO COc1ccc(-c2ccc(CN[C@H]3C[C@@H](C)[N@@H+](C4CC4)C3)o2)c([N+](=O)[O-])c1 ZINC000237427308 946456746 /nfs/dbraw/zinc/45/67/46/946456746.db2.gz MUEVCUFEIXJUBX-KGLIPLIRSA-N 1 1 371.437 3.578 20 5 FHBDMO COc1ccc(-c2ccc(CN[C@H]3C[C@@H](C)[N@H+](C4CC4)C3)o2)c([N+](=O)[O-])c1 ZINC000237427308 946456767 /nfs/dbraw/zinc/45/67/67/946456767.db2.gz MUEVCUFEIXJUBX-KGLIPLIRSA-N 1 1 371.437 3.578 20 5 FHBDMO CC[C@@H](Cc1ccc(C)cc1)[N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000441373792 946524790 /nfs/dbraw/zinc/52/47/90/946524790.db2.gz FKQDDZMRJSKOEA-ICSRJNTNSA-N 1 1 372.465 3.596 20 5 FHBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCCCC[N@@H+]1CCCC[C@H]1C ZINC000475551976 946622007 /nfs/dbraw/zinc/62/20/07/946622007.db2.gz VXKBXUYXGIQFCL-MRXNPFEDSA-N 1 1 362.474 3.988 20 5 FHBDMO CCS[C@H]1CCCC[N@@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000112088937 946659419 /nfs/dbraw/zinc/65/94/19/946659419.db2.gz UBNDPAJCNWGPFM-HNNXBMFYSA-N 1 1 365.499 3.839 20 5 FHBDMO C[N@@H+](CCNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)C1CCCC1 ZINC000475225694 946735101 /nfs/dbraw/zinc/73/51/01/946735101.db2.gz UMDLNRIQPZXOJT-UHFFFAOYSA-N 1 1 374.363 3.610 20 5 FHBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH+]3CCC(COc4ccccc4)CC3)nc2c1 ZINC000444588693 947015514 /nfs/dbraw/zinc/01/55/14/947015514.db2.gz FYBBWKHHFOWTMT-UHFFFAOYSA-N 1 1 366.421 3.762 20 5 FHBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H](C)Cc1ccc(OC)cc1 ZINC000444613303 947040111 /nfs/dbraw/zinc/04/01/11/947040111.db2.gz WDTOXCYNDNVCSJ-CQSZACIVSA-N 1 1 368.437 3.933 20 5 FHBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H](COC)Cc1ccccc1 ZINC000444649660 947070001 /nfs/dbraw/zinc/07/00/01/947070001.db2.gz QUVODPJPCBPFDS-QGZVFWFLSA-N 1 1 368.437 3.551 20 5 FHBDMO CC[C@@](C)(O)C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1ccccc1 ZINC000444683974 947108183 /nfs/dbraw/zinc/10/81/83/947108183.db2.gz HESZVGQEQCAMNB-HXUWFJFHSA-N 1 1 368.437 3.634 20 5 FHBDMO CC[C@@](C)(O)C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1ccccc1 ZINC000444683974 947108177 /nfs/dbraw/zinc/10/81/77/947108177.db2.gz HESZVGQEQCAMNB-HXUWFJFHSA-N 1 1 368.437 3.634 20 5 FHBDMO COc1cccc(N2CCC[N@@H+](Cc3ccccc3C)CC2)c1[N+](=O)[O-] ZINC000613869766 947138263 /nfs/dbraw/zinc/13/82/63/947138263.db2.gz NIHORYAQLBKDTC-UHFFFAOYSA-N 1 1 355.438 3.624 20 5 FHBDMO Cc1ccc(C)c([C@@H](C)[N@@H+](C)C[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000523438731 947269017 /nfs/dbraw/zinc/26/90/17/947269017.db2.gz NOURIPQRZBVXRG-SJLPKXTDSA-N 1 1 358.438 3.644 20 5 FHBDMO COc1ccc(OC)c(C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000523702145 947527883 /nfs/dbraw/zinc/52/78/83/947527883.db2.gz YYBCIHVGLIUGAL-UHFFFAOYSA-N 1 1 356.422 3.819 20 5 FHBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000072837536 947569200 /nfs/dbraw/zinc/56/92/00/947569200.db2.gz ATLOIUSFRUUKAD-ZBFHGGJFSA-N 1 1 365.499 3.838 20 5 FHBDMO O=C([C@@H]1CC[N@H+](C2CCCCC2)C1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000129530723 947788605 /nfs/dbraw/zinc/78/86/05/947788605.db2.gz VCLIACOIZKTPEH-QGZVFWFLSA-N 1 1 371.481 3.740 20 5 FHBDMO Cc1ccccc1[C@H]1C[N@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@H](C)CO1 ZINC000441472393 947791883 /nfs/dbraw/zinc/79/18/83/947791883.db2.gz XKPZOYOJJCRRPD-OXQOHEQNSA-N 1 1 356.422 3.744 20 5 FHBDMO Cc1ccccc1[C@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@H](C)CO1 ZINC000441472393 947791891 /nfs/dbraw/zinc/79/18/91/947791891.db2.gz XKPZOYOJJCRRPD-OXQOHEQNSA-N 1 1 356.422 3.744 20 5 FHBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+](Cc1ccc(F)cc1)C1CCCCC1 ZINC000536378784 947849801 /nfs/dbraw/zinc/84/98/01/947849801.db2.gz PWVLHXKBZRTYHD-UHFFFAOYSA-N 1 1 373.428 3.731 20 5 FHBDMO CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000180220521 948071506 /nfs/dbraw/zinc/07/15/06/948071506.db2.gz CSYSNZMEOHVXBX-ZIAGYGMSSA-N 1 1 365.499 3.650 20 5 FHBDMO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CCc1ccc2cn[nH]c2c1)C1CC1 ZINC000585765549 948277241 /nfs/dbraw/zinc/27/72/41/948277241.db2.gz PRXDXUVHVDDUBQ-GOSISDBHSA-N 1 1 350.422 3.625 20 5 FHBDMO C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCC[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000574735027 948420292 /nfs/dbraw/zinc/42/02/92/948420292.db2.gz LCQDRPPFQANUEC-MWLKLMTCSA-N 1 1 372.469 3.623 20 5 FHBDMO CCOC[C@@H]1CCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000072977033 948516225 /nfs/dbraw/zinc/51/62/25/948516225.db2.gz QZBIEHHMFDPPGV-OAHLLOKOSA-N 1 1 359.426 3.541 20 5 FHBDMO C[C@@H]1CC[C@H](c2ccccc2)[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000512165034 948602775 /nfs/dbraw/zinc/60/27/75/948602775.db2.gz KQDDACKIDOVSHM-RDTXWAMCSA-N 1 1 353.422 3.667 20 5 FHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[NH+](Cc2ccccc2)CC1 ZINC000068838917 132376658 /nfs/dbraw/zinc/37/66/58/132376658.db2.gz UZMLFPPGLJGZAT-UHFFFAOYSA-N 1 1 365.355 3.936 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000541787704 567821774 /nfs/dbraw/zinc/82/17/74/567821774.db2.gz WBTKBQLMGXULSJ-CYBMUJFWSA-N 1 1 352.410 3.510 20 5 FHBDMO C[NH+](C)[C@@H](CNC(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-])c1ccco1 ZINC000291080204 568011774 /nfs/dbraw/zinc/01/17/74/568011774.db2.gz GMRVBXUHRICASZ-LBPRGKRZSA-N 1 1 372.208 3.527 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC(F)(F)[C@H](CO)C3)s2)cc1 ZINC000291189898 568074192 /nfs/dbraw/zinc/07/41/92/568074192.db2.gz GMRYQEVZVJROOQ-ZDUSSCGKSA-N 1 1 368.405 3.773 20 5 FHBDMO Cc1cnc(N2CC[C@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000481995500 568221677 /nfs/dbraw/zinc/22/16/77/568221677.db2.gz YKIWXKAQSRLQMO-OALUTQOASA-N 1 1 366.465 3.789 20 5 FHBDMO Cc1cnc(N2CC[C@@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000481995502 568221714 /nfs/dbraw/zinc/22/17/14/568221714.db2.gz YKIWXKAQSRLQMO-RBUKOAKNSA-N 1 1 366.465 3.789 20 5 FHBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC2(CCC2)[C@@H]1c1ccccc1 ZINC000453031515 568264986 /nfs/dbraw/zinc/26/49/86/568264986.db2.gz YWAUTTYYEWLCQW-XLIONFOSSA-N 1 1 368.433 3.562 20 5 FHBDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC000609489680 568510081 /nfs/dbraw/zinc/51/00/81/568510081.db2.gz YSWOAHFTHYDIKB-CQSZACIVSA-N 1 1 372.469 3.707 20 5 FHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc(Oc2cnccn2)cc1 ZINC000570760559 568519896 /nfs/dbraw/zinc/51/98/96/568519896.db2.gz KRJSHGMFCQYTHW-UHFFFAOYSA-N 1 1 364.405 3.852 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)nc(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)c1 ZINC001164626994 719054246 /nfs/dbraw/zinc/05/42/46/719054246.db2.gz SZWHGGICOOKZAJ-RDJZCZTQSA-N 1 1 372.856 3.744 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)cnc1N1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001164621416 719056244 /nfs/dbraw/zinc/05/62/44/719056244.db2.gz JCYADDNBEWNBEU-YJBOKZPZSA-N 1 1 372.856 3.744 20 5 FHBDMO COc1ccc2c(c1)[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)CCCO2 ZINC000178728327 936326351 /nfs/dbraw/zinc/32/63/51/936326351.db2.gz WYIYYAAEWORMNO-QGZVFWFLSA-N 1 1 358.394 3.616 20 5 FHBDMO C/C(=C/c1nc(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)no1)c1ccc([N+](=O)[O-])cc1 ZINC000612955413 936345418 /nfs/dbraw/zinc/34/54/18/936345418.db2.gz YTJVMNPDXXRPRD-RQIDDLAKSA-N 1 1 354.410 3.879 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCCCC[N@@H+]1CCC[C@@H](C)C1 ZINC000120069009 927038211 /nfs/dbraw/zinc/03/82/11/927038211.db2.gz YSMWHVHMCUHYBZ-CQSZACIVSA-N 1 1 362.474 3.845 20 5 FHBDMO C[C@@H](O)C[N@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000535805021 927598349 /nfs/dbraw/zinc/59/83/49/927598349.db2.gz PYLQXRVTTREODO-CYBMUJFWSA-N 1 1 366.364 3.579 20 5 FHBDMO C[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000535805021 927598357 /nfs/dbraw/zinc/59/83/57/927598357.db2.gz PYLQXRVTTREODO-CYBMUJFWSA-N 1 1 366.364 3.579 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH+]1CCC(c2ccsc2)CC1 ZINC000186957167 927622548 /nfs/dbraw/zinc/62/25/48/927622548.db2.gz KDQHDJXIVLVKTA-UHFFFAOYSA-N 1 1 359.451 3.783 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000430200120 927939403 /nfs/dbraw/zinc/93/94/03/927939403.db2.gz FQUXJAOUOWZFTJ-HXUWFJFHSA-N 1 1 354.406 3.625 20 5 FHBDMO Cc1ccc(NC(=O)[C@H]2CCC[N@H+]([C@@H](C)c3ccccc3[N+](=O)[O-])C2)nc1 ZINC000471156276 928146503 /nfs/dbraw/zinc/14/65/03/928146503.db2.gz JUCISHOOFRCQDG-HOTGVXAUSA-N 1 1 368.437 3.710 20 5 FHBDMO CCOC(=O)C(C)(C)C1CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000510093523 928157595 /nfs/dbraw/zinc/15/75/95/928157595.db2.gz ZIHJSABCUADCKR-UHFFFAOYSA-N 1 1 352.406 3.535 20 5 FHBDMO COc1cccc([C@H]2[C@@H](Nc3ccc([N+](=O)[O-])cc3)CC[N@H+]2C2CC2)c1 ZINC000302009544 928204611 /nfs/dbraw/zinc/20/46/11/928204611.db2.gz AETPSVDJTKVHRK-PMACEKPBSA-N 1 1 353.422 3.993 20 5 FHBDMO C[C@@H]1C[C@H](CCNC(=O)c2ccc([N+](=O)[O-])s2)C[N@H+]1Cc1ccccc1 ZINC000510097871 928231975 /nfs/dbraw/zinc/23/19/75/928231975.db2.gz IQDNTKPJRIILMN-ZBFHGGJFSA-N 1 1 373.478 3.687 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](Cc1ccccc1)C[C@H]1CCCO1 ZINC000430229534 928323464 /nfs/dbraw/zinc/32/34/64/928323464.db2.gz XXIMJQZMHLDFBU-LJQANCHMSA-N 1 1 356.422 3.785 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](Cc1ccccc1)C[C@H]1CCCO1 ZINC000430229534 928323467 /nfs/dbraw/zinc/32/34/67/928323467.db2.gz XXIMJQZMHLDFBU-LJQANCHMSA-N 1 1 356.422 3.785 20 5 FHBDMO COc1cc(OC)c(OC)cc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000127057616 928455117 /nfs/dbraw/zinc/45/51/17/928455117.db2.gz OWHMVGSFHLVPSN-UHFFFAOYSA-N 1 1 372.421 3.785 20 5 FHBDMO COc1cc(OC)c(OC)cc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000127057616 928455123 /nfs/dbraw/zinc/45/51/23/928455123.db2.gz OWHMVGSFHLVPSN-UHFFFAOYSA-N 1 1 372.421 3.785 20 5 FHBDMO Cn1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c(-c2ccncc2)n1 ZINC000154270079 928660973 /nfs/dbraw/zinc/66/09/73/928660973.db2.gz IWAKKQUVRUQGFB-UHFFFAOYSA-N 1 1 363.421 3.555 20 5 FHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CCCSCc3ccccc3)C2)nc1 ZINC000535624037 929216163 /nfs/dbraw/zinc/21/61/63/929216163.db2.gz IOYLWMQUHGKRQQ-QGZVFWFLSA-N 1 1 372.494 3.800 20 5 FHBDMO C[N@@H+](CCc1cccc(NC(=O)Nc2cccc([N+](=O)[O-])c2)c1)C1CC1 ZINC000091629777 937313698 /nfs/dbraw/zinc/31/36/98/937313698.db2.gz GLMDHEJBBCVDCT-UHFFFAOYSA-N 1 1 354.410 3.876 20 5 FHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](C(=O)N(C)c2ccccc2)C1 ZINC000430294687 929355077 /nfs/dbraw/zinc/35/50/77/929355077.db2.gz BLFKUKXVPKGCQL-HZPDHXFCSA-N 1 1 353.422 3.641 20 5 FHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](C(=O)N(C)c2ccccc2)C1 ZINC000430296407 929399325 /nfs/dbraw/zinc/39/93/25/929399325.db2.gz JBTIHIORUVJLNY-WBVHZDCISA-N 1 1 353.422 3.641 20 5 FHBDMO COc1cc(C[N@H+]2CCC3(CCC3)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180163972 929410818 /nfs/dbraw/zinc/41/08/18/929410818.db2.gz DDXLZFFPOIYPNI-UHFFFAOYSA-N 1 1 356.369 3.623 20 5 FHBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000580017289 929894969 /nfs/dbraw/zinc/89/49/69/929894969.db2.gz YHWKLMJVUPRSDZ-DNVCBOLYSA-N 1 1 372.469 3.638 20 5 FHBDMO CCOc1ccccc1N1CC[NH+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000023697259 929915876 /nfs/dbraw/zinc/91/58/76/929915876.db2.gz KODVTQPHCFYGRP-MRXNPFEDSA-N 1 1 355.438 3.877 20 5 FHBDMO COc1ccc(CN2CC[C@H](C)[N@@H+](Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000610372013 930178634 /nfs/dbraw/zinc/17/86/34/930178634.db2.gz GUUIAUKFAPJHKA-KRWDZBQOSA-N 1 1 369.465 3.700 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCC[C@](CO)(Cc2ccccc2)C1 ZINC000463034472 930184146 /nfs/dbraw/zinc/18/41/46/930184146.db2.gz OQILJGPZHBYCAQ-KXAJWGBNSA-N 1 1 366.461 3.925 20 5 FHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@](C)(c2ccccc2)C1 ZINC001167367138 930354463 /nfs/dbraw/zinc/35/44/63/930354463.db2.gz BSGUWVCTCXTQIT-HRAATJIYSA-N 1 1 367.449 3.976 20 5 FHBDMO C[N@H+]1CCC[C@@H](CNC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H]1c1cccs1 ZINC000247252021 930513928 /nfs/dbraw/zinc/51/39/28/930513928.db2.gz DXZTXOWXLBZFBB-GUYCJALGSA-N 1 1 374.466 3.861 20 5 FHBDMO O=[N+]([O-])c1ccc([C@@H](NC[C@@H]2CCCC[N@@H+]2C2CC2)C(F)(F)F)cc1 ZINC000579601984 930597819 /nfs/dbraw/zinc/59/78/19/930597819.db2.gz KLUZSWDSUBKVMD-JKSUJKDBSA-N 1 1 357.376 3.805 20 5 FHBDMO O=[N+]([O-])c1ccc([C@@H](NC[C@@H]2CCCC[N@H+]2C2CC2)C(F)(F)F)cc1 ZINC000579601984 930597825 /nfs/dbraw/zinc/59/78/25/930597825.db2.gz KLUZSWDSUBKVMD-JKSUJKDBSA-N 1 1 357.376 3.805 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000038859615 930748859 /nfs/dbraw/zinc/74/88/59/930748859.db2.gz AGJFDVYLHOKHMU-QGZVFWFLSA-N 1 1 353.422 3.754 20 5 FHBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1N(C)C(=O)c1ccc([N+](=O)[O-])s1 ZINC000135058007 930750682 /nfs/dbraw/zinc/75/06/82/930750682.db2.gz WHNYDIMSWDKKCL-HOCLYGCPSA-N 1 1 373.478 3.639 20 5 FHBDMO Cc1c(C(=O)N2CC[N@H+](Cc3ccccc3)CC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000610445998 930790021 /nfs/dbraw/zinc/79/00/21/930790021.db2.gz NJCPGUBJACJDCO-INIZCTEOSA-N 1 1 367.449 3.640 20 5 FHBDMO C[N@@H+](CCc1cccc(NC(=O)CCc2cccc([N+](=O)[O-])c2)c1)C1CC1 ZINC000537126755 930820446 /nfs/dbraw/zinc/82/04/46/930820446.db2.gz IJWWCSIQFVTCAD-UHFFFAOYSA-N 1 1 367.449 3.803 20 5 FHBDMO Cc1ccc([C@@H](C)NC(=O)[C@H]2CC[N@H+](C3CCCCC3)C2)cc1[N+](=O)[O-] ZINC000177837332 931266675 /nfs/dbraw/zinc/26/66/75/931266675.db2.gz JTFKNMDEOHLRBD-WBVHZDCISA-N 1 1 359.470 3.735 20 5 FHBDMO CCc1ccc(C[N@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000023815636 931420336 /nfs/dbraw/zinc/42/03/36/931420336.db2.gz WVHGEUQEVQXYKT-UHFFFAOYSA-N 1 1 352.394 3.839 20 5 FHBDMO CCc1ccc(C[N@@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000023815636 931420341 /nfs/dbraw/zinc/42/03/41/931420341.db2.gz WVHGEUQEVQXYKT-UHFFFAOYSA-N 1 1 352.394 3.839 20 5 FHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+]([C@H]3CCCc4ccc(F)cc43)C2)nc1 ZINC000510383286 931811743 /nfs/dbraw/zinc/81/17/43/931811743.db2.gz ZYVBGQMUKDZMQA-QAPCUYQASA-N 1 1 356.401 3.693 20 5 FHBDMO Cc1ccc(C[N@H+](C)[C@H](C)c2ccc(-n3cncn3)cc2)cc1[N+](=O)[O-] ZINC000127175756 931863776 /nfs/dbraw/zinc/86/37/76/931863776.db2.gz NPPXZNRZTPZVRO-OAHLLOKOSA-N 1 1 351.410 3.677 20 5 FHBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000276228657 932115071 /nfs/dbraw/zinc/11/50/71/932115071.db2.gz KBFQMFSNHZCDLH-LBPRGKRZSA-N 1 1 370.331 3.808 20 5 FHBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000276228657 932115076 /nfs/dbraw/zinc/11/50/76/932115076.db2.gz KBFQMFSNHZCDLH-LBPRGKRZSA-N 1 1 370.331 3.808 20 5 FHBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000489544107 932522165 /nfs/dbraw/zinc/52/21/65/932522165.db2.gz BQEQZPPXIDCQDQ-WBVHZDCISA-N 1 1 362.474 3.528 20 5 FHBDMO COc1ccc(NC(=O)CC[N@H+]2CCC3(C2)CCCCC3)c([N+](=O)[O-])c1 ZINC000581758716 932617345 /nfs/dbraw/zinc/61/73/45/932617345.db2.gz ZCXIQWCDMIQGAI-UHFFFAOYSA-N 1 1 361.442 3.588 20 5 FHBDMO C[C@@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)[NH+]1C2CCC1CC2 ZINC000610538543 932682660 /nfs/dbraw/zinc/68/26/60/932682660.db2.gz QWWFATQHOGTVGX-XGNXJENSSA-N 1 1 372.450 3.672 20 5 FHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](NC(=O)c2ccccc2)C1 ZINC001167483650 932698658 /nfs/dbraw/zinc/69/86/58/932698658.db2.gz YCDOGCPFUSRFFU-RDJZCZTQSA-N 1 1 353.422 3.550 20 5 FHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](NC(=O)c2ccccc2)C1 ZINC001167483650 932698663 /nfs/dbraw/zinc/69/86/63/932698663.db2.gz YCDOGCPFUSRFFU-RDJZCZTQSA-N 1 1 353.422 3.550 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)[C@H]1C ZINC000561590396 932759626 /nfs/dbraw/zinc/75/96/26/932759626.db2.gz JKZBQUNDEHSGGP-YJBOKZPZSA-N 1 1 368.437 3.688 20 5 FHBDMO O=[N+]([O-])c1ccc(N2CC[C@H](n3c[nH+]c4c3CCCC4)C2)c2ncccc12 ZINC000548334286 933008170 /nfs/dbraw/zinc/00/81/70/933008170.db2.gz WXHXCVPHTRQTNL-AWEZNQCLSA-N 1 1 363.421 3.670 20 5 FHBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CC[N@H+](C)[C@@H]1c1ccccc1 ZINC000588447230 933174788 /nfs/dbraw/zinc/17/47/88/933174788.db2.gz WNNWBJQSXCLXKA-HJPMFFMGSA-N 1 1 365.433 3.560 20 5 FHBDMO COc1cc(C[N@H+]2CC(C)=C[C@@H](C)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000430882218 933355288 /nfs/dbraw/zinc/35/52/88/933355288.db2.gz IPSVRRIWLMRQSM-LLVKDONJSA-N 1 1 374.359 3.943 20 5 FHBDMO COc1cc(C[N@@H+]2CC(C)=C[C@@H](C)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000430882218 933355300 /nfs/dbraw/zinc/35/53/00/933355300.db2.gz IPSVRRIWLMRQSM-LLVKDONJSA-N 1 1 374.359 3.943 20 5 FHBDMO C[N@@H+](CCOc1cccc(Cl)c1)CCOc1ccccc1[N+](=O)[O-] ZINC000501436868 933844953 /nfs/dbraw/zinc/84/49/53/933844953.db2.gz OTXHJSUGDZZGHD-UHFFFAOYSA-N 1 1 350.802 3.638 20 5 FHBDMO CCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC)C[C@H]1COc2ccccc2O1 ZINC000610795967 934223207 /nfs/dbraw/zinc/22/32/07/934223207.db2.gz NKBYIQRKOBQPJU-KRWDZBQOSA-N 1 1 372.421 3.655 20 5 FHBDMO CCC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC)C[C@H]1COc2ccccc2O1 ZINC000610795967 934223214 /nfs/dbraw/zinc/22/32/14/934223214.db2.gz NKBYIQRKOBQPJU-KRWDZBQOSA-N 1 1 372.421 3.655 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCC[C@@H]4COCC[C@@H]43)cs2)c1 ZINC000535800471 934395023 /nfs/dbraw/zinc/39/50/23/934395023.db2.gz BNIDSJCXZLGQNH-PBHICJAKSA-N 1 1 359.451 3.719 20 5 FHBDMO Cn1ccnc1[C@H]([NH2+]CC(C)(C)[C@H]1CCCCO1)c1ccc([N+](=O)[O-])cc1 ZINC000611560792 934844656 /nfs/dbraw/zinc/84/46/56/934844656.db2.gz XMNJMNCOYKUTFO-QZTJIDSGSA-N 1 1 372.469 3.603 20 5 FHBDMO CCC[N@@H+]1Cc2cccc(NC(=O)Cc3cccc([N+](=O)[O-])c3C)c2C1 ZINC000119593813 934907129 /nfs/dbraw/zinc/90/71/29/934907129.db2.gz MFWAZDWBRPSVJR-UHFFFAOYSA-N 1 1 353.422 3.810 20 5 FHBDMO CCC[N@H+]1Cc2cccc(NC(=O)Cc3cccc([N+](=O)[O-])c3C)c2C1 ZINC000119593813 934907131 /nfs/dbraw/zinc/90/71/31/934907131.db2.gz MFWAZDWBRPSVJR-UHFFFAOYSA-N 1 1 353.422 3.810 20 5 FHBDMO CSc1cccc(C(=O)N2CCC(C[N@@H+](C)C(C)C)CC2)c1[N+](=O)[O-] ZINC000548600013 934970874 /nfs/dbraw/zinc/97/08/74/934970874.db2.gz BLNPBOVBRJLGRT-UHFFFAOYSA-N 1 1 365.499 3.509 20 5 FHBDMO C[C@@H](CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[N@H+]1CCCC[C@@H]1C ZINC000437151492 945071052 /nfs/dbraw/zinc/07/10/52/945071052.db2.gz GOXASQLLTOWSQT-RYUDHWBXSA-N 1 1 373.375 3.606 20 5 FHBDMO CSc1ccc(NC(=O)[C@H](C)[N@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000511072856 935240191 /nfs/dbraw/zinc/24/01/91/935240191.db2.gz MULHCDTYSWZUQZ-AWEZNQCLSA-N 1 1 373.478 3.818 20 5 FHBDMO CSc1ccc(NC(=O)[C@H](C)[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000511072856 935240196 /nfs/dbraw/zinc/24/01/96/935240196.db2.gz MULHCDTYSWZUQZ-AWEZNQCLSA-N 1 1 373.478 3.818 20 5 FHBDMO Cc1sc(C(=O)N2CCC[C@@H](n3cc[nH+]c3C(C)C)C2)cc1[N+](=O)[O-] ZINC000370877212 935392908 /nfs/dbraw/zinc/39/29/08/935392908.db2.gz RHFCSUADUJGXLL-CYBMUJFWSA-N 1 1 362.455 3.762 20 5 FHBDMO C[C@H](c1nc(-c2cccs2)no1)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511093605 935440432 /nfs/dbraw/zinc/44/04/32/935440432.db2.gz DELSKCPQRREPCW-GFCCVEGCSA-N 1 1 358.423 3.942 20 5 FHBDMO C[C@H](c1nc(-c2cccs2)no1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511093605 935440436 /nfs/dbraw/zinc/44/04/36/935440436.db2.gz DELSKCPQRREPCW-GFCCVEGCSA-N 1 1 358.423 3.942 20 5 FHBDMO C[N@@H+](CCC(=O)NCCCCc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000548719438 935473014 /nfs/dbraw/zinc/47/30/14/935473014.db2.gz FGLMOJWULMPSAZ-UHFFFAOYSA-N 1 1 361.486 3.688 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC=C(c4ccco4)C3)n2)c1 ZINC000511106928 935583732 /nfs/dbraw/zinc/58/37/32/935583732.db2.gz MMYPSOZKFHNBFP-UHFFFAOYSA-N 1 1 352.350 3.527 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC=C(c4ccco4)C3)n2)c1 ZINC000511106928 935583735 /nfs/dbraw/zinc/58/37/35/935583735.db2.gz MMYPSOZKFHNBFP-UHFFFAOYSA-N 1 1 352.350 3.527 20 5 FHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])[C@@H]1CCN(c2ccccc2Cl)C1=O ZINC000511107720 935593718 /nfs/dbraw/zinc/59/37/18/935593718.db2.gz OIWPWJPFEJWCRR-GOSISDBHSA-N 1 1 373.840 3.528 20 5 FHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])[C@@H]1CCN(c2ccccc2Cl)C1=O ZINC000511107720 935593722 /nfs/dbraw/zinc/59/37/22/935593722.db2.gz OIWPWJPFEJWCRR-GOSISDBHSA-N 1 1 373.840 3.528 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCCN2c3ccccc3C[C@H]2C1 ZINC000582388739 935612514 /nfs/dbraw/zinc/61/25/14/935612514.db2.gz AEXBZUYUZHECIE-KRWDZBQOSA-N 1 1 357.841 3.885 20 5 FHBDMO COc1ccc(C(=O)Nc2cccc3c2C[N@@H+](CC(C)C)C3)cc1[N+](=O)[O-] ZINC000158287897 935683917 /nfs/dbraw/zinc/68/39/17/935683917.db2.gz KHCSAOVCLAIMCA-UHFFFAOYSA-N 1 1 369.421 3.827 20 5 FHBDMO CC(C)C[N@H+]1Cc2cccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3N)c2C1 ZINC000158337683 935736893 /nfs/dbraw/zinc/73/68/93/935736893.db2.gz ISXBHPGLOWPFLO-UHFFFAOYSA-N 1 1 372.400 3.540 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])c(N[C@@H](Cc2[nH+]ccn2C)c2ccccc2)n1 ZINC000611616734 935814851 /nfs/dbraw/zinc/81/48/51/935814851.db2.gz AOUODFZRNZJJED-INIZCTEOSA-N 1 1 351.410 3.736 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](O)C2)ccc1Oc1ccccc1Cl ZINC000158746849 935953961 /nfs/dbraw/zinc/95/39/61/935953961.db2.gz IHNNVSUTMSSNHK-CQSZACIVSA-N 1 1 362.813 3.997 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](O)C2)ccc1Oc1ccccc1Cl ZINC000158746849 935953964 /nfs/dbraw/zinc/95/39/64/935953964.db2.gz IHNNVSUTMSSNHK-CQSZACIVSA-N 1 1 362.813 3.997 20 5 FHBDMO CC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000472255095 936077207 /nfs/dbraw/zinc/07/72/07/936077207.db2.gz HJUSHMOEPHDDOT-GFCCVEGCSA-N 1 1 356.348 3.893 20 5 FHBDMO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000161541831 936266319 /nfs/dbraw/zinc/26/63/19/936266319.db2.gz XWNQAXLIHUSQKA-CYBMUJFWSA-N 1 1 358.394 3.629 20 5 FHBDMO COc1ccc(C[N@H+]2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)cc1[N+](=O)[O-] ZINC000511798329 945156738 /nfs/dbraw/zinc/15/67/38/945156738.db2.gz SAPFUESCHKBZPN-GUDVDZBRSA-N 1 1 368.433 3.608 20 5 FHBDMO CCC[N@H+]1Cc2cccc(NC(=O)/C=C\c3ccc([N+](=O)[O-])cc3)c2C1 ZINC000255577528 938365368 /nfs/dbraw/zinc/36/53/68/938365368.db2.gz PLBCLMBKMNQKDE-FLIBITNWSA-N 1 1 351.406 3.972 20 5 FHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@H](O)c1ccccc1Br ZINC000179001113 938480787 /nfs/dbraw/zinc/48/07/87/938480787.db2.gz RSIXAJYQQUXGAF-INIZCTEOSA-N 1 1 365.227 3.523 20 5 FHBDMO CCC[N@@H+](CC)C[C@H](C)NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000584142554 938618348 /nfs/dbraw/zinc/61/83/48/938618348.db2.gz GDDLVXBKENLDKS-AWEZNQCLSA-N 1 1 362.499 3.928 20 5 FHBDMO C[N@H+]1CCC[C@@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000108428821 945196365 /nfs/dbraw/zinc/19/63/65/945196365.db2.gz HVHDAZPAAQOLRW-ZDUSSCGKSA-N 1 1 363.845 3.940 20 5 FHBDMO CN1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000108428821 945196386 /nfs/dbraw/zinc/19/63/86/945196386.db2.gz HVHDAZPAAQOLRW-ZDUSSCGKSA-N 1 1 363.845 3.940 20 5 FHBDMO CN(C(=O)C[N@@H+](C)Cc1cccc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000053017243 938786631 /nfs/dbraw/zinc/78/66/31/938786631.db2.gz WBGDDOXIDJOFQN-UHFFFAOYSA-N 1 1 363.417 3.843 20 5 FHBDMO COc1ccc(C[N@H+]2CCCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@@H]2O)cc1[N+](=O)[O-] ZINC000573263487 938908688 /nfs/dbraw/zinc/90/86/88/938908688.db2.gz UQGUQHWZQKPEQV-RMRDIRSESA-N 1 1 362.470 3.755 20 5 FHBDMO Cn1cccc1[C@@H]1CCC[N@@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000179219367 938991120 /nfs/dbraw/zinc/99/11/20/938991120.db2.gz FDSOFXGCFRQETO-SFHVURJKSA-N 1 1 352.394 3.925 20 5 FHBDMO Cn1cccc1[C@@H]1CCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000179219367 938991121 /nfs/dbraw/zinc/99/11/21/938991121.db2.gz FDSOFXGCFRQETO-SFHVURJKSA-N 1 1 352.394 3.925 20 5 FHBDMO Cc1ccc([C@@H](C)[N@@H+](C)C[C@H](O)COc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000544069379 938991633 /nfs/dbraw/zinc/99/16/33/938991633.db2.gz NXIDUXNVQMOSMT-SJORKVTESA-N 1 1 358.438 3.644 20 5 FHBDMO C[C@@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000511294229 938991752 /nfs/dbraw/zinc/99/17/52/938991752.db2.gz QNCNZNKKYUVMKH-KGLIPLIRSA-N 1 1 371.437 3.724 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H](Cc2ccccc2)[C@H]1C ZINC000472341978 939001158 /nfs/dbraw/zinc/00/11/58/939001158.db2.gz IBFIPHMORVLIFN-SJLPKXTDSA-N 1 1 367.449 3.795 20 5 FHBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CC[C@H](Cc3ccncc3)C2)c1 ZINC000611983711 939011826 /nfs/dbraw/zinc/01/18/26/939011826.db2.gz BGOIESNZFXNPPX-CQSZACIVSA-N 1 1 363.364 3.656 20 5 FHBDMO Cc1cccc([C@@H]2CC[N@@H+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)C2)c1 ZINC000612172537 939188448 /nfs/dbraw/zinc/18/84/48/939188448.db2.gz ZDGBJWCLTJSYGM-MRXNPFEDSA-N 1 1 354.406 3.759 20 5 FHBDMO COC[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@@H](C)O1 ZINC000188371293 939214536 /nfs/dbraw/zinc/21/45/36/939214536.db2.gz OTZNAWRZRFKLFH-CZUORRHYSA-N 1 1 362.451 3.559 20 5 FHBDMO COC[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@@H](C)O1 ZINC000188371293 939214539 /nfs/dbraw/zinc/21/45/39/939214539.db2.gz OTZNAWRZRFKLFH-CZUORRHYSA-N 1 1 362.451 3.559 20 5 FHBDMO Cc1cccc([C@H]2CCC[N@H+]2C[C@@H](O)COc2ccccc2[N+](=O)[O-])c1C ZINC000544143118 945277581 /nfs/dbraw/zinc/27/75/81/945277581.db2.gz YCKHOPOAJSKMAI-IEBWSBKVSA-N 1 1 370.449 3.788 20 5 FHBDMO COc1ccc(NC(=O)CC[N@@H+]([C@H](C)c2ccco2)C2CC2)c([N+](=O)[O-])c1 ZINC000411394511 940037325 /nfs/dbraw/zinc/03/73/25/940037325.db2.gz UGWIKPCTGUPOIT-CYBMUJFWSA-N 1 1 373.409 3.751 20 5 FHBDMO CC(C)[C@@H](NC(=O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000548933596 940091666 /nfs/dbraw/zinc/09/16/66/940091666.db2.gz HHYJMPKTQJMSSG-OAQYLSRUSA-N 1 1 369.465 3.583 20 5 FHBDMO CC(C)[C@@H](NC(=O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000548933596 940091671 /nfs/dbraw/zinc/09/16/71/940091671.db2.gz HHYJMPKTQJMSSG-OAQYLSRUSA-N 1 1 369.465 3.583 20 5 FHBDMO CC(C)([NH2+]CC(=O)N1CCC[C@@H]2CCCC[C@H]21)c1ccccc1[N+](=O)[O-] ZINC000411759089 940113153 /nfs/dbraw/zinc/11/31/53/940113153.db2.gz PAJWDOUAFCCBTF-DOTOQJQBSA-N 1 1 359.470 3.601 20 5 FHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@]2(C1)CC(=O)c1ccccc1O2 ZINC000411982040 940173209 /nfs/dbraw/zinc/17/32/09/940173209.db2.gz KUMIJYHXKLWWAS-XOBRGWDASA-N 1 1 352.390 3.766 20 5 FHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@]2(C1)CC(=O)c1ccccc1O2 ZINC000411982040 940173212 /nfs/dbraw/zinc/17/32/12/940173212.db2.gz KUMIJYHXKLWWAS-XOBRGWDASA-N 1 1 352.390 3.766 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](Oc3ccccc3)C2)c2c(c1)COCO2 ZINC000411985373 940173360 /nfs/dbraw/zinc/17/33/60/940173360.db2.gz PEJWLHBXIPUGOT-IBGZPJMESA-N 1 1 370.405 3.505 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](Oc3ccccc3)C2)c2c(c1)COCO2 ZINC000411985373 940173363 /nfs/dbraw/zinc/17/33/63/940173363.db2.gz PEJWLHBXIPUGOT-IBGZPJMESA-N 1 1 370.405 3.505 20 5 FHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC2(CCOCC2)[C@H]1c1ccccc1 ZINC000411994885 940179849 /nfs/dbraw/zinc/17/98/49/940179849.db2.gz BKIGTWFVSJNUOB-HXUWFJFHSA-N 1 1 368.433 3.827 20 5 FHBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2nn(C)c3ccccc23)cc1[N+](=O)[O-] ZINC000612829284 940300252 /nfs/dbraw/zinc/30/02/52/940300252.db2.gz OCPLOEFTHWXVRQ-CYBMUJFWSA-N 1 1 354.410 3.731 20 5 FHBDMO C[C@H]1C[C@H](c2ccc(F)cc2)C[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000580602026 940482119 /nfs/dbraw/zinc/48/21/19/940482119.db2.gz ZMPHSBQYXSGUAR-HOCLYGCPSA-N 1 1 371.412 3.941 20 5 FHBDMO C[C@@H]1CN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)CC[N@H+](C2CCC2)C1 ZINC000581088048 940493334 /nfs/dbraw/zinc/49/33/34/940493334.db2.gz JANHTEMGNRZHIC-HNNXBMFYSA-N 1 1 373.497 3.839 20 5 FHBDMO C[C@H]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000174179967 940712443 /nfs/dbraw/zinc/71/24/43/940712443.db2.gz DIRGMQWZZKDSHY-INIZCTEOSA-N 1 1 368.437 3.723 20 5 FHBDMO C[C@H](C1CC1)[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000582565520 940732592 /nfs/dbraw/zinc/73/25/92/940732592.db2.gz AOXDKAJUXYFZND-MRXNPFEDSA-N 1 1 367.449 3.858 20 5 FHBDMO Cc1oc(-c2cccs2)nc1C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000365512621 940771937 /nfs/dbraw/zinc/77/19/37/940771937.db2.gz MGFWAJHGUHMBGU-UHFFFAOYSA-N 1 1 373.438 3.653 20 5 FHBDMO Cc1c[nH+]cn1C1CCN(c2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000376475180 941067194 /nfs/dbraw/zinc/06/71/94/941067194.db2.gz QLRNJHLVKYHIII-UHFFFAOYSA-N 1 1 365.231 3.704 20 5 FHBDMO C[C@H]1C[C@@H](NC(=O)c2cc(F)ccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000176721205 941073698 /nfs/dbraw/zinc/07/36/98/941073698.db2.gz ZTPMHTJAFDLQCT-YOEHRIQHSA-N 1 1 371.412 3.517 20 5 FHBDMO CO[C@@H]1CC[C@@H]2OCC[N@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)[C@@H]2C1 ZINC000180815600 941080788 /nfs/dbraw/zinc/08/07/88/941080788.db2.gz AVLSDNCWZODHQZ-POAQFYNOSA-N 1 1 372.421 3.623 20 5 FHBDMO CO[C@@H]1CC[C@@H]2OCC[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)[C@@H]2C1 ZINC000180815600 941080789 /nfs/dbraw/zinc/08/07/89/941080789.db2.gz AVLSDNCWZODHQZ-POAQFYNOSA-N 1 1 372.421 3.623 20 5 FHBDMO CC(C)[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@@H]1CCC(=O)N1 ZINC000414557587 941378721 /nfs/dbraw/zinc/37/87/21/941378721.db2.gz MCCUOBXWEAKRHT-HNNXBMFYSA-N 1 1 373.478 3.812 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2ccc(CN3CCCC[C@H]3[C@@H]3CC[NH2+]C3)o2)c1 ZINC000415057752 941570503 /nfs/dbraw/zinc/57/05/03/941570503.db2.gz URVPNIATTPQHPE-APWZRJJASA-N 1 1 355.438 3.819 20 5 FHBDMO COc1cc(NC[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000311959454 941706465 /nfs/dbraw/zinc/70/64/65/941706465.db2.gz IZXILAIWPDANFA-FQEVSTJZSA-N 1 1 355.438 3.928 20 5 FHBDMO C[C@@H](CCNC(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1 ZINC000472798929 941812422 /nfs/dbraw/zinc/81/24/22/941812422.db2.gz XQTPMPXRCGMNJS-HNNXBMFYSA-N 1 1 356.426 3.627 20 5 FHBDMO COc1ccccc1O[C@@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000513386811 941884927 /nfs/dbraw/zinc/88/49/27/941884927.db2.gz QQFOGZUFFQRNEA-MRXNPFEDSA-N 1 1 372.421 3.526 20 5 FHBDMO COc1ccccc1O[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000513410530 941909126 /nfs/dbraw/zinc/90/91/26/941909126.db2.gz CYVKQAOMBYDARP-MRXNPFEDSA-N 1 1 372.421 3.655 20 5 FHBDMO COc1ccccc1O[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000513410530 941909127 /nfs/dbraw/zinc/90/91/27/941909127.db2.gz CYVKQAOMBYDARP-MRXNPFEDSA-N 1 1 372.421 3.655 20 5 FHBDMO C[C@@]1(CCCO)CCC[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000290343574 941969639 /nfs/dbraw/zinc/96/96/39/941969639.db2.gz FOPWBHWHHMSEHE-SFHVURJKSA-N 1 1 361.467 3.845 20 5 FHBDMO COc1c(C)cc(C[N@H+](C)Cc2cc([N+](=O)[O-])cc3c2OCOC3)cc1C ZINC000101566445 941981713 /nfs/dbraw/zinc/98/17/13/941981713.db2.gz ZVVPFQNLYRIBOI-UHFFFAOYSA-N 1 1 372.421 3.719 20 5 FHBDMO COc1c(C)cc(C[N@@H+](C)Cc2cc([N+](=O)[O-])cc3c2OCOC3)cc1C ZINC000101566445 941981714 /nfs/dbraw/zinc/98/17/14/941981714.db2.gz ZVVPFQNLYRIBOI-UHFFFAOYSA-N 1 1 372.421 3.719 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCCC[N@H+](C)C1CCCCC1 ZINC000085620840 942031208 /nfs/dbraw/zinc/03/12/08/942031208.db2.gz CMLYLHUCIKXGST-UHFFFAOYSA-N 1 1 362.474 3.988 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](Cc3ccccc3)C2)c2c(c1)COCO2 ZINC000513637117 942049537 /nfs/dbraw/zinc/04/95/37/942049537.db2.gz FTWYOBDLKXJPLI-KRWDZBQOSA-N 1 1 368.433 3.916 20 5 FHBDMO C[N@H+](Cc1csc2ccccc12)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000502002499 942164078 /nfs/dbraw/zinc/16/40/78/942164078.db2.gz PUDOTWFZMHDLKI-MRXNPFEDSA-N 1 1 372.446 3.681 20 5 FHBDMO CO[C@@]1(C)CCC[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000280572646 942209530 /nfs/dbraw/zinc/20/95/30/942209530.db2.gz SCIMHMYOSYWRNW-UGSOOPFHSA-N 1 1 360.414 3.597 20 5 FHBDMO CO[C@@]1(C)CCC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000280572638 942209656 /nfs/dbraw/zinc/20/96/56/942209656.db2.gz SCIMHMYOSYWRNW-ACJLOTCBSA-N 1 1 360.414 3.597 20 5 FHBDMO COc1ccc(OCC[N@H+]2CCC[C@@H](CC(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000420948700 942271552 /nfs/dbraw/zinc/27/15/52/942271552.db2.gz OCJINVDHCFNNOP-LBPRGKRZSA-N 1 1 362.348 3.647 20 5 FHBDMO CC(C)[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccc(F)cc1 ZINC000501086860 942291508 /nfs/dbraw/zinc/29/15/08/942291508.db2.gz AVOMBIDYXKUUNW-UHFFFAOYSA-N 1 1 359.401 3.973 20 5 FHBDMO CSc1cccc(C(=O)NCCC[N@@H+](C)C2CCCCC2)c1[N+](=O)[O-] ZINC000188037968 942317360 /nfs/dbraw/zinc/31/73/60/942317360.db2.gz NAWZFZSODHHHGR-UHFFFAOYSA-N 1 1 365.499 3.701 20 5 FHBDMO CCc1[nH+]ccn1[C@@H]1CCCN(c2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413130053 942326101 /nfs/dbraw/zinc/32/61/01/942326101.db2.gz QLCUGZKWGUUAJJ-CQSZACIVSA-N 1 1 351.410 3.743 20 5 FHBDMO O=[N+]([O-])c1ccc(N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c2cccnc21 ZINC000413199959 942472371 /nfs/dbraw/zinc/47/23/71/942472371.db2.gz JTKMKTVQBCDUCK-RHSMWYFYSA-N 1 1 352.438 3.596 20 5 FHBDMO Cc1[nH+]c(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)c2n1CCCC2 ZINC000378393559 942702376 /nfs/dbraw/zinc/70/23/76/942702376.db2.gz HNKGGPMIWTXCEI-UHFFFAOYSA-N 1 1 366.421 3.986 20 5 FHBDMO Cn1ccnc1[C@@H]([NH2+]CCc1c(F)cccc1F)c1cccc([N+](=O)[O-])c1 ZINC000514104374 942748260 /nfs/dbraw/zinc/74/82/60/942748260.db2.gz JKBKONHSAHYSRE-SFHVURJKSA-N 1 1 372.375 3.528 20 5 FHBDMO Cc1cc(NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)cn2cc[nH+]c12 ZINC000502810116 942762735 /nfs/dbraw/zinc/76/27/35/942762735.db2.gz FPJPZTZOAJAJTQ-UHFFFAOYSA-N 1 1 368.396 3.890 20 5 FHBDMO C[C@@]1(CCc2ccccc2)CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000434910868 943046629 /nfs/dbraw/zinc/04/66/29/943046629.db2.gz WJVPVQZZZYLENP-OAQYLSRUSA-N 1 1 367.449 3.539 20 5 FHBDMO Cc1cc(Nc2ccc(C(N)=O)cc2[N+](=O)[O-])c[nH+]c1N1CCCC[C@H]1C ZINC000503279139 943097005 /nfs/dbraw/zinc/09/70/05/943097005.db2.gz HKCXSJKSONMZHR-CYBMUJFWSA-N 1 1 369.425 3.520 20 5 FHBDMO CC(C)[N@H+](Cc1cnn(C)c1C(F)(F)F)Cc1ccc([N+](=O)[O-])cc1 ZINC000133665263 943120141 /nfs/dbraw/zinc/12/01/41/943120141.db2.gz VSJNTSPRAVQZLA-UHFFFAOYSA-N 1 1 356.348 3.758 20 5 FHBDMO CC(C)[N@@H+](Cc1cnn(C)c1C(F)(F)F)Cc1ccc([N+](=O)[O-])cc1 ZINC000133665263 943120147 /nfs/dbraw/zinc/12/01/47/943120147.db2.gz VSJNTSPRAVQZLA-UHFFFAOYSA-N 1 1 356.348 3.758 20 5 FHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cnn(-c3ccc(F)cc3)c2)c(Cl)c1 ZINC000183801774 943186740 /nfs/dbraw/zinc/18/67/40/943186740.db2.gz TWFVCDWNHGSJOM-UHFFFAOYSA-N 1 1 360.776 3.863 20 5 FHBDMO CCCNC(=O)C[NH2+]Cc1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000236854702 943391284 /nfs/dbraw/zinc/39/12/84/943391284.db2.gz AIEBIBQSCZLCJY-UHFFFAOYSA-N 1 1 373.478 3.670 20 5 FHBDMO C[C@@H](c1cccc(Cl)c1)[N@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000053233717 943416464 /nfs/dbraw/zinc/41/64/64/943416464.db2.gz GZCWLQOLZCQSGT-ZDUSSCGKSA-N 1 1 361.829 3.904 20 5 FHBDMO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000053233717 943416467 /nfs/dbraw/zinc/41/64/67/943416467.db2.gz GZCWLQOLZCQSGT-ZDUSSCGKSA-N 1 1 361.829 3.904 20 5 FHBDMO CCc1ccc([C@H](NCC[C@H]2CCC[NH2+]C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423258871 943462056 /nfs/dbraw/zinc/46/20/56/943462056.db2.gz MXKCUVMFJKOZAQ-FOIQADDNSA-N 1 1 357.454 3.819 20 5 FHBDMO CC[C@H]([NH2+][C@@H]1CNCC[C@@H]1c1ccc(OC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000423328554 943481254 /nfs/dbraw/zinc/48/12/54/943481254.db2.gz KUVQLFDOSNGKIR-QHAWAJNXSA-N 1 1 369.465 3.790 20 5 FHBDMO CCOc1ccc([C@H](C)[NH2+]C[C@H]2NCCc3ccccc32)cc1[N+](=O)[O-] ZINC000423446940 943513403 /nfs/dbraw/zinc/51/34/03/943513403.db2.gz ZMFAAWHZXQBFDB-KBXCAEBGSA-N 1 1 355.438 3.531 20 5 FHBDMO COC1CCC([N@@H+](C)Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000425404520 943573577 /nfs/dbraw/zinc/57/35/77/943573577.db2.gz LRMHFMWNQAYAGO-UHFFFAOYSA-N 1 1 357.248 3.747 20 5 FHBDMO CC[C@@H](C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1 ZINC000516897920 943814532 /nfs/dbraw/zinc/81/45/32/943814532.db2.gz KMQXBXIYIMGSNI-APWZRJJASA-N 1 1 369.465 3.991 20 5 FHBDMO Cc1ccc(NC(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000504912942 943909332 /nfs/dbraw/zinc/90/93/32/943909332.db2.gz ABZCELBBFXOUGX-GOSISDBHSA-N 1 1 368.437 3.689 20 5 FHBDMO COCC[C@@H]([NH2+]Cc1ccc(Br)cc1[N+](=O)[O-])c1ccco1 ZINC000425433015 943909856 /nfs/dbraw/zinc/90/98/56/943909856.db2.gz MQXKYPLRIIEMJV-CYBMUJFWSA-N 1 1 369.215 3.818 20 5 FHBDMO CCOC1(C)CC[NH+](Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000425443973 943957516 /nfs/dbraw/zinc/95/75/16/943957516.db2.gz KXZHTZSLZNCUIV-UHFFFAOYSA-N 1 1 357.248 3.748 20 5 FHBDMO COCC1(C)CC[NH+](Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000425456095 943980937 /nfs/dbraw/zinc/98/09/37/943980937.db2.gz IUQWINUXIGTHKZ-UHFFFAOYSA-N 1 1 357.248 3.606 20 5 FHBDMO C[C@H]1[C@@H](c2ccccc2)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500093947 944084365 /nfs/dbraw/zinc/08/43/65/944084365.db2.gz SWXAIUKYWYEQFH-RDJZCZTQSA-N 1 1 353.422 3.801 20 5 FHBDMO C[C@@H]1C[C@@H](c2ccc(F)cc2)C[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500126385 944141381 /nfs/dbraw/zinc/14/13/81/944141381.db2.gz RZXVNNFEZGRGKB-GDBMZVCRSA-N 1 1 371.412 3.941 20 5 FHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(c2cc(C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000436303068 944186814 /nfs/dbraw/zinc/18/68/14/944186814.db2.gz BMIVTCZPVVSILL-XQQFMLRXSA-N 1 1 372.391 3.850 20 5 FHBDMO COc1ccc(CNC[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000312655969 944192455 /nfs/dbraw/zinc/19/24/55/944192455.db2.gz LOPRSFIYXUDLQU-NRFANRHFSA-N 1 1 369.465 3.605 20 5 FHBDMO COc1ccc(-c2ccc(C[NH2+]Cc3ncccc3C)o2)c([N+](=O)[O-])c1 ZINC000106481075 944256724 /nfs/dbraw/zinc/25/67/24/944256724.db2.gz SPYSDDFFMQXWHU-UHFFFAOYSA-N 1 1 353.378 3.857 20 5 FHBDMO O=[N+]([O-])c1cnc(N2CC[C@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)c(F)c1 ZINC000518336044 944283164 /nfs/dbraw/zinc/28/31/64/944283164.db2.gz OZHKIBZPKFHQFI-APWZRJJASA-N 1 1 370.428 3.620 20 5 FHBDMO CN(C(=O)C[N@@H+]1CCC[C@@H]1/C=C/c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000505825146 944331780 /nfs/dbraw/zinc/33/17/80/944331780.db2.gz KGFKFIKRCDUBNY-JBVUFVISSA-N 1 1 365.433 3.735 20 5 FHBDMO CN(C(=O)C[N@H+]1CCC[C@@H]1/C=C/c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000505825146 944331789 /nfs/dbraw/zinc/33/17/89/944331789.db2.gz KGFKFIKRCDUBNY-JBVUFVISSA-N 1 1 365.433 3.735 20 5 FHBDMO CC(C)c1ccc(C(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)cc1[N+](=O)[O-] ZINC000439133376 944351901 /nfs/dbraw/zinc/35/19/01/944351901.db2.gz RPOXDCAGMZUIQS-GOSISDBHSA-N 1 1 371.437 3.878 20 5 FHBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@@H+](C)[C@@H](C)CC ZINC000506180871 944365901 /nfs/dbraw/zinc/36/59/01/944365901.db2.gz YKRDHOFGEIDYKM-ZDUSSCGKSA-N 1 1 353.488 3.557 20 5 FHBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000518430084 944374526 /nfs/dbraw/zinc/37/45/26/944374526.db2.gz AFFOJSCNKWILQL-RHSMWYFYSA-N 1 1 354.410 3.552 20 5 FHBDMO C[C@H](NC(=O)[C@H](c1cccc(Cl)c1)[NH+](C)C)c1cccc([N+](=O)[O-])c1 ZINC000518443807 944381307 /nfs/dbraw/zinc/38/13/07/944381307.db2.gz SDVIFEVQONEKIO-SJCJKPOMSA-N 1 1 361.829 3.728 20 5 FHBDMO C[C@@H](NC(=O)[C@H](c1cccc(Cl)c1)[NH+](C)C)c1cccc([N+](=O)[O-])c1 ZINC000518443806 944381584 /nfs/dbraw/zinc/38/15/84/944381584.db2.gz SDVIFEVQONEKIO-PXAZEXFGSA-N 1 1 361.829 3.728 20 5 FHBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[N@H+](C(C)C)CC1 ZINC000506182323 944388911 /nfs/dbraw/zinc/38/89/11/944388911.db2.gz JKBHEVPRLAFDQY-UHFFFAOYSA-N 1 1 365.499 3.653 20 5 FHBDMO C[C@@H]1[C@@H](CO)CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000425960794 944414055 /nfs/dbraw/zinc/41/40/55/944414055.db2.gz YWKAEBMJRIQEJL-VXGBXAGGSA-N 1 1 350.802 3.711 20 5 FHBDMO Cc1cc(NC(=O)N[C@@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000473789232 944469022 /nfs/dbraw/zinc/46/90/22/944469022.db2.gz RTDBPIHMKOOCLY-CRAIPNDOSA-N 1 1 368.437 3.860 20 5 FHBDMO Cc1ccc2c(c1)[C@@H]1C[N@@H+](C)CC[C@H]1N2C(=O)c1cc([N+](=O)[O-])ccc1C ZINC000843740415 944472308 /nfs/dbraw/zinc/47/23/08/944472308.db2.gz WWXDNDWWOQEODI-AZUAARDMSA-N 1 1 365.433 3.660 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)C1CCC(C)(C)CC1 ZINC000438488288 944673690 /nfs/dbraw/zinc/67/36/90/944673690.db2.gz GWDSJXFWUWSDFT-UHFFFAOYSA-N 1 1 363.458 3.833 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@](C)(c2ccccc2)C1 ZINC000438490622 944682567 /nfs/dbraw/zinc/68/25/67/944682567.db2.gz LBRIZIWQKLYCNL-FQEVSTJZSA-N 1 1 353.422 3.505 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@](C)(c2ccccc2)C1 ZINC000438490622 944682574 /nfs/dbraw/zinc/68/25/74/944682574.db2.gz LBRIZIWQKLYCNL-FQEVSTJZSA-N 1 1 353.422 3.505 20 5 FHBDMO CC(=O)c1cc(N(C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000383074614 944707891 /nfs/dbraw/zinc/70/78/91/944707891.db2.gz SWTAUCGJJFQWOJ-GOSISDBHSA-N 1 1 367.449 3.756 20 5 FHBDMO C[C@@H]1C[N@H+](C2CCN(c3c(Cl)cc(Cl)cc3[N+](=O)[O-])CC2)CCO1 ZINC000408101257 944708997 /nfs/dbraw/zinc/70/89/97/944708997.db2.gz JGPSDBLFEKMIKB-LLVKDONJSA-N 1 1 374.268 3.591 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000506281869 944788332 /nfs/dbraw/zinc/78/83/32/944788332.db2.gz MVKUROAMVQSBBP-WBVHZDCISA-N 1 1 368.437 3.860 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](Cc1ccccc1)C(C)(C)C ZINC000438594674 944819404 /nfs/dbraw/zinc/81/94/04/944819404.db2.gz ZTTBXRCCGPCUMV-UHFFFAOYSA-N 1 1 371.437 3.843 20 5 FHBDMO CCC[N@H+]1CC[C@H](CNc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C1 ZINC000506993817 944844018 /nfs/dbraw/zinc/84/40/18/944844018.db2.gz ADOXZTZTDPPLGS-MRXNPFEDSA-N 1 1 367.449 3.970 20 5 FHBDMO COc1cc(C[N@H+]2CCC[C@H]2Cc2ccccc2)c([N+](=O)[O-])cc1OC ZINC000506675120 944966767 /nfs/dbraw/zinc/96/67/67/944966767.db2.gz KDNYQBCNHDWICG-KRWDZBQOSA-N 1 1 356.422 3.819 20 5 FHBDMO O=C(NC[C@@H](c1cccc(Cl)c1)[NH+]1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000106167708 945040082 /nfs/dbraw/zinc/04/00/82/945040082.db2.gz MRPAHOXMQYUTPK-SFHVURJKSA-N 1 1 373.840 3.815 20 5 FHBDMO C[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)[N@@H+](C)C1CC1 ZINC000110695567 945054125 /nfs/dbraw/zinc/05/41/25/945054125.db2.gz CMXARDAVZIPTBL-CQSZACIVSA-N 1 1 369.421 3.600 20 5 FHBDMO CCC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)C[C@H]1CCCCO1 ZINC000106867041 945418683 /nfs/dbraw/zinc/41/86/83/945418683.db2.gz GBURVVLTBVMLAO-QGZVFWFLSA-N 1 1 363.458 3.513 20 5 FHBDMO CC[C@H](C(=O)N[C@@H](C)c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000519488682 945460643 /nfs/dbraw/zinc/46/06/43/945460643.db2.gz RXCNQWVYMHQSPN-MAUKXSAKSA-N 1 1 355.438 3.683 20 5 FHBDMO C[C@H](O)[C@H]1CC[N@@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000507697631 945461250 /nfs/dbraw/zinc/46/12/50/945461250.db2.gz KMDIKMHVPJBVEZ-ZFWWWQNUSA-N 1 1 360.385 3.729 20 5 FHBDMO COc1cc(C[N@H+]2CC[C@H](COc3ccccc3)C2)c([N+](=O)[O-])cc1OC ZINC000507712635 945485902 /nfs/dbraw/zinc/48/59/02/945485902.db2.gz DKKHMLMSLCVYIZ-HNNXBMFYSA-N 1 1 372.421 3.513 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCc2c(C)cccc2C1 ZINC000729479827 945702163 /nfs/dbraw/zinc/70/21/63/945702163.db2.gz GCFYDPZCEAHYSL-UHFFFAOYSA-N 1 1 353.422 3.599 20 5 FHBDMO CC[N@H+](Cc1cccc([N+](=O)[O-])c1C)[C@@H]1CCN(c2ccccc2)C1=O ZINC000522711773 945706313 /nfs/dbraw/zinc/70/63/13/945706313.db2.gz PNXWKYFZYLQMLY-LJQANCHMSA-N 1 1 353.422 3.531 20 5 FHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)[C@@H]1CCN(c2ccccc2)C1=O ZINC000522711773 945706325 /nfs/dbraw/zinc/70/63/25/945706325.db2.gz PNXWKYFZYLQMLY-LJQANCHMSA-N 1 1 353.422 3.531 20 5 FHBDMO CN(CCC[N@@H+](C)Cc1ccco1)c1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000519773791 945733250 /nfs/dbraw/zinc/73/32/50/945733250.db2.gz KCVSWRQAPURSCV-UHFFFAOYSA-N 1 1 354.410 3.694 20 5 FHBDMO C[C@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC[N@@H+](Cc2ccccc2)C1 ZINC000454310132 945743885 /nfs/dbraw/zinc/74/38/85/945743885.db2.gz FWTBIKGFUCBRKN-MRXNPFEDSA-N 1 1 368.437 3.581 20 5 FHBDMO CCC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000729482890 946023711 /nfs/dbraw/zinc/02/37/11/946023711.db2.gz DZGOZWUMADACDW-INIZCTEOSA-N 1 1 363.458 3.816 20 5 FHBDMO Cc1ccc([C@H]2CCC[C@@H]2[N@@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1 ZINC000444236959 946109334 /nfs/dbraw/zinc/10/93/34/946109334.db2.gz IYDICLCDPQRDSE-MOPGFXCFSA-N 1 1 367.449 3.770 20 5 FHBDMO Cc1ccc([C@H]2CCC[C@H]2[N@@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1 ZINC000444236962 946109508 /nfs/dbraw/zinc/10/95/08/946109508.db2.gz IYDICLCDPQRDSE-RTBURBONSA-N 1 1 367.449 3.770 20 5 FHBDMO CC(C)c1ccc(C(=O)N[C@H]2C[N@@H+](C)C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000439742336 946138395 /nfs/dbraw/zinc/13/83/95/946138395.db2.gz UBXNBYOCJRHXHP-OALUTQOASA-N 1 1 367.449 3.546 20 5 FHBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@@](C)(c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000438490134 946281842 /nfs/dbraw/zinc/28/18/42/946281842.db2.gz KNLWHRUPYALTHN-OAQYLSRUSA-N 1 1 367.449 3.895 20 5 FHBDMO Cc1cc(C(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)ccc1[N+](=O)[O-] ZINC000109564748 946339893 /nfs/dbraw/zinc/33/98/93/946339893.db2.gz APOKLOJDPKVUJT-HNNXBMFYSA-N 1 1 373.478 3.607 20 5 FHBDMO CCOc1ccc(C[NH+]2CCN([C@H](C)c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000441242995 946352388 /nfs/dbraw/zinc/35/23/88/946352388.db2.gz GRJUDVHBTGMJLK-QGZVFWFLSA-N 1 1 369.465 3.872 20 5 FHBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2cc(C(F)(F)F)n[nH]2)cc(C(F)(F)F)c1 ZINC000441336575 946444255 /nfs/dbraw/zinc/44/42/55/946444255.db2.gz BRBBTDXZGSNCMN-UHFFFAOYSA-N 1 1 368.237 3.645 20 5 FHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000441395413 946550303 /nfs/dbraw/zinc/55/03/03/946550303.db2.gz MLQQQZSJKVFQJN-OXJNMPFZSA-N 1 1 373.497 3.831 20 5 FHBDMO CC(C)c1ccc(C(=O)NC[C@H](C)[N@@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC001126133065 946565817 /nfs/dbraw/zinc/56/58/17/946565817.db2.gz BMQBCQZGRNONGE-INIZCTEOSA-N 1 1 369.465 3.969 20 5 FHBDMO CCS[C@@H]1CCCC[N@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000112088871 946659607 /nfs/dbraw/zinc/65/96/07/946659607.db2.gz DJTBHCXALFWVGM-UONOGXRCSA-N 1 1 351.472 3.529 20 5 FHBDMO CC[N@H+]1C[C@H](C)N(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[C@H]1C ZINC000475194479 946678348 /nfs/dbraw/zinc/67/83/48/946678348.db2.gz QPACKDCEPGXPRS-MNOVXSKESA-N 1 1 374.363 3.560 20 5 FHBDMO Cc1cc(NC[C@@H]2CC[N@H+](C(C)C)C2)c(Br)cc1[N+](=O)[O-] ZINC000232651402 946882943 /nfs/dbraw/zinc/88/29/43/946882943.db2.gz SMAOCPOGJAZGQI-LBPRGKRZSA-N 1 1 356.264 3.808 20 5 FHBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@H]1C ZINC000475361235 946952470 /nfs/dbraw/zinc/95/24/70/946952470.db2.gz FSHXZAHSXCTMIA-CXAGYDPISA-N 1 1 374.462 3.954 20 5 FHBDMO CC(C)c1ccc(C(=O)N2CC[NH2+][C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000457011818 947026854 /nfs/dbraw/zinc/02/68/54/947026854.db2.gz FYQHXRNPMWCIME-GOSISDBHSA-N 1 1 353.422 3.505 20 5 FHBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)CC1(c2ccccc2)CC1 ZINC000444676493 947101032 /nfs/dbraw/zinc/10/10/32/947101032.db2.gz QOICJEOAQJIHBX-OAHLLOKOSA-N 1 1 353.422 3.585 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)Cc1cc(C)cc(C)c1 ZINC000444695765 947120267 /nfs/dbraw/zinc/12/02/67/947120267.db2.gz UEZGOYZGRITYAG-UHFFFAOYSA-N 1 1 371.437 3.681 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000074448508 947170620 /nfs/dbraw/zinc/17/06/20/947170620.db2.gz JPFDSBDPKVGODD-LJQANCHMSA-N 1 1 367.449 3.640 20 5 FHBDMO COc1ccc(C[N@@H+]2C[C@]3(C[C@@H]4CC[C@H]3C4)OC(C)(C)C2)cc1[N+](=O)[O-] ZINC000440539181 947187898 /nfs/dbraw/zinc/18/78/98/947187898.db2.gz NMRWIMMITUUMFV-IIMJZQEZSA-N 1 1 360.454 3.773 20 5 FHBDMO COc1ccc(C[N@H+]2C[C@]3(C[C@@H]4CC[C@H]3C4)OC(C)(C)C2)cc1[N+](=O)[O-] ZINC000440539181 947187905 /nfs/dbraw/zinc/18/79/05/947187905.db2.gz NMRWIMMITUUMFV-IIMJZQEZSA-N 1 1 360.454 3.773 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@H+]2C[C@@H](O)C3(CC3)C2)ccc1Oc1ccccc1Cl ZINC000428379686 947237278 /nfs/dbraw/zinc/23/72/78/947237278.db2.gz KGUQOWSLAWGGIU-GOSISDBHSA-N 1 1 374.824 3.997 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@@H+]2C[C@@H](O)C3(CC3)C2)ccc1Oc1ccccc1Cl ZINC000428379686 947237285 /nfs/dbraw/zinc/23/72/85/947237285.db2.gz KGUQOWSLAWGGIU-GOSISDBHSA-N 1 1 374.824 3.997 20 5 FHBDMO CC[C@H](Cc1ccccc1)[N@@H+](C)CCOc1ccc(OC)cc1[N+](=O)[O-] ZINC000441434113 947237811 /nfs/dbraw/zinc/23/78/11/947237811.db2.gz IXNJGNKVGQVMBP-QGZVFWFLSA-N 1 1 358.438 3.935 20 5 FHBDMO Cc1cc(NCc2ccc(N)[nH+]c2C)c([N+](=O)[O-])cc1Br ZINC001167787227 947244981 /nfs/dbraw/zinc/24/49/81/947244981.db2.gz VFCCCIAAOIHVLG-UHFFFAOYSA-N 1 1 351.204 3.563 20 5 FHBDMO COCC[N@H+](Cc1cc(OC)c(OC)cc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000508516003 947440886 /nfs/dbraw/zinc/44/08/86/947440886.db2.gz HZLFLICITFJGRI-HNNXBMFYSA-N 1 1 374.437 3.822 20 5 FHBDMO COCC[N@@H+](Cc1cc(OC)c(OC)cc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000508516003 947440897 /nfs/dbraw/zinc/44/08/97/947440897.db2.gz HZLFLICITFJGRI-HNNXBMFYSA-N 1 1 374.437 3.822 20 5 FHBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000072838453 947570495 /nfs/dbraw/zinc/57/04/95/947570495.db2.gz LSBYVGKCKREIAS-CABCVRRESA-N 1 1 362.455 3.751 20 5 FHBDMO CC[NH+](CC)[C@H](CNCc1ccc(OC)c([N+](=O)[O-])c1)c1ccccc1 ZINC000236894045 947603352 /nfs/dbraw/zinc/60/33/52/947603352.db2.gz JRCFMWXFJBWSKI-LJQANCHMSA-N 1 1 357.454 3.776 20 5 FHBDMO COc1ccc(OCC[N@H+]2CC[C@@H](c3ccccc3C)C2)c([N+](=O)[O-])c1 ZINC000441535409 948232986 /nfs/dbraw/zinc/23/29/86/948232986.db2.gz PSNUABQHXPTOIW-MRXNPFEDSA-N 1 1 356.422 3.780 20 5 FHBDMO O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CCC=C(c3ccccc3)C1)OCCO2 ZINC000585767898 948278447 /nfs/dbraw/zinc/27/84/47/948278447.db2.gz AHKJWHAQPMZMSN-UHFFFAOYSA-N 1 1 352.390 3.655 20 5 FHBDMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CCC=C(c3ccccc3)C1)OCCO2 ZINC000585767898 948278457 /nfs/dbraw/zinc/27/84/57/948278457.db2.gz AHKJWHAQPMZMSN-UHFFFAOYSA-N 1 1 352.390 3.655 20 5 FHBDMO C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)[C@@H](C)C[N@@H+]1C ZINC000512101887 948418699 /nfs/dbraw/zinc/41/86/99/948418699.db2.gz VTRKPMVQFRRXRA-CABCVRRESA-N 1 1 369.421 3.552 20 5 FHBDMO C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)[C@@H](C)C[N@H+]1C ZINC000512101887 948418705 /nfs/dbraw/zinc/41/87/05/948418705.db2.gz VTRKPMVQFRRXRA-CABCVRRESA-N 1 1 369.421 3.552 20 5 FHBDMO CCC(C)(C)[C@@H]1CCC[N@H+]1CCCn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000441649198 948454235 /nfs/dbraw/zinc/45/42/35/948454235.db2.gz RGMZYDDWZSRXIK-KRWDZBQOSA-N 1 1 361.442 3.793 20 5 FHBDMO COc1ccc(NC(=O)CC[N@H+]2CCC[C@]3(CC=CCC3)C2)c([N+](=O)[O-])c1 ZINC000512153762 948568594 /nfs/dbraw/zinc/56/85/94/948568594.db2.gz KWTHOSWWTDBIGM-HXUWFJFHSA-N 1 1 373.453 3.754 20 5 FHBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C1 ZINC000090113405 948666482 /nfs/dbraw/zinc/66/64/82/948666482.db2.gz OONNBOUMTAGEIP-SJORKVTESA-N 1 1 352.438 3.577 20 5 FHBDMO Cc1cccc(OCC[N@@H+](C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)c1 ZINC000728899507 948704649 /nfs/dbraw/zinc/70/46/49/948704649.db2.gz IEWXVGWTKWZPCX-UHFFFAOYSA-N 1 1 366.421 3.735 20 5 FHBDMO Cc1cccc(OCC[N@H+](C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)c1 ZINC000728899507 948704655 /nfs/dbraw/zinc/70/46/55/948704655.db2.gz IEWXVGWTKWZPCX-UHFFFAOYSA-N 1 1 366.421 3.735 20 5 FHBDMO CC[C@@H]1[C@@H](C)CC[N@H+]1Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000481414151 567913555 /nfs/dbraw/zinc/91/35/55/567913555.db2.gz OEVMLQBTLVJKSX-WCQYABFASA-N 1 1 358.385 3.868 20 5 FHBDMO O=[N+]([O-])c1ccc(CCN2CCN(c3cc[nH+]c4ccccc43)CC2)cc1 ZINC000568139371 567932036 /nfs/dbraw/zinc/93/20/36/567932036.db2.gz FFFSDHUMBADKCF-UHFFFAOYSA-N 1 1 362.433 3.508 20 5 FHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@@H](c2ccc3cccnc3n2)C1 ZINC000602888027 568006338 /nfs/dbraw/zinc/00/63/38/568006338.db2.gz OPBSSPDMNRYZQW-CQSZACIVSA-N 1 1 352.369 3.667 20 5 FHBDMO COc1cc(C[NH+]2CC(C3CCC3)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000568564456 568050615 /nfs/dbraw/zinc/05/06/15/568050615.db2.gz XUDOVKUQCYOTKK-UHFFFAOYSA-N 1 1 374.359 3.776 20 5 FHBDMO CCSCC[C@H](C)[N@@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000072901161 568056826 /nfs/dbraw/zinc/05/68/26/568056826.db2.gz IAMQHCKCUBIYBG-NSHDSACASA-N 1 1 359.879 3.650 20 5 FHBDMO CS[C@H](C[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)C(C)(C)C ZINC000568671654 568116940 /nfs/dbraw/zinc/11/69/40/568116940.db2.gz ITDBALRHUQSPBM-HZPDHXFCSA-N 1 1 362.499 3.785 20 5 FHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC(F)(F)[C@H](CO)C2)s1 ZINC000291351744 568118562 /nfs/dbraw/zinc/11/85/62/568118562.db2.gz XGZRAYWNUCQVAM-LBPRGKRZSA-N 1 1 368.405 3.773 20 5 FHBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC2(CCC2)[C@H]1c1ccccc1 ZINC000453031519 568264992 /nfs/dbraw/zinc/26/49/92/568264992.db2.gz YWAUTTYYEWLCQW-YLJYHZDGSA-N 1 1 368.433 3.562 20 5 FHBDMO C[C@H]1CC[C@]2(CC[N@H+](CC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)C2)C1 ZINC000541949699 568270802 /nfs/dbraw/zinc/27/08/02/568270802.db2.gz VBOZPAFPNUHIDU-SJCJKPOMSA-N 1 1 351.834 3.699 20 5 FHBDMO C[C@H]1CC[C@]2(CC[N@@H+](CC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)C2)C1 ZINC000541949699 568270804 /nfs/dbraw/zinc/27/08/04/568270804.db2.gz VBOZPAFPNUHIDU-SJCJKPOMSA-N 1 1 351.834 3.699 20 5 FHBDMO CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)CCc1ccccc1 ZINC000604435489 568292653 /nfs/dbraw/zinc/29/26/53/568292653.db2.gz KWGXGBJZTGNCNS-UHFFFAOYSA-N 1 1 355.438 3.796 20 5 FHBDMO COc1ccccc1[C@H](CO)[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000569908213 568435764 /nfs/dbraw/zinc/43/57/64/568435764.db2.gz SLRKULOYJYWWDY-ROUUACIJSA-N 1 1 356.422 3.649 20 5 FHBDMO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(-c3nn[nH]n3)cc2F)cc1[N+](=O)[O-] ZINC000826283222 609342958 /nfs/dbraw/zinc/34/29/58/609342958.db2.gz MZIBYNMEWSTVMP-RYUDHWBXSA-N 1 1 370.388 3.634 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000079556586 937133463 /nfs/dbraw/zinc/13/34/63/937133463.db2.gz DSKJYRQMZDZCEX-SJLPKXTDSA-N 1 1 367.449 3.686 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(Nc2ccc(F)cc2)CC1 ZINC000430194767 927853939 /nfs/dbraw/zinc/85/39/39/927853939.db2.gz KWFJYXWMIBDGOX-UHFFFAOYSA-N 1 1 359.401 3.819 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1CN[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000430203835 928001982 /nfs/dbraw/zinc/00/19/82/928001982.db2.gz JJGUYZPJHUEQEO-OXQOHEQNSA-N 1 1 369.465 3.604 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[NH+](Cc2ccccc2)CC1 ZINC000120301704 928020147 /nfs/dbraw/zinc/02/01/47/928020147.db2.gz ISEGGSJDIPSBEV-UHFFFAOYSA-N 1 1 368.437 3.561 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H]1CC(=O)c1ccc(F)cc1 ZINC000430216444 928198561 /nfs/dbraw/zinc/19/85/61/928198561.db2.gz HMQPDCRNAVCFBB-KRWDZBQOSA-N 1 1 372.396 3.980 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]1CC(=O)c1ccc(F)cc1 ZINC000430216444 928198583 /nfs/dbraw/zinc/19/85/83/928198583.db2.gz HMQPDCRNAVCFBB-KRWDZBQOSA-N 1 1 372.396 3.980 20 5 FHBDMO C[C@H]1C[C@H](CCNC(=O)c2ccc([N+](=O)[O-])s2)C[N@H+]1Cc1ccccc1 ZINC000510097870 928232387 /nfs/dbraw/zinc/23/23/87/928232387.db2.gz IQDNTKPJRIILMN-HOCLYGCPSA-N 1 1 373.478 3.687 20 5 FHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](C(=O)N(C)c2ccccc2)C1 ZINC000430296406 929398672 /nfs/dbraw/zinc/39/86/72/929398672.db2.gz JBTIHIORUVJLNY-RDJZCZTQSA-N 1 1 353.422 3.641 20 5 FHBDMO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCC[C@@H]2C[C@@H](O)c2cccs2)cc1 ZINC000175816896 929630574 /nfs/dbraw/zinc/63/05/74/929630574.db2.gz BDBZZSRUVRVNFS-NVXWUHKLSA-N 1 1 362.451 3.623 20 5 FHBDMO C[C@@H](c1ccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1)[NH+]1CCOCC1 ZINC000109846648 929714039 /nfs/dbraw/zinc/71/40/39/929714039.db2.gz VHKDYDCYROAFEF-AWEZNQCLSA-N 1 1 370.409 3.632 20 5 FHBDMO CC(C)(C)OC(=O)NCc1cc(Nc2cccc([N+](=O)[O-])c2F)cc[nH+]1 ZINC001210381938 929724593 /nfs/dbraw/zinc/72/45/93/929724593.db2.gz SHHRVWKNKBCKSK-UHFFFAOYSA-N 1 1 362.361 3.897 20 5 FHBDMO Cc1ccc([C@H]2CCCCC[N@H+]2C[C@H](O)COc2cccc([N+](=O)[O-])c2)o1 ZINC000610004520 929772126 /nfs/dbraw/zinc/77/21/26/929772126.db2.gz PXFXXBZDRSLVOJ-PKOBYXMFSA-N 1 1 374.437 3.853 20 5 FHBDMO COc1ccc(C[N@H+]2CCC[C@H]2C[C@H](O)c2cccs2)cc1[N+](=O)[O-] ZINC000175851074 929968154 /nfs/dbraw/zinc/96/81/54/929968154.db2.gz LLQCAZKZUXKZGQ-HOCLYGCPSA-N 1 1 362.451 3.753 20 5 FHBDMO COCC1(C[NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CCCCC1 ZINC000564426659 930300328 /nfs/dbraw/zinc/30/03/28/930300328.db2.gz CGKPODGUKBVBRB-GOSISDBHSA-N 1 1 372.469 3.604 20 5 FHBDMO CC1=C(c2ccco2)C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000579498154 930392166 /nfs/dbraw/zinc/39/21/66/930392166.db2.gz APSMXQAHNKNLHL-UHFFFAOYSA-N 1 1 366.377 3.917 20 5 FHBDMO CC1=C(c2ccco2)C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000579498154 930392170 /nfs/dbraw/zinc/39/21/70/930392170.db2.gz APSMXQAHNKNLHL-UHFFFAOYSA-N 1 1 366.377 3.917 20 5 FHBDMO O=[N+]([O-])c1cn(C[N@@H+]2CCSC3(CCCCC3)C2)nc1-c1ccncc1 ZINC000175926827 930485028 /nfs/dbraw/zinc/48/50/28/930485028.db2.gz XLFYZFSQIOSFFJ-UHFFFAOYSA-N 1 1 373.482 3.563 20 5 FHBDMO O=[N+]([O-])c1cn(C[N@H+]2CCSC3(CCCCC3)C2)nc1-c1ccncc1 ZINC000175926827 930485031 /nfs/dbraw/zinc/48/50/31/930485031.db2.gz XLFYZFSQIOSFFJ-UHFFFAOYSA-N 1 1 373.482 3.563 20 5 FHBDMO CC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@H](C)Cc1ccc(OC)cc1 ZINC001167387463 930593508 /nfs/dbraw/zinc/59/35/08/930593508.db2.gz SQZAZPHMGGHBGT-MRXNPFEDSA-N 1 1 358.438 3.935 20 5 FHBDMO Cc1[nH+]ccn1-c1ccc([C@@H](C)NC(=O)c2ccc([N+](=O)[O-])s2)cc1 ZINC000119302097 931068567 /nfs/dbraw/zinc/06/85/67/931068567.db2.gz KXWBZMJBNZWYMX-LLVKDONJSA-N 1 1 356.407 3.641 20 5 FHBDMO CCC[N@@H+]1Cc2cccc(NC(=O)COc3ccc([N+](=O)[O-])c(C)c3)c2C1 ZINC000430556331 931827150 /nfs/dbraw/zinc/82/71/50/931827150.db2.gz YVXDPNSICYQDMM-UHFFFAOYSA-N 1 1 369.421 3.646 20 5 FHBDMO CCC[N@H+]1Cc2cccc(NC(=O)COc3ccc([N+](=O)[O-])c(C)c3)c2C1 ZINC000430556331 931827161 /nfs/dbraw/zinc/82/71/61/931827161.db2.gz YVXDPNSICYQDMM-UHFFFAOYSA-N 1 1 369.421 3.646 20 5 FHBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@H]2c2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000610505304 932015975 /nfs/dbraw/zinc/01/59/75/932015975.db2.gz GGSVIAMMQYCXEP-SFHVURJKSA-N 1 1 357.385 3.818 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H]1c1cccc(F)c1 ZINC000610505423 932016056 /nfs/dbraw/zinc/01/60/56/932016056.db2.gz KXKFEGSBFHRRCN-SFHVURJKSA-N 1 1 357.385 3.818 20 5 FHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CCc1nc(-c2ccccc2)no1)C1CC1 ZINC000135235552 932085969 /nfs/dbraw/zinc/08/59/69/932085969.db2.gz BFPUGHFKTXTHIP-UHFFFAOYSA-N 1 1 364.405 3.852 20 5 FHBDMO CN(C(=O)CC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccccc1 ZINC000135236537 932086300 /nfs/dbraw/zinc/08/63/00/932086300.db2.gz KRHDMNRXYWYSBK-UHFFFAOYSA-N 1 1 353.422 3.612 20 5 FHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](OCc2c(C)noc2C)C1 ZINC000581456160 932090162 /nfs/dbraw/zinc/09/01/62/932090162.db2.gz SHWNALZQUFYSCG-BZPDREMPSA-N 1 1 371.437 3.894 20 5 FHBDMO C[C@@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1ncc(Br)s1 ZINC000537968114 932174995 /nfs/dbraw/zinc/17/49/95/932174995.db2.gz RBNFCILUOAQGCB-SECBINFHSA-N 1 1 372.244 3.543 20 5 FHBDMO COc1cc(CNc2ccc(C)c[nH+]2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000157445181 932550880 /nfs/dbraw/zinc/55/08/80/932550880.db2.gz YVGFYTLZDHTRJR-UHFFFAOYSA-N 1 1 371.315 3.860 20 5 FHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@H]1c1ccc2c(c1)OCO2 ZINC000477516199 932665633 /nfs/dbraw/zinc/66/56/33/932665633.db2.gz YJLTXELAUISNLX-HNNXBMFYSA-N 1 1 356.378 3.539 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(NCc2ccccc2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)n1 ZINC000178173837 932756430 /nfs/dbraw/zinc/75/64/30/932756430.db2.gz VOYIPHFMQVKEDU-IYBDPMFKSA-N 1 1 370.453 3.520 20 5 FHBDMO C[C@@H]1CC[C@@H](C)[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC001167487425 932849936 /nfs/dbraw/zinc/84/99/36/932849936.db2.gz LXSWMKFFXKYXNH-GHMZBOCLSA-N 1 1 350.806 3.919 20 5 FHBDMO COc1ccc(C[N@H+](Cn2nc(C)c([N+](=O)[O-])c2C)[C@@H](C)C2CC2)cc1 ZINC000098051734 932934571 /nfs/dbraw/zinc/93/45/71/932934571.db2.gz XAJLDFXHHTVAJQ-AWEZNQCLSA-N 1 1 358.442 3.675 20 5 FHBDMO COc1ccc(C[N@@H+](Cn2nc(C)c([N+](=O)[O-])c2C)[C@@H](C)C2CC2)cc1 ZINC000098051734 932934575 /nfs/dbraw/zinc/93/45/75/932934575.db2.gz XAJLDFXHHTVAJQ-AWEZNQCLSA-N 1 1 358.442 3.675 20 5 FHBDMO C[C@H]1C[C@@H](O)C[N@H+]1Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000471803358 932974288 /nfs/dbraw/zinc/97/42/88/932974288.db2.gz GUHWYHCHUYCQOV-GXTWGEPZSA-N 1 1 362.813 3.996 20 5 FHBDMO CN(C(=O)[C@H]1CC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1)c1ccccc1 ZINC000430879220 933357727 /nfs/dbraw/zinc/35/77/27/933357727.db2.gz MXWBXLVXWVZGDG-KOEDOTQGSA-N 1 1 365.433 3.593 20 5 FHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+](CCc3ccccc3)[C@H]3CCOC3)nc2c1 ZINC000610619443 933547778 /nfs/dbraw/zinc/54/77/78/933547778.db2.gz QILOKRRVYFAVFE-KRWDZBQOSA-N 1 1 367.405 3.570 20 5 FHBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000247527472 934089147 /nfs/dbraw/zinc/08/91/47/934089147.db2.gz XERCSTCSPFFCAU-CABCVRRESA-N 1 1 374.510 3.928 20 5 FHBDMO C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000247638599 934494787 /nfs/dbraw/zinc/49/47/87/934494787.db2.gz VLGGXDCQCXRFNL-UOIKSKOESA-N 1 1 373.478 3.543 20 5 FHBDMO COC(=O)[C@H](C)[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccccc1 ZINC000176225456 934533548 /nfs/dbraw/zinc/53/35/48/934533548.db2.gz MBMNHNKDVJRYEF-SJKOYZFVSA-N 1 1 362.813 3.888 20 5 FHBDMO Cc1c[nH+]cn1C1CCN(C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000375654772 935029641 /nfs/dbraw/zinc/02/96/41/935029641.db2.gz AVROONSRYVOPEK-UHFFFAOYSA-N 1 1 356.426 3.700 20 5 FHBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1cccc(Br)c1 ZINC000551229406 935224065 /nfs/dbraw/zinc/22/40/65/935224065.db2.gz XCQOFXJPYNIKTH-UHFFFAOYSA-N 1 1 365.227 3.868 20 5 FHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1 ZINC000439921221 945091713 /nfs/dbraw/zinc/09/17/13/945091713.db2.gz YOYYMXRKEANQNL-BBRMVZONSA-N 1 1 372.400 3.691 20 5 FHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1 ZINC000439921221 945091722 /nfs/dbraw/zinc/09/17/22/945091722.db2.gz YOYYMXRKEANQNL-BBRMVZONSA-N 1 1 372.400 3.691 20 5 FHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1nnc(-c2ccc(Cl)cc2)o1 ZINC000511094793 935447333 /nfs/dbraw/zinc/44/73/33/935447333.db2.gz UUVAIUGAHPLJOW-UHFFFAOYSA-N 1 1 372.812 3.973 20 5 FHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1nnc(-c2ccc(Cl)cc2)o1 ZINC000511094793 935447337 /nfs/dbraw/zinc/44/73/37/935447337.db2.gz UUVAIUGAHPLJOW-UHFFFAOYSA-N 1 1 372.812 3.973 20 5 FHBDMO Cc1c(NC(=O)CC[N@H+]2CCC=C(c3ccco3)C2)cccc1[N+](=O)[O-] ZINC000511105863 935583288 /nfs/dbraw/zinc/58/32/88/935583288.db2.gz GMVBFMNCFVRMSB-UHFFFAOYSA-N 1 1 355.394 3.614 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCN2c3ccccc3C[C@@H]2C1 ZINC000562045916 935705516 /nfs/dbraw/zinc/70/55/16/935705516.db2.gz KDSVBPBTQDGQFV-LJQANCHMSA-N 1 1 367.449 3.631 20 5 FHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCc2sccc2[C@H]1c1cccs1 ZINC000611658566 935880067 /nfs/dbraw/zinc/88/00/67/935880067.db2.gz LSJXBYMSJOBEFY-KRWDZBQOSA-N 1 1 374.491 3.870 20 5 FHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCc2sccc2[C@H]1c1cccs1 ZINC000611658566 935880071 /nfs/dbraw/zinc/88/00/71/935880071.db2.gz LSJXBYMSJOBEFY-KRWDZBQOSA-N 1 1 374.491 3.870 20 5 FHBDMO O=[N+]([O-])c1ccc2ncnc(N3CCC[N@@H+](CC4CCCCC4)CC3)c2c1 ZINC000611707311 935949040 /nfs/dbraw/zinc/94/90/40/935949040.db2.gz FLQZWNFDGBEDQO-UHFFFAOYSA-N 1 1 369.469 3.630 20 5 FHBDMO C[C@@H](CC[N@@H+]1CCOc2ccc([N+](=O)[O-])cc2C1)OCc1ccccc1 ZINC000582694954 935951029 /nfs/dbraw/zinc/95/10/29/935951029.db2.gz QCNPZPSSPCHILW-INIZCTEOSA-N 1 1 356.422 3.785 20 5 FHBDMO C[C@@H](CC[N@H+]1CCOc2ccc([N+](=O)[O-])cc2C1)OCc1ccccc1 ZINC000582694954 935951035 /nfs/dbraw/zinc/95/10/35/935951035.db2.gz QCNPZPSSPCHILW-INIZCTEOSA-N 1 1 356.422 3.785 20 5 FHBDMO COc1cc(C[N@@H+]2CC=CCC2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000611521149 935976684 /nfs/dbraw/zinc/97/66/84/935976684.db2.gz HIVOCSVNZSAYOF-UHFFFAOYSA-N 1 1 354.406 3.944 20 5 FHBDMO C[C@@H](Nc1ncnc2ccc([N+](=O)[O-])cc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000611713909 936076006 /nfs/dbraw/zinc/07/60/06/936076006.db2.gz LGZQLGOLEXVYSL-ZIAGYGMSSA-N 1 1 355.442 3.603 20 5 FHBDMO COc1ccc(-n2ccc(C[NH2+][C@H](C)c3ccc(C)c([N+](=O)[O-])c3)n2)cc1 ZINC000178711529 936280408 /nfs/dbraw/zinc/28/04/08/936280408.db2.gz FLOLRPKNRRXJPP-OAHLLOKOSA-N 1 1 366.421 3.948 20 5 FHBDMO C[C@@]1(O)CC[N@@H+](Cc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)C1 ZINC000583456608 938261092 /nfs/dbraw/zinc/26/10/92/938261092.db2.gz NZTCETDFFXVZBK-GOSISDBHSA-N 1 1 362.813 3.997 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C\CNc1ccccc1C[NH+]1CCOCC1 ZINC000536101279 938358274 /nfs/dbraw/zinc/35/82/74/938358274.db2.gz QOWXTOIBQXOQRW-YVMONPNESA-N 1 1 353.422 3.552 20 5 FHBDMO C[C@H](C(=O)N1CCC[C@@H]([N@@H+]2[C@H](C)CC[C@@H]2C)C1)c1cccc([N+](=O)[O-])c1 ZINC000583787049 938408509 /nfs/dbraw/zinc/40/85/09/938408509.db2.gz YOLLNAGSLIFXNE-CYJAXWMASA-N 1 1 359.470 3.562 20 5 FHBDMO CCc1[nH+]ccn1[C@@H]1CCCN(c2cc(C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000278443599 938436449 /nfs/dbraw/zinc/43/64/49/938436449.db2.gz QYNWCDLISMQREF-LLVKDONJSA-N 1 1 369.347 3.609 20 5 FHBDMO CC1(C)c2ccccc2CC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000584040692 938566767 /nfs/dbraw/zinc/56/67/67/938566767.db2.gz VSYGKJLVORXRBV-UHFFFAOYSA-N 1 1 353.422 3.717 20 5 FHBDMO COc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cc1O ZINC000278627986 938597255 /nfs/dbraw/zinc/59/72/55/938597255.db2.gz FDHSVPHTLFJMMJ-UHFFFAOYSA-N 1 1 356.300 3.618 20 5 FHBDMO Cc1cc(N2CCC(C[N@H+](C)Cc3ccccc3)CC2)ncc1[N+](=O)[O-] ZINC000074746839 938707709 /nfs/dbraw/zinc/70/77/09/938707709.db2.gz URZUGJAYGPAHTL-UHFFFAOYSA-N 1 1 354.454 3.647 20 5 FHBDMO CCCOc1cc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)ccc1OC ZINC000278745529 938779820 /nfs/dbraw/zinc/77/98/20/938779820.db2.gz RQBKBDDNCYEAFU-UHFFFAOYSA-N 1 1 370.409 3.558 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1CCCNc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000077523891 938802716 /nfs/dbraw/zinc/80/27/16/938802716.db2.gz YUFKHPKIFDKTSQ-MRXNPFEDSA-N 1 1 374.485 3.507 20 5 FHBDMO C[C@H]([NH2+]Cc1c(Cl)n(C)nc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000782498280 938922098 /nfs/dbraw/zinc/92/20/98/938922098.db2.gz SDCHPLWKOFQZAC-QMMMGPOBSA-N 1 1 362.739 3.851 20 5 FHBDMO CC(C)c1ccc(C[NH+]2CCC([C@H](O)C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000093766533 938929966 /nfs/dbraw/zinc/92/99/66/938929966.db2.gz MTZYISUZKHKUEL-INIZCTEOSA-N 1 1 360.376 3.853 20 5 FHBDMO C[C@@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@H]1c1cccc(F)c1 ZINC000472351503 939014425 /nfs/dbraw/zinc/01/44/25/939014425.db2.gz SQDWFAGQFRISGH-LXGCGDOSSA-N 1 1 374.412 3.557 20 5 FHBDMO CCOc1c(OC)cc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000179316468 939080312 /nfs/dbraw/zinc/08/03/12/939080312.db2.gz AGEACHVNPMHJKD-UHFFFAOYSA-N 1 1 360.410 3.643 20 5 FHBDMO CCOc1c(OC)cc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000179316468 939080316 /nfs/dbraw/zinc/08/03/16/939080316.db2.gz AGEACHVNPMHJKD-UHFFFAOYSA-N 1 1 360.410 3.643 20 5 FHBDMO Cc1nc(CC[NH2+][C@H](C)c2ccc(-c3ccccc3[N+](=O)[O-])s2)n[nH]1 ZINC000507442863 945238844 /nfs/dbraw/zinc/23/88/44/945238844.db2.gz PBGKPHKEPBBHGT-LLVKDONJSA-N 1 1 357.439 3.643 20 5 FHBDMO Cc1nnc(CC[NH2+][C@H](C)c2ccc(-c3ccccc3[N+](=O)[O-])s2)[nH]1 ZINC000507442863 945238851 /nfs/dbraw/zinc/23/88/51/945238851.db2.gz PBGKPHKEPBBHGT-LLVKDONJSA-N 1 1 357.439 3.643 20 5 FHBDMO O=C1CCCN1C[C@@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000179554283 939887831 /nfs/dbraw/zinc/88/78/31/939887831.db2.gz KPULKANEZZUQKM-QGZVFWFLSA-N 1 1 373.840 3.702 20 5 FHBDMO COc1ccc(-c2ccc(CN[C@H](C)C[N@@H+](C)C(C)C)o2)c([N+](=O)[O-])c1 ZINC000584320792 939904918 /nfs/dbraw/zinc/90/49/18/939904918.db2.gz MOTYOLZRWLQYLP-CQSZACIVSA-N 1 1 361.442 3.682 20 5 FHBDMO COc1ccc(-c2ccc(C[NH2+][C@H](C)CN(C)C(C)C)o2)c([N+](=O)[O-])c1 ZINC000584320792 939904920 /nfs/dbraw/zinc/90/49/20/939904920.db2.gz MOTYOLZRWLQYLP-CQSZACIVSA-N 1 1 361.442 3.682 20 5 FHBDMO Cc1cc(N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c(Br)cc1[N+](=O)[O-] ZINC000235984901 939908178 /nfs/dbraw/zinc/90/81/78/939908178.db2.gz NOFRWKGIONMRDO-NWDGAFQWSA-N 1 1 354.248 3.704 20 5 FHBDMO O=[N+]([O-])c1cccc(F)c1C[NH2+][C@@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000179737706 939928386 /nfs/dbraw/zinc/92/83/86/939928386.db2.gz CVGZPIULAASNBO-LJQANCHMSA-N 1 1 358.369 3.746 20 5 FHBDMO O=[N+]([O-])c1c2cccnc2ccc1N1CC[C@H](n2c[nH+]c3c2CCCC3)C1 ZINC000614735171 939946271 /nfs/dbraw/zinc/94/62/71/939946271.db2.gz JQFPGLLFUMCROM-AWEZNQCLSA-N 1 1 363.421 3.670 20 5 FHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1N(C)C(=O)c1cccc([N+](=O)[O-])c1 ZINC000364815953 940004419 /nfs/dbraw/zinc/00/44/19/940004419.db2.gz DURWYIUTBFIRID-OXQOHEQNSA-N 1 1 367.449 3.577 20 5 FHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1N(C)C(=O)c1csc([N+](=O)[O-])c1 ZINC000364822558 940006476 /nfs/dbraw/zinc/00/64/76/940006476.db2.gz XZNZMGJWPLOYET-RHSMWYFYSA-N 1 1 373.478 3.639 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@H](C)c1cccs1 ZINC000411169698 940010726 /nfs/dbraw/zinc/01/07/26/940010726.db2.gz DTFGDJPHZBEJMT-GFCCVEGCSA-N 1 1 363.439 3.687 20 5 FHBDMO COc1ccc(NC(=O)CC[N@H+]2CCc3ccccc3[C@@H]2C)c([N+](=O)[O-])c1 ZINC000411250926 940022306 /nfs/dbraw/zinc/02/23/06/940022306.db2.gz GTNMNBWHHVWVOM-AWEZNQCLSA-N 1 1 369.421 3.551 20 5 FHBDMO C[C@](O)(C1CC[NH+](C/C=C/c2ccccc2[N+](=O)[O-])CC1)C(F)(F)F ZINC000545244334 940027698 /nfs/dbraw/zinc/02/76/98/940027698.db2.gz NMHAXTXCVYVCFK-NBUZRDOWSA-N 1 1 358.360 3.633 20 5 FHBDMO Cc1ccc(NC(=O)C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)c(Cl)c1 ZINC000548934995 940099945 /nfs/dbraw/zinc/09/99/45/940099945.db2.gz ZSHQQFJITUPWHW-UHFFFAOYSA-N 1 1 361.829 3.670 20 5 FHBDMO Cc1ccc(NC(=O)C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c(Cl)c1 ZINC000548934995 940099949 /nfs/dbraw/zinc/09/99/49/940099949.db2.gz ZSHQQFJITUPWHW-UHFFFAOYSA-N 1 1 361.829 3.670 20 5 FHBDMO CC(C)N(C(=O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000548935760 940101196 /nfs/dbraw/zinc/10/11/96/940101196.db2.gz WOXZOJGAAMXPQD-UHFFFAOYSA-N 1 1 355.438 3.511 20 5 FHBDMO CC(C)N(C(=O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000548935760 940101198 /nfs/dbraw/zinc/10/11/98/940101198.db2.gz WOXZOJGAAMXPQD-UHFFFAOYSA-N 1 1 355.438 3.511 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC2(CCOCC2)[C@H]1c1ccccc1 ZINC000411983834 940173168 /nfs/dbraw/zinc/17/31/68/940173168.db2.gz GSEAITACAWFWAR-HXUWFJFHSA-N 1 1 368.433 3.957 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC2(CCOCC2)[C@H]1c1ccccc1 ZINC000411983834 940173171 /nfs/dbraw/zinc/17/31/71/940173171.db2.gz GSEAITACAWFWAR-HXUWFJFHSA-N 1 1 368.433 3.957 20 5 FHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC3(CCOCC3)[C@@H]2c2ccccc2)cc1 ZINC000411999966 940176130 /nfs/dbraw/zinc/17/61/30/940176130.db2.gz NKYRNJBWVGSSHZ-FQEVSTJZSA-N 1 1 352.434 3.991 20 5 FHBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+](C)Cc1ccc(F)cc1 ZINC000003542034 940475675 /nfs/dbraw/zinc/47/56/75/940475675.db2.gz KNWXKBWWEYSWRD-NSHDSACASA-N 1 1 365.792 3.846 20 5 FHBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)Cc1ccc(F)cc1 ZINC000003542034 940475676 /nfs/dbraw/zinc/47/56/76/940475676.db2.gz KNWXKBWWEYSWRD-NSHDSACASA-N 1 1 365.792 3.846 20 5 FHBDMO C[C@H]1C[C@@H](c2ccc(F)cc2)C[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000580602025 940482070 /nfs/dbraw/zinc/48/20/70/940482070.db2.gz ZMPHSBQYXSGUAR-GOEBONIOSA-N 1 1 371.412 3.941 20 5 FHBDMO C[C@H]1CN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)CC[N@H+](C2CCC2)C1 ZINC000581088049 940493379 /nfs/dbraw/zinc/49/33/79/940493379.db2.gz JANHTEMGNRZHIC-OAHLLOKOSA-N 1 1 373.497 3.839 20 5 FHBDMO CCc1ccc([C@H]([NH2+]CCc2nnc(C)s2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000582127956 940648820 /nfs/dbraw/zinc/64/88/20/940648820.db2.gz QPTSHHHAOVGCQG-GOSISDBHSA-N 1 1 372.450 3.832 20 5 FHBDMO CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000582208732 940654330 /nfs/dbraw/zinc/65/43/30/940654330.db2.gz KEKWDELPCNRQDF-JWTNVVGKSA-N 1 1 355.438 3.912 20 5 FHBDMO COc1ccc(OCC[N@@H+](C)[C@@H](C)c2sc(C)nc2C)c([N+](=O)[O-])c1 ZINC000173712619 940662415 /nfs/dbraw/zinc/66/24/15/940662415.db2.gz SKOQRLUXNQGUNB-LBPRGKRZSA-N 1 1 365.455 3.749 20 5 FHBDMO COc1cc(C[N@@H+]2CCC[C@@H](CC(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000540907719 940743919 /nfs/dbraw/zinc/74/39/19/940743919.db2.gz LPEQLMCEUWXUIM-AWEZNQCLSA-N 1 1 364.442 3.547 20 5 FHBDMO COc1cc(C[N@H+]2CCC[C@@H](CC(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000540907719 940743923 /nfs/dbraw/zinc/74/39/23/940743923.db2.gz LPEQLMCEUWXUIM-AWEZNQCLSA-N 1 1 364.442 3.547 20 5 FHBDMO C[C@@]1(O)CC[N@@H+](Cc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)C1 ZINC000180183940 940782287 /nfs/dbraw/zinc/78/22/87/940782287.db2.gz IGYLRKZPEZOIPI-GOSISDBHSA-N 1 1 362.813 3.997 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCN(c2nccc(C(C)C)n2)CC1 ZINC000613498661 940787317 /nfs/dbraw/zinc/78/73/17/940787317.db2.gz RTSUWNDIFNCHSZ-INIZCTEOSA-N 1 1 369.469 3.700 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc(OC(C)(C)C)nc1 ZINC000180881717 941089431 /nfs/dbraw/zinc/08/94/31/941089431.db2.gz FNMSHRQGKSIVMM-UHFFFAOYSA-N 1 1 359.426 3.856 20 5 FHBDMO Cc1cc(C[C@@H](C)[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)n[nH]1 ZINC000180963871 941097850 /nfs/dbraw/zinc/09/78/50/941097850.db2.gz BVZWTHIRVUKKME-VLIAUNLRSA-N 1 1 350.422 3.937 20 5 FHBDMO O=[N+]([O-])c1ccc2oc(C[NH2+][C@@H](C[C@H]3CCOC3)c3ccccc3)nc2c1 ZINC000181208090 941110921 /nfs/dbraw/zinc/11/09/21/941110921.db2.gz JXIVGQFIPDLGSW-PBHICJAKSA-N 1 1 367.405 3.994 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](Cc1ccco1)C1CCCC1 ZINC000053139603 941252678 /nfs/dbraw/zinc/25/26/78/941252678.db2.gz IFMONFXZXINIJC-UHFFFAOYSA-N 1 1 357.410 3.880 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](Cc1ccco1)C1CCCC1 ZINC000053139603 941252680 /nfs/dbraw/zinc/25/26/80/941252680.db2.gz IFMONFXZXINIJC-UHFFFAOYSA-N 1 1 357.410 3.880 20 5 FHBDMO CCc1ccc(C(=O)N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1[N+](=O)[O-] ZINC000181480949 941330974 /nfs/dbraw/zinc/33/09/74/941330974.db2.gz GWUZLWIVVRXCMB-RHSMWYFYSA-N 1 1 359.470 3.540 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(CN3CCCC[C@@H]3[C@@H]3CC[NH2+]C3)o2)cc1 ZINC000415036620 941553014 /nfs/dbraw/zinc/55/30/14/941553014.db2.gz FPYALCNMILFWHJ-VQIMIIECSA-N 1 1 355.438 3.819 20 5 FHBDMO CC(C)(C)O[C@@H]1C[C@H]([NH2+]Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1(C)C ZINC000412088080 941714372 /nfs/dbraw/zinc/71/43/72/941714372.db2.gz XITISQZQDBJACZ-LSDHHAIUSA-N 1 1 374.441 3.717 20 5 FHBDMO C[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[C@@H]1O ZINC000190054779 941722538 /nfs/dbraw/zinc/72/25/38/941722538.db2.gz ZTCPBZKGERDIOX-ZBEGNZNMSA-N 1 1 350.802 3.711 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@@H](C)C[C@@H]1c1ccccc1 ZINC000513233527 941790320 /nfs/dbraw/zinc/79/03/20/941790320.db2.gz YPHSHKNPZDKDCX-KBXCAEBGSA-N 1 1 353.422 3.925 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@@H](C)C[C@@H]1c1ccccc1 ZINC000513233527 941790324 /nfs/dbraw/zinc/79/03/24/941790324.db2.gz YPHSHKNPZDKDCX-KBXCAEBGSA-N 1 1 353.422 3.925 20 5 FHBDMO C[C@@H]1C[C@@H](c2ccccc2)[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000513272575 941825080 /nfs/dbraw/zinc/82/50/80/941825080.db2.gz RKIDHVOLXQOYOJ-BEFAXECRSA-N 1 1 365.433 3.567 20 5 FHBDMO Cn1cc[nH+]c1[C@H]1CCN(c2c3cc(Cl)ccc3ncc2[N+](=O)[O-])C1 ZINC000892984681 941842761 /nfs/dbraw/zinc/84/27/61/941842761.db2.gz FLOGCKSLNAIIFH-NSHDSACASA-N 1 1 357.801 3.524 20 5 FHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCCN(C(=O)c2ccccc2)CC1 ZINC000433722015 941855485 /nfs/dbraw/zinc/85/54/85/941855485.db2.gz APUWUIKBBJWCLV-MRXNPFEDSA-N 1 1 353.422 3.504 20 5 FHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCN(C(=O)c2ccccc2)CC1 ZINC000433722015 941855491 /nfs/dbraw/zinc/85/54/91/941855491.db2.gz APUWUIKBBJWCLV-MRXNPFEDSA-N 1 1 353.422 3.504 20 5 FHBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1C(F)(F)F)C[C@H]1CCn2ccnc2C1 ZINC000377657325 941874319 /nfs/dbraw/zinc/87/43/19/941874319.db2.gz XPLYDNHPVVBPOA-LBPRGKRZSA-N 1 1 368.359 3.505 20 5 FHBDMO C[C@H]([NH2+]Cc1c(Cl)cccc1[N+](=O)[O-])c1ccc(-n2cncn2)cc1 ZINC000119635987 941891940 /nfs/dbraw/zinc/89/19/40/941891940.db2.gz SUOGYBNLQXIVFT-LBPRGKRZSA-N 1 1 357.801 3.680 20 5 FHBDMO CC(C)[N@H+](CC(=O)Nc1ccc2c(c1)CCC2)Cc1ccc([N+](=O)[O-])cc1 ZINC000513406297 941900348 /nfs/dbraw/zinc/90/03/48/941900348.db2.gz PGHUPBDSRABZCA-UHFFFAOYSA-N 1 1 367.449 3.933 20 5 FHBDMO CC(C)[N@@H+](CC(=O)Nc1ccc2c(c1)CCC2)Cc1ccc([N+](=O)[O-])cc1 ZINC000513406297 941900350 /nfs/dbraw/zinc/90/03/50/941900350.db2.gz PGHUPBDSRABZCA-UHFFFAOYSA-N 1 1 367.449 3.933 20 5 FHBDMO Cc1cn(C[N@@H+](C2CC2)C2CCCCC2)c(=O)n1-c1ccccc1[N+](=O)[O-] ZINC000728708244 941910841 /nfs/dbraw/zinc/91/08/41/941910841.db2.gz YYHPEMZGCNBLRB-UHFFFAOYSA-N 1 1 370.453 3.610 20 5 FHBDMO Cc1ccc(NC(=O)N[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1[N+](=O)[O-] ZINC000182929674 942008550 /nfs/dbraw/zinc/00/85/50/942008550.db2.gz XAJJOZPHXUGESF-LSDHHAIUSA-N 1 1 360.458 3.678 20 5 FHBDMO C[C@H]1CCC[N@H+]1C1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2Cl)CC1 ZINC000377870966 942044054 /nfs/dbraw/zinc/04/40/54/942044054.db2.gz XIAIKEUZPCGMDH-LBPRGKRZSA-N 1 1 366.849 3.729 20 5 FHBDMO Cc1cccc(CC[NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)c1 ZINC000513654024 942057646 /nfs/dbraw/zinc/05/76/46/942057646.db2.gz GVRKVEXBTFNQIW-IBGZPJMESA-N 1 1 350.422 3.558 20 5 FHBDMO C[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F)[N@H+]1CCCC[C@@H]1C ZINC000549365742 942060170 /nfs/dbraw/zinc/06/01/70/942060170.db2.gz CCVFDRAJUWRFKD-RYUDHWBXSA-N 1 1 373.375 3.606 20 5 FHBDMO C[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F)[N@H+]1CCCC[C@H]1C ZINC000549365740 942060442 /nfs/dbraw/zinc/06/04/42/942060442.db2.gz CCVFDRAJUWRFKD-NEPJUHHUSA-N 1 1 373.375 3.606 20 5 FHBDMO Cc1ccccc1C[C@H](C)[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000501850433 942077616 /nfs/dbraw/zinc/07/76/16/942077616.db2.gz JVQOZGQOEYRTGO-INIZCTEOSA-N 1 1 355.438 3.795 20 5 FHBDMO COc1c(O)ccc(C[NH2+][C@H]2CC3(CCC3)Oc3ccccc32)c1[N+](=O)[O-] ZINC000893133412 942095416 /nfs/dbraw/zinc/09/54/16/942095416.db2.gz DNVDZZDXZYOOGS-HNNXBMFYSA-N 1 1 370.405 3.845 20 5 FHBDMO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000501938222 942136153 /nfs/dbraw/zinc/13/61/53/942136153.db2.gz KWGKHAMELJRCTM-CYBMUJFWSA-N 1 1 359.348 3.586 20 5 FHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CCSC3CCCCC3)C2)nc1 ZINC000500984325 942246020 /nfs/dbraw/zinc/24/60/20/942246020.db2.gz LZOXDSVDZQTRKG-CQSZACIVSA-N 1 1 350.488 3.542 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420938955 942264414 /nfs/dbraw/zinc/26/44/14/942264414.db2.gz BGOOVAHRQPNEPB-CYBMUJFWSA-N 1 1 373.375 3.896 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CC[C@H](N4CCCCC4)C3)o2)c1 ZINC000513733763 942285888 /nfs/dbraw/zinc/28/58/88/942285888.db2.gz VXTQGEWPCZTQQS-SFHVURJKSA-N 1 1 355.438 3.915 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@H](N4CCCCC4)C3)o2)c1 ZINC000513733763 942285890 /nfs/dbraw/zinc/28/58/90/942285890.db2.gz VXTQGEWPCZTQQS-SFHVURJKSA-N 1 1 355.438 3.915 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1CN[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000110247952 942348575 /nfs/dbraw/zinc/34/85/75/942348575.db2.gz QJGWDVIJPIIMFA-LJQANCHMSA-N 1 1 369.465 3.748 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1CN[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000110247952 942348581 /nfs/dbraw/zinc/34/85/81/942348581.db2.gz QJGWDVIJPIIMFA-LJQANCHMSA-N 1 1 369.465 3.748 20 5 FHBDMO CC[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2ccccc2C1 ZINC000501385418 942454092 /nfs/dbraw/zinc/45/40/92/942454092.db2.gz DHSZODAGZLVTJI-GOSISDBHSA-N 1 1 368.437 3.553 20 5 FHBDMO Cn1ccnc1[C@@H]([NH2+]C[C@@H]1CC12CCSCC2)c1cccc([N+](=O)[O-])c1 ZINC000421375365 942526940 /nfs/dbraw/zinc/52/69/40/942526940.db2.gz IMHQIFUOUCTJCP-RDJZCZTQSA-N 1 1 372.494 3.541 20 5 FHBDMO CCCn1cc[nH+]c1CCCN(C)c1ccc([N+](=O)[O-])c2ncccc12 ZINC000413268115 942585541 /nfs/dbraw/zinc/58/55/41/942585541.db2.gz RNFPEHCTLQUMJN-UHFFFAOYSA-N 1 1 353.426 3.819 20 5 FHBDMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC000434350071 942597802 /nfs/dbraw/zinc/59/78/02/942597802.db2.gz OORWTAFBCUARKX-IBGZPJMESA-N 1 1 374.485 3.532 20 5 FHBDMO CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@@H]1CCC[N@H+]1C ZINC000421709792 942763553 /nfs/dbraw/zinc/76/35/53/942763553.db2.gz HFYTVYLCXNEPHS-HNNXBMFYSA-N 1 1 365.499 3.653 20 5 FHBDMO Cc1ccc([C@H](C[NH+]2CCOCC2)Nc2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000514180889 942805473 /nfs/dbraw/zinc/80/54/73/942805473.db2.gz XIQXMMLXEZCLIB-IBGZPJMESA-N 1 1 355.438 3.697 20 5 FHBDMO CCn1c(C)nc([N+](=O)[O-])c1S[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000425256582 943067771 /nfs/dbraw/zinc/06/77/71/943067771.db2.gz AIJOFEMLPFTGFK-INIZCTEOSA-N 1 1 360.483 3.876 20 5 FHBDMO CCn1nc(C)c([N+](=O)[O-])c1S[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000425285699 943190498 /nfs/dbraw/zinc/19/04/98/943190498.db2.gz TYUSAFHVCZQYHZ-INIZCTEOSA-N 1 1 360.483 3.876 20 5 FHBDMO Cc1c(C(=O)N[C@@H](C[N@@H+](C)Cc2ccccc2)C(C)C)cccc1[N+](=O)[O-] ZINC001269933353 943307923 /nfs/dbraw/zinc/30/79/23/943307923.db2.gz VIDLIQDOLRCCOC-IBGZPJMESA-N 1 1 369.465 3.790 20 5 FHBDMO Cc1ccc([C@H](C)N[C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1[N+](=O)[O-] ZINC000422916668 943330293 /nfs/dbraw/zinc/33/02/93/943330293.db2.gz BIAFHIPNTWNMDW-KLHJMIIUSA-N 1 1 367.449 3.810 20 5 FHBDMO C[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549464171 943336603 /nfs/dbraw/zinc/33/66/03/943336603.db2.gz LGRPHRFIWDRTMZ-CYBMUJFWSA-N 1 1 368.355 3.997 20 5 FHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H]([C@H](O)C(F)(F)F)C1 ZINC000514910374 943381703 /nfs/dbraw/zinc/38/17/03/943381703.db2.gz SHMSUYZMGSEKLC-SJKNXKOVSA-N 1 1 358.360 3.633 20 5 FHBDMO C[C@H](c1cccc(Cl)c1)[N@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000053233720 943422795 /nfs/dbraw/zinc/42/27/95/943422795.db2.gz GZCWLQOLZCQSGT-CYBMUJFWSA-N 1 1 361.829 3.904 20 5 FHBDMO C[C@H](c1cccc(Cl)c1)[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000053233720 943422798 /nfs/dbraw/zinc/42/27/98/943422798.db2.gz GZCWLQOLZCQSGT-CYBMUJFWSA-N 1 1 361.829 3.904 20 5 FHBDMO CCc1ccc([C@H](N[C@@H]2C[C@H]2C2CC[NH2+]CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423442396 943511980 /nfs/dbraw/zinc/51/19/80/943511980.db2.gz PVSODKRMCASPGO-QKNQBKEWSA-N 1 1 369.465 3.817 20 5 FHBDMO C[N@H+]1CCC[C@H]2CN(Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)CC[C@@H]21 ZINC000549470552 943580008 /nfs/dbraw/zinc/58/00/08/943580008.db2.gz AAIQPXGRUGGXCN-LRDDRELGSA-N 1 1 357.376 3.530 20 5 FHBDMO Cn1cc(C[NH2+][C@@H]2C[C@@]2(F)c2ccccc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000424203741 943787375 /nfs/dbraw/zinc/78/73/75/943787375.db2.gz UTJNCOJBPHFRBU-UYAOXDASSA-N 1 1 366.396 3.722 20 5 FHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCN(c3nccc4sccc43)CC2)cc1 ZINC000516890607 943798403 /nfs/dbraw/zinc/79/84/03/943798403.db2.gz HNVCYIMVIXWWGL-UHFFFAOYSA-N 1 1 354.435 3.527 20 5 FHBDMO COc1cc(C[N@@H+](C[C@@H](C)c2ccccc2)[C@@H](C)CO)ccc1[N+](=O)[O-] ZINC000566520324 943934832 /nfs/dbraw/zinc/93/48/32/943934832.db2.gz PHAVNILQCHXOJZ-CVEARBPZSA-N 1 1 358.438 3.590 20 5 FHBDMO C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H](c2ccco2)C1 ZINC000500069610 944052475 /nfs/dbraw/zinc/05/24/75/944052475.db2.gz ISDZTBXJDGBVPP-PBHICJAKSA-N 1 1 357.410 3.990 20 5 FHBDMO CC(C)[C@@]1(CO)CCC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425478212 944075654 /nfs/dbraw/zinc/07/56/54/944075654.db2.gz MJNNKROBAVQWKE-INIZCTEOSA-N 1 1 371.275 3.588 20 5 FHBDMO CC(C)[C@@]1(CO)CCC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425478212 944075658 /nfs/dbraw/zinc/07/56/58/944075658.db2.gz MJNNKROBAVQWKE-INIZCTEOSA-N 1 1 371.275 3.588 20 5 FHBDMO CC[C@H](Cc1ccccc1)[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500098345 944093775 /nfs/dbraw/zinc/09/37/75/944093775.db2.gz LMEIFHXOYKPBDE-QGZVFWFLSA-N 1 1 355.438 3.877 20 5 FHBDMO CN(C)C(=O)c1ccccc1C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000418072981 944123299 /nfs/dbraw/zinc/12/32/99/944123299.db2.gz LREOQDMNJLMFMR-KRWDZBQOSA-N 1 1 367.449 3.676 20 5 FHBDMO C[C@H]1[C@@H](Cc2ccccc2)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500113230 944128947 /nfs/dbraw/zinc/12/89/47/944128947.db2.gz FPNQWWITSFDMRB-FUHWJXTLSA-N 1 1 367.449 3.877 20 5 FHBDMO Cc1ccc(C[C@@H](C)[N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000500125040 944131906 /nfs/dbraw/zinc/13/19/06/944131906.db2.gz OVKNLWULORXIRO-MRXNPFEDSA-N 1 1 355.438 3.795 20 5 FHBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CCc1ccc(Cl)cc1 ZINC000500141298 944163617 /nfs/dbraw/zinc/16/36/17/944163617.db2.gz SEQUVNPURHVCEH-UHFFFAOYSA-N 1 1 361.829 3.751 20 5 FHBDMO C[C@@H]1[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1Cc1ccccc1 ZINC000382118475 944180841 /nfs/dbraw/zinc/18/08/41/944180841.db2.gz WHPUQBONQMIPHN-FZKQIMNGSA-N 1 1 373.840 3.641 20 5 FHBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](Nc2c3c(ccc2[N+](=O)[O-])NCC3)C1 ZINC000436317065 944195943 /nfs/dbraw/zinc/19/59/43/944195943.db2.gz KFUOOFLZZGCGHT-ZBFHGGJFSA-N 1 1 352.438 3.810 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@@](C)(c2ccccc2)C1 ZINC000500182724 944219354 /nfs/dbraw/zinc/21/93/54/944219354.db2.gz KMFXSATVYCZTAN-OAQYLSRUSA-N 1 1 367.449 3.895 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@@](C)(c2ccccc2)C1 ZINC000500182724 944219360 /nfs/dbraw/zinc/21/93/60/944219360.db2.gz KMFXSATVYCZTAN-OAQYLSRUSA-N 1 1 367.449 3.895 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(CCOc2ccccc2[N+](=O)[O-])C1 ZINC000506474081 944300803 /nfs/dbraw/zinc/30/08/03/944300803.db2.gz LAXOAUKUYWJTCY-QZTJIDSGSA-N 1 1 361.486 3.560 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000506478387 944307783 /nfs/dbraw/zinc/30/77/83/944307783.db2.gz GIRFPCVQJXGIHT-MSOLQXFVSA-N 1 1 361.486 3.560 20 5 FHBDMO CN(C/C=C/c1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000506482491 944333051 /nfs/dbraw/zinc/33/30/51/944333051.db2.gz TVHHDXYCVYMAON-OEMHODTASA-N 1 1 351.450 3.814 20 5 FHBDMO C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@H]1CCN(Cc2ccccc2)C1 ZINC000506482491 944333061 /nfs/dbraw/zinc/33/30/61/944333061.db2.gz TVHHDXYCVYMAON-OEMHODTASA-N 1 1 351.450 3.814 20 5 FHBDMO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@H]1CCN(Cc2ccccc2)C1 ZINC000506482491 944333070 /nfs/dbraw/zinc/33/30/70/944333070.db2.gz TVHHDXYCVYMAON-OEMHODTASA-N 1 1 351.450 3.814 20 5 FHBDMO COc1cc(C[N@@H+](Cc2ccccc2)[C@H](CO)C2CC2)c([N+](=O)[O-])cc1F ZINC000184270716 944374052 /nfs/dbraw/zinc/37/40/52/944374052.db2.gz OQLSZBFEKLPESR-LJQANCHMSA-N 1 1 374.412 3.516 20 5 FHBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000518430085 944374317 /nfs/dbraw/zinc/37/43/17/944374317.db2.gz AFFOJSCNKWILQL-WMLDXEAASA-N 1 1 354.410 3.552 20 5 FHBDMO C[C@H]1CCCC[N@H+]1CCCCNC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000123594106 944386943 /nfs/dbraw/zinc/38/69/43/944386943.db2.gz GPFOGPXXSFILML-HNNXBMFYSA-N 1 1 370.453 3.527 20 5 FHBDMO Cc1nn(C[NH+]2CCC(c3ccc(F)c(F)c3)CC2)c(C)c1[N+](=O)[O-] ZINC000729466061 944400237 /nfs/dbraw/zinc/40/02/37/944400237.db2.gz MAVJEZUXRHQPTL-UHFFFAOYSA-N 1 1 350.369 3.523 20 5 FHBDMO Cc1cccc(C(=O)NC[C@@H]2CCC[N@H+]2CC2CCCCC2)c1[N+](=O)[O-] ZINC000517623401 944451284 /nfs/dbraw/zinc/45/12/84/944451284.db2.gz ZMEOBXXMGCSEMD-KRWDZBQOSA-N 1 1 359.470 3.678 20 5 FHBDMO CCS[C@H]1CCCC[N@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000112088873 944481062 /nfs/dbraw/zinc/48/10/62/944481062.db2.gz DJTBHCXALFWVGM-KBPBESRZSA-N 1 1 351.472 3.529 20 5 FHBDMO CCC[C@H](NC(=O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000516094317 944492721 /nfs/dbraw/zinc/49/27/21/944492721.db2.gz XWWKECWNCPJUJN-FQEVSTJZSA-N 1 1 369.465 3.727 20 5 FHBDMO CCC[C@H](NC(=O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000516094317 944492724 /nfs/dbraw/zinc/49/27/24/944492724.db2.gz XWWKECWNCPJUJN-FQEVSTJZSA-N 1 1 369.465 3.727 20 5 FHBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3cc(F)cc(C(F)(F)F)c3)CC2)n1 ZINC000425980715 944512554 /nfs/dbraw/zinc/51/25/54/944512554.db2.gz LZLKPVMXCLCLFO-UHFFFAOYSA-N 1 1 372.322 3.786 20 5 FHBDMO C[C@@H]1[C@@H](CO)CC[N@H+]1Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000425998162 944586562 /nfs/dbraw/zinc/58/65/62/944586562.db2.gz GHKNJJONXJKSRJ-UKRRQHHQSA-N 1 1 360.385 3.729 20 5 FHBDMO C[N@H+]1CC[C@H](NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)[C@@H]1c1ccccc1 ZINC000536261094 944672495 /nfs/dbraw/zinc/67/24/95/944672495.db2.gz BENVAAWMCKZWRI-LPHOPBHVSA-N 1 1 365.389 3.516 20 5 FHBDMO Cc1ccc(C)c(OC[C@@H](O)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000517825953 944690791 /nfs/dbraw/zinc/69/07/91/944690791.db2.gz LAXOSJGHMFZLBC-FQEVSTJZSA-N 1 1 372.465 3.862 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@](C)(c2ccccc2)C1 ZINC000438508001 944718202 /nfs/dbraw/zinc/71/82/02/944718202.db2.gz XFEBNAPMSXPRSW-HXUWFJFHSA-N 1 1 353.422 3.505 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@](C)(c2ccccc2)C1 ZINC000438508001 944718205 /nfs/dbraw/zinc/71/82/05/944718205.db2.gz XFEBNAPMSXPRSW-HXUWFJFHSA-N 1 1 353.422 3.505 20 5 FHBDMO Cc1cc(C)n(-c2ccc(C[N@@H+]3CCc4ccc([N+](=O)[O-])cc4C3)cc2)n1 ZINC000438519670 944742755 /nfs/dbraw/zinc/74/27/55/944742755.db2.gz WTXWMFDZAHKUOQ-UHFFFAOYSA-N 1 1 362.433 3.956 20 5 FHBDMO Cc1cc(C)n(-c2ccc(C[N@H+]3CCc4ccc([N+](=O)[O-])cc4C3)cc2)n1 ZINC000438519670 944742758 /nfs/dbraw/zinc/74/27/58/944742758.db2.gz WTXWMFDZAHKUOQ-UHFFFAOYSA-N 1 1 362.433 3.956 20 5 FHBDMO Cc1cccc(OCC[N@@H+](C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000027702956 944755143 /nfs/dbraw/zinc/75/51/43/944755143.db2.gz NAHHXUHKWLUAAZ-INIZCTEOSA-N 1 1 371.437 3.549 20 5 FHBDMO Cc1cccc(OCC[N@H+](C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000027702956 944755150 /nfs/dbraw/zinc/75/51/50/944755150.db2.gz NAHHXUHKWLUAAZ-INIZCTEOSA-N 1 1 371.437 3.549 20 5 FHBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[NH+](Cc2ccsc2)CC1 ZINC000015143437 944828086 /nfs/dbraw/zinc/82/80/86/944828086.db2.gz DAQFIRGFUHOGMR-UHFFFAOYSA-N 1 1 371.384 3.997 20 5 FHBDMO COC(=O)[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000506299959 944848392 /nfs/dbraw/zinc/84/83/92/944848392.db2.gz XZZOUDLGISCWAC-AWEZNQCLSA-N 1 1 360.435 3.708 20 5 FHBDMO CC[C@H](c1cccc(OC)c1)[N@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000518000546 944921791 /nfs/dbraw/zinc/92/17/91/944921791.db2.gz PEFYYICHBPTVOL-QGZVFWFLSA-N 1 1 357.410 3.625 20 5 FHBDMO CC[C@H](c1cccc(OC)c1)[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000518000546 944921797 /nfs/dbraw/zinc/92/17/97/944921797.db2.gz PEFYYICHBPTVOL-QGZVFWFLSA-N 1 1 357.410 3.625 20 5 FHBDMO COc1ccc(-c2ccc(C[N@@H+](C)[C@H]3CC[C@H](O)CC3)o2)c([N+](=O)[O-])c1 ZINC000439774086 944975988 /nfs/dbraw/zinc/97/59/88/944975988.db2.gz IYGUAYZDNZJWAR-HDJSIYSDSA-N 1 1 360.410 3.599 20 5 FHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21 ZINC000511762754 945051769 /nfs/dbraw/zinc/05/17/69/945051769.db2.gz OITFDMSKMRHOTP-HHXXYDBFSA-N 1 1 356.397 3.738 20 5 FHBDMO COc1cc(C[N@H+]2C[C@H](c3ccccc3)[C@@H]3COCC[C@@H]32)ccc1[N+](=O)[O-] ZINC000511764176 945059401 /nfs/dbraw/zinc/05/94/01/945059401.db2.gz CTZRCGASKIFJDI-QYZOEREBSA-N 1 1 368.433 3.608 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCc2ccccc2[C@H]1C ZINC000106862473 945419061 /nfs/dbraw/zinc/41/90/61/945419061.db2.gz KIAIRRRDHQJKEE-CQSZACIVSA-N 1 1 369.421 3.551 20 5 FHBDMO Cc1cc(NC(=O)N2CC[C@@H]([N@@H+](C)Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000613778070 945943760 /nfs/dbraw/zinc/94/37/60/945943760.db2.gz RRBBCYIHVDFDIT-GOSISDBHSA-N 1 1 368.437 3.641 20 5 FHBDMO C[C@H]1C[C@H](c2cccc(F)c2)[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000444167890 946015133 /nfs/dbraw/zinc/01/51/33/946015133.db2.gz MRPPAOZORPMQEM-IFXJQAMLSA-N 1 1 371.412 3.780 20 5 FHBDMO C[C@H]1C[C@H](c2cccc(F)c2)[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000444167890 946015143 /nfs/dbraw/zinc/01/51/43/946015143.db2.gz MRPPAOZORPMQEM-IFXJQAMLSA-N 1 1 371.412 3.780 20 5 FHBDMO Cc1[nH+]ccn1-c1ccccc1CNC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000143247046 946117817 /nfs/dbraw/zinc/11/78/17/946117817.db2.gz SFQOMVNWMRQFPX-UHFFFAOYSA-N 1 1 370.796 3.672 20 5 FHBDMO O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000186022100 946331289 /nfs/dbraw/zinc/33/12/89/946331289.db2.gz CIWSTRBBMNQOFY-CQSZACIVSA-N 1 1 365.861 3.519 20 5 FHBDMO COc1ccc(OCC[N@@H+](C)[C@H](C)Cc2ccccc2OC)c([N+](=O)[O-])c1 ZINC000441408510 946563014 /nfs/dbraw/zinc/56/30/14/946563014.db2.gz XKSYECGTYGYNHA-OAHLLOKOSA-N 1 1 374.437 3.554 20 5 FHBDMO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+]C1CC(N2CCCCC2)C1 ZINC000475560097 946640897 /nfs/dbraw/zinc/64/08/97/946640897.db2.gz RZYIZNPLESXDAU-SGZDXZSOSA-N 1 1 357.498 3.913 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](CO)c1ccccc1OC(F)(F)F ZINC000475563854 946655663 /nfs/dbraw/zinc/65/56/63/946655663.db2.gz WQAZFODMRHNTFR-OAHLLOKOSA-N 1 1 370.327 3.625 20 5 FHBDMO COc1cc(C)c([C@@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1OC ZINC000444673586 947097539 /nfs/dbraw/zinc/09/75/39/947097539.db2.gz NFQKADJIWWHJNZ-GFCCVEGCSA-N 1 1 370.409 3.648 20 5 FHBDMO Cc1ccccc1[C@@H]1C[N@H+](CCOc2cccc([N+](=O)[O-])c2)[C@H](C)CO1 ZINC000441447944 947486238 /nfs/dbraw/zinc/48/62/38/947486238.db2.gz FIPLZFSSYGSQPV-UZLBHIALSA-N 1 1 356.422 3.744 20 5 FHBDMO Cc1ccccc1[C@@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)[C@H](C)CO1 ZINC000441447944 947486246 /nfs/dbraw/zinc/48/62/46/947486246.db2.gz FIPLZFSSYGSQPV-UZLBHIALSA-N 1 1 356.422 3.744 20 5 FHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000072837917 947569743 /nfs/dbraw/zinc/56/97/43/947569743.db2.gz SIKSWPLBCHTDJV-STQMWFEESA-N 1 1 371.890 3.793 20 5 FHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(c2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000432348785 948186350 /nfs/dbraw/zinc/18/63/50/948186350.db2.gz SZIMECPLVGWZRF-XHSDSOJGSA-N 1 1 354.454 3.985 20 5 FHBDMO C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCC[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000574735028 948420080 /nfs/dbraw/zinc/42/00/80/948420080.db2.gz LCQDRPPFQANUEC-UVDFWXMISA-N 1 1 372.469 3.623 20 5 FHBDMO C[C@H]1CC[C@H](c2ccccc2)[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000512165029 948602522 /nfs/dbraw/zinc/60/25/22/948602522.db2.gz KQDDACKIDOVSHM-KBXCAEBGSA-N 1 1 353.422 3.667 20 5 FHBDMO COc1cc(C[N@H+]2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)c([N+](=O)[O-])cc1F ZINC000574854958 948634204 /nfs/dbraw/zinc/63/42/04/948634204.db2.gz FYDUTTBXXQFIJC-KYJSFNMBSA-N 1 1 366.433 3.648 20 5 FHBDMO CC(C)[C@@H](C)NC(=O)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000182103000 948663054 /nfs/dbraw/zinc/66/30/54/948663054.db2.gz XRRARYUHZWRYRG-CYBMUJFWSA-N 1 1 367.877 3.621 20 5 FHBDMO COc1ccc(CN2CCC[C@H](C[N@H+]3CCCC[C@@H]3C)C2)cc1[N+](=O)[O-] ZINC000512182462 948706562 /nfs/dbraw/zinc/70/65/62/948706562.db2.gz SHAGMLVOVHCWFU-WMZOPIPTSA-N 1 1 361.486 3.690 20 5 FHBDMO Cc1nn(C)c(NCc2ccccc2C[N@@H+]2CCCC[C@H]2C)c1[N+](=O)[O-] ZINC000052245200 210061441 /nfs/dbraw/zinc/06/14/41/210061441.db2.gz HLIICLHBJPOTTR-CQSZACIVSA-N 1 1 357.458 3.623 20 5 FHBDMO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC000541834963 567955332 /nfs/dbraw/zinc/95/53/32/567955332.db2.gz UYBFNPXBIYHCQL-ZDUSSCGKSA-N 1 1 366.437 3.756 20 5 FHBDMO Cc1cc(C[NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)cc(C)n1 ZINC000602695650 568016189 /nfs/dbraw/zinc/01/61/89/568016189.db2.gz BUNLKAAJUAWZAT-UHFFFAOYSA-N 1 1 356.245 3.720 20 5 FHBDMO C[C@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@H](c2ccco2)C1 ZINC000072905304 568057077 /nfs/dbraw/zinc/05/70/77/568057077.db2.gz ZHMDCCQKQKDIMR-YOEHRIQHSA-N 1 1 357.410 3.624 20 5 FHBDMO C[C@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@H](c2ccco2)C1 ZINC000072905304 568057078 /nfs/dbraw/zinc/05/70/78/568057078.db2.gz ZHMDCCQKQKDIMR-YOEHRIQHSA-N 1 1 357.410 3.624 20 5 FHBDMO CC(=O)c1cc(NCc2cc(C)[nH+]c(N3CCCC3)c2)ccc1[N+](=O)[O-] ZINC000291114935 568057989 /nfs/dbraw/zinc/05/79/89/568057989.db2.gz LUKUQNJRVSKXJB-UHFFFAOYSA-N 1 1 354.410 3.713 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1cc(OC)c(OC)cc1C ZINC000024744787 568065042 /nfs/dbraw/zinc/06/50/42/568065042.db2.gz FDZNZVQIIWPCCV-UHFFFAOYSA-N 1 1 360.410 3.561 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1cc(OC)c(OC)cc1C ZINC000024744787 568065043 /nfs/dbraw/zinc/06/50/43/568065043.db2.gz FDZNZVQIIWPCCV-UHFFFAOYSA-N 1 1 360.410 3.561 20 5 FHBDMO COc1ccc(C[N@@H+]2CCC[C@H]2c2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] ZINC000051560136 568079884 /nfs/dbraw/zinc/07/98/84/568079884.db2.gz GQXHOLCGHXYDEM-INIZCTEOSA-N 1 1 370.405 3.712 20 5 FHBDMO COc1ccc(C[N@H+]2CCC[C@H]2c2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] ZINC000051560136 568079885 /nfs/dbraw/zinc/07/98/85/568079885.db2.gz GQXHOLCGHXYDEM-INIZCTEOSA-N 1 1 370.405 3.712 20 5 FHBDMO Cn1ccnc1[C@H]([NH2+][C@@H]1C[C@H]1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000568660948 568113047 /nfs/dbraw/zinc/11/30/47/568113047.db2.gz ZALFKGOGCOWKCQ-MISYRCLQSA-N 1 1 362.433 3.639 20 5 FHBDMO C[C@H]1CCC[N@@H+](Cc2ccccc2CNC(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000481802256 568127539 /nfs/dbraw/zinc/12/75/39/568127539.db2.gz XCCNCXZEXYZGGW-AWEZNQCLSA-N 1 1 373.478 3.818 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])c(N2CCC[N@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC000541931849 568250646 /nfs/dbraw/zinc/25/06/46/568250646.db2.gz CSZAXYFAGQTOPU-QGZVFWFLSA-N 1 1 354.454 3.707 20 5 FHBDMO Cc1nc(C2([NH2+]CCCOc3ccc([N+](=O)[O-])cc3)CCCCC2)no1 ZINC000604467042 568297220 /nfs/dbraw/zinc/29/72/20/568297220.db2.gz FDEBMEWXWKNGAV-UHFFFAOYSA-N 1 1 360.414 3.504 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000569268894 568323802 /nfs/dbraw/zinc/32/38/02/568323802.db2.gz NSKPKJXFCMNWIJ-BETUJISGSA-N 1 1 373.375 3.895 20 5 FHBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC000569298013 568344302 /nfs/dbraw/zinc/34/43/02/568344302.db2.gz NWHFQAFVSPINJL-ZWKOTPCHSA-N 1 1 356.422 3.562 20 5 FHBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCCC[C@H]1c1ccccc1 ZINC000569298010 568344355 /nfs/dbraw/zinc/34/43/55/568344355.db2.gz NWHFQAFVSPINJL-MSOLQXFVSA-N 1 1 356.422 3.562 20 5 FHBDMO Cc1sc(NC(=O)C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)c(C)c1C ZINC000569791581 568425079 /nfs/dbraw/zinc/42/50/79/568425079.db2.gz VGZLGTDXQMTZHN-UHFFFAOYSA-N 1 1 361.467 3.695 20 5 FHBDMO Cc1sc(NC(=O)C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c(C)c1C ZINC000569791581 568425081 /nfs/dbraw/zinc/42/50/81/568425081.db2.gz VGZLGTDXQMTZHN-UHFFFAOYSA-N 1 1 361.467 3.695 20 5 FHBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@@H](c3cccc(F)c3)C2)cccc1[N+](=O)[O-] ZINC000569875136 568433014 /nfs/dbraw/zinc/43/30/14/568433014.db2.gz HPUUUSHFYMOEMB-MRXNPFEDSA-N 1 1 371.412 3.860 20 5 FHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@@H](c3ccncc3)C2)c1 ZINC000570173716 568455072 /nfs/dbraw/zinc/45/50/72/568455072.db2.gz LTKWWVSSJJQCBU-CYBMUJFWSA-N 1 1 351.328 3.998 20 5 FHBDMO Cc1c(NC(=O)CC[N@@H+]2Cc3ccccc3OC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000542012729 568503218 /nfs/dbraw/zinc/50/32/18/568503218.db2.gz KVEMOZBOVUTRBS-AWEZNQCLSA-N 1 1 369.421 3.515 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)cc(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)n1 ZINC001164626754 719072481 /nfs/dbraw/zinc/07/24/81/719072481.db2.gz PHEDDXDEBNGHOS-DOTOQJQBSA-N 1 1 372.856 3.744 20 5 FHBDMO Cc1cnc(N2CCC[C@]3(CC[N@H+]3Cc3cccc(F)c3)C2)c([N+](=O)[O-])c1 ZINC001164992847 722192225 /nfs/dbraw/zinc/19/22/25/722192225.db2.gz BFLSODHNXDDRAT-FQEVSTJZSA-N 1 1 370.428 3.682 20 5 FHBDMO Cc1ccnc(N2CCC[C@@]3(CC[N@H+]3Cc3cccc(F)c3)C2)c1[N+](=O)[O-] ZINC001164993895 722195760 /nfs/dbraw/zinc/19/57/60/722195760.db2.gz IWCUIQWYSQVWQH-HXUWFJFHSA-N 1 1 370.428 3.682 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc([C@@H](C)[NH+]2CCOCC2)cc1 ZINC000110720996 945065838 /nfs/dbraw/zinc/06/58/38/945065838.db2.gz SYRXAHNSVGNYLD-OAHLLOKOSA-N 1 1 369.421 3.549 20 5 FHBDMO COc1ccc([C@H]2CCC[N@@H+]2CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000025414805 937118276 /nfs/dbraw/zinc/11/82/76/937118276.db2.gz VOAVPZIJWASFRQ-LJQANCHMSA-N 1 1 369.421 3.687 20 5 FHBDMO COc1ccc([C@H]2CCC[N@H+]2CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000025414805 937118277 /nfs/dbraw/zinc/11/82/77/937118277.db2.gz VOAVPZIJWASFRQ-LJQANCHMSA-N 1 1 369.421 3.687 20 5 FHBDMO CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1csc([N+](=O)[O-])c1 ZINC000175284315 927460061 /nfs/dbraw/zinc/46/00/61/927460061.db2.gz WVFCXWJCBDRNEA-MRXNPFEDSA-N 1 1 373.478 3.641 20 5 FHBDMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000246864279 927708234 /nfs/dbraw/zinc/70/82/34/927708234.db2.gz DLAYTOQKYZOFMA-HIFRSBDPSA-N 1 1 359.451 3.508 20 5 FHBDMO COc1ccc(-c2ccc(CNCC[N@@H+]3CCCC[C@@H]3C)o2)c([N+](=O)[O-])c1 ZINC000608835940 927817330 /nfs/dbraw/zinc/81/73/30/927817330.db2.gz AQZNEDWGTFKSIT-HNNXBMFYSA-N 1 1 373.453 3.827 20 5 FHBDMO COc1ccc(-c2ccc(CNCC[N@H+]3CCCC[C@@H]3C)o2)c([N+](=O)[O-])c1 ZINC000608835940 927817334 /nfs/dbraw/zinc/81/73/34/927817334.db2.gz AQZNEDWGTFKSIT-HNNXBMFYSA-N 1 1 373.453 3.827 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@]2(C1)OCc1ccccc12 ZINC000430200119 927938810 /nfs/dbraw/zinc/93/88/10/927938810.db2.gz FQUXJAOUOWZFTJ-FQEVSTJZSA-N 1 1 354.406 3.625 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](CCCO)[C@@H]1CCCc2ccccc21 ZINC000430211293 928131158 /nfs/dbraw/zinc/13/11/58/928131158.db2.gz XMVAKLVRXJYKLP-HXUWFJFHSA-N 1 1 370.449 3.865 20 5 FHBDMO COc1cc(N2CCC[C@H](C[N@H+]3CCCC[C@H]3C)C2)c(F)cc1[N+](=O)[O-] ZINC000302029574 928208639 /nfs/dbraw/zinc/20/86/39/928208639.db2.gz HZFQYOFSGLOKJM-HUUCEWRRSA-N 1 1 365.449 3.833 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1CCC1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC000157569834 928266262 /nfs/dbraw/zinc/26/62/62/928266262.db2.gz OYLQYWCEMZHQRU-MRXNPFEDSA-N 1 1 359.470 3.712 20 5 FHBDMO C[C@H]1CCCC[N@H+]1CCC1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC000157570001 928266600 /nfs/dbraw/zinc/26/66/00/928266600.db2.gz OYLQYWCEMZHQRU-INIZCTEOSA-N 1 1 359.470 3.712 20 5 FHBDMO COCCOc1cccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000127059210 928456724 /nfs/dbraw/zinc/45/67/24/928456724.db2.gz FYDHNTMZRNFGAK-UHFFFAOYSA-N 1 1 356.422 3.785 20 5 FHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CCCSCc3ccccc3)C2)nc1 ZINC000535624035 929216745 /nfs/dbraw/zinc/21/67/45/929216745.db2.gz IOYLWMQUHGKRQQ-KRWDZBQOSA-N 1 1 372.494 3.800 20 5 FHBDMO C[N@@H+](CCc1cccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2)c1)C1CC1 ZINC000091629712 937313276 /nfs/dbraw/zinc/31/32/76/937313276.db2.gz MORSKLZHYPLADY-UHFFFAOYSA-N 1 1 354.410 3.876 20 5 FHBDMO C[C@H](c1ccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1)[NH+]1CCOCC1 ZINC000109846651 929699584 /nfs/dbraw/zinc/69/95/84/929699584.db2.gz VHKDYDCYROAFEF-CQSZACIVSA-N 1 1 370.409 3.632 20 5 FHBDMO Cn1ccnc1[C@H]([NH2+][C@H]1C[C@H](c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000560533573 929875717 /nfs/dbraw/zinc/87/57/17/929875717.db2.gz QCQPHZFNAKONFE-QWFCFKBJSA-N 1 1 362.433 3.954 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](n2cnc3c2CCCC3)C1 ZINC000548010742 929937172 /nfs/dbraw/zinc/93/71/72/929937172.db2.gz ZLMXMRYKPIIJSA-DOTOQJQBSA-N 1 1 354.454 3.987 20 5 FHBDMO CC(=O)NC[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000155557221 929992743 /nfs/dbraw/zinc/99/27/43/929992743.db2.gz GBJRGILZEFTIKF-OAHLLOKOSA-N 1 1 373.478 3.671 20 5 FHBDMO C[C@H]1CCC[C@H](C)[NH+]1CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC001167337638 929993409 /nfs/dbraw/zinc/99/34/09/929993409.db2.gz VCKMQOODHUPGPS-STQMWFEESA-N 1 1 374.466 3.920 20 5 FHBDMO CCC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)Cc1ccc(OC)cc1 ZINC000610390266 930297333 /nfs/dbraw/zinc/29/73/33/930297333.db2.gz OXFFLJXPBLCUKL-UHFFFAOYSA-N 1 1 371.437 3.763 20 5 FHBDMO Cc1ccc(C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C2CC2)o1 ZINC000164992636 930316686 /nfs/dbraw/zinc/31/66/86/930316686.db2.gz LCAUXTNHMLDLRJ-UHFFFAOYSA-N 1 1 357.410 3.798 20 5 FHBDMO Cc1ccc(C(=O)N2CC[N@H+](Cc3ccccc3)CC[C@H]2C)cc1[N+](=O)[O-] ZINC000610445638 930809111 /nfs/dbraw/zinc/80/91/11/930809111.db2.gz AHGPHUXVPDKYGX-QGZVFWFLSA-N 1 1 367.449 3.640 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+](Cc3ccccc3)CC[C@H]2C)c1 ZINC000610446420 930818697 /nfs/dbraw/zinc/81/86/97/930818697.db2.gz YKNMJNRITMVULC-QGZVFWFLSA-N 1 1 367.449 3.640 20 5 FHBDMO CC[C@H](NC(=O)N1CCC([N@H+]2CCC[C@H]2C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000090684561 931476437 /nfs/dbraw/zinc/47/64/37/931476437.db2.gz UBBQBIXIRMBKMY-BEFAXECRSA-N 1 1 374.485 3.704 20 5 FHBDMO COc1cc(C[N@H+]2CCC[C@@H]2Cc2cccc(F)c2)c([N+](=O)[O-])cc1OC ZINC000510398386 931906039 /nfs/dbraw/zinc/90/60/39/931906039.db2.gz XZPNESKMVAWSBR-QGZVFWFLSA-N 1 1 374.412 3.958 20 5 FHBDMO C[C@@H](CNC(=O)OC(C)(C)C)[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000178018284 932106223 /nfs/dbraw/zinc/10/62/23/932106223.db2.gz JQGFMGQUJMMYAL-NSHDSACASA-N 1 1 357.838 3.593 20 5 FHBDMO CCn1c(SCCc2c[nH+]cn2C)nc2cc3ccccc3cc2c1=O ZINC000581535052 932220563 /nfs/dbraw/zinc/22/05/63/932220563.db2.gz CHWMOLICNXZGKC-UHFFFAOYSA-N 1 1 364.474 3.638 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H](C1CC1)[N@@H+](C)Cc1ccccc1 ZINC000477282041 932439996 /nfs/dbraw/zinc/43/99/96/932439996.db2.gz WIXQQJYBPVVIAP-HXUWFJFHSA-N 1 1 367.449 3.544 20 5 FHBDMO Cc1cnc(CC[N@H+](C)[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)s1 ZINC000157420562 932511134 /nfs/dbraw/zinc/51/11/34/932511134.db2.gz IYTCBANEGNALIN-LBPRGKRZSA-N 1 1 373.438 3.645 20 5 FHBDMO C[C@@H]([NH2+]CCOc1cccc([N+](=O)[O-])c1)c1nc(C(F)(F)F)cs1 ZINC000490053596 932753631 /nfs/dbraw/zinc/75/36/31/932753631.db2.gz KJLMRLXMKMLRFA-SECBINFHSA-N 1 1 361.345 3.800 20 5 FHBDMO COc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(OC)c([N+](=O)[O-])c2)c(OC)c1 ZINC000051260306 932760348 /nfs/dbraw/zinc/76/03/48/932760348.db2.gz FSRWMAXGKIKVOZ-QGZVFWFLSA-N 1 1 372.421 3.958 20 5 FHBDMO COc1ccc([C@H]2CCC[N@H+]2Cc2ccc(OC)c([N+](=O)[O-])c2)c(OC)c1 ZINC000051260306 932760352 /nfs/dbraw/zinc/76/03/52/932760352.db2.gz FSRWMAXGKIKVOZ-QGZVFWFLSA-N 1 1 372.421 3.958 20 5 FHBDMO Cn1c2c(nc1[C@@H]1CCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1)CCCC2 ZINC000548350830 933070558 /nfs/dbraw/zinc/07/05/58/933070558.db2.gz ZXUMYOCTOGMUMQ-IBGZPJMESA-N 1 1 354.454 3.587 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCc2c(cnn2-c2ccccc2)C1 ZINC000510517825 933182559 /nfs/dbraw/zinc/18/25/59/933182559.db2.gz LRHWCJNYPSEKKR-VURMDHGXSA-N 1 1 360.417 3.852 20 5 FHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+](Cc3cccc(O)c3)CC3CC3)nc2c1 ZINC000610581550 933308487 /nfs/dbraw/zinc/30/84/87/933308487.db2.gz SFBLTOIOKQSKAZ-UHFFFAOYSA-N 1 1 353.378 3.854 20 5 FHBDMO COc1ccc(-c2ccc(C[N@@H+]3CCO[C@H]4CCC[C@H]43)o2)c([N+](=O)[O-])c1 ZINC000430876945 933343929 /nfs/dbraw/zinc/34/39/29/933343929.db2.gz UBQRXOPFDIWEES-APWZRJJASA-N 1 1 358.394 3.617 20 5 FHBDMO COc1ccc(-c2ccc(C[N@H+]3CCO[C@H]4CCC[C@H]43)o2)c([N+](=O)[O-])c1 ZINC000430876945 933343936 /nfs/dbraw/zinc/34/39/36/933343936.db2.gz UBQRXOPFDIWEES-APWZRJJASA-N 1 1 358.394 3.617 20 5 FHBDMO CN(C(=O)[C@@H]1CC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1)c1ccccc1 ZINC000430879221 933358192 /nfs/dbraw/zinc/35/81/92/933358192.db2.gz MXWBXLVXWVZGDG-PDFOZTTASA-N 1 1 365.433 3.593 20 5 FHBDMO CC[C@H]1CN(C)c2ccccc2C[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610676595 933737990 /nfs/dbraw/zinc/73/79/90/933737990.db2.gz ALHUDZGYYWYNHH-HNNXBMFYSA-N 1 1 366.421 3.967 20 5 FHBDMO CC[C@H]1CN(C)c2ccccc2C[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610676595 933737993 /nfs/dbraw/zinc/73/79/93/933737993.db2.gz ALHUDZGYYWYNHH-HNNXBMFYSA-N 1 1 366.421 3.967 20 5 FHBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[C@@H](C)C1 ZINC000247463496 933779854 /nfs/dbraw/zinc/77/98/54/933779854.db2.gz RFQGGYVNQZTLCE-SWLSCSKDSA-N 1 1 361.467 3.612 20 5 FHBDMO Cc1noc(C[C@@H]([NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c2ccccc2)n1 ZINC000277040787 934463326 /nfs/dbraw/zinc/46/33/26/934463326.db2.gz GCXLRILENNXCIL-CXAGYDPISA-N 1 1 352.394 3.921 20 5 FHBDMO Cc1noc(C[C@H]([NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c2ccccc2)n1 ZINC000277040790 934463349 /nfs/dbraw/zinc/46/33/49/934463349.db2.gz GCXLRILENNXCIL-DYVFJYSZSA-N 1 1 352.394 3.921 20 5 FHBDMO O=[N+]([O-])c1ccn(CC[N@@H+]2CCc3sccc3[C@@H]2c2cccs2)n1 ZINC000176198171 934597800 /nfs/dbraw/zinc/59/78/00/934597800.db2.gz NBMFXZILDGOJJS-MRXNPFEDSA-N 1 1 360.464 3.562 20 5 FHBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCc3sccc3[C@@H]2c2cccs2)n1 ZINC000176198171 934597808 /nfs/dbraw/zinc/59/78/08/934597808.db2.gz NBMFXZILDGOJJS-MRXNPFEDSA-N 1 1 360.464 3.562 20 5 FHBDMO COc1ccc([C@H]2CCC[N@@H+]2Cc2cc3c(cc2[N+](=O)[O-])OCCO3)cc1 ZINC000610931006 934632770 /nfs/dbraw/zinc/63/27/70/934632770.db2.gz BHCUMEGKRDTJTI-QGZVFWFLSA-N 1 1 370.405 3.712 20 5 FHBDMO COc1ccc([C@H]2CCC[N@H+]2Cc2cc3c(cc2[N+](=O)[O-])OCCO3)cc1 ZINC000610931006 934632774 /nfs/dbraw/zinc/63/27/74/934632774.db2.gz BHCUMEGKRDTJTI-QGZVFWFLSA-N 1 1 370.405 3.712 20 5 FHBDMO O=C(NC[C@@H]1CCCC[N@H+]1Cc1ccccc1[N+](=O)[O-])Nc1ccccc1 ZINC000071887177 934937956 /nfs/dbraw/zinc/93/79/56/934937956.db2.gz QVLGAOXALQPACZ-SFHVURJKSA-N 1 1 368.437 3.771 20 5 FHBDMO O=C(NC[C@@H]1CCCC[N@@H+]1Cc1ccccc1[N+](=O)[O-])Nc1ccccc1 ZINC000071887177 934937958 /nfs/dbraw/zinc/93/79/58/934937958.db2.gz QVLGAOXALQPACZ-SFHVURJKSA-N 1 1 368.437 3.771 20 5 FHBDMO COc1cc(C[N@H+]2CC[C@H]3CCC[C@H]32)c([N+](=O)[O-])cc1OCC(F)F ZINC000426526463 945081219 /nfs/dbraw/zinc/08/12/19/945081219.db2.gz SYTSXBMVNQLWHP-DGCLKSJQSA-N 1 1 356.369 3.622 20 5 FHBDMO Cc1ccc(NC(=O)[C@H](C)[N@H+](C)CCc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000511060379 935182672 /nfs/dbraw/zinc/18/26/72/935182672.db2.gz ROXMEAHEKDUDQA-INIZCTEOSA-N 1 1 355.438 3.713 20 5 FHBDMO Cc1ccc(NC(=O)[C@H](C)[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000511060379 935182673 /nfs/dbraw/zinc/18/26/73/935182673.db2.gz ROXMEAHEKDUDQA-INIZCTEOSA-N 1 1 355.438 3.713 20 5 FHBDMO O=[N+]([O-])c1ccc(CC[N@@H+](Cc2ccccc2)C[C@@H](O)C(F)(F)F)cc1 ZINC000611575010 935246218 /nfs/dbraw/zinc/24/62/18/935246218.db2.gz BEEQBCICHYNTKY-QGZVFWFLSA-N 1 1 368.355 3.563 20 5 FHBDMO Cc1cc(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)n(C)n1 ZINC000551585208 935313483 /nfs/dbraw/zinc/31/34/83/935313483.db2.gz RCPZJSSMWOIXFO-UHFFFAOYSA-N 1 1 360.801 3.840 20 5 FHBDMO O=[N+]([O-])c1ccc([C@H](NCc2c[nH+]c3n2CCCC3)C(F)(F)F)cc1 ZINC000563263421 935326168 /nfs/dbraw/zinc/32/61/68/935326168.db2.gz FURPHOHSPAQNDO-HNNXBMFYSA-N 1 1 354.332 3.521 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCCN(c3ccc(F)c(F)c3)CC2)cs1 ZINC000551736310 935335071 /nfs/dbraw/zinc/33/50/71/935335071.db2.gz AZPZQYWTYHOHCG-UHFFFAOYSA-N 1 1 353.394 3.647 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCN(c3ccc(F)c(F)c3)CC2)cs1 ZINC000551736310 935335076 /nfs/dbraw/zinc/33/50/76/935335076.db2.gz AZPZQYWTYHOHCG-UHFFFAOYSA-N 1 1 353.394 3.647 20 5 FHBDMO Cc1cc(C(=O)N2CCC[C@@H](n3cc[nH+]c3C(C)C)C2)ccc1[N+](=O)[O-] ZINC000370873310 935381633 /nfs/dbraw/zinc/38/16/33/935381633.db2.gz UMCIKEJGRCXZMY-MRXNPFEDSA-N 1 1 356.426 3.700 20 5 FHBDMO Cc1sc(C(=O)N2CCC[C@H](n3cc[nH+]c3C(C)C)C2)cc1[N+](=O)[O-] ZINC000370877213 935392641 /nfs/dbraw/zinc/39/26/41/935392641.db2.gz RHFCSUADUJGXLL-ZDUSSCGKSA-N 1 1 362.455 3.762 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21 ZINC000511785138 945111329 /nfs/dbraw/zinc/11/13/29/945111329.db2.gz IYROCCUZXZUGIR-HSALFYBXSA-N 1 1 368.433 3.608 20 5 FHBDMO CCn1c2cccc(F)c2nc1C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511108168 935599865 /nfs/dbraw/zinc/59/98/65/935599865.db2.gz MBLBJKBZSAATRI-UHFFFAOYSA-N 1 1 356.401 3.778 20 5 FHBDMO CCn1c2cccc(F)c2nc1C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511108168 935599867 /nfs/dbraw/zinc/59/98/67/935599867.db2.gz MBLBJKBZSAATRI-UHFFFAOYSA-N 1 1 356.401 3.778 20 5 FHBDMO CC(C)C[N@H+]1Cc2cccc(NC(=O)Cc3cccc([N+](=O)[O-])c3)c2C1 ZINC000158322801 935731691 /nfs/dbraw/zinc/73/16/91/935731691.db2.gz UWESBRJHWNHXJJ-UHFFFAOYSA-N 1 1 353.422 3.748 20 5 FHBDMO Cc1ccc(C)c(NC(=O)[C@@H](C)[N@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511146017 935786185 /nfs/dbraw/zinc/78/61/85/935786185.db2.gz XPLBKCWZVCFFIS-MRXNPFEDSA-N 1 1 355.438 3.713 20 5 FHBDMO Cc1ccc(C)c(NC(=O)[C@@H](C)[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511146017 935786186 /nfs/dbraw/zinc/78/61/86/935786186.db2.gz XPLBKCWZVCFFIS-MRXNPFEDSA-N 1 1 355.438 3.713 20 5 FHBDMO Cc1ccc2c(C[N@@H+](C)CCc3ccccc3[N+](=O)[O-])ccc(O)c2n1 ZINC000511145630 935787261 /nfs/dbraw/zinc/78/72/61/935787261.db2.gz WNDZYMZOCZGNOK-UHFFFAOYSA-N 1 1 351.406 3.832 20 5 FHBDMO COc1cc(C[NH2+]Cc2ccc(-c3ccccc3)o2)c([N+](=O)[O-])cc1O ZINC000509574426 945126748 /nfs/dbraw/zinc/12/67/48/945126748.db2.gz YARIWZZQJCTPRE-UHFFFAOYSA-N 1 1 354.362 3.859 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000158562471 935839751 /nfs/dbraw/zinc/83/97/51/935839751.db2.gz LJTUCBOGWHJXFE-CRAIPNDOSA-N 1 1 372.469 3.692 20 5 FHBDMO CC(C)C[NH+]1CCN(C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CC1 ZINC000277729554 935864272 /nfs/dbraw/zinc/86/42/72/935864272.db2.gz HACBTUPHCJHNGI-UHFFFAOYSA-N 1 1 363.461 3.507 20 5 FHBDMO COc1ccc(OCC[N@H+]2CC[C@H](c3ccccc3)[C@@H]2C)c([N+](=O)[O-])c1 ZINC001167599145 935943673 /nfs/dbraw/zinc/94/36/73/935943673.db2.gz PMGROUILCMNQGY-YJBOKZPZSA-N 1 1 356.422 3.860 20 5 FHBDMO C[C@]1(CCc2ccccc2)CC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC001167599244 935945785 /nfs/dbraw/zinc/94/57/85/935945785.db2.gz RGPWVSPRXQBQDW-NRFANRHFSA-N 1 1 367.449 3.878 20 5 FHBDMO C[C@]1(CCc2ccccc2)CC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC001167599244 935945787 /nfs/dbraw/zinc/94/57/87/935945787.db2.gz RGPWVSPRXQBQDW-NRFANRHFSA-N 1 1 367.449 3.878 20 5 FHBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](Nc2ncnc3ccc([N+](=O)[O-])cc32)C1 ZINC000611709387 935957480 /nfs/dbraw/zinc/95/74/80/935957480.db2.gz PLNJUMQHRJNUBS-ZBFHGGJFSA-N 1 1 363.421 3.785 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCS[C@@H]2CCCC[C@H]21 ZINC000246117127 938336686 /nfs/dbraw/zinc/33/66/86/938336686.db2.gz KUIIYTSRTHVXAH-IAGOWNOFSA-N 1 1 363.483 3.592 20 5 FHBDMO Cc1[nH+]ccn1-c1ccc(CNc2ccc([N+](=O)[O-])c3cnccc23)cn1 ZINC000052510393 938353574 /nfs/dbraw/zinc/35/35/74/938353574.db2.gz GCJFDQZDJUGRKW-UHFFFAOYSA-N 1 1 360.377 3.644 20 5 FHBDMO Cc1ccc(OC[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)cc1[N+](=O)[O-] ZINC000583721599 938375862 /nfs/dbraw/zinc/37/58/62/938375862.db2.gz GNHILKOVQPDIEA-LJQANCHMSA-N 1 1 356.422 3.573 20 5 FHBDMO Cc1cnc(C2CC[NH+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])CC2)s1 ZINC000278412166 938397727 /nfs/dbraw/zinc/39/77/27/938397727.db2.gz QEKUXVLOGRIEMZ-UHFFFAOYSA-N 1 1 362.411 3.648 20 5 FHBDMO CS[C@@H]1CCCC[N@@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000246979521 938424875 /nfs/dbraw/zinc/42/48/75/938424875.db2.gz VVIFPAPWOLEHKK-WCQYABFASA-N 1 1 371.890 3.793 20 5 FHBDMO CS[C@@H]1CCCC[N@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000246979521 938424878 /nfs/dbraw/zinc/42/48/78/938424878.db2.gz VVIFPAPWOLEHKK-WCQYABFASA-N 1 1 371.890 3.793 20 5 FHBDMO CCc1ccc(C(=O)N2CCC(Oc3cc[nH+]cc3C)CC2)cc1[N+](=O)[O-] ZINC000278436838 938427882 /nfs/dbraw/zinc/42/78/82/938427882.db2.gz VOBPBLFQUOVFIR-UHFFFAOYSA-N 1 1 369.421 3.544 20 5 FHBDMO Cc1cc([N+](=O)[O-])cnc1N1CCC[N@@H+](Cc2ccc(Cl)cc2)CC1 ZINC000110932050 945176716 /nfs/dbraw/zinc/17/67/16/945176716.db2.gz PXFVHNJXNYEPGL-UHFFFAOYSA-N 1 1 360.845 3.664 20 5 FHBDMO Cc1c[nH+]ccc1OC1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000278738083 938709373 /nfs/dbraw/zinc/70/93/73/938709373.db2.gz SJVCTOMIEYCFBW-UHFFFAOYSA-N 1 1 370.409 3.682 20 5 FHBDMO CC[N@H+](Cc1ccccc1Cl)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000106268964 945200814 /nfs/dbraw/zinc/20/08/14/945200814.db2.gz HFDGCEABSNQFKO-MRXNPFEDSA-N 1 1 364.829 3.510 20 5 FHBDMO Cn1ccnc1[C@@H]([NH2+]CCc1ccc(F)cc1F)c1ccc([N+](=O)[O-])cc1 ZINC000573273550 938963401 /nfs/dbraw/zinc/96/34/01/938963401.db2.gz MQYAWMFQQIFACC-SFHVURJKSA-N 1 1 372.375 3.528 20 5 FHBDMO O=[N+]([O-])c1ncccc1N[C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000612101927 939050398 /nfs/dbraw/zinc/05/03/98/939050398.db2.gz YRCYXRUGRZHCDR-KZNAEPCWSA-N 1 1 352.438 3.702 20 5 FHBDMO O=[N+]([O-])c1cnc(N2CCC(c3[nH+]cc4n3CCCC4)CC2)c(Cl)c1 ZINC000278839962 945265184 /nfs/dbraw/zinc/26/51/84/945265184.db2.gz KWFHWHIUWYCAMO-UHFFFAOYSA-N 1 1 361.833 3.560 20 5 FHBDMO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccccc1N1CCOCC1 ZINC000179761798 939931472 /nfs/dbraw/zinc/93/14/72/939931472.db2.gz QIICPPXQRWWSLR-RMKNXTFCSA-N 1 1 367.449 3.577 20 5 FHBDMO O=C(Nc1cccc([N+](=O)[O-])c1)[C@H]1CCC[N@@H+](Cc2cccc(F)c2)C1 ZINC000065857468 939984678 /nfs/dbraw/zinc/98/46/78/939984678.db2.gz ULHYGKNMRQUYDU-HNNXBMFYSA-N 1 1 357.385 3.585 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[C@@H]([N@@H+](C)Cc2ccccc2)C1 ZINC000615034234 939989891 /nfs/dbraw/zinc/98/98/91/939989891.db2.gz SVCAHWNRJHAQBE-GOSISDBHSA-N 1 1 368.437 3.641 20 5 FHBDMO COc1ccc(NC(=O)CC[N@@H+](C)[C@@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000411140525 940002329 /nfs/dbraw/zinc/00/23/29/940002329.db2.gz XNINBSOKNMMUKT-AWEZNQCLSA-N 1 1 357.410 3.625 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH+]3CCC([C@H]4CCOC4)CC3)cs2)c1 ZINC000612402110 940048017 /nfs/dbraw/zinc/04/80/17/940048017.db2.gz JVQLOOZEHOJLEJ-INIZCTEOSA-N 1 1 373.478 3.967 20 5 FHBDMO CSc1ccccc1NC(=O)[C@@H](C)[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548928350 940053075 /nfs/dbraw/zinc/05/30/75/940053075.db2.gz OWCSDINCXLJILW-CQSZACIVSA-N 1 1 373.478 3.818 20 5 FHBDMO CSc1ccccc1NC(=O)[C@@H](C)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548928350 940053077 /nfs/dbraw/zinc/05/30/77/940053077.db2.gz OWCSDINCXLJILW-CQSZACIVSA-N 1 1 373.478 3.818 20 5 FHBDMO Cn1cc(C[N@@H+]2CCc3sccc3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000179886841 940083971 /nfs/dbraw/zinc/08/39/71/940083971.db2.gz XKHVJFADORMXOS-UHFFFAOYSA-N 1 1 354.435 3.615 20 5 FHBDMO Cn1cc(C[N@H+]2CCc3sccc3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000179886841 940083976 /nfs/dbraw/zinc/08/39/76/940083976.db2.gz XKHVJFADORMXOS-UHFFFAOYSA-N 1 1 354.435 3.615 20 5 FHBDMO Cc1ccc(F)cc1NC(=O)[C@@H](C)[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548935141 940106329 /nfs/dbraw/zinc/10/63/29/940106329.db2.gz DKCRVUMOOHZXID-CQSZACIVSA-N 1 1 359.401 3.544 20 5 FHBDMO Cc1ccc(F)cc1NC(=O)[C@@H](C)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548935141 940106330 /nfs/dbraw/zinc/10/63/30/940106330.db2.gz DKCRVUMOOHZXID-CQSZACIVSA-N 1 1 359.401 3.544 20 5 FHBDMO C[C@@H]1[C@@H](CC(F)(F)F)C[C@H](C)[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411767551 940110249 /nfs/dbraw/zinc/11/02/49/940110249.db2.gz FWHQRRPQHKLVKZ-YNEHKIRRSA-N 1 1 373.375 3.975 20 5 FHBDMO COc1c(O)ccc(C[NH2+][C@H]2CCSc3c(F)cccc32)c1[N+](=O)[O-] ZINC000892508020 940206045 /nfs/dbraw/zinc/20/60/45/940206045.db2.gz IKLRQRBUVOCNHW-ZDUSSCGKSA-N 1 1 364.398 3.775 20 5 FHBDMO Cn1cc(C[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)c(-c2ccc(F)cc2)n1 ZINC000580276411 940471676 /nfs/dbraw/zinc/47/16/76/940471676.db2.gz PWGNFWFRSKXOGZ-UHFFFAOYSA-N 1 1 366.396 3.693 20 5 FHBDMO Cn1cc(C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)c(-c2ccc(F)cc2)n1 ZINC000580276411 940471678 /nfs/dbraw/zinc/47/16/78/940471678.db2.gz PWGNFWFRSKXOGZ-UHFFFAOYSA-N 1 1 366.396 3.693 20 5 FHBDMO COc1cc(C[NH2+]Cc2ccc(OC3CCCC3)cc2)c([N+](=O)[O-])cc1O ZINC000580729386 940483137 /nfs/dbraw/zinc/48/31/37/940483137.db2.gz ABYYFUMZGNFBBZ-UHFFFAOYSA-N 1 1 372.421 3.920 20 5 FHBDMO CN(C)c1ncccc1C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180112453 940483902 /nfs/dbraw/zinc/48/39/02/940483902.db2.gz WBIFRZXRYYYYPM-FQEVSTJZSA-N 1 1 362.433 3.935 20 5 FHBDMO CC[N@@H+](CCC(=O)OC)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000511474982 940506363 /nfs/dbraw/zinc/50/63/63/940506363.db2.gz CUSRIHXJQFCIEM-UHFFFAOYSA-N 1 1 366.801 3.893 20 5 FHBDMO Cc1c([C@H](C)[NH2+][C@H]2c3sccc3OC(C)(C)[C@@H]2O)cccc1[N+](=O)[O-] ZINC000414179613 940721172 /nfs/dbraw/zinc/72/11/72/940721172.db2.gz KYAWBYQIYNCGLH-XNJJOIOASA-N 1 1 362.451 3.889 20 5 FHBDMO Cn1cc([C@H]([NH2+]Cc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)cn1 ZINC000376352016 940822081 /nfs/dbraw/zinc/82/20/81/940822081.db2.gz OBUQHKJJTMMASE-GOSISDBHSA-N 1 1 356.813 3.861 20 5 FHBDMO CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000180220573 940828985 /nfs/dbraw/zinc/82/89/85/940828985.db2.gz CSYSNZMEOHVXBX-KBPBESRZSA-N 1 1 365.499 3.650 20 5 FHBDMO CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000180220538 940829028 /nfs/dbraw/zinc/82/90/28/940829028.db2.gz CSYSNZMEOHVXBX-UONOGXRCSA-N 1 1 365.499 3.650 20 5 FHBDMO CCC[N@@H+](CC(=O)N(C)C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000511508483 940975580 /nfs/dbraw/zinc/97/55/80/940975580.db2.gz YIJFLUMLBSZXFN-UHFFFAOYSA-N 1 1 361.467 3.624 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])c(N2CC[C@@H](C)[N@H+](Cc3ccccc3)CC2)n1 ZINC000541006388 941101490 /nfs/dbraw/zinc/10/14/90/941101490.db2.gz PREBHFRWWWHEBT-QGZVFWFLSA-N 1 1 354.454 3.707 20 5 FHBDMO C[C@@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccc(N2CCOC2=O)cc1 ZINC000181274345 941118689 /nfs/dbraw/zinc/11/86/89/941118689.db2.gz MTTGVOKOSZODGH-GFCCVEGCSA-N 1 1 359.357 3.541 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CC1(c2ccccc2)CC1 ZINC000189286849 941155377 /nfs/dbraw/zinc/15/53/77/941155377.db2.gz VPQBIYWCMMZWPJ-UHFFFAOYSA-N 1 1 353.422 3.505 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)CC1(c2ccccc2)CC1 ZINC000189286849 941155378 /nfs/dbraw/zinc/15/53/78/941155378.db2.gz VPQBIYWCMMZWPJ-UHFFFAOYSA-N 1 1 353.422 3.505 20 5 FHBDMO C[C@@H](NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000181455665 941288369 /nfs/dbraw/zinc/28/83/69/941288369.db2.gz IYPMSRBLOHOCFS-CHWSQXEVSA-N 1 1 365.861 3.631 20 5 FHBDMO COc1cc(NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000311543027 941323665 /nfs/dbraw/zinc/32/36/65/941323665.db2.gz UIFXNHFOJVJIGN-QGZVFWFLSA-N 1 1 355.438 3.928 20 5 FHBDMO CC(=O)c1ccc(N(C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000311684175 941360149 /nfs/dbraw/zinc/36/01/49/941360149.db2.gz JGEREOGQGVLVKL-SFHVURJKSA-N 1 1 353.422 3.508 20 5 FHBDMO COc1ccc(C[NH2+]Cc2cc(C)ccc2Br)cc1[N+](=O)[O-] ZINC000414514167 941370497 /nfs/dbraw/zinc/37/04/97/941370497.db2.gz LCFQSXDSZZPFCH-UHFFFAOYSA-N 1 1 365.227 3.964 20 5 FHBDMO Cc1cc(C(=O)Nc2ccccc2C[NH+]2CCSCC2)cc([N+](=O)[O-])c1 ZINC000128322335 941393884 /nfs/dbraw/zinc/39/38/84/941393884.db2.gz QIZBFFXVQJROND-UHFFFAOYSA-N 1 1 371.462 3.704 20 5 FHBDMO C[C@H]1C[C@H](c2ccccc2)[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000513227764 941798106 /nfs/dbraw/zinc/79/81/06/941798106.db2.gz GCJYSBJXAKLWDX-MGPUTAFESA-N 1 1 365.433 3.567 20 5 FHBDMO CO[C@@H](C)C[N@H+](C)[C@@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000513261804 941814917 /nfs/dbraw/zinc/81/49/17/941814917.db2.gz POCKKXRNSVBWOG-HNAYVOBHSA-N 1 1 371.437 3.550 20 5 FHBDMO CO[C@@H](C)C[N@@H+](C)[C@@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000513261804 941814922 /nfs/dbraw/zinc/81/49/22/941814922.db2.gz POCKKXRNSVBWOG-HNAYVOBHSA-N 1 1 371.437 3.550 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@@H](C)C[C@@H]1c1ccccc1 ZINC000513275779 941826161 /nfs/dbraw/zinc/82/61/61/941826161.db2.gz KCCOKIHWRSJJKU-IFXJQAMLSA-N 1 1 353.422 3.925 20 5 FHBDMO C[N@H+](Cc1ccc2c(c1)OCO2)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549336082 941992893 /nfs/dbraw/zinc/99/28/93/941992893.db2.gz YMQXLWTXWFXXSR-UHFFFAOYSA-N 1 1 368.311 3.974 20 5 FHBDMO C[N@@H+](Cc1ccc2c(c1)OCO2)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549336082 941992897 /nfs/dbraw/zinc/99/28/97/941992897.db2.gz YMQXLWTXWFXXSR-UHFFFAOYSA-N 1 1 368.311 3.974 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H]2CCCC[C@@H]21 ZINC000103266283 942239766 /nfs/dbraw/zinc/23/97/66/942239766.db2.gz PIWUYWLBSGDVHY-YOEHRIQHSA-N 1 1 361.442 3.587 20 5 FHBDMO CCCC[N@@H+](C)CC1CCN(c2ncc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000413061984 942247825 /nfs/dbraw/zinc/24/78/25/942247825.db2.gz AMKVNIZOFGUZQG-UHFFFAOYSA-N 1 1 374.407 3.957 20 5 FHBDMO O=[N+]([O-])c1ccc2ccnc(NCC[N@H+]3CCc4sccc4C3)c2c1 ZINC000413072767 942259781 /nfs/dbraw/zinc/25/97/81/942259781.db2.gz NTDFKMOEVQDGOL-UHFFFAOYSA-N 1 1 354.435 3.675 20 5 FHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(c2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000413075089 942259836 /nfs/dbraw/zinc/25/98/36/942259836.db2.gz KEQCRHXGWCFCEW-DAYGRLMNSA-N 1 1 354.454 3.985 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420955618 942275320 /nfs/dbraw/zinc/27/53/20/942275320.db2.gz WRGAUXNDMODLAX-CYBMUJFWSA-N 1 1 373.375 3.896 20 5 FHBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420955967 942275375 /nfs/dbraw/zinc/27/53/75/942275375.db2.gz XJDGOGFKXLZOMN-VXGBXAGGSA-N 1 1 359.348 3.586 20 5 FHBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420955967 942275379 /nfs/dbraw/zinc/27/53/79/942275379.db2.gz XJDGOGFKXLZOMN-VXGBXAGGSA-N 1 1 359.348 3.586 20 5 FHBDMO O=[N+]([O-])c1ccc2ccnc(Nc3cccc(C[NH+]4CCOCC4)c3)c2c1 ZINC000413093961 942284231 /nfs/dbraw/zinc/28/42/31/942284231.db2.gz JVWFMNZMLYDHEY-UHFFFAOYSA-N 1 1 364.405 3.719 20 5 FHBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000366804111 942384805 /nfs/dbraw/zinc/38/48/05/942384805.db2.gz IJLFGDNUIGQSEW-LJQANCHMSA-N 1 1 367.449 3.722 20 5 FHBDMO C[N@@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])cc2F)[C@@H]1c1ccc(Cl)cc1 ZINC000413200733 942473231 /nfs/dbraw/zinc/47/32/31/942473231.db2.gz FICWALRATIJNFV-CABCVRRESA-N 1 1 350.781 3.640 20 5 FHBDMO C[N@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])cc2F)[C@@H]1c1ccc(Cl)cc1 ZINC000413200733 942473236 /nfs/dbraw/zinc/47/32/36/942473236.db2.gz FICWALRATIJNFV-CABCVRRESA-N 1 1 350.781 3.640 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1C(=O)Nc1nc2c(s1)C[N@H+](C(C)(C)C)CC2 ZINC000425035240 942511852 /nfs/dbraw/zinc/51/18/52/942511852.db2.gz HLJDKGVMZUIPLG-UHFFFAOYSA-N 1 1 374.466 3.769 20 5 FHBDMO C[C@@H]1C[C@H](CO)C[N@@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000421361030 942514198 /nfs/dbraw/zinc/51/41/98/942514198.db2.gz KCDPSHXHKFNLCI-ZBFHGGJFSA-N 1 1 374.412 3.977 20 5 FHBDMO COc1cccc([C@H]2[C@H](Nc3ncc([N+](=O)[O-])cc3F)CC[N@H+]2C2CC2)c1 ZINC000413246423 942560898 /nfs/dbraw/zinc/56/08/98/942560898.db2.gz ZNDRTHQCHVRMNN-MSOLQXFVSA-N 1 1 372.400 3.527 20 5 FHBDMO CC[N@@H+](CCNc1nccc2ccc([N+](=O)[O-])cc21)CCC(F)(F)F ZINC000413257387 942568308 /nfs/dbraw/zinc/56/83/08/942568308.db2.gz FHOJYNDLXVOWPC-UHFFFAOYSA-N 1 1 356.348 3.829 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1C[C@H]2CCC[N@H+]2Cc2ccccc21 ZINC000421438040 942573582 /nfs/dbraw/zinc/57/35/82/942573582.db2.gz UCMAAQUKEQAAFU-QGZVFWFLSA-N 1 1 365.433 3.836 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)CCOc1cccc(Cl)c1 ZINC000016421736 942598305 /nfs/dbraw/zinc/59/83/05/942598305.db2.gz QPDXGDVWIYRISS-UHFFFAOYSA-N 1 1 350.802 3.768 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CCOc1cccc(Cl)c1 ZINC000016421736 942598308 /nfs/dbraw/zinc/59/83/08/942598308.db2.gz QPDXGDVWIYRISS-UHFFFAOYSA-N 1 1 350.802 3.768 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000421513721 942619327 /nfs/dbraw/zinc/61/93/27/942619327.db2.gz QINGJXPUDQUMPO-CVEARBPZSA-N 1 1 359.470 3.594 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@H]1CCc2ccccc21 ZINC000063492133 942708472 /nfs/dbraw/zinc/70/84/72/942708472.db2.gz KNDIJPAEFJUXCE-IBGZPJMESA-N 1 1 353.422 3.851 20 5 FHBDMO Cc1cc(NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)cn2cc[nH+]c12 ZINC000502773639 942733432 /nfs/dbraw/zinc/73/34/32/942733432.db2.gz LFEPOEGEOXHZAR-UHFFFAOYSA-N 1 1 368.396 3.890 20 5 FHBDMO Cc1cc(NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cn2cc[nH+]c12 ZINC000502808252 942761068 /nfs/dbraw/zinc/76/10/68/942761068.db2.gz DZXLROUMSRZIFO-UHFFFAOYSA-N 1 1 364.283 3.822 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)C1CCN(Cc2ccncc2)CC1 ZINC000378505597 942840794 /nfs/dbraw/zinc/84/07/94/942840794.db2.gz DMWBZUTYNNSGRM-KRWDZBQOSA-N 1 1 368.481 3.956 20 5 FHBDMO Cc1cc(NC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])cn2cc[nH+]c12 ZINC000502899172 942841135 /nfs/dbraw/zinc/84/11/35/942841135.db2.gz LWGNKFCTZWAKBE-UHFFFAOYSA-N 1 1 373.372 3.865 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)NC(C)(C)C[N@@H+](C)Cc1ccccc1 ZINC000514244760 942859653 /nfs/dbraw/zinc/85/96/53/942859653.db2.gz MWILGHHCIBSMCY-UHFFFAOYSA-N 1 1 355.438 3.544 20 5 FHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+](C)Cc1cccs1 ZINC000016586886 942880908 /nfs/dbraw/zinc/88/09/08/942880908.db2.gz BJVXYQNOJMQGQM-JTQLQIEISA-N 1 1 353.831 3.769 20 5 FHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)Cc1cccs1 ZINC000016586886 942880914 /nfs/dbraw/zinc/88/09/14/942880914.db2.gz BJVXYQNOJMQGQM-JTQLQIEISA-N 1 1 353.831 3.769 20 5 FHBDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000502996707 942898747 /nfs/dbraw/zinc/89/87/47/942898747.db2.gz GLGROMIJXPSGFB-QGZVFWFLSA-N 1 1 374.485 3.554 20 5 FHBDMO NC(=O)c1ccc(C[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C2CC2)c(F)c1 ZINC000430092110 942903780 /nfs/dbraw/zinc/90/37/80/942903780.db2.gz WWLPNIXJCGEXCB-HWKANZROSA-N 1 1 369.396 3.511 20 5 FHBDMO NC(=O)c1ccc(C[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C2CC2)c(F)c1 ZINC000430092110 942903782 /nfs/dbraw/zinc/90/37/82/942903782.db2.gz WWLPNIXJCGEXCB-HWKANZROSA-N 1 1 369.396 3.511 20 5 FHBDMO C[C@@H]1[C@@H](c2ccccc2)CC[N@H+]1[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000434892329 943022431 /nfs/dbraw/zinc/02/24/31/943022431.db2.gz QJXMTNJSLLAQLB-XPGWFJOJSA-N 1 1 365.433 3.578 20 5 FHBDMO NC(=O)c1ccc(C[N@H+]2CC=C(c3ccc(Cl)cc3)CC2)c([N+](=O)[O-])c1 ZINC000434902800 943039947 /nfs/dbraw/zinc/03/99/47/943039947.db2.gz FXEAWNXMJGRBGR-UHFFFAOYSA-N 1 1 371.824 3.636 20 5 FHBDMO NC(=O)c1ccc(C[N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)c([N+](=O)[O-])c1 ZINC000434902800 943039954 /nfs/dbraw/zinc/03/99/54/943039954.db2.gz FXEAWNXMJGRBGR-UHFFFAOYSA-N 1 1 371.824 3.636 20 5 FHBDMO CC(C)c1ccc(C[N@@H+](C)C2CCN(c3cnccn3)CC2)cc1[N+](=O)[O-] ZINC000435054054 943126555 /nfs/dbraw/zinc/12/65/55/943126555.db2.gz AAZVSYPCYPVUOR-UHFFFAOYSA-N 1 1 369.469 3.609 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(C[N@@H+]2CCC[C@H](O)C2)cc1 ZINC000435057965 943129992 /nfs/dbraw/zinc/12/99/92/943129992.db2.gz RAIBPUSXOAGERH-HNNXBMFYSA-N 1 1 362.813 3.997 20 5 FHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000503380813 943157476 /nfs/dbraw/zinc/15/74/76/943157476.db2.gz WJBFINNJOUQVBT-AWEZNQCLSA-N 1 1 358.417 3.646 20 5 FHBDMO CCn1nc(C)c([N+](=O)[O-])c1S[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000425285700 943190569 /nfs/dbraw/zinc/19/05/69/943190569.db2.gz TYUSAFHVCZQYHZ-MRXNPFEDSA-N 1 1 360.483 3.876 20 5 FHBDMO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+]C1CCN(C2CCC2)CC1 ZINC000513789027 943192975 /nfs/dbraw/zinc/19/29/75/943192975.db2.gz BGYOBQOOJATQGF-OXQOHEQNSA-N 1 1 357.498 3.913 20 5 FHBDMO C[C@H](CCNC(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1ccccc1 ZINC000473018022 943281773 /nfs/dbraw/zinc/28/17/73/943281773.db2.gz UTFIWVKWSPLVBY-OAHLLOKOSA-N 1 1 356.426 3.627 20 5 FHBDMO C[C@@H](CCNC(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1ccccc1 ZINC000473018021 943281924 /nfs/dbraw/zinc/28/19/24/943281924.db2.gz UTFIWVKWSPLVBY-HNNXBMFYSA-N 1 1 356.426 3.627 20 5 FHBDMO O=[N+]([O-])c1ccc(CC[N@@H+](Cc2cccc(O)c2)[C@H]2CC[C@H](O)CC2)cc1 ZINC000566428669 943382621 /nfs/dbraw/zinc/38/26/21/943382621.db2.gz IPTOWFBOZVOKLJ-KESTWPANSA-N 1 1 370.449 3.649 20 5 FHBDMO CN(CC[C@H]1CCCC[N@H+]1C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549464844 943393273 /nfs/dbraw/zinc/39/32/73/943393273.db2.gz IAOINPZMXWPODT-CQSZACIVSA-N 1 1 359.392 3.920 20 5 FHBDMO C[C@H](N[C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000423144747 943406831 /nfs/dbraw/zinc/40/68/31/943406831.db2.gz HVJJMIKVMFFNCZ-ADLFWFRXSA-N 1 1 353.422 3.501 20 5 FHBDMO O=[N+]([O-])c1ccc(CN(Cc2ccsc2)[C@H]2CC23CC[NH2+]CC3)cc1 ZINC000435427392 943407331 /nfs/dbraw/zinc/40/73/31/943407331.db2.gz LQWSZFQOWGIAKT-SFHVURJKSA-N 1 1 357.479 3.801 20 5 FHBDMO C[N@H+]1CCC[C@@H]2CN(Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)CC[C@H]21 ZINC000549470553 943579871 /nfs/dbraw/zinc/57/98/71/943579871.db2.gz AAIQPXGRUGGXCN-MLGOLLRUSA-N 1 1 357.376 3.530 20 5 FHBDMO CCC[N@@H+](C)C[C@@H]1CCN(Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425428828 943901403 /nfs/dbraw/zinc/90/14/03/943901403.db2.gz YCVOZBOQNIACOV-ZDUSSCGKSA-N 1 1 370.291 3.521 20 5 FHBDMO Cc1ccc(NC(=O)N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000504912943 943909591 /nfs/dbraw/zinc/90/95/91/943909591.db2.gz ABZCELBBFXOUGX-SFHVURJKSA-N 1 1 368.437 3.689 20 5 FHBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2cc(OC)ccc2OC)cc1[N+](=O)[O-] ZINC000504928772 943925845 /nfs/dbraw/zinc/92/58/45/943925845.db2.gz DJSUINBRFWNADZ-CYBMUJFWSA-N 1 1 360.410 3.862 20 5 FHBDMO O=C(NC[C@H]1CCC[N@H+]1C1CCCCC1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000436227215 944116720 /nfs/dbraw/zinc/11/67/20/944116720.db2.gz KRXQMISMJHRQNC-MRXNPFEDSA-N 1 1 370.453 3.603 20 5 FHBDMO C[C@@]1(c2ccccc2)CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000500172364 944210893 /nfs/dbraw/zinc/21/08/93/944210893.db2.gz MRVYCPQHKYZAPE-OAQYLSRUSA-N 1 1 367.449 3.977 20 5 FHBDMO O=[N+]([O-])c1cnc(N2CC[C@@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)c(F)c1 ZINC000518336047 944283355 /nfs/dbraw/zinc/28/33/55/944283355.db2.gz OZHKIBZPKFHQFI-VQIMIIECSA-N 1 1 370.428 3.620 20 5 FHBDMO COc1cc(C[NH+]2CCC(OCc3ccccc3)CC2)c([N+](=O)[O-])cc1F ZINC000184224164 944286619 /nfs/dbraw/zinc/28/66/19/944286619.db2.gz JJYDUBLZRAMNOZ-UHFFFAOYSA-N 1 1 374.412 3.924 20 5 FHBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000506474871 944289282 /nfs/dbraw/zinc/28/92/82/944289282.db2.gz QFVABSOISYKOPI-ZWKOTPCHSA-N 1 1 361.486 3.560 20 5 FHBDMO CC[N@@H+](Cc1ccc(C(=O)Nc2ccc([N+](=O)[O-])c(C)n2)cc1)C(C)C ZINC000133867077 944312374 /nfs/dbraw/zinc/31/23/74/944312374.db2.gz DGLZUSJPNYNSON-UHFFFAOYSA-N 1 1 356.426 3.781 20 5 FHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CCCCCOc3ccccc3)C2)nc1 ZINC000438099678 944340160 /nfs/dbraw/zinc/34/01/60/944340160.db2.gz XIJZTHDGWFBGHM-KRWDZBQOSA-N 1 1 370.453 3.725 20 5 FHBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000506487098 944347549 /nfs/dbraw/zinc/34/75/49/944347549.db2.gz NLYHYLRDZRUAMQ-AWEZNQCLSA-N 1 1 365.499 3.511 20 5 FHBDMO Cc1cccc(C(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)c1[N+](=O)[O-] ZINC000140075827 944365096 /nfs/dbraw/zinc/36/50/96/944365096.db2.gz GGLNQLKCDTXGBW-HNNXBMFYSA-N 1 1 373.478 3.607 20 5 FHBDMO C[C@H]1C[C@@H](c2ccccc2)CC[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000439315547 944521383 /nfs/dbraw/zinc/52/13/83/944521383.db2.gz JKCJOVRDEKBADC-RDJZCZTQSA-N 1 1 353.422 3.801 20 5 FHBDMO C[C@H]1C[C@@H](c2ccccc2)CC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000439315547 944521392 /nfs/dbraw/zinc/52/13/92/944521392.db2.gz JKCJOVRDEKBADC-RDJZCZTQSA-N 1 1 353.422 3.801 20 5 FHBDMO CC[N@H+]1CCC[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)C1 ZINC000543578745 944534698 /nfs/dbraw/zinc/53/46/98/944534698.db2.gz XMNQFZCGKIBDFH-CQSZACIVSA-N 1 1 365.499 3.557 20 5 FHBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@](C)(c2ccccc2)C1 ZINC000438505738 944681159 /nfs/dbraw/zinc/68/11/59/944681159.db2.gz OBMQKUJMSDZWIU-MGPUTAFESA-N 1 1 353.422 3.585 20 5 FHBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@](C)(c2ccccc2)C1 ZINC000438505738 944681166 /nfs/dbraw/zinc/68/11/66/944681166.db2.gz OBMQKUJMSDZWIU-MGPUTAFESA-N 1 1 353.422 3.585 20 5 FHBDMO CC(C)[C@@H](c1ccccc1)[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000543203017 944873603 /nfs/dbraw/zinc/87/36/03/944873603.db2.gz OCADXFHZQOXSTQ-PXNSSMCTSA-N 1 1 358.438 3.664 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C[C@H](C)c1ccccc1)[C@@H](C)CO ZINC000566814359 944902399 /nfs/dbraw/zinc/90/23/99/944902399.db2.gz IUHJFGMGCJREIC-HOTGVXAUSA-N 1 1 358.438 3.590 20 5 FHBDMO COc1ccc(-c2ccc(C[N@@H+](C)CCCn3ccnc3)o2)c([N+](=O)[O-])c1 ZINC000516514555 944964525 /nfs/dbraw/zinc/96/45/25/944964525.db2.gz YRUKQDPIVPFJQV-UHFFFAOYSA-N 1 1 370.409 3.582 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+](CCO)C3CCC3)o2)c(Cl)c1 ZINC000439787979 944993281 /nfs/dbraw/zinc/99/32/81/944993281.db2.gz GLPAAOVIDAKSTG-UHFFFAOYSA-N 1 1 350.802 3.855 20 5 FHBDMO Cc1ccccc1[C@@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000507184186 945015015 /nfs/dbraw/zinc/01/50/15/945015015.db2.gz TUNIGVBABPUJAA-MRXNPFEDSA-N 1 1 364.405 3.943 20 5 FHBDMO CCC[N@@H+](Cc1cc(OC)c(OCC(F)(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000507225788 945057404 /nfs/dbraw/zinc/05/74/04/945057404.db2.gz FGGROPYYWWRBRY-UHFFFAOYSA-N 1 1 362.348 3.919 20 5 FHBDMO CC[C@@H](C)[N@H+](Cc1ccccc1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000507665158 945415525 /nfs/dbraw/zinc/41/55/25/945415525.db2.gz REHMUCVSCFSVQW-VQIMIIECSA-N 1 1 358.438 3.635 20 5 FHBDMO C[C@@H]1C[C@@H](c2ccccc2F)[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000544150605 945491931 /nfs/dbraw/zinc/49/19/31/945491931.db2.gz OMNWLJOAIPOXOK-CLCXKQKWSA-N 1 1 374.412 3.557 20 5 FHBDMO C[C@@]1(O)CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000129400387 945531637 /nfs/dbraw/zinc/53/16/37/945531637.db2.gz DJBHPTRGAAFJCL-QGZVFWFLSA-N 1 1 350.802 3.855 20 5 FHBDMO Cc1cc(N2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549524979 945605118 /nfs/dbraw/zinc/60/51/18/945605118.db2.gz OYFYHCVGWNQEHN-GXTWGEPZSA-N 1 1 357.376 3.843 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@]2(C1)OCc1ccccc12 ZINC000186438512 945917441 /nfs/dbraw/zinc/91/74/41/945917441.db2.gz OHHBQDQIIKMFOV-FQEVSTJZSA-N 1 1 354.406 3.625 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@]2(C1)OCc1ccccc12 ZINC000186438512 945917446 /nfs/dbraw/zinc/91/74/46/945917446.db2.gz OHHBQDQIIKMFOV-FQEVSTJZSA-N 1 1 354.406 3.625 20 5 FHBDMO CSc1cccc(C(=O)NCCC[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000186009702 946089536 /nfs/dbraw/zinc/08/95/36/946089536.db2.gz CRMXQNVDZVSWJR-UHFFFAOYSA-N 1 1 373.478 3.569 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@@H](c4cc[nH]n4)C3)o2)c1 ZINC000121240096 946102471 /nfs/dbraw/zinc/10/24/71/946102471.db2.gz PPTRQCPRLZYJEV-OAHLLOKOSA-N 1 1 352.394 3.958 20 5 FHBDMO Cc1ccc([C@@H]2CCC[C@@H]2[N@@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1 ZINC000444236960 946109703 /nfs/dbraw/zinc/10/97/03/946109703.db2.gz IYDICLCDPQRDSE-OALUTQOASA-N 1 1 367.449 3.770 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@](C)(c2ccccc2)C1 ZINC000438490623 946304823 /nfs/dbraw/zinc/30/48/23/946304823.db2.gz LBRIZIWQKLYCNL-HXUWFJFHSA-N 1 1 353.422 3.505 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@](C)(c2ccccc2)C1 ZINC000438490623 946304835 /nfs/dbraw/zinc/30/48/35/946304835.db2.gz LBRIZIWQKLYCNL-HXUWFJFHSA-N 1 1 353.422 3.505 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCC[C@H]([C@@H]4CCOC4)C3)o2)c1 ZINC000441209223 946317995 /nfs/dbraw/zinc/31/79/95/946317995.db2.gz ZCCIPBKEQKZZEA-DLBZAZTESA-N 1 1 371.437 3.541 20 5 FHBDMO COc1ccc(-c2ccc(CN[C@@H]3C[C@@H](C)[N@@H+](C4CC4)C3)o2)c([N+](=O)[O-])c1 ZINC000237425494 946455538 /nfs/dbraw/zinc/45/55/38/946455538.db2.gz MUEVCUFEIXJUBX-ZIAGYGMSSA-N 1 1 371.437 3.578 20 5 FHBDMO COc1ccc(-c2ccc(CN[C@@H]3C[C@@H](C)[N@H+](C4CC4)C3)o2)c([N+](=O)[O-])c1 ZINC000237425494 946455544 /nfs/dbraw/zinc/45/55/44/946455544.db2.gz MUEVCUFEIXJUBX-ZIAGYGMSSA-N 1 1 371.437 3.578 20 5 FHBDMO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000441344594 946492709 /nfs/dbraw/zinc/49/27/09/946492709.db2.gz IWMLTNZXGFFXHP-DJKXOVBDSA-N 1 1 374.412 3.557 20 5 FHBDMO Cc1c(NC(=O)NC[C@H](C)[N@@H+](C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000111707236 946515404 /nfs/dbraw/zinc/51/54/04/946515404.db2.gz PNYUTUKRYMXARM-AWEZNQCLSA-N 1 1 356.426 3.545 20 5 FHBDMO Cc1cc(N2CC[C@@]3(C2)CCC[N@H+](C)C3)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549576866 946826784 /nfs/dbraw/zinc/82/67/84/946826784.db2.gz FLWKFCCSRTXPCR-INIZCTEOSA-N 1 1 357.376 3.844 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@H]3c3ccccc3)n2)c1 ZINC000025934870 946905573 /nfs/dbraw/zinc/90/55/73/946905573.db2.gz VFQHSSKNJBFQCT-KRWDZBQOSA-N 1 1 350.378 3.982 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@H]3c3ccccc3)n2)c1 ZINC000025934870 946905581 /nfs/dbraw/zinc/90/55/81/946905581.db2.gz VFQHSSKNJBFQCT-KRWDZBQOSA-N 1 1 350.378 3.982 20 5 FHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3ccc(C(F)(F)F)cc3)C2)nc1 ZINC000112629324 946911557 /nfs/dbraw/zinc/91/15/57/946911557.db2.gz XZBSHSWVDJYMLC-AWEZNQCLSA-N 1 1 366.343 3.695 20 5 FHBDMO CCc1ccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000026191005 946914171 /nfs/dbraw/zinc/91/41/71/946914171.db2.gz SLRXAIBNKXCHEB-HNNXBMFYSA-N 1 1 355.438 3.925 20 5 FHBDMO COc1cccc(NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)c1[N+](=O)[O-] ZINC000475356033 946937109 /nfs/dbraw/zinc/93/71/09/946937109.db2.gz XSMKJMASMOSHQH-CQSZACIVSA-N 1 1 361.467 3.989 20 5 FHBDMO CCC[N@@H+](Cc1c([N+](=O)[O-])ncn1C)[C@@H]1C[C@H](OCC)C12CCCCC2 ZINC000475356206 946937399 /nfs/dbraw/zinc/93/73/99/946937399.db2.gz SEDSLKGWPGXTKI-SJORKVTESA-N 1 1 364.490 3.668 20 5 FHBDMO COc1ccccc1C[C@@H](C)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444646188 947068439 /nfs/dbraw/zinc/06/84/39/947068439.db2.gz AWVCVCRYKZQICB-CYBMUJFWSA-N 1 1 354.410 3.543 20 5 FHBDMO Cc1cc(C)cc(C[N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000444695649 947121278 /nfs/dbraw/zinc/12/12/78/947121278.db2.gz SQARZXQKKKCMOH-UHFFFAOYSA-N 1 1 361.829 3.936 20 5 FHBDMO Cc1cc(C)cc(C[N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000444695649 947121285 /nfs/dbraw/zinc/12/12/85/947121285.db2.gz SQARZXQKKKCMOH-UHFFFAOYSA-N 1 1 361.829 3.936 20 5 FHBDMO C[C@H](CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1ccccc1 ZINC000523486510 947304347 /nfs/dbraw/zinc/30/43/47/947304347.db2.gz UEKAIPFKXXKFNR-MRXNPFEDSA-N 1 1 369.465 3.509 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCC[N@H+](C2CCCC2)CC1 ZINC000184481960 947402205 /nfs/dbraw/zinc/40/22/05/947402205.db2.gz CPPMSLKFCKMTKQ-UHFFFAOYSA-N 1 1 360.458 3.694 20 5 FHBDMO C[C@@H]1C[C@H](NC(=O)c2ccc(F)cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000150781124 947533202 /nfs/dbraw/zinc/53/32/02/947533202.db2.gz ZVILIDPPHKKONY-RHSMWYFYSA-N 1 1 371.412 3.517 20 5 FHBDMO O=C1[C@@H]([N@@H+]2CCC[C@@H]2c2ccsc2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000067377191 947548820 /nfs/dbraw/zinc/54/88/20/947548820.db2.gz IFKCNGGIWUXQIZ-SJORKVTESA-N 1 1 357.435 3.599 20 5 FHBDMO O=C1[C@@H]([N@H+]2CCC[C@@H]2c2ccsc2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000067377191 947548826 /nfs/dbraw/zinc/54/88/26/947548826.db2.gz IFKCNGGIWUXQIZ-SJORKVTESA-N 1 1 357.435 3.599 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCCCC[N@@H+]1CCCC[C@H]1C ZINC000093971240 947622388 /nfs/dbraw/zinc/62/23/88/947622388.db2.gz WLBYVANYVMJJKN-MRXNPFEDSA-N 1 1 361.486 3.904 20 5 FHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000278870498 947899308 /nfs/dbraw/zinc/89/93/08/947899308.db2.gz SOFUDTVCHFJJDT-GHMZBOCLSA-N 1 1 370.331 3.980 20 5 FHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000278870498 947899317 /nfs/dbraw/zinc/89/93/17/947899317.db2.gz SOFUDTVCHFJJDT-GHMZBOCLSA-N 1 1 370.331 3.980 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@@H+](CCO)CC2CC2)ccc1Oc1ccc(F)cc1 ZINC000512037820 948262075 /nfs/dbraw/zinc/26/20/75/948262075.db2.gz IFSHHVCIIKNPNL-UHFFFAOYSA-N 1 1 360.385 3.731 20 5 FHBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3C[N@H+]2Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000574796815 948518034 /nfs/dbraw/zinc/51/80/34/948518034.db2.gz LVWLHNIMHIGAJJ-WIHIRCLASA-N 1 1 371.462 3.574 20 5 FHBDMO C[N@@H+](CCc1ccc(F)cc1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728899291 948712243 /nfs/dbraw/zinc/71/22/43/948712243.db2.gz QTOPIZUCNARCHU-UHFFFAOYSA-N 1 1 354.385 3.729 20 5 FHBDMO CN(C)CC[C@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C(C)(C)C ZINC000126019675 948715381 /nfs/dbraw/zinc/71/53/81/948715381.db2.gz HYJPAKHNOXYRPJ-IBGZPJMESA-N 1 1 362.518 3.520 20 5 FHBDMO Cc1ccc(NC(=O)[C@H]2CCC[N@@H+](Cc3cccc(F)c3)C2)cc1[N+](=O)[O-] ZINC000072035425 221398042 /nfs/dbraw/zinc/39/80/42/221398042.db2.gz OINVLCLGDJKHMH-INIZCTEOSA-N 1 1 371.412 3.893 20 5 FHBDMO CC[C@](C)([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1nc(C)cs1 ZINC000072863051 567840822 /nfs/dbraw/zinc/84/08/22/567840822.db2.gz GKFMDGHFNYNRBA-KRWDZBQOSA-N 1 1 362.455 3.522 20 5 FHBDMO COc1ccc(C[N@@H+](Cc2cccs2)C[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000051429688 567879004 /nfs/dbraw/zinc/87/90/04/567879004.db2.gz ZTKXMZHFEFJQIK-OAHLLOKOSA-N 1 1 362.451 3.846 20 5 FHBDMO COc1ccc(C[N@H+](Cc2cccs2)C[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000051429688 567879005 /nfs/dbraw/zinc/87/90/05/567879005.db2.gz ZTKXMZHFEFJQIK-OAHLLOKOSA-N 1 1 362.451 3.846 20 5 FHBDMO COCC[C@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1ccc(Cl)c(Cl)c1 ZINC000568304860 568049401 /nfs/dbraw/zinc/04/94/01/568049401.db2.gz AMRJAMNNNWZEAK-ZDUSSCGKSA-N 1 1 373.240 3.503 20 5 FHBDMO Cc1sc(C(=O)N2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)cc1[N+](=O)[O-] ZINC000265004318 568060361 /nfs/dbraw/zinc/06/03/61/568060361.db2.gz FGYPQLXIQWPJTK-DZGCQCFKSA-N 1 1 365.499 3.691 20 5 FHBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1SCC ZINC000568575649 568061389 /nfs/dbraw/zinc/06/13/89/568061389.db2.gz ZBHKDGXYJSTXMR-CYBMUJFWSA-N 1 1 353.488 3.557 20 5 FHBDMO C[C@@H]1CCC[N@@H+](Cc2ccccc2CNC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000481766064 568119642 /nfs/dbraw/zinc/11/96/42/568119642.db2.gz AEOJBYLEOJAUOE-MRXNPFEDSA-N 1 1 367.449 3.757 20 5 FHBDMO Cc1cnc(N2CC[C@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000481995498 568221672 /nfs/dbraw/zinc/22/16/72/568221672.db2.gz YKIWXKAQSRLQMO-MOPGFXCFSA-N 1 1 366.465 3.789 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)nc(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c1 ZINC001164626992 719053865 /nfs/dbraw/zinc/05/38/65/719053865.db2.gz SZWHGGICOOKZAJ-DOTOQJQBSA-N 1 1 372.856 3.744 20 5 FHBDMO CCOc1cccc(N2CC[C@H]([N@@H+](C)Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000613045315 936363941 /nfs/dbraw/zinc/36/39/41/936363941.db2.gz SLKXHKVARMNSLX-KRWDZBQOSA-N 1 1 355.438 3.704 20 5 FHBDMO Cc1cc(C[NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)nc(N2CCCC2)n1 ZINC000430143332 927235658 /nfs/dbraw/zinc/23/56/58/927235658.db2.gz XHBVZYHYDVBEDP-UHFFFAOYSA-N 1 1 369.469 3.707 20 5 FHBDMO C/C(=C/C(=O)OC[C@H]1CCC[N@H+]1Cc1ccco1)c1ccc([N+](=O)[O-])cc1 ZINC000784900961 927239845 /nfs/dbraw/zinc/23/98/45/927239845.db2.gz DSUFEFWXCQQNPD-WTQUMQLASA-N 1 1 370.405 3.799 20 5 FHBDMO COc1cc(N2CCC[C@@H](C[N@H+]3CCCC[C@H]3C)C2)c([N+](=O)[O-])cc1F ZINC000302026285 927278128 /nfs/dbraw/zinc/27/81/28/927278128.db2.gz GYDLGYKRHOZZRJ-CABCVRRESA-N 1 1 365.449 3.833 20 5 FHBDMO Cc1c(NC(=O)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000044790290 927421707 /nfs/dbraw/zinc/42/17/07/927421707.db2.gz CLOIWNFHKHEGJI-KRWDZBQOSA-N 1 1 353.422 3.754 20 5 FHBDMO CC[N@H+]1CCC[C@@H]1CN(Cc1csc([N+](=O)[O-])c1)Cc1ccncc1 ZINC000583170477 937205681 /nfs/dbraw/zinc/20/56/81/937205681.db2.gz ACZKCCMXDFKFJE-QGZVFWFLSA-N 1 1 360.483 3.538 20 5 FHBDMO C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC000064801070 927911947 /nfs/dbraw/zinc/91/19/47/927911947.db2.gz KYAZXLSLXMUYBK-OKILXGFUSA-N 1 1 372.469 3.562 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000120298377 928019127 /nfs/dbraw/zinc/01/91/27/928019127.db2.gz KKKRIBQYQCGVLS-HOTGVXAUSA-N 1 1 374.485 3.986 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](Cc1ccccc1)[C@@H](CO)C(C)C ZINC000430209500 928087631 /nfs/dbraw/zinc/08/76/31/928087631.db2.gz RHBFUFQBXLIBRM-IBGZPJMESA-N 1 1 358.438 3.623 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H](C(=O)c2ccc(F)cc2)C1 ZINC000430215038 928203883 /nfs/dbraw/zinc/20/38/83/928203883.db2.gz CUOXSDFPGBDXDN-MRXNPFEDSA-N 1 1 372.396 3.837 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](C(=O)c2ccc(F)cc2)C1 ZINC000430215038 928203894 /nfs/dbraw/zinc/20/38/94/928203894.db2.gz CUOXSDFPGBDXDN-MRXNPFEDSA-N 1 1 372.396 3.837 20 5 FHBDMO COc1cc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc(OC)c1OC ZINC000126978438 928361754 /nfs/dbraw/zinc/36/17/54/928361754.db2.gz PNBVGHIWGVHNOV-UHFFFAOYSA-N 1 1 372.421 3.785 20 5 FHBDMO COc1cc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc(OC)c1OC ZINC000126978438 928361767 /nfs/dbraw/zinc/36/17/67/928361767.db2.gz PNBVGHIWGVHNOV-UHFFFAOYSA-N 1 1 372.421 3.785 20 5 FHBDMO CC(C)(C)[N@H+]1CCCN(Cn2c3cc([N+](=O)[O-])ccc3oc2=S)CC1 ZINC000748081732 928564517 /nfs/dbraw/zinc/56/45/17/928564517.db2.gz CMADVRQQPWKKQW-UHFFFAOYSA-N 1 1 364.471 3.636 20 5 FHBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCCCC[N@@H+]1CCCC[C@H]1C ZINC000445196539 929024073 /nfs/dbraw/zinc/02/40/73/929024073.db2.gz WQSPNVIDMQLJGC-CQSZACIVSA-N 1 1 367.877 3.941 20 5 FHBDMO COc1ccc(C[N@H+]2CCC[C@@H]2C[C@H](O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000134794330 929276685 /nfs/dbraw/zinc/27/66/85/929276685.db2.gz QDKUIFOMHVCKBW-MJGOQNOKSA-N 1 1 374.412 3.831 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@H](C(=O)N(C)c2ccccc2)C1 ZINC000430301021 929545869 /nfs/dbraw/zinc/54/58/69/929545869.db2.gz PNOPZOWHSMIXRL-SJORKVTESA-N 1 1 367.449 3.949 20 5 FHBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000610296825 929714428 /nfs/dbraw/zinc/71/44/28/929714428.db2.gz KXTKAZUOTAMNPR-INIZCTEOSA-N 1 1 373.840 3.595 20 5 FHBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275678585 929849795 /nfs/dbraw/zinc/84/97/95/929849795.db2.gz BTYXXPYWCKLNBV-XOBRGWDASA-N 1 1 363.461 3.506 20 5 FHBDMO Cc1c(C[N@H+]2CCC[C@@H](C(=O)Nc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000052314987 937389292 /nfs/dbraw/zinc/38/92/92/937389292.db2.gz WEXZUPQAEISUCY-QGZVFWFLSA-N 1 1 353.422 3.754 20 5 FHBDMO O=C(C[N@H+]1CCC[C@@H]1C1CC1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000610390813 930304526 /nfs/dbraw/zinc/30/45/26/930304526.db2.gz FRPAXEIHTCCEFE-MRXNPFEDSA-N 1 1 372.450 3.531 20 5 FHBDMO Cc1nn(C)c(NCc2ccccc2C[N@@H+]2C[C@H](C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000052331314 937417267 /nfs/dbraw/zinc/41/72/67/937417267.db2.gz BPMXXRYZVCCLFJ-GASCZTMLSA-N 1 1 371.485 3.727 20 5 FHBDMO CC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@@H](C)Cc1ccc(OC)cc1 ZINC001167387462 930593073 /nfs/dbraw/zinc/59/30/73/930593073.db2.gz SQZAZPHMGGHBGT-INIZCTEOSA-N 1 1 358.438 3.935 20 5 FHBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C[C@H]1C ZINC000610125577 930719661 /nfs/dbraw/zinc/71/96/61/930719661.db2.gz GUFZQKMUUIENTB-ZBFHGGJFSA-N 1 1 361.486 3.837 20 5 FHBDMO Cc1c(Cl)cccc1NC(=O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000580537146 930819433 /nfs/dbraw/zinc/81/94/33/930819433.db2.gz XPHPVPSXHJTBDG-UHFFFAOYSA-N 1 1 361.829 3.670 20 5 FHBDMO Cc1c(Cl)cccc1NC(=O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000580537146 930819439 /nfs/dbraw/zinc/81/94/39/930819439.db2.gz XPHPVPSXHJTBDG-UHFFFAOYSA-N 1 1 361.829 3.670 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCS[C@H]4COCC[C@H]43)o2)cc1 ZINC000247289386 931087975 /nfs/dbraw/zinc/08/79/75/931087975.db2.gz ZASZDWAABGYXCU-AEFFLSMTSA-N 1 1 360.435 3.561 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CCC=C(c4cccnc4)C3)co2)cc1 ZINC000580980686 931442019 /nfs/dbraw/zinc/44/20/19/931442019.db2.gz VUSZIPBEMRBSSK-UHFFFAOYSA-N 1 1 362.389 3.934 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC=C(c4cccnc4)C3)co2)cc1 ZINC000580980686 931442022 /nfs/dbraw/zinc/44/20/22/931442022.db2.gz VUSZIPBEMRBSSK-UHFFFAOYSA-N 1 1 362.389 3.934 20 5 FHBDMO CN(C(=O)CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1)c1ccccc1 ZINC000135166061 932018873 /nfs/dbraw/zinc/01/88/73/932018873.db2.gz IGHVACSEWFXALJ-UHFFFAOYSA-N 1 1 353.422 3.612 20 5 FHBDMO COCC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@H](C)c1ccccc1 ZINC000610581527 932073274 /nfs/dbraw/zinc/07/32/74/932073274.db2.gz PDTCYVNIFJTDPV-CQSZACIVSA-N 1 1 355.394 3.946 20 5 FHBDMO COCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@H](C)c1ccccc1 ZINC000610581527 932073279 /nfs/dbraw/zinc/07/32/79/932073279.db2.gz PDTCYVNIFJTDPV-CQSZACIVSA-N 1 1 355.394 3.946 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@@H](C)Cc1ccc(O)cc1 ZINC000119381665 932158974 /nfs/dbraw/zinc/15/89/74/932158974.db2.gz WHGZFFKUNHIOTF-HNNXBMFYSA-N 1 1 371.437 3.500 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@H](C)Cc1ccc(O)cc1 ZINC000119381818 932159079 /nfs/dbraw/zinc/15/90/79/932159079.db2.gz WHGZFFKUNHIOTF-OAHLLOKOSA-N 1 1 371.437 3.500 20 5 FHBDMO COc1ccc(NC(=O)CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000178076082 932313623 /nfs/dbraw/zinc/31/36/23/932313623.db2.gz MQGGUFUIYLDVMT-UHFFFAOYSA-N 1 1 369.421 3.597 20 5 FHBDMO C[C@H]1C[C@H](NC(=O)OC(C)(C)C)CC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000134661766 932837630 /nfs/dbraw/zinc/83/76/30/932837630.db2.gz HOIXBUXLJMBWCL-GOEBONIOSA-N 1 1 363.458 3.515 20 5 FHBDMO CCN1C[C@H](C[N@@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)Oc2ccccc21 ZINC000610556991 932969558 /nfs/dbraw/zinc/96/95/58/932969558.db2.gz HXTQDEFXIJGSLB-QAPCUYQASA-N 1 1 355.438 3.875 20 5 FHBDMO CC(C)[C@@H]1CCC[N@@H+]1Cc1cc(I)cc([N+](=O)[O-])c1 ZINC001167490541 933075951 /nfs/dbraw/zinc/07/59/51/933075951.db2.gz CZRYHBHEVXWOIU-AWEZNQCLSA-N 1 1 374.222 3.820 20 5 FHBDMO CC(C)[C@@H]1CCC[N@H+]1Cc1cc(I)cc([N+](=O)[O-])c1 ZINC001167490541 933075955 /nfs/dbraw/zinc/07/59/55/933075955.db2.gz CZRYHBHEVXWOIU-AWEZNQCLSA-N 1 1 374.222 3.820 20 5 FHBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CC[N@H+](C)[C@H]1c1ccccc1 ZINC000588447232 933175197 /nfs/dbraw/zinc/17/51/97/933175197.db2.gz WNNWBJQSXCLXKA-YLRLEHAUSA-N 1 1 365.433 3.560 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@H](c4ncc[nH]4)C3)o2)c1 ZINC000510534512 933194477 /nfs/dbraw/zinc/19/44/77/933194477.db2.gz QPSMSYDDKFCADQ-HNNXBMFYSA-N 1 1 352.394 3.958 20 5 FHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@H](C)O[C@]2(CCO[C@@H](C)C2)C1 ZINC000430780866 933233371 /nfs/dbraw/zinc/23/33/71/933233371.db2.gz PPTJTRAFSDEPFE-XHUQVCHSSA-N 1 1 360.454 3.657 20 5 FHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1C[C@H](C)O[C@]2(CCO[C@@H](C)C2)C1 ZINC000430780866 933233377 /nfs/dbraw/zinc/23/33/77/933233377.db2.gz PPTJTRAFSDEPFE-XHUQVCHSSA-N 1 1 360.454 3.657 20 5 FHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@H](C)O[C@]2(CCO[C@@H](C)C2)C1 ZINC000430780864 933233624 /nfs/dbraw/zinc/23/36/24/933233624.db2.gz PPTJTRAFSDEPFE-MKSDAICUSA-N 1 1 360.454 3.657 20 5 FHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1C[C@H](C)O[C@]2(CCO[C@@H](C)C2)C1 ZINC000430780864 933233627 /nfs/dbraw/zinc/23/36/27/933233627.db2.gz PPTJTRAFSDEPFE-MKSDAICUSA-N 1 1 360.454 3.657 20 5 FHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000610581383 933319566 /nfs/dbraw/zinc/31/95/66/933319566.db2.gz NLFRLRPULJWYBJ-IJEWVQPXSA-N 1 1 358.442 3.573 20 5 FHBDMO COC(=O)c1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1F ZINC000089117117 933411854 /nfs/dbraw/zinc/41/18/54/933411854.db2.gz USJAZWBHTKGDGX-UHFFFAOYSA-N 1 1 360.385 3.931 20 5 FHBDMO CCc1ccc(C(=O)N2CC[N@H+](Cc3ccccc3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000471910753 933675285 /nfs/dbraw/zinc/67/52/85/933675285.db2.gz JGWWPLDKUGNONZ-INIZCTEOSA-N 1 1 367.449 3.504 20 5 FHBDMO CCc1ccc(C(=O)N2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000471910753 933675287 /nfs/dbraw/zinc/67/52/87/933675287.db2.gz JGWWPLDKUGNONZ-INIZCTEOSA-N 1 1 367.449 3.504 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1C[N@H+](C(C)(C)C)C[C@H]1C(F)(F)F ZINC000431250846 934250916 /nfs/dbraw/zinc/25/09/16/934250916.db2.gz YRQUJLVLMFHTPQ-CHWSQXEVSA-N 1 1 373.375 3.751 20 5 FHBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC[C@@H]1CCC[N@@H+](C)C1 ZINC000458209704 934380205 /nfs/dbraw/zinc/38/02/05/934380205.db2.gz KOUJZUNXKRHTRY-AWEZNQCLSA-N 1 1 365.499 3.559 20 5 FHBDMO Cc1ccc(C[N@@H+](C)Cc2cc(Br)cn2C)cc1[N+](=O)[O-] ZINC000091961486 934810012 /nfs/dbraw/zinc/81/00/12/934810012.db2.gz JXOAWBOOXUEGIF-UHFFFAOYSA-N 1 1 352.232 3.636 20 5 FHBDMO Cc1ccc(C[N@H+](C)Cc2cc(Br)cn2C)cc1[N+](=O)[O-] ZINC000091961486 934810014 /nfs/dbraw/zinc/81/00/14/934810014.db2.gz JXOAWBOOXUEGIF-UHFFFAOYSA-N 1 1 352.232 3.636 20 5 FHBDMO COc1ccc(C[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C2CC2)cc1 ZINC000611253022 934816370 /nfs/dbraw/zinc/81/63/70/934816370.db2.gz ZEPAMTXLQZYUHS-UHFFFAOYSA-N 1 1 370.405 3.539 20 5 FHBDMO COc1ccc(C[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C2CC2)cc1 ZINC000611253022 934816375 /nfs/dbraw/zinc/81/63/75/934816375.db2.gz ZEPAMTXLQZYUHS-UHFFFAOYSA-N 1 1 370.405 3.539 20 5 FHBDMO Cn1ccnc1[C@@H]([NH2+]CC(C)(C)[C@@H]1CCCCO1)c1cccc([N+](=O)[O-])c1 ZINC000611560717 934852293 /nfs/dbraw/zinc/85/22/93/934852293.db2.gz BMFAJZSPEPSWSK-ROUUACIJSA-N 1 1 372.469 3.603 20 5 FHBDMO Cc1noc([C@@H]2CCC[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C2)n1 ZINC000091832681 934861535 /nfs/dbraw/zinc/86/15/35/934861535.db2.gz BXPZTDXOJHIPLZ-CQSZACIVSA-N 1 1 368.393 3.926 20 5 FHBDMO CCO[C@H]1C[C@H]([N@@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1(C)C ZINC000538716966 934897335 /nfs/dbraw/zinc/89/73/35/934897335.db2.gz SDDFNXZNGWDGAP-ROUUACIJSA-N 1 1 372.469 3.631 20 5 FHBDMO CCC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CC(=O)Nc1ccccc1C ZINC000071950424 935069106 /nfs/dbraw/zinc/06/91/06/935069106.db2.gz BRQGTHAYFBPWRR-UHFFFAOYSA-N 1 1 371.437 3.633 20 5 FHBDMO Cc1ccc(NC(=O)[C@H](C)[N@H+](C)CCc2ccccc2[N+](=O)[O-])c(F)c1 ZINC000511059844 935178120 /nfs/dbraw/zinc/17/81/20/935178120.db2.gz OWPKOPFNNFPVEP-AWEZNQCLSA-N 1 1 359.401 3.544 20 5 FHBDMO Cc1ccc(NC(=O)[C@H](C)[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c(F)c1 ZINC000511059844 935178123 /nfs/dbraw/zinc/17/81/23/935178123.db2.gz OWPKOPFNNFPVEP-AWEZNQCLSA-N 1 1 359.401 3.544 20 5 FHBDMO C[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[S@@]1=O ZINC000277445654 935184301 /nfs/dbraw/zinc/18/43/01/935184301.db2.gz JPJVZOKIGICMLC-RZFZLAGVSA-N 1 1 364.492 3.666 20 5 FHBDMO C[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[S@@]1=O ZINC000277445654 935184303 /nfs/dbraw/zinc/18/43/03/935184303.db2.gz JPJVZOKIGICMLC-RZFZLAGVSA-N 1 1 364.492 3.666 20 5 FHBDMO Cc1ccc(F)cc1NC(=O)[C@H](C)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511073383 935256403 /nfs/dbraw/zinc/25/64/03/935256403.db2.gz OWLPWCWGMNQPIO-AWEZNQCLSA-N 1 1 359.401 3.544 20 5 FHBDMO Cc1ccc(F)cc1NC(=O)[C@H](C)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511073383 935256408 /nfs/dbraw/zinc/25/64/08/935256408.db2.gz OWLPWCWGMNQPIO-AWEZNQCLSA-N 1 1 359.401 3.544 20 5 FHBDMO C[C@H](C(=O)Nc1cccc(Cl)c1)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511074877 935263955 /nfs/dbraw/zinc/26/39/55/935263955.db2.gz WUWYRTBTIYXKDJ-CYBMUJFWSA-N 1 1 361.829 3.750 20 5 FHBDMO C[C@H](C(=O)Nc1cccc(Cl)c1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511074877 935263959 /nfs/dbraw/zinc/26/39/59/935263959.db2.gz WUWYRTBTIYXKDJ-CYBMUJFWSA-N 1 1 361.829 3.750 20 5 FHBDMO COc1ccc(-c2cnc(C[N@H+](C)CCc3ccccc3[N+](=O)[O-])o2)cc1 ZINC000511076920 935281004 /nfs/dbraw/zinc/28/10/04/935281004.db2.gz ZYTRITFFGLSEIC-UHFFFAOYSA-N 1 1 367.405 3.933 20 5 FHBDMO COc1ccc(-c2cnc(C[N@@H+](C)CCc3ccccc3[N+](=O)[O-])o2)cc1 ZINC000511076920 935281010 /nfs/dbraw/zinc/28/10/10/935281010.db2.gz ZYTRITFFGLSEIC-UHFFFAOYSA-N 1 1 367.405 3.933 20 5 FHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1nnc(-c2cccc(Cl)c2)o1 ZINC000511089927 935374480 /nfs/dbraw/zinc/37/44/80/935374480.db2.gz HOYZFAFIMPAVIK-UHFFFAOYSA-N 1 1 372.812 3.973 20 5 FHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1nnc(-c2cccc(Cl)c2)o1 ZINC000511089927 935374484 /nfs/dbraw/zinc/37/44/84/935374484.db2.gz HOYZFAFIMPAVIK-UHFFFAOYSA-N 1 1 372.812 3.973 20 5 FHBDMO CC(C)C1CCC([NH+]2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)CC1 ZINC000513183491 935375748 /nfs/dbraw/zinc/37/57/48/935375748.db2.gz LCOUBGKSSSDVOU-UHFFFAOYSA-N 1 1 365.499 3.629 20 5 FHBDMO COC(=O)COc1ccc(C[N@@H+](C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000187743470 935630356 /nfs/dbraw/zinc/63/03/56/935630356.db2.gz OBUUBPYMKMNTPL-HNNXBMFYSA-N 1 1 372.421 3.648 20 5 FHBDMO Cc1cc(-n2ccnc2)ccc1C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511118644 935665423 /nfs/dbraw/zinc/66/54/23/935665423.db2.gz BBUWVRSQWZLREK-UHFFFAOYSA-N 1 1 350.422 3.763 20 5 FHBDMO CC(C)[C@H](NC(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000511138584 935772265 /nfs/dbraw/zinc/77/22/65/935772265.db2.gz OEPQUGMLWUPUFC-NRFANRHFSA-N 1 1 369.465 3.583 20 5 FHBDMO CC(C)[C@H](NC(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000511138584 935772266 /nfs/dbraw/zinc/77/22/66/935772266.db2.gz OEPQUGMLWUPUFC-NRFANRHFSA-N 1 1 369.465 3.583 20 5 FHBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CCC[C@H]2COC)cc1OC ZINC000611668880 935891706 /nfs/dbraw/zinc/89/17/06/935891706.db2.gz UTCYMVVILXLYCA-ZBFHGGJFSA-N 1 1 366.458 3.639 20 5 FHBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CCC[C@H]2COC)cc1OC ZINC000611668880 935891709 /nfs/dbraw/zinc/89/17/09/935891709.db2.gz UTCYMVVILXLYCA-ZBFHGGJFSA-N 1 1 366.458 3.639 20 5 FHBDMO COC(=O)c1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(F)c1 ZINC000548750365 935928642 /nfs/dbraw/zinc/92/86/42/935928642.db2.gz HOAZNMQZKIZLET-UHFFFAOYSA-N 1 1 360.385 3.931 20 5 FHBDMO COC(=O)c1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(F)c1 ZINC000548750365 935928646 /nfs/dbraw/zinc/92/86/46/935928646.db2.gz HOAZNMQZKIZLET-UHFFFAOYSA-N 1 1 360.385 3.931 20 5 FHBDMO COc1ccc(C[N@H+](C)C[C@@H](C)OC)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000582693764 935952887 /nfs/dbraw/zinc/95/28/87/935952887.db2.gz WXXAGJPUEMXVGH-OAHLLOKOSA-N 1 1 374.437 3.649 20 5 FHBDMO C[C@H](Nc1ncnc2ccc([N+](=O)[O-])cc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000611713906 936075652 /nfs/dbraw/zinc/07/56/52/936075652.db2.gz LGZQLGOLEXVYSL-KBPBESRZSA-N 1 1 355.442 3.603 20 5 FHBDMO CC[C@H]1C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC[C@H]1c1ccccc1 ZINC000472262303 936140904 /nfs/dbraw/zinc/14/09/04/936140904.db2.gz URDGWTCBDNHDDW-HNAYVOBHSA-N 1 1 367.449 3.709 20 5 FHBDMO COc1ccc(-n2ccc(C[NH2+][C@@H](C)c3cccc([N+](=O)[O-])c3C)n2)cc1 ZINC000178712002 936275812 /nfs/dbraw/zinc/27/58/12/936275812.db2.gz YWIMWCTXGBOWCJ-HNNXBMFYSA-N 1 1 366.421 3.948 20 5 FHBDMO Cc1cc([NH+]2CCCCCC2)ccc1Nc1nccc(C(N)=O)c1[N+](=O)[O-] ZINC000582937433 936304040 /nfs/dbraw/zinc/30/40/40/936304040.db2.gz QZPOJBSQFWKFCG-UHFFFAOYSA-N 1 1 369.425 3.521 20 5 FHBDMO Cc1nc(C)c(C[NH2+]Cc2ccc(Br)cc2[N+](=O)[O-])s1 ZINC000312897059 945178494 /nfs/dbraw/zinc/17/84/94/945178494.db2.gz XUWAJXVBWYDYFH-UHFFFAOYSA-N 1 1 356.245 3.720 20 5 FHBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000074772977 945215431 /nfs/dbraw/zinc/21/54/31/945215431.db2.gz YVFUTDOCQOMTJH-CYBMUJFWSA-N 1 1 368.275 3.525 20 5 FHBDMO Cn1cc(C[C@@H]2CC[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C2)cn1 ZINC000093870210 938931197 /nfs/dbraw/zinc/93/11/97/938931197.db2.gz QUNNHHZTEKCZDW-HNNXBMFYSA-N 1 1 366.421 3.653 20 5 FHBDMO COc1cc(N2CCC[C@H](c3[nH+]cc4n3CCCC4)C2)c([N+](=O)[O-])cc1F ZINC000409653327 938984810 /nfs/dbraw/zinc/98/48/10/938984810.db2.gz TTZIAXUICDPULX-ZDUSSCGKSA-N 1 1 374.416 3.659 20 5 FHBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CC[C@@H](CC(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000278781133 938994679 /nfs/dbraw/zinc/99/46/79/938994679.db2.gz NOZWZAULEFEUJS-NEPJUHHUSA-N 1 1 359.348 3.505 20 5 FHBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@@H](CC(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000278781133 938994680 /nfs/dbraw/zinc/99/46/80/938994680.db2.gz NOZWZAULEFEUJS-NEPJUHHUSA-N 1 1 359.348 3.505 20 5 FHBDMO COc1c(O)ccc(C[NH2+]Cc2ccc(F)cc2CSC)c1[N+](=O)[O-] ZINC000892401594 938997120 /nfs/dbraw/zinc/99/71/20/938997120.db2.gz FIWVFLZCQSPEPD-UHFFFAOYSA-N 1 1 366.414 3.601 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(n2cc(Cl)cn2)CC1 ZINC000506022335 945224143 /nfs/dbraw/zinc/22/41/43/945224143.db2.gz LWKRPDIFRSVMMC-UHFFFAOYSA-N 1 1 364.833 3.681 20 5 FHBDMO Cc1ccc(C[N@@H+]2CC[C@H](CN(C)C(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000179449606 939164408 /nfs/dbraw/zinc/16/44/08/939164408.db2.gz WYGMFOVYSSDHFN-MRXNPFEDSA-N 1 1 363.458 3.592 20 5 FHBDMO COC[C@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@H](C)O1 ZINC000188352957 939209180 /nfs/dbraw/zinc/20/91/80/939209180.db2.gz YJGNQVCQENLLNK-UONOGXRCSA-N 1 1 362.451 3.559 20 5 FHBDMO COC[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@H](C)O1 ZINC000188352957 939209187 /nfs/dbraw/zinc/20/91/87/939209187.db2.gz YJGNQVCQENLLNK-UONOGXRCSA-N 1 1 362.451 3.559 20 5 FHBDMO CC[C@@H]([NH2+]Cc1cccnc1OCC(F)F)c1cccc([N+](=O)[O-])c1 ZINC000179522802 939877170 /nfs/dbraw/zinc/87/71/70/939877170.db2.gz PQMULBURQNOVRQ-OAHLLOKOSA-N 1 1 351.353 3.875 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000614261260 939903428 /nfs/dbraw/zinc/90/34/28/939903428.db2.gz QHWQBNDIZPLEQO-HZPDHXFCSA-N 1 1 371.485 3.558 20 5 FHBDMO Cc1cc(N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c(Br)cc1[N+](=O)[O-] ZINC000235980353 939907017 /nfs/dbraw/zinc/90/70/17/939907017.db2.gz NOFRWKGIONMRDO-VXGBXAGGSA-N 1 1 354.248 3.704 20 5 FHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H](O)Cc1ccc2ccccc2c1 ZINC000548934099 940099787 /nfs/dbraw/zinc/09/97/87/940099787.db2.gz REGKNMPEOWWQGC-QFIPXVFZSA-N 1 1 364.445 3.826 20 5 FHBDMO C[C@@H]1C[C@H](C(F)(F)F)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411809097 940123782 /nfs/dbraw/zinc/12/37/82/940123782.db2.gz SYTJKRCVKGCSDO-VXGBXAGGSA-N 1 1 359.348 3.586 20 5 FHBDMO O=[N+]([O-])c1cnn(CC[N@@H+](Cc2ccccc2)Cc2ccc(F)cc2)c1 ZINC000472438547 940128771 /nfs/dbraw/zinc/12/87/71/940128771.db2.gz HXTWNVLMCDIVRN-UHFFFAOYSA-N 1 1 354.385 3.633 20 5 FHBDMO NC(=O)c1cccc(C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)c1 ZINC000180039027 940305977 /nfs/dbraw/zinc/30/59/77/940305977.db2.gz YZNBNLCNDRGPJQ-HXUWFJFHSA-N 1 1 361.401 3.573 20 5 FHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CC3(CCOCC3)[C@@H]2c2ccccc2)c1 ZINC000412003159 940328606 /nfs/dbraw/zinc/32/86/06/940328606.db2.gz WMYZZZHIILWDEL-FQEVSTJZSA-N 1 1 368.433 3.827 20 5 FHBDMO CC(=O)c1cc(N[C@H]2CC[N@@H+](Cc3ccccn3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000376177164 940422801 /nfs/dbraw/zinc/42/28/01/940422801.db2.gz ZZMPTIRSBROWJR-LIRRHRJNSA-N 1 1 368.437 3.515 20 5 FHBDMO CC(=O)c1cc(N[C@H]2CC[N@H+](Cc3ccccn3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000376177164 940422802 /nfs/dbraw/zinc/42/28/02/940422802.db2.gz ZZMPTIRSBROWJR-LIRRHRJNSA-N 1 1 368.437 3.515 20 5 FHBDMO O=[N+]([O-])c1cccc([C@H](NC[C@H]2CC[N@H+](C3CC3)C2)c2ccccc2)c1 ZINC000180095192 940468238 /nfs/dbraw/zinc/46/82/38/940468238.db2.gz QWLJLZDONMSOLU-IIBYNOLFSA-N 1 1 351.450 3.758 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000581131980 940495887 /nfs/dbraw/zinc/49/58/87/940495887.db2.gz CZGXGPNYBLBZRB-APWZRJJASA-N 1 1 367.449 3.544 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](c2ccccc2F)C1 ZINC000582374089 940661916 /nfs/dbraw/zinc/66/19/16/940661916.db2.gz ZDTXFOJQQPXUDR-OAHLLOKOSA-N 1 1 371.412 3.860 20 5 FHBDMO COc1cc(C[N@@H+]2CC3(CCOCC3)[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000412015862 940690076 /nfs/dbraw/zinc/69/00/76/940690076.db2.gz UILNKANSFWLGRB-FQEVSTJZSA-N 1 1 368.433 3.957 20 5 FHBDMO COc1cc(C[N@H+]2CC3(CCOCC3)[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000412015862 940690078 /nfs/dbraw/zinc/69/00/78/940690078.db2.gz UILNKANSFWLGRB-FQEVSTJZSA-N 1 1 368.433 3.957 20 5 FHBDMO Cc1ccc(C[N@@H+](CC(=O)Nc2ccc(F)cc2)C(C)C)cc1[N+](=O)[O-] ZINC000506804437 945343238 /nfs/dbraw/zinc/34/32/38/945343238.db2.gz GMEQOFVLOHTOPH-UHFFFAOYSA-N 1 1 359.401 3.891 20 5 FHBDMO Cc1ccc(C[N@H+](CC(=O)Nc2ccc(F)cc2)C(C)C)cc1[N+](=O)[O-] ZINC000506804437 945343250 /nfs/dbraw/zinc/34/32/50/945343250.db2.gz GMEQOFVLOHTOPH-UHFFFAOYSA-N 1 1 359.401 3.891 20 5 FHBDMO CCN(C(=O)c1cc(C)ccc1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000186305713 940979472 /nfs/dbraw/zinc/97/94/72/940979472.db2.gz WGDIJINLRDGJPN-SFHVURJKSA-N 1 1 367.449 3.640 20 5 FHBDMO C[N@H+](Cc1ccccc1)CC1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC000066676269 940998160 /nfs/dbraw/zinc/99/81/60/940998160.db2.gz ALDMYAISMGNIHK-UHFFFAOYSA-N 1 1 367.449 3.579 20 5 FHBDMO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])CCc1nc(-c2ccccc2)no1 ZINC000583051259 941010081 /nfs/dbraw/zinc/01/00/81/941010081.db2.gz HHTDGCLZWUKYGP-XFFZJAGNSA-N 1 1 364.405 3.833 20 5 FHBDMO C[C@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2F)CC[N@H+]1Cc1ccccc1 ZINC000176583756 941060306 /nfs/dbraw/zinc/06/03/06/941060306.db2.gz HMNCLZXOQFCYQK-GOEBONIOSA-N 1 1 371.412 3.517 20 5 FHBDMO CN(c1ccccc1)C1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000177025699 941094726 /nfs/dbraw/zinc/09/47/26/941094726.db2.gz FNACMSYIEWXDKW-UHFFFAOYSA-N 1 1 366.421 3.837 20 5 FHBDMO CC(=O)NCC[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000564323455 941097786 /nfs/dbraw/zinc/09/77/86/941097786.db2.gz KBOLMLNXFGHHMF-INIZCTEOSA-N 1 1 371.437 3.593 20 5 FHBDMO C[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC1(c2ccccc2)CC1 ZINC000189289054 941155469 /nfs/dbraw/zinc/15/54/69/941155469.db2.gz PYWXDJOZKDDRBQ-UHFFFAOYSA-N 1 1 373.840 3.850 20 5 FHBDMO C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC1(c2ccccc2)CC1 ZINC000189289054 941155470 /nfs/dbraw/zinc/15/54/70/941155470.db2.gz PYWXDJOZKDDRBQ-UHFFFAOYSA-N 1 1 373.840 3.850 20 5 FHBDMO CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@@H+](C)[C@@H](C)C1 ZINC000513189481 941768313 /nfs/dbraw/zinc/76/83/13/941768313.db2.gz JZDVZNKXAOMFDR-OKILXGFUSA-N 1 1 365.499 3.508 20 5 FHBDMO CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@H+](C)[C@@H](C)C1 ZINC000513189481 941768318 /nfs/dbraw/zinc/76/83/18/941768318.db2.gz JZDVZNKXAOMFDR-OKILXGFUSA-N 1 1 365.499 3.508 20 5 FHBDMO COc1ccc(NC(=O)C[N@@H+]2C[C@@H](C)C[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000513277449 941826861 /nfs/dbraw/zinc/82/68/61/941826861.db2.gz YCHKSOCQJOHJCD-KBXCAEBGSA-N 1 1 369.421 3.625 20 5 FHBDMO COc1ccc(NC(=O)C[N@H+]2C[C@@H](C)C[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000513277449 941826874 /nfs/dbraw/zinc/82/68/74/941826874.db2.gz YCHKSOCQJOHJCD-KBXCAEBGSA-N 1 1 369.421 3.625 20 5 FHBDMO COc1ccc(NC(=O)C[N@@H+]2C[C@H](C)C[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000513277452 941827169 /nfs/dbraw/zinc/82/71/69/941827169.db2.gz YCHKSOCQJOHJCD-RDTXWAMCSA-N 1 1 369.421 3.625 20 5 FHBDMO COc1ccc(NC(=O)C[N@H+]2C[C@H](C)C[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000513277452 941827175 /nfs/dbraw/zinc/82/71/75/941827175.db2.gz YCHKSOCQJOHJCD-RDTXWAMCSA-N 1 1 369.421 3.625 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H](c3cccc(F)c3)C2)c2c(c1)COCO2 ZINC000513461202 941948792 /nfs/dbraw/zinc/94/87/92/941948792.db2.gz KSFSNQUAIDEDQF-CQSZACIVSA-N 1 1 358.369 3.590 20 5 FHBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@H]1CCN(C2CC2)C1 ZINC000513472812 941952501 /nfs/dbraw/zinc/95/25/01/941952501.db2.gz MOTAHKJIXJIDBO-KRWDZBQOSA-N 1 1 357.479 3.992 20 5 FHBDMO CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@H]1CC[N@@H+](C2CC2)C1 ZINC000513472812 941952503 /nfs/dbraw/zinc/95/25/03/941952503.db2.gz MOTAHKJIXJIDBO-KRWDZBQOSA-N 1 1 357.479 3.992 20 5 FHBDMO CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000513472812 941952507 /nfs/dbraw/zinc/95/25/07/941952507.db2.gz MOTAHKJIXJIDBO-KRWDZBQOSA-N 1 1 357.479 3.992 20 5 FHBDMO O=[N+]([O-])c1cc(CN[C@@H]2CC[N@@H+](C3CC3)C2)ccc1Oc1ccc(F)cc1 ZINC000517545128 941958494 /nfs/dbraw/zinc/95/84/94/941958494.db2.gz CWHBCOUVLNUPNY-MRXNPFEDSA-N 1 1 371.412 3.853 20 5 FHBDMO O=[N+]([O-])c1cc(CN[C@@H]2CC[N@H+](C3CC3)C2)ccc1Oc1ccc(F)cc1 ZINC000517545128 941958496 /nfs/dbraw/zinc/95/84/96/941958496.db2.gz CWHBCOUVLNUPNY-MRXNPFEDSA-N 1 1 371.412 3.853 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(Nc2ccc(F)cc2)CC1 ZINC000101561538 941987118 /nfs/dbraw/zinc/98/71/18/941987118.db2.gz SILIGLPBQPTVFW-UHFFFAOYSA-N 1 1 359.401 3.819 20 5 FHBDMO Cc1cc(C(=O)N2CCC[C@@H]2Cn2cc[nH+]c2C(C)C)ccc1[N+](=O)[O-] ZINC000377794763 941998921 /nfs/dbraw/zinc/99/89/21/941998921.db2.gz MAXHACLGVVTFFH-MRXNPFEDSA-N 1 1 356.426 3.528 20 5 FHBDMO C[C@@]1(c2ccc(F)cc2)CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000501868610 942089458 /nfs/dbraw/zinc/08/94/58/942089458.db2.gz CHGJZULRXZGKIY-HXUWFJFHSA-N 1 1 371.412 3.726 20 5 FHBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@H](CC(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000420954703 942274317 /nfs/dbraw/zinc/27/43/17/942274317.db2.gz VAWFFWXMWIXFBK-CHWSQXEVSA-N 1 1 373.375 3.895 20 5 FHBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@H](CC(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000420954703 942274321 /nfs/dbraw/zinc/27/43/21/942274321.db2.gz VAWFFWXMWIXFBK-CHWSQXEVSA-N 1 1 373.375 3.895 20 5 FHBDMO CC(C)(C)c1ccc(NC(=O)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000501086752 942291289 /nfs/dbraw/zinc/29/12/89/942291289.db2.gz XAGXIHZBJFVAKI-LSDHHAIUSA-N 1 1 360.458 3.641 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)C1CC(OC(C)(C)C)C1 ZINC000421016287 942305908 /nfs/dbraw/zinc/30/59/08/942305908.db2.gz UNAXSASVKLVDFC-UHFFFAOYSA-N 1 1 363.458 3.510 20 5 FHBDMO CC[C@@H](C)[N@@H+](C)CCNCc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000237025531 942332024 /nfs/dbraw/zinc/33/20/24/942332024.db2.gz KWTZCGMOALYQSX-CQSZACIVSA-N 1 1 361.442 3.683 20 5 FHBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(N3CCc4ccccc43)CC2)c(F)c1 ZINC000502330568 942364300 /nfs/dbraw/zinc/36/43/00/942364300.db2.gz FXPBJPYMHAYICJ-UHFFFAOYSA-N 1 1 355.413 3.761 20 5 FHBDMO O=[N+]([O-])c1cnc(N2CC[C@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)c(F)c1 ZINC000413185601 942438296 /nfs/dbraw/zinc/43/82/96/942438296.db2.gz QPMWYYAAVLROLV-HXUWFJFHSA-N 1 1 370.428 3.621 20 5 FHBDMO CC[C@H](c1ccccc1)[N@@H+](CC)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000541271884 942548256 /nfs/dbraw/zinc/54/82/56/942548256.db2.gz GOEOXNPZTPTBHW-QZTJIDSGSA-N 1 1 358.438 3.808 20 5 FHBDMO COc1ccc(C[NH2+]Cc2cc(F)ccc2Br)cc1[N+](=O)[O-] ZINC000237215060 942551394 /nfs/dbraw/zinc/55/13/94/942551394.db2.gz GMIGVVDJXBZWAL-UHFFFAOYSA-N 1 1 369.190 3.795 20 5 FHBDMO CN(c1ccccc1)c1ccc(C[N@@H+]2CC[C@]23CCOC3)cc1[N+](=O)[O-] ZINC000421404272 942555186 /nfs/dbraw/zinc/55/51/86/942555186.db2.gz YQXABOHMVAARCJ-HXUWFJFHSA-N 1 1 353.422 3.728 20 5 FHBDMO CN(c1ccccc1)c1ccc(C[N@H+]2CC[C@]23CCOC3)cc1[N+](=O)[O-] ZINC000421404272 942555189 /nfs/dbraw/zinc/55/51/89/942555189.db2.gz YQXABOHMVAARCJ-HXUWFJFHSA-N 1 1 353.422 3.728 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000421513724 942619668 /nfs/dbraw/zinc/61/96/68/942619668.db2.gz QINGJXPUDQUMPO-JKSUJKDBSA-N 1 1 359.470 3.594 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1nc2c(s1)C[N@H+](C(C)C)CC2 ZINC000421514343 942620981 /nfs/dbraw/zinc/62/09/81/942620981.db2.gz QWWGQDNQZMSIGW-UHFFFAOYSA-N 1 1 374.466 3.687 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1nc2c(s1)C[N@@H+](C(C)C)CC2 ZINC000421514343 942620986 /nfs/dbraw/zinc/62/09/86/942620986.db2.gz QWWGQDNQZMSIGW-UHFFFAOYSA-N 1 1 374.466 3.687 20 5 FHBDMO Cn1cc(C[N@@H+](C)CC2(O)CCCCCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000190139267 942821910 /nfs/dbraw/zinc/82/19/10/942821910.db2.gz ZNSLGFBYOAORPF-UHFFFAOYSA-N 1 1 372.469 3.512 20 5 FHBDMO O=[N+]([O-])c1cccc([C@H](N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c2ccccc2)c1 ZINC000378494346 942826762 /nfs/dbraw/zinc/82/67/62/942826762.db2.gz KXJUKPAXOZSNRW-QKNQBKEWSA-N 1 1 351.450 3.901 20 5 FHBDMO Cc1c(C(=O)NC(C)(C)C[N@@H+](C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000514244592 942859430 /nfs/dbraw/zinc/85/94/30/942859430.db2.gz KJTOINGQMIASBI-UHFFFAOYSA-N 1 1 355.438 3.544 20 5 FHBDMO CCC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)Cc1ccc(F)cc1 ZINC000434750608 942952100 /nfs/dbraw/zinc/95/21/00/942952100.db2.gz XOHZVXOUAJYIHK-UHFFFAOYSA-N 1 1 359.401 3.893 20 5 FHBDMO CCC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)Cc1ccc(F)cc1 ZINC000434750608 942952102 /nfs/dbraw/zinc/95/21/02/942952102.db2.gz XOHZVXOUAJYIHK-UHFFFAOYSA-N 1 1 359.401 3.893 20 5 FHBDMO Cn1cc(C[N@H+]2CCSC(C)(C)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000435047950 943118980 /nfs/dbraw/zinc/11/89/80/943118980.db2.gz FMHYARJFKGCVMR-UHFFFAOYSA-N 1 1 360.483 3.713 20 5 FHBDMO CC[N@@H+](C)[C@H](C(=O)NCc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000183751869 943125009 /nfs/dbraw/zinc/12/50/09/943125009.db2.gz MCECIYXRRGMGAG-KRWDZBQOSA-N 1 1 361.829 3.557 20 5 FHBDMO COc1cc(C[N@H+]2CCC[C@H](c3ncc4n3CCCC4)C2)ccc1[N+](=O)[O-] ZINC000503371503 943145349 /nfs/dbraw/zinc/14/53/49/943145349.db2.gz BRNLQBACBQSYLB-INIZCTEOSA-N 1 1 370.453 3.516 20 5 FHBDMO COC[C@H]1CCCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000468698040 943341910 /nfs/dbraw/zinc/34/19/10/943341910.db2.gz CWIXHKGDFYRCFX-AWEZNQCLSA-N 1 1 361.467 3.967 20 5 FHBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1nccn1CC(F)(F)F)CCCC2 ZINC000417301683 943495171 /nfs/dbraw/zinc/49/51/71/943495171.db2.gz BUERSPVTBQLDLC-HNNXBMFYSA-N 1 1 368.359 3.911 20 5 FHBDMO CCc1ccc([C@@H](N[C@@H]2C[C@H]2C2CC[NH2+]CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423442398 943512542 /nfs/dbraw/zinc/51/25/42/943512542.db2.gz PVSODKRMCASPGO-ZVDOUQERSA-N 1 1 369.465 3.817 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)C[C@@H]1OCCc2ccccc21 ZINC000511621934 943563981 /nfs/dbraw/zinc/56/39/81/943563981.db2.gz BOXLNFRSVITPFV-FQEVSTJZSA-N 1 1 356.422 3.739 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C[C@@H]1OCCc2ccccc21 ZINC000511621934 943563987 /nfs/dbraw/zinc/56/39/87/943563987.db2.gz BOXLNFRSVITPFV-FQEVSTJZSA-N 1 1 356.422 3.739 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H]1Cc1ccccc1 ZINC000303040732 943641025 /nfs/dbraw/zinc/64/10/25/943641025.db2.gz STSBXEWSXRUTFX-SFHVURJKSA-N 1 1 367.449 3.939 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(OC)(C(F)(F)F)CC1 ZINC000418088220 944141163 /nfs/dbraw/zinc/14/11/63/944141163.db2.gz GETPXMOEZOZLLM-UHFFFAOYSA-N 1 1 362.348 3.537 20 5 FHBDMO CN(C/C=C\c1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000506482493 944332315 /nfs/dbraw/zinc/33/23/15/944332315.db2.gz TVHHDXYCVYMAON-QRGKHIHXSA-N 1 1 351.450 3.814 20 5 FHBDMO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@H]1CCN(Cc2ccccc2)C1 ZINC000506482493 944332323 /nfs/dbraw/zinc/33/23/23/944332323.db2.gz TVHHDXYCVYMAON-QRGKHIHXSA-N 1 1 351.450 3.814 20 5 FHBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@H]1CCN(Cc2ccccc2)C1 ZINC000506482493 944332330 /nfs/dbraw/zinc/33/23/30/944332330.db2.gz TVHHDXYCVYMAON-QRGKHIHXSA-N 1 1 351.450 3.814 20 5 FHBDMO CC(C)c1[nH+]ccn1Cc1cc(I)cc([N+](=O)[O-])c1 ZINC000518442888 944395961 /nfs/dbraw/zinc/39/59/61/944395961.db2.gz BQDLQTYYEYQACP-UHFFFAOYSA-N 1 1 371.178 3.568 20 5 FHBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3ccccc3OC(F)(F)F)CC2)n1 ZINC000425970710 944454947 /nfs/dbraw/zinc/45/49/47/944454947.db2.gz IKGAQOMMNWODTE-UHFFFAOYSA-N 1 1 370.331 3.527 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](COc2ccccc2)C1 ZINC000505874719 944572855 /nfs/dbraw/zinc/57/28/55/944572855.db2.gz MWIGICGPZAMVIN-INIZCTEOSA-N 1 1 356.422 3.894 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+](CCO)Cc3cccc(F)c3)o2)c1 ZINC000426371308 944575907 /nfs/dbraw/zinc/57/59/07/944575907.db2.gz KCFPSMZQVFMSCA-UHFFFAOYSA-N 1 1 370.380 3.988 20 5 FHBDMO COc1ccc(NC(=O)CC[N@@H+](C)C[C@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000066854662 944631337 /nfs/dbraw/zinc/63/13/37/944631337.db2.gz BZPJBQFLHPDSHM-HNNXBMFYSA-N 1 1 371.437 3.668 20 5 FHBDMO C[C@H](C[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1ccccc1 ZINC000066853574 944642373 /nfs/dbraw/zinc/64/23/73/944642373.db2.gz ZIEGTODKQIPSEJ-CQSZACIVSA-N 1 1 352.394 3.880 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+](C)C[C@H](C)c1ccccc1 ZINC000066854636 944642422 /nfs/dbraw/zinc/64/24/22/944642422.db2.gz OMZNJNLZNMEOBX-GJZGRUSLSA-N 1 1 371.437 3.666 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@](C)(c2ccccc2)C1 ZINC000438507999 944718091 /nfs/dbraw/zinc/71/80/91/944718091.db2.gz XFEBNAPMSXPRSW-FQEVSTJZSA-N 1 1 353.422 3.505 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@](C)(c2ccccc2)C1 ZINC000438507999 944718096 /nfs/dbraw/zinc/71/80/96/944718096.db2.gz XFEBNAPMSXPRSW-FQEVSTJZSA-N 1 1 353.422 3.505 20 5 FHBDMO O=[N+]([O-])c1ccc2[nH]cc(CC[NH2+]Cc3c[nH]c(-c4ccccc4)n3)c2c1 ZINC000518827036 944836245 /nfs/dbraw/zinc/83/62/45/944836245.db2.gz HXXOJKTZQQFWKD-UHFFFAOYSA-N 1 1 361.405 3.799 20 5 FHBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000053749555 944851849 /nfs/dbraw/zinc/85/18/49/944851849.db2.gz AFFOJSCNKWILQL-PBHICJAKSA-N 1 1 354.410 3.552 20 5 FHBDMO O=C(Nc1c[nH+]ccc1-n1cccn1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000518894770 944898554 /nfs/dbraw/zinc/89/85/54/944898554.db2.gz YKAKOICPLJPZSN-UHFFFAOYSA-N 1 1 365.374 3.643 20 5 FHBDMO O=C(Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)[C@H]1CCC[N@H+]1C1CC1 ZINC000426880394 944901539 /nfs/dbraw/zinc/90/15/39/944901539.db2.gz BSOYDYXRXOKLEQ-LJQANCHMSA-N 1 1 367.405 3.952 20 5 FHBDMO O=C(C[NH+]1CCC(Cc2ccc(F)cc2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000507173713 945022226 /nfs/dbraw/zinc/02/22/26/945022226.db2.gz ATIDHTGULICQMN-UHFFFAOYSA-N 1 1 371.412 3.627 20 5 FHBDMO O=C(NC[C@H]1CCC[N@H+]1C1CCCCC1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000437845840 945034907 /nfs/dbraw/zinc/03/49/07/945034907.db2.gz KKTDRCPEGLPMFJ-QGZVFWFLSA-N 1 1 371.437 3.868 20 5 FHBDMO NC(=O)C[C@@H]([NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1ccccc1 ZINC000550292272 945438518 /nfs/dbraw/zinc/43/85/18/945438518.db2.gz UJKMDLVFXCCLAR-GOSISDBHSA-N 1 1 365.389 3.561 20 5 FHBDMO CC[C@H](C(=O)N[C@H](C)c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000519488681 945460922 /nfs/dbraw/zinc/46/09/22/945460922.db2.gz RXCNQWVYMHQSPN-CRAIPNDOSA-N 1 1 355.438 3.683 20 5 FHBDMO C[C@@H](O)[C@@H]1CC[N@@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000507697630 945461453 /nfs/dbraw/zinc/46/14/53/945461453.db2.gz KMDIKMHVPJBVEZ-UKRRQHHQSA-N 1 1 360.385 3.729 20 5 FHBDMO COc1cccc([C@H](C)N2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000507687709 945469420 /nfs/dbraw/zinc/46/94/20/945469420.db2.gz JKXZXDNYIBQMGS-KRWDZBQOSA-N 1 1 369.465 3.525 20 5 FHBDMO C[C@H](O)[C@H]1CC[N@@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000507706890 945480968 /nfs/dbraw/zinc/48/09/68/945480968.db2.gz ZXTWIPIRONIZAH-RDJZCZTQSA-N 1 1 355.438 3.565 20 5 FHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@@H](c3cc[nH]n3)C2)o1 ZINC000121220665 945721191 /nfs/dbraw/zinc/72/11/91/945721191.db2.gz PFTPICUULJBUFC-CQSZACIVSA-N 1 1 352.394 3.958 20 5 FHBDMO CC(C)c1ccc(-c2nc([C@@H]3C[N@H+]4CCC[C@@]4(C)CO3)no2)cc1[N+](=O)[O-] ZINC000574440080 945801058 /nfs/dbraw/zinc/80/10/58/945801058.db2.gz NJCNYTDTSREOAG-LPHOPBHVSA-N 1 1 372.425 3.694 20 5 FHBDMO CCn1c(C)nc([N+](=O)[O-])c1Nc1ccc2c(c1)[nH+]c1n2CCCCC1 ZINC000519555927 945887615 /nfs/dbraw/zinc/88/76/15/945887615.db2.gz MGXVEUBUFBYIFF-UHFFFAOYSA-N 1 1 354.414 3.939 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](Cc1ccc(F)cc1)C(C)C ZINC000506846958 945915396 /nfs/dbraw/zinc/91/53/96/945915396.db2.gz MNTBQCYHABOJFG-UHFFFAOYSA-N 1 1 359.401 3.891 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](Cc1ccc(F)cc1)C(C)C ZINC000506846958 945915402 /nfs/dbraw/zinc/91/54/02/945915402.db2.gz MNTBQCYHABOJFG-UHFFFAOYSA-N 1 1 359.401 3.891 20 5 FHBDMO C[C@H](NC(=O)NCCCC[N@H+]1CCCC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000108466241 945980794 /nfs/dbraw/zinc/98/07/94/945980794.db2.gz SGACSPOMGUEWKX-CVEARBPZSA-N 1 1 362.474 3.610 20 5 FHBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1cccc(Br)c1 ZINC000520058918 946068074 /nfs/dbraw/zinc/06/80/74/946068074.db2.gz NUWMECCVUHZVIR-UHFFFAOYSA-N 1 1 365.227 3.868 20 5 FHBDMO CCN(CC)[C@H](C)C[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000236871508 946079877 /nfs/dbraw/zinc/07/98/77/946079877.db2.gz LRHFZULZHPCBMX-CQSZACIVSA-N 1 1 361.442 3.683 20 5 FHBDMO Cc1ccc(C[C@H](C)[N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000444226958 946094579 /nfs/dbraw/zinc/09/45/79/946094579.db2.gz PTBFHGLANXTLGW-INIZCTEOSA-N 1 1 355.438 3.713 20 5 FHBDMO Cc1ccc([C@@H]2CCC[C@H]2[N@@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1 ZINC000444236961 946109351 /nfs/dbraw/zinc/10/93/51/946109351.db2.gz IYDICLCDPQRDSE-RBUKOAKNSA-N 1 1 367.449 3.770 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@H](C)c1ccc(C)cc1 ZINC000052907270 946195367 /nfs/dbraw/zinc/19/53/67/946195367.db2.gz JDWTWKMEALHHKO-CQSZACIVSA-N 1 1 357.410 3.543 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@H](C)c1ccc(C)cc1 ZINC000052907270 946195369 /nfs/dbraw/zinc/19/53/69/946195369.db2.gz JDWTWKMEALHHKO-CQSZACIVSA-N 1 1 357.410 3.543 20 5 FHBDMO CC(C)[N@@H+](CCC(=O)N(C)c1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000441142586 946253400 /nfs/dbraw/zinc/25/34/00/946253400.db2.gz NIMMNTCBJGAZAS-UHFFFAOYSA-N 1 1 355.438 3.858 20 5 FHBDMO C/C(=C\C(=O)NCCCC[N@@H+]1CCCC[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000785284476 946267019 /nfs/dbraw/zinc/26/70/19/946267019.db2.gz XKKLMSMGMBYLLQ-INFVRCAFSA-N 1 1 359.470 3.769 20 5 FHBDMO O=[N+]([O-])c1sc(C[NH2+][C@H]2CCCc3cccnc32)cc1Br ZINC000897072494 946569957 /nfs/dbraw/zinc/56/99/57/946569957.db2.gz QPZOGVKXDRWGIM-LBPRGKRZSA-N 1 1 368.256 3.981 20 5 FHBDMO Cc1cc(C(=O)NC[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000129763621 946907926 /nfs/dbraw/zinc/90/79/26/946907926.db2.gz LNBHZBMWFZWFBW-YJBOKZPZSA-N 1 1 373.478 3.778 20 5 FHBDMO CCC[N@@H+](Cc1c([N+](=O)[O-])ncn1C)[C@H]1C[C@H](OCC)C12CCCCC2 ZINC000475356205 946937128 /nfs/dbraw/zinc/93/71/28/946937128.db2.gz SEDSLKGWPGXTKI-IRXDYDNUSA-N 1 1 364.490 3.668 20 5 FHBDMO C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000054260418 947017911 /nfs/dbraw/zinc/01/79/11/947017911.db2.gz HACZNQDBVXMMGN-BETUJISGSA-N 1 1 367.877 3.735 20 5 FHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CCCc3ccc(Cl)cc3)C2)nc1 ZINC000440495514 947066180 /nfs/dbraw/zinc/06/61/80/947066180.db2.gz CAONQPGBWROHQH-INIZCTEOSA-N 1 1 360.845 3.762 20 5 FHBDMO COc1ccccc1C[C@@H](C)[N@@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC000441427713 947087639 /nfs/dbraw/zinc/08/76/39/947087639.db2.gz HPQDWWNRZNLNEN-MRXNPFEDSA-N 1 1 358.438 3.935 20 5 FHBDMO COc1ccc(C[C@H](C)C[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444674305 947098763 /nfs/dbraw/zinc/09/87/63/947098763.db2.gz KISLUAOFZGLZFM-AWEZNQCLSA-N 1 1 368.437 3.790 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)Cc1cc(F)cc(F)c1 ZINC000444692783 947116360 /nfs/dbraw/zinc/11/63/60/947116360.db2.gz NHWWTXIDKISSJS-UHFFFAOYSA-N 1 1 363.364 3.642 20 5 FHBDMO Cc1ccc(F)c(C[N@@H+](C)CCC(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000444743866 947180170 /nfs/dbraw/zinc/18/01/70/947180170.db2.gz NCDMLGDXQWLMGO-UHFFFAOYSA-N 1 1 359.401 3.811 20 5 FHBDMO C[C@H](c1cccc(Cl)c1)[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248373561 947221265 /nfs/dbraw/zinc/22/12/65/947221265.db2.gz JSOZAGAAAMYIFK-CZUORRHYSA-N 1 1 364.829 3.681 20 5 FHBDMO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248374644 947222953 /nfs/dbraw/zinc/22/29/53/947222953.db2.gz SERZMLUVYYJUGY-GOEBONIOSA-N 1 1 370.405 3.774 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000072810934 947351899 /nfs/dbraw/zinc/35/18/99/947351899.db2.gz ZFIVKZJAOFIIKL-IRXDYDNUSA-N 1 1 359.470 3.630 20 5 FHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000072837795 947569786 /nfs/dbraw/zinc/56/97/86/947569786.db2.gz UORBXCABYGZWPT-AAEUAGOBSA-N 1 1 371.890 3.793 20 5 FHBDMO Cc1ccnc(NCC2([N@H+]3CCOC(C)(C)C3)CCCCC2)c1[N+](=O)[O-] ZINC000523755413 947571513 /nfs/dbraw/zinc/57/15/13/947571513.db2.gz YMLOXNATFYKWPI-UHFFFAOYSA-N 1 1 362.474 3.524 20 5 FHBDMO C/C(=C\C(=O)Nc1cccnc1-n1cc[nH+]c1C)c1ccc([N+](=O)[O-])cc1 ZINC000785340022 947804787 /nfs/dbraw/zinc/80/47/87/947804787.db2.gz HOZCMJISMZJCMC-OUKQBFOZSA-N 1 1 363.377 3.526 20 5 FHBDMO CC(C)(C)c1ccc([C@@H]2CCC[N@H+]2CCn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC000536380338 947852642 /nfs/dbraw/zinc/85/26/42/947852642.db2.gz WWMHNAUKJJYSJW-IBGZPJMESA-N 1 1 369.465 3.891 20 5 FHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000278870507 947898928 /nfs/dbraw/zinc/89/89/28/947898928.db2.gz SOFUDTVCHFJJDT-MNOVXSKESA-N 1 1 370.331 3.980 20 5 FHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000278870507 947898936 /nfs/dbraw/zinc/89/89/36/947898936.db2.gz SOFUDTVCHFJJDT-MNOVXSKESA-N 1 1 370.331 3.980 20 5 FHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)CCc1ccccc1 ZINC000053047723 947990309 /nfs/dbraw/zinc/99/03/09/947990309.db2.gz YYRQLCUDCZRGLX-ZDUSSCGKSA-N 1 1 361.829 3.750 20 5 FHBDMO COc1ccc(-c2ccc(C[NH2+][C@@H](C)Cc3cc(C)[nH]n3)o2)c([N+](=O)[O-])c1 ZINC000136788278 947995457 /nfs/dbraw/zinc/99/54/57/947995457.db2.gz ZSWHZPGXBNPPFO-LBPRGKRZSA-N 1 1 370.409 3.616 20 5 FHBDMO C[N@H+](Cc1ccc(OC(F)(F)F)cc1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136914591 948090793 /nfs/dbraw/zinc/09/07/93/948090793.db2.gz BNONEJKJRWCCTH-MRXNPFEDSA-N 1 1 370.327 3.659 20 5 FHBDMO O=[N+]([O-])c1cccc2c(N3CC[C@@H]4[C@H](CCC[N@H+]4C4CC4)C3)ccnc21 ZINC000432341329 948165395 /nfs/dbraw/zinc/16/53/95/948165395.db2.gz WGMIKDAXUBKGHF-RHSMWYFYSA-N 1 1 352.438 3.596 20 5 FHBDMO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CCc1ccc2cn[nH]c2c1)C1CC1 ZINC000585765550 948277167 /nfs/dbraw/zinc/27/71/67/948277167.db2.gz PRXDXUVHVDDUBQ-SFHVURJKSA-N 1 1 350.422 3.625 20 5 FHBDMO C[C@@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])c1nc(C(F)(F)F)cs1 ZINC000278940091 948311307 /nfs/dbraw/zinc/31/13/07/948311307.db2.gz NJFNXKOIKMWQCH-SECBINFHSA-N 1 1 361.345 3.800 20 5 FHBDMO CC[N@@H+](Cc1c[nH]c2ccccc12)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000190454927 948318466 /nfs/dbraw/zinc/31/84/66/948318466.db2.gz HTBDJGSVDORHJF-AWEZNQCLSA-N 1 1 366.421 3.925 20 5 FHBDMO CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000087129082 948592689 /nfs/dbraw/zinc/59/26/89/948592689.db2.gz TWLZSSDOTCXAOT-UHFFFAOYSA-N 1 1 369.465 3.684 20 5 FHBDMO CCOc1ccc(NC(=O)C[N@@H+]2CCC[C@@]3(CC=CCC3)C2)c([N+](=O)[O-])c1 ZINC000512176293 948663206 /nfs/dbraw/zinc/66/32/06/948663206.db2.gz UVZBBDISEMFIQC-FQEVSTJZSA-N 1 1 373.453 3.754 20 5 FHBDMO CCOc1ccc(NC(=O)C[N@H+]2CCC[C@@]3(CC=CCC3)C2)c([N+](=O)[O-])c1 ZINC000512176293 948663213 /nfs/dbraw/zinc/66/32/13/948663213.db2.gz UVZBBDISEMFIQC-FQEVSTJZSA-N 1 1 373.453 3.754 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)c1ccc([N+](=O)[O-])s1 ZINC000107584665 222397516 /nfs/dbraw/zinc/39/75/16/222397516.db2.gz CPNRNXHHTQJZLK-CQSZACIVSA-N 1 1 373.478 3.961 20 5 FHBDMO Cc1c(CNC(=O)[C@@H]2CCCC[N@H+]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000481479080 567975449 /nfs/dbraw/zinc/97/54/49/567975449.db2.gz PLGBLRBDAQMWJT-FQEVSTJZSA-N 1 1 367.449 3.574 20 5 FHBDMO COc1ccc([C@@H](O)C2CC[NH+](Cc3csc([N+](=O)[O-])c3)CC2)cc1 ZINC000291192679 568072839 /nfs/dbraw/zinc/07/28/39/568072839.db2.gz GSWCNJFWCZDFFR-GOSISDBHSA-N 1 1 362.451 3.611 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(NCc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)n1 ZINC000481682909 568085744 /nfs/dbraw/zinc/08/57/44/568085744.db2.gz BKBFMDLUBQGCGE-IYBDPMFKSA-N 1 1 370.453 3.520 20 5 FHBDMO O=[N+]([O-])c1c2cccnc2ccc1N1CC[NH+](C/C=C\c2ccccc2)CC1 ZINC000603837001 568159714 /nfs/dbraw/zinc/15/97/14/568159714.db2.gz QFIXYRRZCHLVEN-YVMONPNESA-N 1 1 374.444 3.978 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(N2CC[C@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)n1 ZINC000481990155 568215875 /nfs/dbraw/zinc/21/58/75/568215875.db2.gz IMRIFKHGDOQNAD-MOPGFXCFSA-N 1 1 366.465 3.789 20 5 FHBDMO C[C@H](C(=O)NCC(C)(C)[N@@H+]1C[C@H](C)C[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000568942305 568256385 /nfs/dbraw/zinc/25/63/85/568256385.db2.gz RHMIUAFFFILDEX-XHSDSOJGSA-N 1 1 361.486 3.571 20 5 FHBDMO COc1ccc(-c2n[nH]cc2C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000584687774 568264317 /nfs/dbraw/zinc/26/43/17/568264317.db2.gz MZZPEISWJSGZBJ-UHFFFAOYSA-N 1 1 366.421 3.668 20 5 FHBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC2(CCC2)[C@@H]1c1ccccc1 ZINC000453031509 568265197 /nfs/dbraw/zinc/26/51/97/568265197.db2.gz YWAUTTYYEWLCQW-PXNSSMCTSA-N 1 1 368.433 3.562 20 5 FHBDMO C[C@@H]1CC[C@@]2(CC[N@H+](CC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)C2)C1 ZINC000541949700 568272799 /nfs/dbraw/zinc/27/27/99/568272799.db2.gz VBOZPAFPNUHIDU-SJKOYZFVSA-N 1 1 351.834 3.699 20 5 FHBDMO C[C@@H]1CC[C@@]2(CC[N@@H+](CC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)C2)C1 ZINC000541949700 568272800 /nfs/dbraw/zinc/27/28/00/568272800.db2.gz VBOZPAFPNUHIDU-SJKOYZFVSA-N 1 1 351.834 3.699 20 5 FHBDMO CC(C)[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000181984212 568343421 /nfs/dbraw/zinc/34/34/21/568343421.db2.gz WJXXOMPMUXAPEZ-IBGZPJMESA-N 1 1 360.385 3.992 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)cnc1N1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001164621406 719056598 /nfs/dbraw/zinc/05/65/98/719056598.db2.gz JCYADDNBEWNBEU-CRAIPNDOSA-N 1 1 372.856 3.744 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)C1CCC(F)(F)CC1 ZINC000572909136 936344597 /nfs/dbraw/zinc/34/45/97/936344597.db2.gz DGAUEVNNOHGBEO-UHFFFAOYSA-N 1 1 355.385 3.742 20 5 FHBDMO COc1cccc(C2=CC[N@H+](Cc3ccc([N+](=O)[O-])cc3OC)CC2)c1 ZINC000430202934 927992154 /nfs/dbraw/zinc/99/21/54/927992154.db2.gz DUCMYIRSSXRWCB-UHFFFAOYSA-N 1 1 354.406 3.901 20 5 FHBDMO COc1cccc(C2=CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3OC)CC2)c1 ZINC000430202934 927992165 /nfs/dbraw/zinc/99/21/65/927992165.db2.gz DUCMYIRSSXRWCB-UHFFFAOYSA-N 1 1 354.406 3.901 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000120298517 928019791 /nfs/dbraw/zinc/01/97/91/928019791.db2.gz KKKRIBQYQCGVLS-CVEARBPZSA-N 1 1 374.485 3.986 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H](OCCCc2ccccc2)C1 ZINC000430210041 928110847 /nfs/dbraw/zinc/11/08/47/928110847.db2.gz ZZUILQBXSKZLJW-FQEVSTJZSA-N 1 1 370.449 3.827 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](OCCCc2ccccc2)C1 ZINC000430210041 928110850 /nfs/dbraw/zinc/11/08/50/928110850.db2.gz ZZUILQBXSKZLJW-FQEVSTJZSA-N 1 1 370.449 3.827 20 5 FHBDMO O=C(c1cccc(Cl)c1[N+](=O)[O-])N1C[C@@H]2CCC[N@H+]2Cc2ccccc21 ZINC000175756653 928320269 /nfs/dbraw/zinc/32/02/69/928320269.db2.gz QQPKLPBKDDSFIU-AWEZNQCLSA-N 1 1 371.824 3.873 20 5 FHBDMO COc1ccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c(OC)c1OC ZINC000126979684 928361685 /nfs/dbraw/zinc/36/16/85/928361685.db2.gz VAANUGUVFIHLKV-UHFFFAOYSA-N 1 1 372.421 3.785 20 5 FHBDMO COc1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c(OC)c1OC ZINC000126979684 928361697 /nfs/dbraw/zinc/36/16/97/928361697.db2.gz VAANUGUVFIHLKV-UHFFFAOYSA-N 1 1 372.421 3.785 20 5 FHBDMO CC[N@@H+](Cc1ccc(C(=O)NCc2ccccc2[N+](=O)[O-])cc1)C(C)C ZINC000110123987 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PALOAIKCGXRNTB-KSSFIOAISA-N 1 1 360.845 3.772 20 5 FHBDMO CC[N@@H+](CCC1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC1)CC1CC1 ZINC000536134041 930244578 /nfs/dbraw/zinc/24/45/78/930244578.db2.gz PIZUBDSYSMUNNG-UHFFFAOYSA-N 1 1 374.485 3.961 20 5 FHBDMO CCc1cc(NCCC[N@@H+](C)C(C)C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000064914125 930311041 /nfs/dbraw/zinc/31/10/41/930311041.db2.gz JKAPQJMMGYXVAU-UHFFFAOYSA-N 1 1 357.458 3.756 20 5 FHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@](C)(c2ccccc2)C1 ZINC001167367141 930354267 /nfs/dbraw/zinc/35/42/67/930354267.db2.gz BSGUWVCTCXTQIT-KKSFZXQISA-N 1 1 367.449 3.976 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](Cc2ccccc2)CC[C@@H]1C ZINC000610446413 930818395 /nfs/dbraw/zinc/81/83/95/930818395.db2.gz XXRJZMNYFALSJQ-KRWDZBQOSA-N 1 1 367.449 3.640 20 5 FHBDMO CC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccc(C(=O)N(C)C)cc1 ZINC000255885405 931321790 /nfs/dbraw/zinc/32/17/90/931321790.db2.gz OILIKBDEQYFXOI-CLFYSBASSA-N 1 1 367.449 3.832 20 5 FHBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCC(c2ccccc2F)CC1 ZINC001167443306 931511073 /nfs/dbraw/zinc/51/10/73/931511073.db2.gz RWROKCXXTIPGMH-AWEZNQCLSA-N 1 1 371.412 3.941 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H](c2nccs2)C1 ZINC000157013669 931774619 /nfs/dbraw/zinc/77/46/19/931774619.db2.gz FHKWAZUECAGZIG-AWEZNQCLSA-N 1 1 374.466 3.568 20 5 FHBDMO COc1ccc(OCC[N@H+]2CCC[C@H]2c2ccc(O)cc2)c([N+](=O)[O-])c1 ZINC000610390099 932009422 /nfs/dbraw/zinc/00/94/22/932009422.db2.gz GNVWJDCVEADUAQ-KRWDZBQOSA-N 1 1 358.394 3.525 20 5 FHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CCc1nc(-c2ccccc2)no1 ZINC000077247592 932208571 /nfs/dbraw/zinc/20/85/71/932208571.db2.gz QCNLTHOGNRNTNR-CQSZACIVSA-N 1 1 352.394 3.880 20 5 FHBDMO CCOc1cc(N2CC[C@H]([N@@H+](C)Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000610515861 932333632 /nfs/dbraw/zinc/33/36/32/932333632.db2.gz CJGNYHCEGAZSFF-SFHVURJKSA-N 1 1 355.438 3.704 20 5 FHBDMO COC[C@@H](C)[N@@H+](C)Cc1ccc(OC)c(OCc2ccc([N+](=O)[O-])cc2)c1 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C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[S@]1=O ZINC000277445649 935184099 /nfs/dbraw/zinc/18/40/99/935184099.db2.gz JPJVZOKIGICMLC-YEBMWUKDSA-N 1 1 364.492 3.666 20 5 FHBDMO CC(C)N(Cc1ccccc1)C(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511061711 935187418 /nfs/dbraw/zinc/18/74/18/935187418.db2.gz ZBNIQGLZZVBUMI-UHFFFAOYSA-N 1 1 369.465 3.506 20 5 FHBDMO CC(C)N(Cc1ccccc1)C(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511061711 935187419 /nfs/dbraw/zinc/18/74/19/935187419.db2.gz ZBNIQGLZZVBUMI-UHFFFAOYSA-N 1 1 369.465 3.506 20 5 FHBDMO CCC[C@H](NC(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000511072935 935240221 /nfs/dbraw/zinc/24/02/21/935240221.db2.gz NBYZEARSIHOBAO-IBGZPJMESA-N 1 1 369.465 3.727 20 5 FHBDMO CCC[C@H](NC(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000511072935 935240225 /nfs/dbraw/zinc/24/02/25/935240225.db2.gz NBYZEARSIHOBAO-IBGZPJMESA-N 1 1 369.465 3.727 20 5 FHBDMO C[C@H](C(=O)Nc1ccccc1Cl)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511073660 935250969 /nfs/dbraw/zinc/25/09/69/935250969.db2.gz PZEFYCIKMFMFNG-CYBMUJFWSA-N 1 1 361.829 3.750 20 5 FHBDMO C[C@H](C(=O)Nc1ccccc1Cl)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511073660 935250972 /nfs/dbraw/zinc/25/09/72/935250972.db2.gz PZEFYCIKMFMFNG-CYBMUJFWSA-N 1 1 361.829 3.750 20 5 FHBDMO COc1cccc(C(=O)Nc2ccc(C[NH+](C)C)c(Cl)c2)c1[N+](=O)[O-] ZINC000478035185 935254029 /nfs/dbraw/zinc/25/40/29/935254029.db2.gz TUVJOYLDWKUCCY-UHFFFAOYSA-N 1 1 363.801 3.571 20 5 FHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1 ZINC000439921246 945091555 /nfs/dbraw/zinc/09/15/55/945091555.db2.gz YOYYMXRKEANQNL-XJKSGUPXSA-N 1 1 372.400 3.691 20 5 FHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1 ZINC000439921246 945091565 /nfs/dbraw/zinc/09/15/65/945091565.db2.gz YOYYMXRKEANQNL-XJKSGUPXSA-N 1 1 372.400 3.691 20 5 FHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000051560293 935477242 /nfs/dbraw/zinc/47/72/42/935477242.db2.gz 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ZARFGEVWDAYWBB-ZDUSSCGKSA-N 1 1 353.378 3.800 20 5 FHBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1cc2ccccc2o1 ZINC000472300972 938391704 /nfs/dbraw/zinc/39/17/04/938391704.db2.gz ZARFGEVWDAYWBB-ZDUSSCGKSA-N 1 1 353.378 3.800 20 5 FHBDMO COc1ccc(C[N@H+](Cc2ccccc2)C[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000052866457 938637054 /nfs/dbraw/zinc/63/70/54/938637054.db2.gz GPKCXJGJPCRACL-GOSISDBHSA-N 1 1 356.422 3.785 20 5 FHBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@@H](CC(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000278766460 938840199 /nfs/dbraw/zinc/84/01/99/938840199.db2.gz MYIRDAFADPBHDP-LBPRGKRZSA-N 1 1 359.348 3.506 20 5 FHBDMO COc1cc(C[N@H+]2CC[C@H](c3ccc(F)cc3)C2)c([N+](=O)[O-])cc1OC ZINC000093335614 938924846 /nfs/dbraw/zinc/92/48/46/938924846.db2.gz OGTUUXIHFUQXOA-AWEZNQCLSA-N 1 1 360.385 3.741 20 5 FHBDMO COc1ccc(-c2ccc(C[NH2+]Cc3cccc(C)n3)o2)c([N+](=O)[O-])c1 ZINC000102423652 939018580 /nfs/dbraw/zinc/01/85/80/939018580.db2.gz LSCRGSDDVPUFHK-UHFFFAOYSA-N 1 1 353.378 3.857 20 5 FHBDMO CC(=O)c1cc(N2CC[N@@H+](Cc3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000383104567 945246463 /nfs/dbraw/zinc/24/64/63/945246463.db2.gz GGVDBYSTNQJRTR-OAHLLOKOSA-N 1 1 353.422 3.508 20 5 FHBDMO CC(=O)c1cc(N2CC[N@H+](Cc3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000383104567 945246475 /nfs/dbraw/zinc/24/64/75/945246475.db2.gz GGVDBYSTNQJRTR-OAHLLOKOSA-N 1 1 353.422 3.508 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@@H](C)c1ccccc1 ZINC000411140563 940002217 /nfs/dbraw/zinc/00/22/17/940002217.db2.gz XTSIGHCVKZJDMC-AWEZNQCLSA-N 1 1 357.410 3.625 20 5 FHBDMO Cc1cc(-c2noc([C@H]3CCC[N@H+]3C3CCOCC3)n2)c([N+](=O)[O-])cc1C ZINC000364862155 940011299 /nfs/dbraw/zinc/01/12/99/940011299.db2.gz GDLZQQUJXCNYQR-MRXNPFEDSA-N 1 1 372.425 3.578 20 5 FHBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2ncnc3cccc([N+](=O)[O-])c32)C1 ZINC000612444841 940072809 /nfs/dbraw/zinc/07/28/09/940072809.db2.gz WSXNTSGQJGPOAB-HOTGVXAUSA-N 1 1 369.469 3.629 20 5 FHBDMO Cc1c(NC(=O)CC[N@H+]2CCSC3(CCC3)CC2)cccc1[N+](=O)[O-] ZINC000411872919 940145678 /nfs/dbraw/zinc/14/56/78/940145678.db2.gz WUMHTCDSFIOFPN-UHFFFAOYSA-N 1 1 363.483 3.593 20 5 FHBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000177544510 940269026 /nfs/dbraw/zinc/26/90/26/940269026.db2.gz NRXJIUYAEGUMFD-RWMBFGLXSA-N 1 1 351.834 3.697 20 5 FHBDMO CC(C)c1[nH+]ccn1[C@@H]1CCCN(c2ncnc3sc([N+](=O)[O-])cc32)C1 ZINC000376188063 940439048 /nfs/dbraw/zinc/43/90/48/940439048.db2.gz NPZYDNBWFRPYLB-GFCCVEGCSA-N 1 1 372.454 3.761 20 5 FHBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCC[C@@H](Cc2csc3ccccc23)C1 ZINC000466923140 940460954 /nfs/dbraw/zinc/46/09/54/940460954.db2.gz AAQILMXUUJMSBF-AWEZNQCLSA-N 1 1 370.478 3.998 20 5 FHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H](O)c1ccc(F)cc1F ZINC000066434593 940486887 /nfs/dbraw/zinc/48/68/87/940486887.db2.gz UZRLDUJTVAFCLZ-GOSISDBHSA-N 1 1 350.365 3.817 20 5 FHBDMO CC(=O)c1ccc(Nc2cccc([C@H](C)[NH+]3CCOCC3)c2)c([N+](=O)[O-])c1 ZINC000511456407 940488593 /nfs/dbraw/zinc/48/85/93/940488593.db2.gz XSVRTAOARSFODC-AWEZNQCLSA-N 1 1 369.421 3.934 20 5 FHBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2NCc1cccc(C[NH+]2CCCC2)c1 ZINC000581081805 940493171 /nfs/dbraw/zinc/49/31/71/940493171.db2.gz FYYTUBUHSWSKAH-HXUWFJFHSA-N 1 1 351.450 3.968 20 5 FHBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C(C)C ZINC000581279610 940498310 /nfs/dbraw/zinc/49/83/10/940498310.db2.gz DYYXSJJOAYPVHZ-WBVHZDCISA-N 1 1 360.458 3.636 20 5 FHBDMO O=C1CCCN1Cc1ccccc1C[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000892546762 940714349 /nfs/dbraw/zinc/71/43/49/940714349.db2.gz NALKVXUCIFLPNO-UHFFFAOYSA-N 1 1 373.840 3.660 20 5 FHBDMO CCc1[nH+]ccn1C[C@H]1CCCN1C(=O)Nc1cc([N+](=O)[O-])ccc1CC ZINC000582635775 940774571 /nfs/dbraw/zinc/77/45/71/940774571.db2.gz CWNHIMOCAVUGED-MRXNPFEDSA-N 1 1 371.441 3.613 20 5 FHBDMO O=[N+]([O-])c1cccc([C@@H]([NH2+][C@@H]2c3ccccc3C[C@@H]2O)c2ccccc2)c1 ZINC000180220930 940828990 /nfs/dbraw/zinc/82/89/90/940828990.db2.gz KDCCAAGZNJHBGZ-FDFHNCONSA-N 1 1 360.413 3.932 20 5 FHBDMO O=[N+]([O-])c1cccc([C@H]([NH2+][C@@H]2c3ccccc3C[C@@H]2O)c2ccccc2)c1 ZINC000180220945 940829134 /nfs/dbraw/zinc/82/91/34/940829134.db2.gz KDCCAAGZNJHBGZ-BHDDXSALSA-N 1 1 360.413 3.932 20 5 FHBDMO COc1cc(C)c(C[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1OC ZINC000176990178 941091993 /nfs/dbraw/zinc/09/19/93/941091993.db2.gz AVBBDMWSBOSDSP-UHFFFAOYSA-N 1 1 371.393 3.694 20 5 FHBDMO COc1cc(C)c(C[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1OC ZINC000176990178 941091995 /nfs/dbraw/zinc/09/19/95/941091995.db2.gz AVBBDMWSBOSDSP-UHFFFAOYSA-N 1 1 371.393 3.694 20 5 FHBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3c(N)cccc3[N+](=O)[O-])cc2)C1 ZINC000180939269 941094148 /nfs/dbraw/zinc/09/41/48/941094148.db2.gz SLCNLSDWDSOYAC-CQSZACIVSA-N 1 1 368.437 3.661 20 5 FHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cnn(Cc3ccc(F)cc3)c2)c(Cl)c1 ZINC000189410945 941157254 /nfs/dbraw/zinc/15/72/54/941157254.db2.gz XOSSLDYSIPNSBK-UHFFFAOYSA-N 1 1 374.803 3.922 20 5 FHBDMO CC[C@@H](CO)[N@H+](Cc1ccccc1)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000467189605 941158992 /nfs/dbraw/zinc/15/89/92/941158992.db2.gz BIMHXUGSIZOHDU-INIZCTEOSA-N 1 1 362.401 3.516 20 5 FHBDMO CC[C@@H](CO)[N@@H+](Cc1ccccc1)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000467189605 941158993 /nfs/dbraw/zinc/15/89/93/941158993.db2.gz BIMHXUGSIZOHDU-INIZCTEOSA-N 1 1 362.401 3.516 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@@H]1CC[N@H+](C)[C@@H]1c1ccccc1 ZINC000189783041 941276868 /nfs/dbraw/zinc/27/68/68/941276868.db2.gz UIHFGICMQLFUNF-VQIMIIECSA-N 1 1 368.437 3.779 20 5 FHBDMO Cc1ccc([C@H]2C[C@H](C)[N@H+](Cn3c4cc([N+](=O)[O-])ccc4oc3=O)C2)cc1 ZINC000782954250 941331646 /nfs/dbraw/zinc/33/16/46/941331646.db2.gz LVJWEARFQWBSSY-HOCLYGCPSA-N 1 1 367.405 3.647 20 5 FHBDMO CC[C@@H](C(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1ccccc1 ZINC000452185424 941366489 /nfs/dbraw/zinc/36/64/89/941366489.db2.gz MZKWRXWELSDRQG-KXBFYZLASA-N 1 1 355.438 3.683 20 5 FHBDMO COc1cc(N2CC[NH+]([C@H](C)c3ccccc3[N+](=O)[O-])CC2)ccc1F ZINC000549119336 941399717 /nfs/dbraw/zinc/39/97/17/941399717.db2.gz SDFQZVHFJNYBTM-CQSZACIVSA-N 1 1 359.401 3.626 20 5 FHBDMO CCC[C@]1(CO)CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000290264417 941559671 /nfs/dbraw/zinc/55/96/71/941559671.db2.gz XCTHQADPHNTYPS-SFHVURJKSA-N 1 1 361.467 3.703 20 5 FHBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN2CCCC[C@@H]2[C@H]2CC[NH2+]C2)o1 ZINC000415060575 941578870 /nfs/dbraw/zinc/57/88/70/941578870.db2.gz YSJWFXXJSRQBEC-MAUKXSAKSA-N 1 1 355.438 3.819 20 5 FHBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN2CCCC[C@H]2[C@H]2CC[NH2+]C2)o1 ZINC000415060577 941579326 /nfs/dbraw/zinc/57/93/26/941579326.db2.gz YSJWFXXJSRQBEC-YJBOKZPZSA-N 1 1 355.438 3.819 20 5 FHBDMO Cc1ccc(C(=O)C2CC[NH+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000136981990 941756506 /nfs/dbraw/zinc/75/65/06/941756506.db2.gz HTWOYFOOSYVDMM-HXUWFJFHSA-N 1 1 368.433 3.532 20 5 FHBDMO COC(=O)[C@@H](C)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000182348119 941811894 /nfs/dbraw/zinc/81/18/94/941811894.db2.gz WTRCOSTVWJYSQT-SJCJKPOMSA-N 1 1 362.813 3.888 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@@H](C)C[C@@H]1c1ccccc1 ZINC000513261189 941814235 /nfs/dbraw/zinc/81/42/35/941814235.db2.gz MCTCQNMHQWPKJF-IFXJQAMLSA-N 1 1 353.422 3.925 20 5 FHBDMO COc1ccccc1O[C@H]1CCC[N@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000513376214 941883478 /nfs/dbraw/zinc/88/34/78/941883478.db2.gz MTPATMSBCGLCHN-INIZCTEOSA-N 1 1 372.421 3.655 20 5 FHBDMO COc1ccccc1O[C@H]1CCC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000513376214 941883483 /nfs/dbraw/zinc/88/34/83/941883483.db2.gz MTPATMSBCGLCHN-INIZCTEOSA-N 1 1 372.421 3.655 20 5 FHBDMO COc1ccccc1O[C@@H]1CCC[N@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000513376216 941883669 /nfs/dbraw/zinc/88/36/69/941883669.db2.gz MTPATMSBCGLCHN-MRXNPFEDSA-N 1 1 372.421 3.655 20 5 FHBDMO COc1ccccc1O[C@@H]1CCC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000513376216 941883672 /nfs/dbraw/zinc/88/36/72/941883672.db2.gz MTPATMSBCGLCHN-MRXNPFEDSA-N 1 1 372.421 3.655 20 5 FHBDMO Cc1nc(C)n(C[C@H]2CCC[N@H+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC000182756758 941965904 /nfs/dbraw/zinc/96/59/04/941965904.db2.gz NJOSELNDUSCYDR-PBHICJAKSA-N 1 1 357.458 3.585 20 5 FHBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@@H]1CCN(C2CC2)C1 ZINC000513503539 941966961 /nfs/dbraw/zinc/96/69/61/941966961.db2.gz SWMKDAXDRQGRLH-OAHLLOKOSA-N 1 1 357.479 3.992 20 5 FHBDMO CN(Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000513503539 941966962 /nfs/dbraw/zinc/96/69/62/941966962.db2.gz SWMKDAXDRQGRLH-OAHLLOKOSA-N 1 1 357.479 3.992 20 5 FHBDMO CN(Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000513503539 941966965 /nfs/dbraw/zinc/96/69/65/941966965.db2.gz SWMKDAXDRQGRLH-OAHLLOKOSA-N 1 1 357.479 3.992 20 5 FHBDMO CC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](C)Cc1ccsc1 ZINC000501971021 942145394 /nfs/dbraw/zinc/14/53/94/942145394.db2.gz BJAGKTILQDHLKR-CQSZACIVSA-N 1 1 361.467 3.938 20 5 FHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CCSC3CCCCC3)C2)nc1 ZINC000500984324 942245697 /nfs/dbraw/zinc/24/56/97/942245697.db2.gz LZOXDSVDZQTRKG-AWEZNQCLSA-N 1 1 350.488 3.542 20 5 FHBDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000137028495 942246713 /nfs/dbraw/zinc/24/67/13/942246713.db2.gz NOMOTRFPWPOBSN-CYBMUJFWSA-N 1 1 367.877 3.879 20 5 FHBDMO COc1cc(C[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)c([N+](=O)[O-])cc1F ZINC000420940514 942265632 /nfs/dbraw/zinc/26/56/32/942265632.db2.gz DJYGKVXLFGQHPF-JTQLQIEISA-N 1 1 350.312 3.907 20 5 FHBDMO COc1cc(C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)c([N+](=O)[O-])cc1F ZINC000420940514 942265635 /nfs/dbraw/zinc/26/56/35/942265635.db2.gz DJYGKVXLFGQHPF-JTQLQIEISA-N 1 1 350.312 3.907 20 5 FHBDMO CC[C@@H]1Cc2ccccc2C[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000501054377 942280103 /nfs/dbraw/zinc/28/01/03/942280103.db2.gz NCSQJXCWYIQAHL-QGZVFWFLSA-N 1 1 353.422 3.760 20 5 FHBDMO O=[N+]([O-])c1cnc(NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)c(F)c1 ZINC000413098102 942285882 /nfs/dbraw/zinc/28/58/82/942285882.db2.gz DSCVPBZETSKMNB-LBPRGKRZSA-N 1 1 350.419 3.515 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@H](C)[N@@H+](C)Cc1ccccc1 ZINC000085637640 942315387 /nfs/dbraw/zinc/31/53/87/942315387.db2.gz YQZVPIHJDSRWQE-HNNXBMFYSA-N 1 1 370.453 3.854 20 5 FHBDMO Cc1cccc(N2CCC(Nc3nccc4ccc([N+](=O)[O-])cc43)CC2)[nH+]1 ZINC000413139661 942338345 /nfs/dbraw/zinc/33/83/45/942338345.db2.gz FDXIDPSWDCEHJJ-UHFFFAOYSA-N 1 1 363.421 3.927 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1CN[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000110247955 942347588 /nfs/dbraw/zinc/34/75/88/942347588.db2.gz QJGWDVIJPIIMFA-IBGZPJMESA-N 1 1 369.465 3.748 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1CN[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000110247955 942347593 /nfs/dbraw/zinc/34/75/93/942347593.db2.gz QJGWDVIJPIIMFA-IBGZPJMESA-N 1 1 369.465 3.748 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000502311263 942359325 /nfs/dbraw/zinc/35/93/25/942359325.db2.gz SWBSJTMFHJQLLT-KRWDZBQOSA-N 1 1 354.454 3.816 20 5 FHBDMO Cc1ccc(N2CCC(Nc3ccc([N+](=O)[O-])c4ncccc34)CC2)[nH+]c1 ZINC000413170292 942393583 /nfs/dbraw/zinc/39/35/83/942393583.db2.gz ZBNQKSXDERAQFU-UHFFFAOYSA-N 1 1 363.421 3.927 20 5 FHBDMO O=[N+]([O-])c1ccc2ccnc(N3CC[C@@H]4[C@@H](CCC[N@H+]4C4CC4)C3)c2c1 ZINC000413199110 942458364 /nfs/dbraw/zinc/45/83/64/942458364.db2.gz IRTKPKAKPFSSCB-HNAYVOBHSA-N 1 1 352.438 3.596 20 5 FHBDMO C[N@@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])cc2F)[C@H]1c1ccc(Cl)cc1 ZINC000413200739 942473212 /nfs/dbraw/zinc/47/32/12/942473212.db2.gz FICWALRATIJNFV-LSDHHAIUSA-N 1 1 350.781 3.640 20 5 FHBDMO C[N@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])cc2F)[C@H]1c1ccc(Cl)cc1 ZINC000413200739 942473217 /nfs/dbraw/zinc/47/32/17/942473217.db2.gz FICWALRATIJNFV-LSDHHAIUSA-N 1 1 350.781 3.640 20 5 FHBDMO C[C@H]1C[C@@H](CO)C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000421362926 942515822 /nfs/dbraw/zinc/51/58/22/942515822.db2.gz OJDUGCIMDHAVNZ-QWHCGFSZSA-N 1 1 364.829 3.959 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@@H](N4CCCCC4)C3)o2)cc1 ZINC000513718214 942574133 /nfs/dbraw/zinc/57/41/33/942574133.db2.gz WSPODJUTUFVHAH-GOSISDBHSA-N 1 1 355.438 3.915 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@H](N4CCCCC4)C3)o2)cc1 ZINC000513718214 942574136 /nfs/dbraw/zinc/57/41/36/942574136.db2.gz WSPODJUTUFVHAH-GOSISDBHSA-N 1 1 355.438 3.915 20 5 FHBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CCc1ccccc1 ZINC000104674965 942579808 /nfs/dbraw/zinc/57/98/08/942579808.db2.gz JKVKWDDXZLGCHH-UHFFFAOYSA-N 1 1 351.406 3.967 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)CCOc1ccccc1Cl ZINC000016422092 942598118 /nfs/dbraw/zinc/59/81/18/942598118.db2.gz PVOGIFRKKQLKRF-UHFFFAOYSA-N 1 1 350.802 3.768 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CCOc1ccccc1Cl ZINC000016422092 942598122 /nfs/dbraw/zinc/59/81/22/942598122.db2.gz PVOGIFRKKQLKRF-UHFFFAOYSA-N 1 1 350.802 3.768 20 5 FHBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@@H](c2ccccc2)CC1 ZINC000541347801 942623397 /nfs/dbraw/zinc/62/33/97/942623397.db2.gz PSDNCCDOTXEKBO-RTBURBONSA-N 1 1 370.449 3.604 20 5 FHBDMO Cc1c(C(=O)Nc2nc3c(s2)C[N@H+](C(C)(C)C)CC3)cccc1[N+](=O)[O-] ZINC000425075126 942627514 /nfs/dbraw/zinc/62/75/14/942627514.db2.gz DCDNVMPPFGDFBS-UHFFFAOYSA-N 1 1 374.466 3.769 20 5 FHBDMO Cc1cccc([C@@H]2CC[N@@H+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)C2)c1 ZINC000541391236 942684323 /nfs/dbraw/zinc/68/43/23/942684323.db2.gz XGNMQQAWONUPRN-QGZVFWFLSA-N 1 1 364.405 3.943 20 5 FHBDMO Cc1ccccc1C[C@H]1CCC[N@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000514185781 942794430 /nfs/dbraw/zinc/79/44/30/942794430.db2.gz KWMGAWIKSHGTSD-GOSISDBHSA-N 1 1 367.449 3.857 20 5 FHBDMO Cc1cc(NC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)cn2cc[nH+]c12 ZINC000502888478 942818642 /nfs/dbraw/zinc/81/86/42/942818642.db2.gz OXSNXRUKNFAMTM-UHFFFAOYSA-N 1 1 364.283 3.822 20 5 FHBDMO CC1(C)C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC[C@@H]1C(F)(F)F ZINC000190206175 942858224 /nfs/dbraw/zinc/85/82/24/942858224.db2.gz UMGOVCAZAHMVCZ-AWEZNQCLSA-N 1 1 373.375 3.834 20 5 FHBDMO O=C(Nc1cccc2c1C[N@H+](C1CC1)C2)c1ccc([N+](=O)[O-])cc1Cl ZINC000378526292 942863008 /nfs/dbraw/zinc/86/30/08/942863008.db2.gz MAFTWLOSINXNBM-UHFFFAOYSA-N 1 1 357.797 3.979 20 5 FHBDMO C[N@H+]1CC[C@]2(CCN(Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)C2)C1 ZINC000430114276 942926589 /nfs/dbraw/zinc/92/65/89/942926589.db2.gz CASZZYYLDLPXPG-IBGZPJMESA-N 1 1 357.479 3.851 20 5 FHBDMO CN1CC[C@]2(CC[N@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)C2)C1 ZINC000430114276 942926606 /nfs/dbraw/zinc/92/66/06/942926606.db2.gz CASZZYYLDLPXPG-IBGZPJMESA-N 1 1 357.479 3.851 20 5 FHBDMO CN1CC[C@]2(CC[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)C2)C1 ZINC000430114276 942926612 /nfs/dbraw/zinc/92/66/12/942926612.db2.gz CASZZYYLDLPXPG-IBGZPJMESA-N 1 1 357.479 3.851 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@H](c2ccccc2)[C@H]1C ZINC000434901218 943038086 /nfs/dbraw/zinc/03/80/86/943038086.db2.gz TUVNFSYFENRJME-NVXWUHKLSA-N 1 1 353.422 3.720 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@H](c2ccccc2)[C@H]1C ZINC000434901218 943038091 /nfs/dbraw/zinc/03/80/91/943038091.db2.gz TUVNFSYFENRJME-NVXWUHKLSA-N 1 1 353.422 3.720 20 5 FHBDMO Cc1ccc(NC(=O)NCCC[N@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000514511002 943073431 /nfs/dbraw/zinc/07/34/31/943073431.db2.gz OPTSWKLNAKRVMR-UHFFFAOYSA-N 1 1 356.426 3.547 20 5 FHBDMO CCN(CC)C(=O)C[N@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000434977913 943082197 /nfs/dbraw/zinc/08/21/97/943082197.db2.gz KPXOEFFKDOGDQP-UHFFFAOYSA-N 1 1 361.467 3.624 20 5 FHBDMO CCN(CC)C(=O)C[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000434977913 943082204 /nfs/dbraw/zinc/08/22/04/943082204.db2.gz KPXOEFFKDOGDQP-UHFFFAOYSA-N 1 1 361.467 3.624 20 5 FHBDMO CCc1nn(C)c(S[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000425276137 943150073 /nfs/dbraw/zinc/15/00/73/943150073.db2.gz CZESELQNPRXDDH-HNNXBMFYSA-N 1 1 360.483 3.647 20 5 FHBDMO C[C@H](N[C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000422934571 943337033 /nfs/dbraw/zinc/33/70/33/943337033.db2.gz CPKAYDNBBHSTLQ-ADLFWFRXSA-N 1 1 353.422 3.501 20 5 FHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H]([C@H](O)C(F)(F)F)C1 ZINC000514910373 943381602 /nfs/dbraw/zinc/38/16/02/943381602.db2.gz SHMSUYZMGSEKLC-MUDDQBKWSA-N 1 1 358.360 3.633 20 5 FHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ncnn1-c1ccccc1)CCCC2 ZINC000417333873 943522144 /nfs/dbraw/zinc/52/21/44/943522144.db2.gz QOGAUAUAJBNQSN-LJQANCHMSA-N 1 1 363.421 3.733 20 5 FHBDMO C[N@@H+]1CCN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)c2ccccc2C1 ZINC000504839837 943827125 /nfs/dbraw/zinc/82/71/25/943827125.db2.gz HXLKWDJFNYJGMS-UHFFFAOYSA-N 1 1 367.449 3.985 20 5 FHBDMO C[N@H+]1CCN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)c2ccccc2C1 ZINC000504839837 943827130 /nfs/dbraw/zinc/82/71/30/943827130.db2.gz HXLKWDJFNYJGMS-UHFFFAOYSA-N 1 1 367.449 3.985 20 5 FHBDMO CCCCO[C@@H]1C[C@@H]([N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1(C)C ZINC001167960083 943935737 /nfs/dbraw/zinc/93/57/37/943935737.db2.gz RXWDNEDQBXIXKS-RCCFBDPRSA-N 1 1 350.459 3.544 20 5 FHBDMO CCCCO[C@@H]1C[C@H]([N@@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1(C)C ZINC001167960080 943935859 /nfs/dbraw/zinc/93/58/59/943935859.db2.gz RXWDNEDQBXIXKS-FGTMMUONSA-N 1 1 350.459 3.544 20 5 FHBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@@H+]1CCC[C@@H]1[C@H]1CCCO1 ZINC000425444418 943953103 /nfs/dbraw/zinc/95/31/03/943953103.db2.gz NOUKWSQAGZTQKY-UKRRQHHQSA-N 1 1 355.232 3.501 20 5 FHBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1CCC[C@@H]1[C@H]1CCCO1 ZINC000425444418 943953105 /nfs/dbraw/zinc/95/31/05/943953105.db2.gz NOUKWSQAGZTQKY-UKRRQHHQSA-N 1 1 355.232 3.501 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21 ZINC000511645711 944001593 /nfs/dbraw/zinc/00/15/93/944001593.db2.gz GXTWPSXOPTZQFT-HSALFYBXSA-N 1 1 368.433 3.608 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]Cc1ccnc(N2CCCCC2)c1 ZINC000893329932 944055416 /nfs/dbraw/zinc/05/54/16/944055416.db2.gz VIYFLXGZMQTDGM-UHFFFAOYSA-N 1 1 360.845 3.923 20 5 FHBDMO C[C@H]1[C@H](c2ccccc2)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500093945 944084771 /nfs/dbraw/zinc/08/47/71/944084771.db2.gz SWXAIUKYWYEQFH-DOTOQJQBSA-N 1 1 353.422 3.801 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[N@@H+](C)C[C@H]1c1ccccc1 ZINC000517214669 944096095 /nfs/dbraw/zinc/09/60/95/944096095.db2.gz AMFOFAWJVRNIBM-SFHVURJKSA-N 1 1 368.437 3.732 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[N@H+](C)C[C@H]1c1ccccc1 ZINC000517214669 944096102 /nfs/dbraw/zinc/09/61/02/944096102.db2.gz AMFOFAWJVRNIBM-SFHVURJKSA-N 1 1 368.437 3.732 20 5 FHBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000437839594 944171590 /nfs/dbraw/zinc/17/15/90/944171590.db2.gz UZSWBAXAFLOTTN-DOTOQJQBSA-N 1 1 353.422 3.547 20 5 FHBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000437839594 944171593 /nfs/dbraw/zinc/17/15/93/944171593.db2.gz UZSWBAXAFLOTTN-DOTOQJQBSA-N 1 1 353.422 3.547 20 5 FHBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CCCC[C@H]1C ZINC000505788893 944183121 /nfs/dbraw/zinc/18/31/21/944183121.db2.gz YJWWMMSTDBYUIT-CQSZACIVSA-N 1 1 365.499 3.701 20 5 FHBDMO C[C@]1(c2ccccc2)CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000500172362 944211189 /nfs/dbraw/zinc/21/11/89/944211189.db2.gz MRVYCPQHKYZAPE-NRFANRHFSA-N 1 1 367.449 3.977 20 5 FHBDMO CC(C)[N@H+](CC(=O)N[C@@H](C)c1ccc(F)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000140801739 944241334 /nfs/dbraw/zinc/24/13/34/944241334.db2.gz RQNVGDMWMLHTHK-HNNXBMFYSA-N 1 1 373.428 3.822 20 5 FHBDMO CC(C)[N@@H+](CC(=O)N[C@@H](C)c1ccc(F)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000140801739 944241338 /nfs/dbraw/zinc/24/13/38/944241338.db2.gz RQNVGDMWMLHTHK-HNNXBMFYSA-N 1 1 373.428 3.822 20 5 FHBDMO O=C(CC1CCCC1)N1CCC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000506499134 944387938 /nfs/dbraw/zinc/38/79/38/944387938.db2.gz JMNQLOXXSZWWJB-YHYXMXQVSA-N 1 1 371.481 3.723 20 5 FHBDMO O=C(CC1CCCC1)N1CCC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000506499134 944387947 /nfs/dbraw/zinc/38/79/47/944387947.db2.gz JMNQLOXXSZWWJB-YHYXMXQVSA-N 1 1 371.481 3.723 20 5 FHBDMO O=[N+]([O-])c1ccc(NCC[N@H+]2CCc3sccc3C2)c2ncccc12 ZINC000053580054 944400499 /nfs/dbraw/zinc/40/04/99/944400499.db2.gz AKKYGLDMOMFDRL-UHFFFAOYSA-N 1 1 354.435 3.675 20 5 FHBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@@H]2/C=C\c2ccccc2)c1 ZINC000505844005 944411583 /nfs/dbraw/zinc/41/15/83/944411583.db2.gz CRPOKQMRXVUZMK-YZMSFBEDSA-N 1 1 368.433 3.512 20 5 FHBDMO C[C@@H]1C[C@H](c2ccccc2)CC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000439330333 944542961 /nfs/dbraw/zinc/54/29/61/944542961.db2.gz ZHLDDXRXZOTXOQ-BHIYHBOVSA-N 1 1 370.449 3.603 20 5 FHBDMO COc1cc(C[N@H+](C)Cc2cccc3[nH]ccc32)c([N+](=O)[O-])cc1OC ZINC000426374732 944584311 /nfs/dbraw/zinc/58/43/11/944584311.db2.gz YGDYGWYVLUNTJK-UHFFFAOYSA-N 1 1 355.394 3.725 20 5 FHBDMO COc1cc(C[N@@H+](C)Cc2cccc3[nH]ccc32)c([N+](=O)[O-])cc1OC ZINC000426374732 944584314 /nfs/dbraw/zinc/58/43/14/944584314.db2.gz YGDYGWYVLUNTJK-UHFFFAOYSA-N 1 1 355.394 3.725 20 5 FHBDMO Cc1ccccc1C[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CC1 ZINC000506570947 944598258 /nfs/dbraw/zinc/59/82/58/944598258.db2.gz OWHCSAZIDLPJOL-UHFFFAOYSA-N 1 1 354.406 3.934 20 5 FHBDMO Cc1ccccc1C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CC1 ZINC000506570947 944598268 /nfs/dbraw/zinc/59/82/68/944598268.db2.gz OWHCSAZIDLPJOL-UHFFFAOYSA-N 1 1 354.406 3.934 20 5 FHBDMO C[C@@H](C[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1ccccc1 ZINC000066853573 944632775 /nfs/dbraw/zinc/63/27/75/944632775.db2.gz ZIEGTODKQIPSEJ-AWEZNQCLSA-N 1 1 352.394 3.880 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccncc1OCC(F)F ZINC000519581006 944666810 /nfs/dbraw/zinc/66/68/10/944666810.db2.gz CSSULSRAESHTJY-LBPRGKRZSA-N 1 1 351.353 3.793 20 5 FHBDMO CC(C)(C)c1ccc(C(=O)Nc2c[nH+]ccc2-n2cccn2)cc1[N+](=O)[O-] ZINC000505900254 944793155 /nfs/dbraw/zinc/79/31/55/944793155.db2.gz XRUWEASTAJAAPH-UHFFFAOYSA-N 1 1 365.393 3.725 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C[C@@H](C)c1ccccc1)[C@@H](C)CO ZINC000566814358 944902818 /nfs/dbraw/zinc/90/28/18/944902818.db2.gz IUHJFGMGCJREIC-CVEARBPZSA-N 1 1 358.438 3.590 20 5 FHBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CC[C@@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000437839595 944939090 /nfs/dbraw/zinc/93/90/90/944939090.db2.gz UZSWBAXAFLOTTN-NVXWUHKLSA-N 1 1 353.422 3.547 20 5 FHBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000437839595 944939095 /nfs/dbraw/zinc/93/90/95/944939095.db2.gz UZSWBAXAFLOTTN-NVXWUHKLSA-N 1 1 353.422 3.547 20 5 FHBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000511741476 944979350 /nfs/dbraw/zinc/97/93/50/944979350.db2.gz JCAXBPDBVNUQHR-MRXNPFEDSA-N 1 1 373.478 3.687 20 5 FHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc(-n2cncn2)cc1 ZINC000507168085 945000450 /nfs/dbraw/zinc/00/04/50/945000450.db2.gz BJFFHDXCDSNUBY-UHFFFAOYSA-N 1 1 351.410 3.586 20 5 FHBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCC[N@H+]1CC ZINC000506361078 945021440 /nfs/dbraw/zinc/02/14/40/945021440.db2.gz BZYFLGNUVZWSRU-OAHLLOKOSA-N 1 1 365.499 3.701 20 5 FHBDMO CC[C@H](c1cccc(OC)c1)[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000519026232 945040155 /nfs/dbraw/zinc/04/01/55/945040155.db2.gz HSUPFQFLBDPUHZ-LJQANCHMSA-N 1 1 371.437 3.649 20 5 FHBDMO Cc1ccccc1[C@@H]1CC[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000507208472 945041115 /nfs/dbraw/zinc/04/11/15/945041115.db2.gz QLQFBAAYCZAFDG-MRXNPFEDSA-N 1 1 353.422 3.640 20 5 FHBDMO CCC[N@@H+]1Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])cc3OC)c2C1 ZINC000427473148 945403882 /nfs/dbraw/zinc/40/38/82/945403882.db2.gz JNZRMBCHRXPQJO-UHFFFAOYSA-N 1 1 355.394 3.581 20 5 FHBDMO CCC[N@H+]1Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])cc3OC)c2C1 ZINC000427473148 945403894 /nfs/dbraw/zinc/40/38/94/945403894.db2.gz JNZRMBCHRXPQJO-UHFFFAOYSA-N 1 1 355.394 3.581 20 5 FHBDMO CC[C@H](C)[N@H+](Cc1ccccc1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000507665157 945416109 /nfs/dbraw/zinc/41/61/09/945416109.db2.gz REHMUCVSCFSVQW-QFBILLFUSA-N 1 1 358.438 3.635 20 5 FHBDMO CCC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C[C@H]1CCCCO1 ZINC000106866595 945417857 /nfs/dbraw/zinc/41/78/57/945417857.db2.gz FUOSQGUOTHBHQV-MRXNPFEDSA-N 1 1 363.458 3.513 20 5 FHBDMO CC[C@@H](C)[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000507680291 945444964 /nfs/dbraw/zinc/44/49/64/945444964.db2.gz YULCVSQURXKUPR-MRXNPFEDSA-N 1 1 355.438 3.858 20 5 FHBDMO Cc1nc(C(C)C)ccc1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000549526914 945663872 /nfs/dbraw/zinc/66/38/72/945663872.db2.gz DSCCXEFGTWIWGU-MRXNPFEDSA-N 1 1 355.442 3.503 20 5 FHBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000729479707 945731382 /nfs/dbraw/zinc/73/13/82/945731382.db2.gz CHGFDRSHEYQHNN-KRWDZBQOSA-N 1 1 363.458 3.816 20 5 FHBDMO Cc1ccccc1OCCC[N@@H+](C)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000108255925 945909135 /nfs/dbraw/zinc/90/91/35/945909135.db2.gz ASSPELJSLZOAGK-MRXNPFEDSA-N 1 1 371.437 3.631 20 5 FHBDMO Cc1ccccc1OCCC[N@H+](C)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000108255925 945909137 /nfs/dbraw/zinc/90/91/37/945909137.db2.gz ASSPELJSLZOAGK-MRXNPFEDSA-N 1 1 371.437 3.631 20 5 FHBDMO Cc1cc(NC(=O)N2CC[C@H]([N@@H+](C)Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000613778071 945943470 /nfs/dbraw/zinc/94/34/70/945943470.db2.gz RRBBCYIHVDFDIT-SFHVURJKSA-N 1 1 368.437 3.641 20 5 FHBDMO Cc1cc(C(=O)NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000109305843 946227358 /nfs/dbraw/zinc/22/73/58/946227358.db2.gz SEZZOJHRDGPDMG-SFHVURJKSA-N 1 1 367.449 3.545 20 5 FHBDMO COc1cc(F)ccc1N1CC[NH+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000441382176 946505358 /nfs/dbraw/zinc/50/53/58/946505358.db2.gz NMFIPEWWMHEIBN-AWEZNQCLSA-N 1 1 359.401 3.626 20 5 FHBDMO CCS[C@@H]1CCCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000112090124 946657965 /nfs/dbraw/zinc/65/79/65/946657965.db2.gz ZJJCMLRPTQVCPL-MRXNPFEDSA-N 1 1 352.456 3.569 20 5 FHBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@H](C)[N@@H+](C)Cc1ccccc1 ZINC000475575217 946723423 /nfs/dbraw/zinc/72/34/23/946723423.db2.gz QNJGFUSYSQUCDU-INIZCTEOSA-N 1 1 370.453 3.854 20 5 FHBDMO CC[C@H](C)[C@H](C)[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC)C1CC1 ZINC000112600077 946917916 /nfs/dbraw/zinc/91/79/16/946917916.db2.gz MZIKSXRJCUJWAU-KBPBESRZSA-N 1 1 363.458 3.831 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1Cc2ccccc2OC[C@@H]1C ZINC000543876111 947062915 /nfs/dbraw/zinc/06/29/15/947062915.db2.gz ZGTDQFLEIALJKH-HNNXBMFYSA-N 1 1 369.421 3.515 20 5 FHBDMO C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CC1(c2ccccc2)CC1 ZINC000444686661 947087688 /nfs/dbraw/zinc/08/76/88/947087688.db2.gz XQSLBYHRXQMLLY-UHFFFAOYSA-N 1 1 353.422 3.587 20 5 FHBDMO CCn1nc(C)c([N+](=O)[O-])c1NC[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC000248676284 947100503 /nfs/dbraw/zinc/10/05/03/947100503.db2.gz YXVZQBJEPQYMQJ-XJKSGUPXSA-N 1 1 363.487 3.676 20 5 FHBDMO Cc1c(C[N@H+](C[C@H](O)COc2ccccc2)C(C)C)cccc1[N+](=O)[O-] ZINC000444820921 947255816 /nfs/dbraw/zinc/25/58/16/947255816.db2.gz XFXUKHLBKDLJEN-SFHVURJKSA-N 1 1 358.438 3.554 20 5 FHBDMO COc1ccc(OC)c([C@H]2CCC[N@H+]2CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000523701379 947526596 /nfs/dbraw/zinc/52/65/96/947526596.db2.gz NWTWZYMYVRPRID-LJQANCHMSA-N 1 1 356.422 3.992 20 5 FHBDMO Cc1cccc(C(=O)N2C[C@@H](C)[N@@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000500437609 947536567 /nfs/dbraw/zinc/53/65/67/947536567.db2.gz APDQSCDPJRTGDP-IAGOWNOFSA-N 1 1 367.449 3.638 20 5 FHBDMO Cc1cccc(C(=O)N2C[C@@H](C)[N@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000500437609 947536574 /nfs/dbraw/zinc/53/65/74/947536574.db2.gz APDQSCDPJRTGDP-IAGOWNOFSA-N 1 1 367.449 3.638 20 5 FHBDMO Cc1cccc(C(=O)N2C[C@H](C)[N@@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000500437611 947537004 /nfs/dbraw/zinc/53/70/04/947537004.db2.gz APDQSCDPJRTGDP-IRXDYDNUSA-N 1 1 367.449 3.638 20 5 FHBDMO Cc1cccc(C(=O)N2C[C@H](C)[N@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000500437611 947537009 /nfs/dbraw/zinc/53/70/09/947537009.db2.gz APDQSCDPJRTGDP-IRXDYDNUSA-N 1 1 367.449 3.638 20 5 FHBDMO CC(C)[N@@H+](CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)C1CCC1 ZINC000440664892 947567947 /nfs/dbraw/zinc/56/79/47/947567947.db2.gz ZJZSZYCYGQFPEY-UHFFFAOYSA-N 1 1 374.466 3.920 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCC([N@@H+]2CCC[C@@H]2C)CC1 ZINC000120346945 947595564 /nfs/dbraw/zinc/59/55/64/947595564.db2.gz BDANQIIBWDHXHR-HNNXBMFYSA-N 1 1 360.458 3.692 20 5 FHBDMO Cc1cc(C(=O)N2C[C@H](C)[N@@H+](Cc3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000500441174 947804004 /nfs/dbraw/zinc/80/40/04/947804004.db2.gz XOQSSTCLYBLGGQ-DLBZAZTESA-N 1 1 367.449 3.638 20 5 FHBDMO Cc1cc(C(=O)N2C[C@H](C)[N@H+](Cc3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000500441174 947804006 /nfs/dbraw/zinc/80/40/06/947804006.db2.gz XOQSSTCLYBLGGQ-DLBZAZTESA-N 1 1 367.449 3.638 20 5 FHBDMO CCN(CC)C(=O)[C@H]1CCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000512081860 948375616 /nfs/dbraw/zinc/37/56/16/948375616.db2.gz FIWMXPYLJIAYPF-GOSISDBHSA-N 1 1 371.437 3.688 20 5 FHBDMO COc1ccc(C[NH2+]Cc2cscc2Br)cc1[N+](=O)[O-] ZINC000512090495 948396211 /nfs/dbraw/zinc/39/62/11/948396211.db2.gz WMYHYONMRLZFKV-UHFFFAOYSA-N 1 1 357.229 3.717 20 5 FHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCCN(c3ccc(F)c(F)c3)CC2)cc1 ZINC000520623208 948433643 /nfs/dbraw/zinc/43/36/43/948433643.db2.gz GPCMKPMZVQZEEJ-UHFFFAOYSA-N 1 1 361.392 3.628 20 5 FHBDMO CCOC[C@H]1CCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000072977034 948516206 /nfs/dbraw/zinc/51/62/06/948516206.db2.gz QZBIEHHMFDPPGV-HNNXBMFYSA-N 1 1 359.426 3.541 20 5 FHBDMO CO[C@@H]1[C@H]2C[C@H]3C[N@@H+](Cc4csc(-c5cccc([N+](=O)[O-])c5)n4)[C@H]1[C@H]3C2 ZINC000574796814 948518413 /nfs/dbraw/zinc/51/84/13/948518413.db2.gz LVWLHNIMHIGAJJ-MZDBXJLNSA-N 1 1 371.462 3.574 20 5 FHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCN(C)c2ccccc2C1 ZINC000517908348 567913982 /nfs/dbraw/zinc/91/39/82/567913982.db2.gz UTWXHPBJFJGUCB-UHFFFAOYSA-N 1 1 355.438 3.834 20 5 FHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCN(C)c2ccccc2C1 ZINC000517908348 567913983 /nfs/dbraw/zinc/91/39/83/567913983.db2.gz UTWXHPBJFJGUCB-UHFFFAOYSA-N 1 1 355.438 3.834 20 5 FHBDMO Cc1c(CNC(=O)[C@H]2CCCC[N@H+]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000481479081 567977634 /nfs/dbraw/zinc/97/76/34/567977634.db2.gz PLGBLRBDAQMWJT-HXUWFJFHSA-N 1 1 367.449 3.574 20 5 FHBDMO Cc1ccncc1[C@H](C)[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602583251 567994013 /nfs/dbraw/zinc/99/40/13/567994013.db2.gz WAXRBAOPQCGQCH-VIFPVBQESA-N 1 1 356.245 3.973 20 5 FHBDMO O=[N+]([O-])c1ccc(CN[C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)cc1 ZINC000568510379 568051757 /nfs/dbraw/zinc/05/17/57/568051757.db2.gz WDXYPODSNBRIIP-LJQANCHMSA-N 1 1 351.450 3.882 20 5 FHBDMO O=[N+]([O-])c1ccc(CN[C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)cc1 ZINC000568510379 568051758 /nfs/dbraw/zinc/05/17/58/568051758.db2.gz WDXYPODSNBRIIP-LJQANCHMSA-N 1 1 351.450 3.882 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC(F)(F)[C@@H](CO)C3)s2)cc1 ZINC000291189893 568073909 /nfs/dbraw/zinc/07/39/09/568073909.db2.gz GMRYQEVZVJROOQ-CYBMUJFWSA-N 1 1 368.405 3.773 20 5 FHBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])[C@H](C)C1 ZINC000291237318 568086755 /nfs/dbraw/zinc/08/67/55/568086755.db2.gz APLDQUXLDWCIIM-YGRLFVJLSA-N 1 1 374.268 3.704 20 5 FHBDMO COc1ccc(OCC[N@H+]2Cc3ccccc3C3(CC3)C2)c([N+](=O)[O-])c1 ZINC000481735156 568099801 /nfs/dbraw/zinc/09/98/01/568099801.db2.gz XXMXVTJKGFFFDR-UHFFFAOYSA-N 1 1 354.406 3.530 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@@H]1CCCc2ccccc21 ZINC000008126886 568268624 /nfs/dbraw/zinc/26/86/24/568268624.db2.gz AFXFDGPJCCPRKJ-GOSISDBHSA-N 1 1 369.421 3.551 20 5 FHBDMO CC(C)S(=O)(=O)c1ccc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000541952853 568273426 /nfs/dbraw/zinc/27/34/26/568273426.db2.gz XEGWKKDPURAGGS-AWEZNQCLSA-N 1 1 362.451 3.628 20 5 FHBDMO COc1ccc([C@@H](O)C2CC[NH+](Cc3ccc([N+](=O)[O-])c(F)c3)CC2)cc1 ZINC000291749744 568296479 /nfs/dbraw/zinc/29/64/79/568296479.db2.gz KLYUNLBLQVUBSV-HXUWFJFHSA-N 1 1 374.412 3.688 20 5 FHBDMO C[C@@H]1[C@H](NC(=O)c2c(Cl)cccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000291770466 568304545 /nfs/dbraw/zinc/30/45/45/568304545.db2.gz MOYCIVSTPBPCLJ-CZUORRHYSA-N 1 1 373.840 3.641 20 5 FHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@H](c3ccncc3)C2)c1 ZINC000570173717 568455206 /nfs/dbraw/zinc/45/52/06/568455206.db2.gz LTKWWVSSJJQCBU-ZDUSSCGKSA-N 1 1 351.328 3.998 20 5 FHBDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000609489670 568509499 /nfs/dbraw/zinc/50/94/99/568509499.db2.gz YHHGNWCTRLMGIJ-CYBMUJFWSA-N 1 1 367.877 3.879 20 5 FHBDMO COc1cc(C[N@H+]2CC[C@]3(C2)CCc2ccccc2O3)ccc1[N+](=O)[O-] ZINC000570762607 568520547 /nfs/dbraw/zinc/52/05/47/568520547.db2.gz DXCQLAPKPCFNBB-FQEVSTJZSA-N 1 1 354.406 3.573 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H]2Cc2cccc(F)c2)c2c(c1)COCO2 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ZINC000430761508 933215455 /nfs/dbraw/zinc/21/54/55/933215455.db2.gz MAVCPGMXDUAKCJ-JXXFODFXSA-N 1 1 362.470 3.877 20 5 FHBDMO CC(C)c1ccc(C[N@H+]2C[C@@H](C)O[C@@]3(CCO[C@H](C)C3)C2)cc1[N+](=O)[O-] ZINC000430761508 933215457 /nfs/dbraw/zinc/21/54/57/933215457.db2.gz MAVCPGMXDUAKCJ-JXXFODFXSA-N 1 1 362.470 3.877 20 5 FHBDMO CN(C(=O)[C@H]1CC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1)c1ccccc1 ZINC000430879219 933358151 /nfs/dbraw/zinc/35/81/51/933358151.db2.gz MXWBXLVXWVZGDG-CNRGFGOASA-N 1 1 365.433 3.593 20 5 FHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@H](OCCCc2ccccc2)C1 ZINC000430932134 933425884 /nfs/dbraw/zinc/42/58/84/933425884.db2.gz YCXSLQZOGIQKIN-IBGZPJMESA-N 1 1 370.449 3.697 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCC12CCCCC2 ZINC000611153899 933601931 /nfs/dbraw/zinc/60/19/31/933601931.db2.gz NICVHUXFJJVRRQ-UHFFFAOYSA-N 1 1 361.442 3.731 20 5 FHBDMO C[C@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)[N@@H+]1CCC[C@@H](C)C1 ZINC000610655866 933659259 /nfs/dbraw/zinc/65/92/59/933659259.db2.gz VWUAOZQHJJUGGR-CHWSQXEVSA-N 1 1 374.466 3.777 20 5 FHBDMO C[C@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)[N@H+]1CCC[C@@H](C)C1 ZINC000610655866 933659266 /nfs/dbraw/zinc/65/92/66/933659266.db2.gz VWUAOZQHJJUGGR-CHWSQXEVSA-N 1 1 374.466 3.777 20 5 FHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@@H]1c1nc2ccccc2s1 ZINC000610782692 934179159 /nfs/dbraw/zinc/17/91/59/934179159.db2.gz LNWIIEVVFPRRCJ-CQSZACIVSA-N 1 1 357.439 3.547 20 5 FHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H]1c1nc2ccccc2s1 ZINC000610782692 934179161 /nfs/dbraw/zinc/17/91/61/934179161.db2.gz LNWIIEVVFPRRCJ-CQSZACIVSA-N 1 1 357.439 3.547 20 5 FHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2cccc3c2OCCCO3)C2CC2)c1 ZINC000535785478 934376001 /nfs/dbraw/zinc/37/60/01/934376001.db2.gz PBXHOMDQRSXZGM-UHFFFAOYSA-N 1 1 354.406 3.921 20 5 FHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cccc3c2OCCCO3)C2CC2)c1 ZINC000535785478 934376009 /nfs/dbraw/zinc/37/60/09/934376009.db2.gz PBXHOMDQRSXZGM-UHFFFAOYSA-N 1 1 354.406 3.921 20 5 FHBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1ccc(Br)s1 ZINC000065208839 934667729 /nfs/dbraw/zinc/66/77/29/934667729.db2.gz OQWBLAOTNXDRIB-UHFFFAOYSA-N 1 1 371.256 3.930 20 5 FHBDMO O=[N+]([O-])c1cccc(N2CC[NH+](Cc3cccc(OC(F)F)c3)CC2)c1 ZINC000065234901 934751090 /nfs/dbraw/zinc/75/10/90/934751090.db2.gz OQMAKAPHEVSZFI-UHFFFAOYSA-N 1 1 363.364 3.518 20 5 FHBDMO C[C@H]([NH2+]Cc1cc(C(N)=O)co1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000187708792 934855652 /nfs/dbraw/zinc/85/56/52/934855652.db2.gz GPVBYMWTOJQRKI-NSHDSACASA-N 1 1 371.418 3.866 20 5 FHBDMO Cc1cc(C(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)cc([N+](=O)[O-])c1 ZINC000119670694 934999674 /nfs/dbraw/zinc/99/96/74/934999674.db2.gz SALKMTGIIBSWGR-OAHLLOKOSA-N 1 1 373.478 3.607 20 5 FHBDMO Cc1ccc(NC(=O)[C@@H](C)[N@H+](C)CCc2ccccc2[N+](=O)[O-])c(F)c1 ZINC000511059845 935177931 /nfs/dbraw/zinc/17/79/31/935177931.db2.gz OWPKOPFNNFPVEP-CQSZACIVSA-N 1 1 359.401 3.544 20 5 FHBDMO 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935569620 /nfs/dbraw/zinc/56/96/20/935569620.db2.gz CYLPAIORXIAZTF-UHFFFAOYSA-N 1 1 363.417 3.861 20 5 FHBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@H](c3cccc(C(F)(F)F)c3)C2)n1 ZINC000511103241 935574161 /nfs/dbraw/zinc/57/41/61/935574161.db2.gz BTXGPUBOXOVGKN-AWEZNQCLSA-N 1 1 368.359 3.690 20 5 FHBDMO CCc1ccc(NC(=O)[C@@H](C)[N@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000511128535 935729305 /nfs/dbraw/zinc/72/93/05/935729305.db2.gz XGSZNLVBJIYJKZ-OAHLLOKOSA-N 1 1 355.438 3.659 20 5 FHBDMO CCc1ccc(NC(=O)[C@@H](C)[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000511128535 935729310 /nfs/dbraw/zinc/72/93/10/935729310.db2.gz XGSZNLVBJIYJKZ-OAHLLOKOSA-N 1 1 355.438 3.659 20 5 FHBDMO Cc1cc(-c2nnc(C[N@H+](C)CCc3ccccc3[N+](=O)[O-])o2)c(C)o1 ZINC000511145041 935789591 /nfs/dbraw/zinc/78/95/91/935789591.db2.gz UZEGOOAOQUHKEJ-UHFFFAOYSA-N 1 1 356.382 3.529 20 5 FHBDMO Cc1cc(-c2nnc(C[N@@H+](C)CCc3ccccc3[N+](=O)[O-])o2)c(C)o1 ZINC000511145041 935789594 /nfs/dbraw/zinc/78/95/94/935789594.db2.gz UZEGOOAOQUHKEJ-UHFFFAOYSA-N 1 1 356.382 3.529 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000158564650 935839715 /nfs/dbraw/zinc/83/97/15/935839715.db2.gz XWHPRBNKLFFNGE-INIZCTEOSA-N 1 1 362.474 3.701 20 5 FHBDMO COc1ccc(C[NH2+]Cc2cc(O)cc(C(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000582695145 935950728 /nfs/dbraw/zinc/95/07/28/935950728.db2.gz ZPWQPNYZPDPJBS-UHFFFAOYSA-N 1 1 356.300 3.618 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)NCc1cccc(C[N@H+](C)C(C)C)c1 ZINC000110870922 945138684 /nfs/dbraw/zinc/13/86/84/945138684.db2.gz YIJYOINYGXBNSN-UHFFFAOYSA-N 1 1 355.438 3.673 20 5 FHBDMO C[C@H](Cc1cccs1)[N@@H+](C)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001167610064 936070771 /nfs/dbraw/zinc/07/07/71/936070771.db2.gz ZFMDASXBHMGEQB-GFCCVEGCSA-N 1 1 358.423 3.769 20 5 FHBDMO CCC[N@@H+](C)C[C@H]1CCN(c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000078562849 936202893 /nfs/dbraw/zinc/20/28/93/936202893.db2.gz UVXAVGXXTWSHAO-GFCCVEGCSA-N 1 1 356.264 3.525 20 5 FHBDMO COc1ccc(-n2ccc(C[NH2+][C@H](C)c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000178712849 936279431 /nfs/dbraw/zinc/27/94/31/936279431.db2.gz LFFZZQGSPMFUBQ-CQSZACIVSA-N 1 1 352.394 3.640 20 5 FHBDMO CC(C)(C(=O)NC[C@H]1CCC[N@H+]1C1CCCCC1)c1ccccc1[N+](=O)[O-] ZINC000511806525 945166675 /nfs/dbraw/zinc/16/66/75/945166675.db2.gz JYJHGWWCECHMEU-QGZVFWFLSA-N 1 1 373.497 3.786 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1CCC1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000157496348 938381287 /nfs/dbraw/zinc/38/12/87/938381287.db2.gz DLPMOMWXLMVXKF-QGZVFWFLSA-N 1 1 373.497 3.640 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)n1 ZINC000409644629 938980718 /nfs/dbraw/zinc/98/07/18/938980718.db2.gz KENVVLPBFZAHSQ-OAHLLOKOSA-N 1 1 355.442 3.523 20 5 FHBDMO C[C@H]1[C@@H](Cc2ccccc2)CC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000472336991 938995366 /nfs/dbraw/zinc/99/53/66/938995366.db2.gz GPBZOEUJODAIBE-FUHWJXTLSA-N 1 1 367.449 3.511 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](Cc2ccccc2)[C@@H]1C ZINC000472352521 939015923 /nfs/dbraw/zinc/01/59/23/939015923.db2.gz ZPMLZUMIXUQGGH-FUHWJXTLSA-N 1 1 367.449 3.795 20 5 FHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)cn1 ZINC000612101619 939050521 /nfs/dbraw/zinc/05/05/21/939050521.db2.gz BVSGEGREFYXELJ-QXAKKESOSA-N 1 1 352.438 3.702 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@@H](C4OCCO4)C3)s2)cc1 ZINC000179367176 939096778 /nfs/dbraw/zinc/09/67/78/939096778.db2.gz VGNVNOCTQAAUNB-OAHLLOKOSA-N 1 1 374.462 3.908 20 5 FHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@H](Cn3cnc4ccccc43)C2)cc1 ZINC000614235838 939902149 /nfs/dbraw/zinc/90/21/49/939902149.db2.gz KDUPXRAAWAEMKP-SFHVURJKSA-N 1 1 364.449 3.899 20 5 FHBDMO O=[N+]([O-])c1cnn([C@H]2CCC[N@H+](Cc3ccc(CSC(F)F)o3)C2)c1 ZINC000364330435 939919592 /nfs/dbraw/zinc/91/95/92/939919592.db2.gz VMRLRZLECISQTQ-NSHDSACASA-N 1 1 372.397 3.677 20 5 FHBDMO O=[N+]([O-])c1cnn([C@H]2CCC[N@@H+](Cc3ccc(CSC(F)F)o3)C2)c1 ZINC000364330435 939919593 /nfs/dbraw/zinc/91/95/93/939919593.db2.gz VMRLRZLECISQTQ-NSHDSACASA-N 1 1 372.397 3.677 20 5 FHBDMO Cc1cnc([C@H]2CCC[N@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C2)s1 ZINC000364384784 939936173 /nfs/dbraw/zinc/93/61/73/939936173.db2.gz NGGGNRVOTHCWIW-LBPRGKRZSA-N 1 1 358.423 3.881 20 5 FHBDMO Cc1cnc([C@H]2CCC[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C2)s1 ZINC000364384784 939936175 /nfs/dbraw/zinc/93/61/75/939936175.db2.gz NGGGNRVOTHCWIW-LBPRGKRZSA-N 1 1 358.423 3.881 20 5 FHBDMO Cc1cc(NC(=O)[C@@H]2C[N@H+](C(C)(C)C)C[C@H]2C(F)(F)F)ccc1[N+](=O)[O-] ZINC000410673182 939941124 /nfs/dbraw/zinc/94/11/24/939941124.db2.gz MPJOPEOGYBKRDO-CHWSQXEVSA-N 1 1 373.375 3.751 20 5 FHBDMO CCc1[nH+]ccn1C[C@@H]1CCCN1C(=O)Nc1cc(C)c([N+](=O)[O-])cc1C ZINC000364539652 939961135 /nfs/dbraw/zinc/96/11/35/939961135.db2.gz QBAFGPSLTRLUPO-HNNXBMFYSA-N 1 1 371.441 3.667 20 5 FHBDMO CCC[N@@H+](C[C@@H]1CCCCO1)[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000411371164 940033009 /nfs/dbraw/zinc/03/30/09/940033009.db2.gz WUVHWDXLQGNFBQ-YOEHRIQHSA-N 1 1 374.441 3.987 20 5 FHBDMO CCc1ccc([C@@H](C)NC(=O)C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000548935343 940104025 /nfs/dbraw/zinc/10/40/25/940104025.db2.gz JJLHBXLEMQMQEZ-MRXNPFEDSA-N 1 1 369.465 3.509 20 5 FHBDMO CCc1ccc([C@@H](C)NC(=O)C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000548935343 940104027 /nfs/dbraw/zinc/10/40/27/940104027.db2.gz JJLHBXLEMQMQEZ-MRXNPFEDSA-N 1 1 369.465 3.509 20 5 FHBDMO Cc1ccc(F)cc1NC(=O)[C@H](C)[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548935140 940106425 /nfs/dbraw/zinc/10/64/25/940106425.db2.gz DKCRVUMOOHZXID-AWEZNQCLSA-N 1 1 359.401 3.544 20 5 FHBDMO Cc1ccc(F)cc1NC(=O)[C@H](C)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548935140 940106428 /nfs/dbraw/zinc/10/64/28/940106428.db2.gz DKCRVUMOOHZXID-AWEZNQCLSA-N 1 1 359.401 3.544 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCSC4(CCC4)CC3)n2)cc1 ZINC000411869372 940148372 /nfs/dbraw/zinc/14/83/72/940148372.db2.gz MRSNWMYWRBWIQO-UHFFFAOYSA-N 1 1 360.439 3.506 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3C[C@@H](O)C[C@H]3c3ccccc3)co2)cc1 ZINC000411919077 940157133 /nfs/dbraw/zinc/15/71/33/940157133.db2.gz DSBBPKQLTBTBGY-OALUTQOASA-N 1 1 365.389 3.558 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3C[C@@H](O)C[C@H]3c3ccccc3)co2)cc1 ZINC000411919077 940157135 /nfs/dbraw/zinc/15/71/35/940157135.db2.gz DSBBPKQLTBTBGY-OALUTQOASA-N 1 1 365.389 3.558 20 5 FHBDMO CC(=O)c1cc(N[C@H]2CC[N@@H+](Cc3ccccn3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000376177163 940422829 /nfs/dbraw/zinc/42/28/29/940422829.db2.gz ZZMPTIRSBROWJR-KUHUBIRLSA-N 1 1 368.437 3.515 20 5 FHBDMO CC(=O)c1cc(N[C@H]2CC[N@H+](Cc3ccccn3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000376177163 940422830 /nfs/dbraw/zinc/42/28/30/940422830.db2.gz ZZMPTIRSBROWJR-KUHUBIRLSA-N 1 1 368.437 3.515 20 5 FHBDMO CNC(=O)CC[C@@H]1CCCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000580006279 940430568 /nfs/dbraw/zinc/43/05/68/940430568.db2.gz SXXITKWJORSMFS-INIZCTEOSA-N 1 1 371.437 3.736 20 5 FHBDMO Cn1cc([C@H]([NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])c2ccc(F)cc2)cn1 ZINC000580216148 940468003 /nfs/dbraw/zinc/46/80/03/940468003.db2.gz OMGIXFXJQZVHJL-AZUAARDMSA-N 1 1 366.396 3.834 20 5 FHBDMO Cc1cc(C(=O)N2CC[C@@H](C)[N@H+](Cc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000173508552 940632911 /nfs/dbraw/zinc/63/29/11/940632911.db2.gz ALMGVMZZZLIXND-QGZVFWFLSA-N 1 1 367.449 3.640 20 5 FHBDMO Cc1c([C@@H](C)[NH2+][C@H]2c3sccc3OC(C)(C)[C@@H]2O)cccc1[N+](=O)[O-] ZINC000414179618 940721078 /nfs/dbraw/zinc/72/10/78/940721078.db2.gz KYAWBYQIYNCGLH-XQAQDONZSA-N 1 1 362.451 3.889 20 5 FHBDMO CC1(C)C[C@H]([NH2+]Cc2ccccc2S(C)(=O)=O)c2cc([N+](=O)[O-])ccc21 ZINC000414268334 940862078 /nfs/dbraw/zinc/86/20/78/940862078.db2.gz XATRSOQZULNSPJ-KRWDZBQOSA-N 1 1 374.462 3.511 20 5 FHBDMO C[C@H]([NH2+]CC(=O)Nc1nc2ccc(F)cc2s1)c1cccc([N+](=O)[O-])c1 ZINC000180425669 941012966 /nfs/dbraw/zinc/01/29/66/941012966.db2.gz DIJDDWAXSSGGMO-JTQLQIEISA-N 1 1 374.397 3.633 20 5 FHBDMO Cc1ccc2nc(NC(=O)C[NH2+][C@H](C)c3cccc([N+](=O)[O-])c3)sc2c1 ZINC000180457687 941022095 /nfs/dbraw/zinc/02/20/95/941022095.db2.gz IGLGCMUUKWJMLO-GFCCVEGCSA-N 1 1 370.434 3.802 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH+]3CCC(c4c[nH]cn4)CC3)cs2)c1 ZINC000376494201 941084850 /nfs/dbraw/zinc/08/48/50/941084850.db2.gz ZLIUZOAPZPLCNB-UHFFFAOYSA-N 1 1 369.450 3.821 20 5 FHBDMO CC(C)[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@H]1CCC(=O)N1 ZINC000414556401 941378211 /nfs/dbraw/zinc/37/82/11/941378211.db2.gz KDEVEVHUQDOAPC-CQSZACIVSA-N 1 1 373.478 3.812 20 5 FHBDMO Cc1ccc(CNC[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000414999164 941534896 /nfs/dbraw/zinc/53/48/96/941534896.db2.gz IYZLNKFPFFJMPE-PKOBYXMFSA-N 1 1 357.429 3.525 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC000377185969 941542335 /nfs/dbraw/zinc/54/23/35/941542335.db2.gz UWGQXEHJZIMHDZ-AEFFLSMTSA-N 1 1 367.449 3.544 20 5 FHBDMO CC(C)n1ncc2cc(C[N@@H+](C)CCc3cccc([N+](=O)[O-])c3)cnc21 ZINC000549153253 941546368 /nfs/dbraw/zinc/54/63/68/941546368.db2.gz GZIKODULOYMYPK-UHFFFAOYSA-N 1 1 353.426 3.595 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CC[C@H](C4CCOCC4)C3)cs2)c1 ZINC000377247820 941592789 /nfs/dbraw/zinc/59/27/89/941592789.db2.gz CLKCZOMFXKIARZ-INIZCTEOSA-N 1 1 373.478 3.967 20 5 FHBDMO Cc1[nH+]ccn1-c1ccccc1CNc1ncnc2sc([N+](=O)[O-])cc21 ZINC000549184773 941605537 /nfs/dbraw/zinc/60/55/37/941605537.db2.gz UHXFPRQNVIQVPK-UHFFFAOYSA-N 1 1 366.406 3.706 20 5 FHBDMO COC(=O)[C@H](C)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000182348179 941813610 /nfs/dbraw/zinc/81/36/10/941813610.db2.gz WTRCOSTVWJYSQT-SJKOYZFVSA-N 1 1 362.813 3.888 20 5 FHBDMO COc1ccccc1O[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000513360972 941868168 /nfs/dbraw/zinc/86/81/68/941868168.db2.gz GUNRIHRERHKVHK-INIZCTEOSA-N 1 1 360.385 3.786 20 5 FHBDMO COc1ccccc1O[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000513360972 941868172 /nfs/dbraw/zinc/86/81/72/941868172.db2.gz GUNRIHRERHKVHK-INIZCTEOSA-N 1 1 360.385 3.786 20 5 FHBDMO COc1ccccc1O[C@@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000513395837 941890305 /nfs/dbraw/zinc/89/03/05/941890305.db2.gz AIMIUIUSSDPROG-GOSISDBHSA-N 1 1 372.421 3.526 20 5 FHBDMO Cc1ccccc1OC[C@@H](O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000513401093 941896303 /nfs/dbraw/zinc/89/63/03/941896303.db2.gz IVQWFNXOXJDFIQ-IBGZPJMESA-N 1 1 358.438 3.554 20 5 FHBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@@H]1CCN(C2CC2)C1 ZINC000513472813 941952827 /nfs/dbraw/zinc/95/28/27/941952827.db2.gz MOTAHKJIXJIDBO-QGZVFWFLSA-N 1 1 357.479 3.992 20 5 FHBDMO CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000513472813 941952828 /nfs/dbraw/zinc/95/28/28/941952828.db2.gz MOTAHKJIXJIDBO-QGZVFWFLSA-N 1 1 357.479 3.992 20 5 FHBDMO CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000513472813 941952829 /nfs/dbraw/zinc/95/28/29/941952829.db2.gz MOTAHKJIXJIDBO-QGZVFWFLSA-N 1 1 357.479 3.992 20 5 FHBDMO C[C@H]1C[C@H](CC[NH2+]Cc2ccccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000513488478 941959721 /nfs/dbraw/zinc/95/97/21/941959721.db2.gz VTZATUYMNGZQGU-HKUYNNGSSA-N 1 1 353.466 3.985 20 5 FHBDMO C[C@@H](Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182817198 941971956 /nfs/dbraw/zinc/97/19/56/941971956.db2.gz MTLCLZHGEVLJCV-UKRRQHHQSA-N 1 1 372.469 3.544 20 5 FHBDMO CN(c1ccccc1)c1ccc(CNC[C@H](C2CC2)[NH+](C)C)cc1[N+](=O)[O-] ZINC000513648191 942063998 /nfs/dbraw/zinc/06/39/98/942063998.db2.gz OFGQHVKAGPFHNW-OAQYLSRUSA-N 1 1 368.481 3.793 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@@H]3Cc3ccccc3)o2)cc1 ZINC000073478389 942081777 /nfs/dbraw/zinc/08/17/77/942081777.db2.gz RKRHIIVSJVXMHZ-GOSISDBHSA-N 1 1 364.405 3.852 20 5 FHBDMO O=[N+]([O-])c1cc2ccccc2nc1N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000473535630 942130020 /nfs/dbraw/zinc/13/00/20/942130020.db2.gz XSKDHLCCVXVXOG-QAPCUYQASA-N 1 1 352.438 3.596 20 5 FHBDMO O=[N+]([O-])c1ccc2oc(C[NH+]3CCC(Cc4ccccn4)CC3)nc2c1 ZINC000378035636 942197944 /nfs/dbraw/zinc/19/79/44/942197944.db2.gz AWZSERSJSBKABL-UHFFFAOYSA-N 1 1 352.394 3.586 20 5 FHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(c2ncc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000413084360 942272044 /nfs/dbraw/zinc/27/20/44/942272044.db2.gz UQHOWFISATYIHO-XQQFMLRXSA-N 1 1 372.391 3.850 20 5 FHBDMO Cc1[nH+]ccn1CCCN(C)C(=O)Nc1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000501105479 942310110 /nfs/dbraw/zinc/31/01/10/942310110.db2.gz BLTYISJREFVIBN-UHFFFAOYSA-N 1 1 373.457 3.951 20 5 FHBDMO CC[N@H+]1CC[C@@H](N(C)Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H](C)C1 ZINC000093638667 942363978 /nfs/dbraw/zinc/36/39/78/942363978.db2.gz SZFINNBZRYMOJK-RDTXWAMCSA-N 1 1 374.510 3.880 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCc2ccccc2C1 ZINC000416122591 942367065 /nfs/dbraw/zinc/36/70/65/942367065.db2.gz JQKDUEJKGPLFQR-UHFFFAOYSA-N 1 1 353.422 3.599 20 5 FHBDMO COc1cc(C[N@H+](C)Cc2ccccc2)c([N+](=O)[O-])cc1OCC(F)F ZINC000183242382 942379447 /nfs/dbraw/zinc/37/94/47/942379447.db2.gz SQQMLOIMGVJGFU-UHFFFAOYSA-N 1 1 366.364 3.879 20 5 FHBDMO COc1cc(C[N@@H+](C)Cc2ccccc2)c([N+](=O)[O-])cc1OCC(F)F ZINC000183242382 942379452 /nfs/dbraw/zinc/37/94/52/942379452.db2.gz SQQMLOIMGVJGFU-UHFFFAOYSA-N 1 1 366.364 3.879 20 5 FHBDMO C[C@H]1CCCC[N@H+]1CCC1CCN(c2ncc([N+](=O)[O-])cc2F)CC1 ZINC000413210329 942479403 /nfs/dbraw/zinc/47/94/03/942479403.db2.gz VQZAWSLELWSZEP-AWEZNQCLSA-N 1 1 350.438 3.610 20 5 FHBDMO C[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CCCC[C@@H]1C ZINC000501477241 942501602 /nfs/dbraw/zinc/50/16/02/942501602.db2.gz IPXSYPCGECEFFZ-NWDGAFQWSA-N 1 1 354.838 3.633 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CCCC[C@H]3Cn3cccn3)co2)cc1 ZINC000378307064 942563417 /nfs/dbraw/zinc/56/34/17/942563417.db2.gz BOFBGRYBMWAGMD-SFHVURJKSA-N 1 1 367.409 3.501 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCCC[C@H]3Cn3cccn3)co2)cc1 ZINC000378307064 942563422 /nfs/dbraw/zinc/56/34/22/942563422.db2.gz BOFBGRYBMWAGMD-SFHVURJKSA-N 1 1 367.409 3.501 20 5 FHBDMO CC(C)[N@@H+](CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)C1CC1 ZINC000434621306 942794029 /nfs/dbraw/zinc/79/40/29/942794029.db2.gz RILVDYZOZCYMSZ-UHFFFAOYSA-N 1 1 360.439 3.530 20 5 FHBDMO Cc1ccccc1C[C@H]1CCC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000514188267 942815671 /nfs/dbraw/zinc/81/56/71/942815671.db2.gz CIOTURJYIMJPIV-QGZVFWFLSA-N 1 1 353.422 3.549 20 5 FHBDMO Cc1cccc(C(=O)N2CCC[N@@H+]([C@H](C)c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000434640020 942831151 /nfs/dbraw/zinc/83/11/51/942831151.db2.gz XRDPYGMFWMLNAZ-QGZVFWFLSA-N 1 1 367.449 3.812 20 5 FHBDMO Cc1cccc(C(=O)N2CCC[N@H+]([C@H](C)c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000434640020 942831157 /nfs/dbraw/zinc/83/11/57/942831157.db2.gz XRDPYGMFWMLNAZ-QGZVFWFLSA-N 1 1 367.449 3.812 20 5 FHBDMO C[N@@H+]1CC[C@@]2(CCN(Cc3ccc(-c4ccc([N+](=O)[O-])cc4)s3)C2)C1 ZINC000430116361 942928532 /nfs/dbraw/zinc/92/85/32/942928532.db2.gz HIXUJUXKOIYELJ-LJQANCHMSA-N 1 1 357.479 3.851 20 5 FHBDMO C[N@H+]1CC[C@@]2(CCN(Cc3ccc(-c4ccc([N+](=O)[O-])cc4)s3)C2)C1 ZINC000430116361 942928536 /nfs/dbraw/zinc/92/85/36/942928536.db2.gz HIXUJUXKOIYELJ-LJQANCHMSA-N 1 1 357.479 3.851 20 5 FHBDMO Cn1cc[nH+]c1CC1CCN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)CC1 ZINC000133626055 942949166 /nfs/dbraw/zinc/94/91/66/942949166.db2.gz WUXVIHLTUYSHNC-UHFFFAOYSA-N 1 1 372.469 3.965 20 5 FHBDMO CC(C)[C@@H]1CCC[N@H+]1CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000434831956 942990266 /nfs/dbraw/zinc/99/02/66/942990266.db2.gz PTHBFYCTMQFBBH-INIZCTEOSA-N 1 1 374.466 3.777 20 5 FHBDMO Cc1ccccc1OCCC[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000434836266 942992793 /nfs/dbraw/zinc/99/27/93/942992793.db2.gz LLUKRWUWQIWJMA-UHFFFAOYSA-N 1 1 355.394 3.945 20 5 FHBDMO O=[N+]([O-])c1cccc(OCC[N@H+](Cc2ccccc2)C[C@H]2CCCO2)c1 ZINC000505552605 943009740 /nfs/dbraw/zinc/00/97/40/943009740.db2.gz BLVKDXCBRBMSDF-HXUWFJFHSA-N 1 1 356.422 3.655 20 5 FHBDMO COCC[N@@H+](C)CC[C@H](Nc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000505560901 943020914 /nfs/dbraw/zinc/02/09/14/943020914.db2.gz YQGPZRGTZHWNRB-SFHVURJKSA-N 1 1 361.417 3.855 20 5 FHBDMO C[C@H]1[C@@H](c2ccccc2)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000434899528 943037279 /nfs/dbraw/zinc/03/72/79/943037279.db2.gz IJWZAHIHZXAQMA-KXBFYZLASA-N 1 1 353.422 3.801 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H](c2ccccc2)[C@@H]1C ZINC000434901219 943037806 /nfs/dbraw/zinc/03/78/06/943037806.db2.gz TUVNFSYFENRJME-RDJZCZTQSA-N 1 1 353.422 3.720 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H](c2ccccc2)[C@@H]1C ZINC000434901219 943037814 /nfs/dbraw/zinc/03/78/14/943037814.db2.gz TUVNFSYFENRJME-RDJZCZTQSA-N 1 1 353.422 3.720 20 5 FHBDMO O=[N+]([O-])c1ccn(CC[N@@H+](Cc2cc(F)ccc2F)C2CCCC2)n1 ZINC000434904780 943042361 /nfs/dbraw/zinc/04/23/61/943042361.db2.gz GSVRUUZYUZKITN-UHFFFAOYSA-N 1 1 350.369 3.514 20 5 FHBDMO CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ncc(Cl)cc1[N+](=O)[O-] ZINC000434944373 943057033 /nfs/dbraw/zinc/05/70/33/943057033.db2.gz VPNWZLHTVJGBLN-INIZCTEOSA-N 1 1 374.872 3.992 20 5 FHBDMO CC[N@@H+](C)[C@@H](C(=O)NCc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000183751888 943124650 /nfs/dbraw/zinc/12/46/50/943124650.db2.gz MCECIYXRRGMGAG-QGZVFWFLSA-N 1 1 361.829 3.557 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000503405639 943166183 /nfs/dbraw/zinc/16/61/83/943166183.db2.gz KCICCFXNCYESOC-MRXNPFEDSA-N 1 1 370.453 3.516 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CC[C@H](c4ccccc4F)C3)n2)c1 ZINC000503653000 943321513 /nfs/dbraw/zinc/32/15/13/943321513.db2.gz BKSCIRUVBHMPKO-AWEZNQCLSA-N 1 1 368.368 3.773 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CC[C@H](c4ccccc4F)C3)n2)c1 ZINC000503653000 943321519 /nfs/dbraw/zinc/32/15/19/943321519.db2.gz BKSCIRUVBHMPKO-AWEZNQCLSA-N 1 1 368.368 3.773 20 5 FHBDMO C[C@@]1(CNC(=O)c2ccc(F)cc2[N+](=O)[O-])CCC[N@H+]1Cc1ccccc1 ZINC000162331917 943332505 /nfs/dbraw/zinc/33/25/05/943332505.db2.gz JRGGNQMZCNPODC-FQEVSTJZSA-N 1 1 371.412 3.518 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@H](c4nnc[nH]4)C3)o2)c(Cl)c1 ZINC000425358794 943364793 /nfs/dbraw/zinc/36/47/93/943364793.db2.gz RMSTZLPGMRSNCW-NSHDSACASA-N 1 1 373.800 3.616 20 5 FHBDMO COc1cccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C[C@@H]2CCCO2)c1 ZINC000053221428 943379989 /nfs/dbraw/zinc/37/99/89/943379989.db2.gz OBCXHWRKWYIPLZ-FQEVSTJZSA-N 1 1 356.422 3.785 20 5 FHBDMO CCc1ccc([C@@H](NCC[C@@H]2CCC[NH2+]C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423258874 943461912 /nfs/dbraw/zinc/46/19/12/943461912.db2.gz MXKCUVMFJKOZAQ-YWZLYKJASA-N 1 1 357.454 3.819 20 5 FHBDMO Cc1cccc(C[NH+]2CCN(C(=O)Nc3ccc(C)c([N+](=O)[O-])c3)CC2)c1 ZINC000515114020 943512125 /nfs/dbraw/zinc/51/21/25/943512125.db2.gz PUYHMPDWKRPIIK-UHFFFAOYSA-N 1 1 368.437 3.561 20 5 FHBDMO C[C@H]1CN(c2cccc3cnccc32)CC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000515123888 943516336 /nfs/dbraw/zinc/51/63/36/943516336.db2.gz MAHFUJOHQBCJLL-INIZCTEOSA-N 1 1 362.433 3.854 20 5 FHBDMO C[C@H]1CN(c2cccc3cnccc32)CC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000515123888 943516340 /nfs/dbraw/zinc/51/63/40/943516340.db2.gz MAHFUJOHQBCJLL-INIZCTEOSA-N 1 1 362.433 3.854 20 5 FHBDMO O=C1CCc2cc([N+](=O)[O-])c(NC[C@@H]3CCC[N@H+]3C3CCCCC3)cc2N1 ZINC000435600783 943519946 /nfs/dbraw/zinc/51/99/46/943519946.db2.gz GDKFYRSHKOUJNH-INIZCTEOSA-N 1 1 372.469 3.689 20 5 FHBDMO COc1ccc([C@@H]2CC[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000504501773 943647374 /nfs/dbraw/zinc/64/73/74/943647374.db2.gz BHALSLARKOAPOK-QGZVFWFLSA-N 1 1 356.422 3.862 20 5 FHBDMO C[C@H](c1ccccc1)N(C)C(=O)C[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000504590204 943701134 /nfs/dbraw/zinc/70/11/34/943701134.db2.gz QLAARRGQTBDYJZ-HOFZKYPUSA-N 1 1 367.449 3.759 20 5 FHBDMO C[C@H](c1ccccc1)N(C)C(=O)C[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000504590204 943701135 /nfs/dbraw/zinc/70/11/35/943701135.db2.gz QLAARRGQTBDYJZ-HOFZKYPUSA-N 1 1 367.449 3.759 20 5 FHBDMO C[C@H]1CCC[N@@H+](CCCCNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000516845198 943765667 /nfs/dbraw/zinc/76/56/67/943765667.db2.gz WEKOFJLHBXARLR-AWEZNQCLSA-N 1 1 359.426 3.583 20 5 FHBDMO CCn1c(C)nc([N+](=O)[O-])c1N(C)[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000515325160 943788972 /nfs/dbraw/zinc/78/89/72/943788972.db2.gz MMGVPBQDTNAKJA-CRAIPNDOSA-N 1 1 371.485 3.609 20 5 FHBDMO C[C@@H]([N@@H+](C)CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)C1(C)CC1 ZINC000437524209 943903624 /nfs/dbraw/zinc/90/36/24/943903624.db2.gz MHDADYJOICDVQM-GFCCVEGCSA-N 1 1 374.466 3.777 20 5 FHBDMO C[C@@H]1[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])CCC12CCOCC2 ZINC000425431163 943921411 /nfs/dbraw/zinc/92/14/11/943921411.db2.gz HKTCRPCNEOUJJA-LBPRGKRZSA-N 1 1 369.259 3.748 20 5 FHBDMO CCOc1ccc([C@H](C)N[C@@H]2CC[N@@H+](CC3CCCC3)C2)cc1[N+](=O)[O-] ZINC000504929772 943926496 /nfs/dbraw/zinc/92/64/96/943926496.db2.gz LGUJRZGSXRCMAH-MAUKXSAKSA-N 1 1 361.486 3.909 20 5 FHBDMO CCOc1ccc([C@H](C)[NH2+][C@@H]2CCN(CC3CCCC3)C2)cc1[N+](=O)[O-] ZINC000504929772 943926501 /nfs/dbraw/zinc/92/65/01/943926501.db2.gz LGUJRZGSXRCMAH-MAUKXSAKSA-N 1 1 361.486 3.909 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C[C@@H](C)c1ccccc1)[C@@H](C)CO ZINC000517048565 943951455 /nfs/dbraw/zinc/95/14/55/943951455.db2.gz SKBISJHGFCHDGZ-CVEARBPZSA-N 1 1 358.438 3.590 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21 ZINC000511645710 944001857 /nfs/dbraw/zinc/00/18/57/944001857.db2.gz GXTWPSXOPTZQFT-AQNXPRMDSA-N 1 1 368.433 3.608 20 5 FHBDMO O=[N+]([O-])c1cc(Br)ccc1C[NH2+][C@@H](CCO)c1ccccc1 ZINC000425460738 944005945 /nfs/dbraw/zinc/00/59/45/944005945.db2.gz RKTJJOPNXSVZEN-HNNXBMFYSA-N 1 1 365.227 3.571 20 5 FHBDMO CCO[C@H]1CC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C[C@H]1C ZINC000425492135 944111303 /nfs/dbraw/zinc/11/13/03/944111303.db2.gz MVVFCPBCZXGOCK-ABAIWWIYSA-N 1 1 357.248 3.604 20 5 FHBDMO CCO[C@H]1CC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C[C@H]1C ZINC000425492135 944111307 /nfs/dbraw/zinc/11/13/07/944111307.db2.gz MVVFCPBCZXGOCK-ABAIWWIYSA-N 1 1 357.248 3.604 20 5 FHBDMO CC[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])[C@@H](C)Cc1ccsc1 ZINC000425921036 944175364 /nfs/dbraw/zinc/17/53/64/944175364.db2.gz QNTFRHYIQSVPTE-AWEZNQCLSA-N 1 1 361.467 3.856 20 5 FHBDMO COc1cc(C[NH+]2CCC(OC3CCCC3)CC2)c([N+](=O)[O-])cc1F ZINC000184259023 944354946 /nfs/dbraw/zinc/35/49/46/944354946.db2.gz VHWOLGZBYALQIS-UHFFFAOYSA-N 1 1 352.406 3.666 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@H]3[C@H](O)C(F)(F)F)o2)cc1 ZINC000123687108 944397388 /nfs/dbraw/zinc/39/73/88/944397388.db2.gz GIHUJPOMCNXVGJ-HOCLYGCPSA-N 1 1 370.327 3.742 20 5 FHBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3cc(C(F)(F)F)ccc3F)CC2)n1 ZINC000425973519 944467656 /nfs/dbraw/zinc/46/76/56/944467656.db2.gz JMRGSIALDKNVSN-UHFFFAOYSA-N 1 1 372.322 3.786 20 5 FHBDMO O=C(NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000110390144 944475413 /nfs/dbraw/zinc/47/54/13/944475413.db2.gz WSEUMRQGEZMYHP-CTXDPNEZSA-N 1 1 365.433 3.520 20 5 FHBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[N@@H+](CC)C1 ZINC000506209272 944526737 /nfs/dbraw/zinc/52/67/37/944526737.db2.gz VGZZXJIVFRIEEP-AWEZNQCLSA-N 1 1 365.499 3.559 20 5 FHBDMO C[C@H]1[C@@H](CO)CC[N@H+]1Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000425998160 944585523 /nfs/dbraw/zinc/58/55/23/944585523.db2.gz GHKNJJONXJKSRJ-DZGCQCFKSA-N 1 1 360.385 3.729 20 5 FHBDMO CC[C@H]1CC[N@H+]([C@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)C1 ZINC000438485021 944667680 /nfs/dbraw/zinc/66/76/80/944667680.db2.gz CKSOVYSFEMKRKB-OLZOCXBDSA-N 1 1 374.466 3.777 20 5 FHBDMO Cc1ccc(NC(=O)c2ccc(NC[C@@H]3CC[N@H+](C)C3)c([N+](=O)[O-])c2)cc1 ZINC000517827618 944690498 /nfs/dbraw/zinc/69/04/98/944690498.db2.gz DBZPHRAIYCMGLX-HNNXBMFYSA-N 1 1 368.437 3.519 20 5 FHBDMO CN(Cc1ccc([N+](=O)[O-])cc1F)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000383074036 944707927 /nfs/dbraw/zinc/70/79/27/944707927.db2.gz ZQFIUFVMOZBAFT-KRWDZBQOSA-N 1 1 357.429 3.688 20 5 FHBDMO Cn1ccnc1[C@H]([NH2+][C@H]1CCCC(F)(F)C1)c1cccc([N+](=O)[O-])c1 ZINC000518805896 944785752 /nfs/dbraw/zinc/78/57/52/944785752.db2.gz BWNVPACGIGYGHO-DZGCQCFKSA-N 1 1 350.369 3.585 20 5 FHBDMO Cn1ccnc1[C@@H]([NH2+][C@H]1CCCC(F)(F)C1)c1cccc([N+](=O)[O-])c1 ZINC000518805899 944786226 /nfs/dbraw/zinc/78/62/26/944786226.db2.gz BWNVPACGIGYGHO-ZFWWWQNUSA-N 1 1 350.369 3.585 20 5 FHBDMO C[C@@H](CNC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)[N@H+]1CCCC[C@@H]1C ZINC000437933602 944811558 /nfs/dbraw/zinc/81/15/58/944811558.db2.gz PPHIJZNIOYNVMB-HOTGVXAUSA-N 1 1 374.485 3.532 20 5 FHBDMO O=C(C[N@H+]1CC[C@H]2CCC[C@@H]21)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000426455518 944841467 /nfs/dbraw/zinc/84/14/67/944841467.db2.gz TWROVJBEYWOWGE-WBMJQRKESA-N 1 1 372.450 3.531 20 5 FHBDMO 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/nfs/dbraw/zinc/09/59/43/946095943.db2.gz MEHHIFSZBVSROT-SJLPKXTDSA-N 1 1 367.449 3.544 20 5 FHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](C[C@@H]3CCC4(CCCCCC4)O3)C2)nc1 ZINC001167778388 946097587 /nfs/dbraw/zinc/09/75/87/946097587.db2.gz FLCIWFUAHVYBEA-WMZOPIPTSA-N 1 1 374.485 3.748 20 5 FHBDMO CC[C@H](Cc1ccc(C)cc1)[N@@H+](CC)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000444237327 946108587 /nfs/dbraw/zinc/10/85/87/946108587.db2.gz JDMCDGDLVCWAIY-LJQANCHMSA-N 1 1 369.465 3.845 20 5 FHBDMO C/C(=C/C(=O)NCCCC[N@@H+]1CCC[C@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000785283390 946225885 /nfs/dbraw/zinc/22/58/85/946225885.db2.gz RUABKALSFNFVJK-GDGUIRGDSA-N 1 1 359.470 3.626 20 5 FHBDMO COc1ccc(-c2ccc(CNC[C@@H]3CC[N@H+](C(C)C)C3)o2)c([N+](=O)[O-])c1 ZINC000549551690 946321982 /nfs/dbraw/zinc/32/19/82/946321982.db2.gz XCMKSRSKIPEPTE-HNNXBMFYSA-N 1 1 373.453 3.683 20 5 FHBDMO CCOc1ccc(NC(=O)C[N@H+](Cc2ccccc2)C2CC2)c([N+](=O)[O-])c1 ZINC000025120345 946491637 /nfs/dbraw/zinc/49/16/37/946491637.db2.gz GQTKTWYRKZMOMJ-UHFFFAOYSA-N 1 1 369.421 3.597 20 5 FHBDMO CCOc1ccc(NC(=O)C[N@@H+](Cc2ccccc2)C2CC2)c([N+](=O)[O-])c1 ZINC000025120345 946491647 /nfs/dbraw/zinc/49/16/47/946491647.db2.gz GQTKTWYRKZMOMJ-UHFFFAOYSA-N 1 1 369.421 3.597 20 5 FHBDMO O=C(C[N@H+](Cc1ccccc1)C1CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000025120379 946493517 /nfs/dbraw/zinc/49/35/17/946493517.db2.gz DYMAJPMMOQIPCA-UHFFFAOYSA-N 1 1 359.813 3.851 20 5 FHBDMO O=C(C[N@@H+](Cc1ccccc1)C1CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000025120379 946493528 /nfs/dbraw/zinc/49/35/28/946493528.db2.gz DYMAJPMMOQIPCA-UHFFFAOYSA-N 1 1 359.813 3.851 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH+]3CCC(O)(C4CCC4)CC3)cs2)c1 ZINC000897034809 946504839 /nfs/dbraw/zinc/50/48/39/946504839.db2.gz MDWPRKZCUHNNOO-UHFFFAOYSA-N 1 1 373.478 3.845 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H](C)[N@@H+](C)Cc1ccccc1 ZINC000111700560 946514073 /nfs/dbraw/zinc/51/40/73/946514073.db2.gz QFXVUOMAHXPLOA-OAHLLOKOSA-N 1 1 356.426 3.545 20 5 FHBDMO Cc1ccc2[nH]c(C[N@H+]3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)cc2c1C ZINC000473141740 946580668 /nfs/dbraw/zinc/58/06/68/946580668.db2.gz AYBFOBAPEKIXNU-OAHLLOKOSA-N 1 1 365.437 3.774 20 5 FHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CCC[C@@H](Nc4ccccc4)C3)nc2c1 ZINC000444664684 947090958 /nfs/dbraw/zinc/09/09/58/947090958.db2.gz OHSBPTSEPWTYFU-OAHLLOKOSA-N 1 1 351.410 3.548 20 5 FHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@@H](Nc4ccccc4)C3)nc2c1 ZINC000444664684 947090969 /nfs/dbraw/zinc/09/09/69/947090969.db2.gz OHSBPTSEPWTYFU-OAHLLOKOSA-N 1 1 351.410 3.548 20 5 FHBDMO CC[C@H]1CCCC[C@@H]1[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000444667136 947093942 /nfs/dbraw/zinc/09/39/42/947093942.db2.gz AVMJRXBPSITRKX-YOEHRIQHSA-N 1 1 363.458 3.833 20 5 FHBDMO CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC)[C@H]1CCCC[C@@H]1C ZINC000444679484 947104522 /nfs/dbraw/zinc/10/45/22/947104522.db2.gz VBVGKNGKXOVCGB-YOEHRIQHSA-N 1 1 363.458 3.833 20 5 FHBDMO 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CC(C)[C@H]1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CCS1 ZINC000072836950 947556318 /nfs/dbraw/zinc/55/63/18/947556318.db2.gz DCSPSXDMSVBEMW-QGZVFWFLSA-N 1 1 361.467 3.866 20 5 FHBDMO CCO[C@H]1C[C@H]([N@@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1(C)C ZINC000536363699 947770749 /nfs/dbraw/zinc/77/07/49/947770749.db2.gz QUUZHSTYCIFTSX-IRXDYDNUSA-N 1 1 359.426 3.885 20 5 FHBDMO C[C@]1(O)CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000129400138 947820994 /nfs/dbraw/zinc/82/09/94/947820994.db2.gz DJBHPTRGAAFJCL-KRWDZBQOSA-N 1 1 350.802 3.855 20 5 FHBDMO Cc1cc(C[NH2+]Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)on1 ZINC000105455561 948037484 /nfs/dbraw/zinc/03/74/84/948037484.db2.gz BFERJPJLACTDPL-UHFFFAOYSA-N 1 1 352.394 3.949 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CCCCC[C@@H]3CCO)cs2)c1 ZINC000585767833 948278497 /nfs/dbraw/zinc/27/84/97/948278497.db2.gz HVXQAWOCJVTQDD-MRXNPFEDSA-N 1 1 361.467 3.845 20 5 FHBDMO Clc1nc2ccc3ccccc3c2nc1NCC[NH+]1CCSCC1 ZINC001167837285 948310635 /nfs/dbraw/zinc/31/06/35/948310635.db2.gz JAGBHBMOSCJCGM-UHFFFAOYSA-N 1 1 358.898 3.897 20 5 FHBDMO COc1ccc(NC(=O)C[N@@H+](Cc2ccccc2)C(C)(C)C)c([N+](=O)[O-])c1 ZINC000438595341 948327291 /nfs/dbraw/zinc/32/72/91/948327291.db2.gz GJLBXMKFZJMAMQ-UHFFFAOYSA-N 1 1 371.437 3.843 20 5 FHBDMO CCC(C)(C)[C@H]1CCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000441637247 948432387 /nfs/dbraw/zinc/43/23/87/948432387.db2.gz UOPSMMOMWCTYAS-QGZVFWFLSA-N 1 1 363.458 3.833 20 5 FHBDMO O=C(NC1CC1)c1ccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000025181019 948632213 /nfs/dbraw/zinc/63/22/13/948632213.db2.gz OWXQXUSHCIAZNH-UHFFFAOYSA-N 1 1 365.433 3.652 20 5 FHBDMO CC(C)COC1CC[NH+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000728898748 948633269 /nfs/dbraw/zinc/63/32/69/948633269.db2.gz KGNACNICIHNFIT-UHFFFAOYSA-N 1 1 358.442 3.553 20 5 FHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@](CO)(C(C)C)C1 ZINC000550433723 948644402 /nfs/dbraw/zinc/64/44/02/948644402.db2.gz SHVIINPURVACGM-LJQANCHMSA-N 1 1 350.459 3.613 20 5 FHBDMO CC(C)c1ccc(C[NH2+][C@H](C[S@@](C)=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000182097301 948662943 /nfs/dbraw/zinc/66/29/43/948662943.db2.gz VUUUCDAXQZDNIS-IQGLISFBSA-N 1 1 360.479 3.928 20 5 FHBDMO COc1ccc(C[N@H+](C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)cc1C ZINC000728900183 948806116 /nfs/dbraw/zinc/80/61/16/948806116.db2.gz GGGPSOBESBVHRG-UHFFFAOYSA-N 1 1 366.421 3.865 20 5 FHBDMO COc1ccc(C[N@@H+](C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)cc1C ZINC000728900183 948806129 /nfs/dbraw/zinc/80/61/29/948806129.db2.gz GGGPSOBESBVHRG-UHFFFAOYSA-N 1 1 366.421 3.865 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000043149547 567840199 /nfs/dbraw/zinc/84/01/99/567840199.db2.gz LYOQXSCXKXEMJO-UHFFFAOYSA-N 1 1 368.437 3.643 20 5 FHBDMO COc1ccc2c(c1)C1(CC1)C[N@@H+](CCOc1ccccc1[N+](=O)[O-])C2 ZINC000568112738 567888597 /nfs/dbraw/zinc/88/85/97/567888597.db2.gz OGBFYUNXOVJVSJ-UHFFFAOYSA-N 1 1 354.406 3.530 20 5 FHBDMO COc1ccc2c(c1)C1(CC1)C[N@H+](CCOc1ccccc1[N+](=O)[O-])C2 ZINC000568112738 567888598 /nfs/dbraw/zinc/88/85/98/567888598.db2.gz OGBFYUNXOVJVSJ-UHFFFAOYSA-N 1 1 354.406 3.530 20 5 FHBDMO O=[N+]([O-])c1ccc(OC2CC[NH+](Cc3ccc(C(F)F)nc3)CC2)cc1 ZINC000602477174 567984446 /nfs/dbraw/zinc/98/44/46/567984446.db2.gz RMHUWSVRICZKDV-UHFFFAOYSA-N 1 1 363.364 3.971 20 5 FHBDMO COc1cc(C[N@H+]2C[C@H](C)CC[C@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000490341115 568033850 /nfs/dbraw/zinc/03/38/50/568033850.db2.gz PCKVXQAMYRZHMU-VXGBXAGGSA-N 1 1 358.385 3.868 20 5 FHBDMO Cc1sc(C(=O)N2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)cc1[N+](=O)[O-] ZINC000265004331 568060837 /nfs/dbraw/zinc/06/08/37/568060837.db2.gz FGYPQLXIQWPJTK-ZFWWWQNUSA-N 1 1 365.499 3.691 20 5 FHBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])[C@@H](C)C1 ZINC000291237313 568086721 /nfs/dbraw/zinc/08/67/21/568086721.db2.gz APLDQUXLDWCIIM-IINYFYTJSA-N 1 1 374.268 3.704 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000481715165 568094006 /nfs/dbraw/zinc/09/40/06/568094006.db2.gz XITUVHLDDSZNJR-HXUWFJFHSA-N 1 1 354.406 3.625 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000481715165 568094007 /nfs/dbraw/zinc/09/40/07/568094007.db2.gz XITUVHLDDSZNJR-HXUWFJFHSA-N 1 1 354.406 3.625 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(N2CC[C@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)n1 ZINC000481996426 568219124 /nfs/dbraw/zinc/21/91/24/568219124.db2.gz AEWNVKJYNQQTPL-OAQYLSRUSA-N 1 1 366.465 3.791 20 5 FHBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000568921890 568252493 /nfs/dbraw/zinc/25/24/93/568252493.db2.gz ORSRYEYAVSFUSW-ZBFHGGJFSA-N 1 1 374.485 3.932 20 5 FHBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC3(CCC3)[C@@H]2c2ccccc2)c1 ZINC000453023917 568254752 /nfs/dbraw/zinc/25/47/52/568254752.db2.gz SBTLSFZKNYHGDU-ICSRJNTNSA-N 1 1 368.433 3.562 20 5 FHBDMO Cc1cc(C(=O)NC[C@@H](c2ccccc2Cl)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000008262422 568284850 /nfs/dbraw/zinc/28/48/50/568284850.db2.gz YSJPOEQIJYUAIU-KRWDZBQOSA-N 1 1 361.829 3.589 20 5 FHBDMO COC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1OC)c1cccc(Cl)c1 ZINC000570196686 568460885 /nfs/dbraw/zinc/46/08/85/568460885.db2.gz BXTPQYIVSTWADY-MRXNPFEDSA-N 1 1 350.802 3.734 20 5 FHBDMO COc1cc(C[N@H+]2CC[C@@]3(C2)CCc2ccccc2O3)ccc1[N+](=O)[O-] ZINC000570762608 568520568 /nfs/dbraw/zinc/52/05/68/568520568.db2.gz DXCQLAPKPCFNBB-HXUWFJFHSA-N 1 1 354.406 3.573 20 5 FHBDMO O=[N+]([O-])c1cnc(Cl)cc1N1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001164618554 719063411 /nfs/dbraw/zinc/06/34/11/719063411.db2.gz BBIANLPRMBMXRS-QAPCUYQASA-N 1 1 372.856 3.744 20 5 FHBDMO Cc1cc([N+](=O)[O-])cnc1N1CCC[C@@]2(CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001164994857 722192262 /nfs/dbraw/zinc/19/22/62/722192262.db2.gz QHAUADWYKPRFAP-HXUWFJFHSA-N 1 1 370.428 3.682 20 5 FHBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)CCCCc1ccccc1 ZINC001167053847 927504871 /nfs/dbraw/zinc/50/48/71/927504871.db2.gz CGIBHYQPOQKJJK-MRXNPFEDSA-N 1 1 355.438 3.877 20 5 FHBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+](C)[C@H]2CCCOC2)cc1OC ZINC000510077271 927791365 /nfs/dbraw/zinc/79/13/65/927791365.db2.gz BORDWRQBNTWHSO-HOCLYGCPSA-N 1 1 366.458 3.639 20 5 FHBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+](C)[C@H]2CCCOC2)cc1OC ZINC000510077271 927791373 /nfs/dbraw/zinc/79/13/73/927791373.db2.gz BORDWRQBNTWHSO-HOCLYGCPSA-N 1 1 366.458 3.639 20 5 FHBDMO COc1ccc(OC)c([C@@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2OC)c1 ZINC000430212546 928141574 /nfs/dbraw/zinc/14/15/74/928141574.db2.gz OBFWLYAFQHJJQR-SFHVURJKSA-N 1 1 372.421 3.958 20 5 FHBDMO COc1ccc(OC)c([C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2OC)c1 ZINC000430212546 928141596 /nfs/dbraw/zinc/14/15/96/928141596.db2.gz OBFWLYAFQHJJQR-SFHVURJKSA-N 1 1 372.421 3.958 20 5 FHBDMO Cc1ccc(NC(=O)[C@H]2CCC[N@H+]([C@H](C)c3ccccc3[N+](=O)[O-])C2)nc1 ZINC000471156275 928146202 /nfs/dbraw/zinc/14/62/02/928146202.db2.gz JUCISHOOFRCQDG-CVEARBPZSA-N 1 1 368.437 3.710 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]1c1ccc2c(c1)OCO2 ZINC000430214594 928176975 /nfs/dbraw/zinc/17/69/75/928176975.db2.gz BXSHVPUDEXWMHX-MRXNPFEDSA-N 1 1 356.378 3.669 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1c1ccc2c(c1)OCO2 ZINC000430214594 928176987 /nfs/dbraw/zinc/17/69/87/928176987.db2.gz BXSHVPUDEXWMHX-MRXNPFEDSA-N 1 1 356.378 3.669 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1ccc(OC(F)F)cc1 ZINC000430221457 928260698 /nfs/dbraw/zinc/26/06/98/928260698.db2.gz RVNWYQULILEKPF-UHFFFAOYSA-N 1 1 352.337 3.837 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1ccc(OC(F)F)cc1 ZINC000430221457 928260711 /nfs/dbraw/zinc/26/07/11/928260711.db2.gz RVNWYQULILEKPF-UHFFFAOYSA-N 1 1 352.337 3.837 20 5 FHBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCCCC[N@@H+]1CCCC[C@@H]1C ZINC000445196537 929023937 /nfs/dbraw/zinc/02/39/37/929023937.db2.gz WQSPNVIDMQLJGC-AWEZNQCLSA-N 1 1 367.877 3.941 20 5 FHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C(=O)N(C)c2ccccc2)C1 ZINC000430296404 929399126 /nfs/dbraw/zinc/39/91/26/929399126.db2.gz JBTIHIORUVJLNY-DOTOQJQBSA-N 1 1 353.422 3.641 20 5 FHBDMO COc1ccccc1O[C@@H]1CCC[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000583325935 937348406 /nfs/dbraw/zinc/34/84/06/937348406.db2.gz DWECIZGMRNKCNG-QGZVFWFLSA-N 1 1 356.422 3.955 20 5 FHBDMO Cc1cc(C(=O)NCC[C@@H](C)[N@@H+](C)Cc2ccccc2)cc([N+](=O)[O-])c1 ZINC000471460892 929752884 /nfs/dbraw/zinc/75/28/84/929752884.db2.gz UTURQMSPFVEFKJ-MRXNPFEDSA-N 1 1 355.438 3.544 20 5 FHBDMO CCN(C[C@H]1CCC[N@H+]1CC)C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000579993622 929789444 /nfs/dbraw/zinc/78/94/44/929789444.db2.gz OIEGOSUAZBJCEV-OAHLLOKOSA-N 1 1 361.467 3.756 20 5 FHBDMO Cc1c(NC(=O)N2CC[C@H]([N@@H+](C)Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000610317615 929885386 /nfs/dbraw/zinc/88/53/86/929885386.db2.gz IXBMBSVSLPMLGY-KRWDZBQOSA-N 1 1 368.437 3.641 20 5 FHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCC[C@H]1C[C@H](O)c1cccs1 ZINC000175845933 929953686 /nfs/dbraw/zinc/95/36/86/929953686.db2.gz ZFCUFSLJBLSGQG-HOCLYGCPSA-N 1 1 350.415 3.884 20 5 FHBDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000610062980 930065441 /nfs/dbraw/zinc/06/54/41/930065441.db2.gz MZGSABVKUZGIRL-GOSISDBHSA-N 1 1 361.486 3.643 20 5 FHBDMO COc1ccc(C)cc1C[NH+]1CCN([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000610367433 930162959 /nfs/dbraw/zinc/16/29/59/930162959.db2.gz HWDBVUIHCUPSQT-KRWDZBQOSA-N 1 1 369.465 3.791 20 5 FHBDMO CCc1ccc(C(=O)N2CC[C@H]([N@@H+](C)Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000610437731 930604214 /nfs/dbraw/zinc/60/42/14/930604214.db2.gz LGKHXMJWDAOPCC-IBGZPJMESA-N 1 1 367.449 3.504 20 5 FHBDMO COc1ccc(NC(=O)C[N@H+]2CCC[C@@H](C(C)(C)C)CC2)c([N+](=O)[O-])c1 ZINC001167406029 930715467 /nfs/dbraw/zinc/71/54/67/930715467.db2.gz MVUBQFBJAZPFCL-CQSZACIVSA-N 1 1 363.458 3.690 20 5 FHBDMO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCC[C@@H]2C[C@H](O)c2cccs2)cc1 ZINC000175816910 930747812 /nfs/dbraw/zinc/74/78/12/930747812.db2.gz BDBZZSRUVRVNFS-WBVHZDCISA-N 1 1 362.451 3.623 20 5 FHBDMO COc1ccc(CN2CC[N@@H+](Cc3ccccc3)CC[C@H]2C)cc1[N+](=O)[O-] ZINC000610451949 931018630 /nfs/dbraw/zinc/01/86/30/931018630.db2.gz PRTYLTXLSYCDLV-QGZVFWFLSA-N 1 1 369.465 3.700 20 5 FHBDMO CN(Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000581218305 931693436 /nfs/dbraw/zinc/69/34/36/931693436.db2.gz MVESXXGKWKSEAP-XYPWUTKMSA-N 1 1 355.438 3.912 20 5 FHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+]([C@@H]3CCCc4ccc(F)cc43)C2)nc1 ZINC000510383284 931811855 /nfs/dbraw/zinc/81/18/55/931811855.db2.gz ZYVBGQMUKDZMQA-CRAIPNDOSA-N 1 1 356.401 3.693 20 5 FHBDMO O=[N+]([O-])c1ccc(CNC[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000394053998 932323371 /nfs/dbraw/zinc/32/33/71/932323371.db2.gz ZBTKSTOJQHCHSA-HXUWFJFHSA-N 1 1 353.466 3.987 20 5 FHBDMO Cc1cc(C(=O)NC[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000247382371 932856348 /nfs/dbraw/zinc/85/63/48/932856348.db2.gz LNBHZBMWFZWFBW-CRAIPNDOSA-N 1 1 373.478 3.778 20 5 FHBDMO CCN1C[C@@H](C[N@@H+](C)[C@@H](C)c2cccc([N+](=O)[O-])c2)Oc2ccccc21 ZINC000610556990 932969361 /nfs/dbraw/zinc/96/93/61/932969361.db2.gz HXTQDEFXIJGSLB-MAUKXSAKSA-N 1 1 355.438 3.875 20 5 FHBDMO Cc1cccc(C(=O)NC[C@H](C2CC2)[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000187608503 933021544 /nfs/dbraw/zinc/02/15/44/933021544.db2.gz GGSMXTKXULZSOL-LJQANCHMSA-N 1 1 367.449 3.544 20 5 FHBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccnc1-n1cc[nH+]c1C ZINC000588444509 933102415 /nfs/dbraw/zinc/10/24/15/933102415.db2.gz PWDLYDUSLQSTNT-SEYXRHQNSA-N 1 1 363.377 3.526 20 5 FHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC[C@H](OCCCc2ccccc2)C1 ZINC000430936163 933441346 /nfs/dbraw/zinc/44/13/46/933441346.db2.gz STNDURIPYSHWEQ-KRWDZBQOSA-N 1 1 358.413 3.958 20 5 FHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@H](OCCCc2ccccc2)C1 ZINC000430936163 933441352 /nfs/dbraw/zinc/44/13/52/933441352.db2.gz STNDURIPYSHWEQ-KRWDZBQOSA-N 1 1 358.413 3.958 20 5 FHBDMO COc1cccc(NC[C@H]2CC[N@@H+](CCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000548443979 933797928 /nfs/dbraw/zinc/79/79/28/933797928.db2.gz GDPZRDHCFVYUNQ-QGZVFWFLSA-N 1 1 355.438 3.580 20 5 FHBDMO COc1cccc(NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000548443978 933798128 /nfs/dbraw/zinc/79/81/28/933798128.db2.gz GDPZRDHCFVYUNQ-KRWDZBQOSA-N 1 1 355.438 3.580 20 5 FHBDMO Cc1nn(C)cc1[C@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000610729568 933988226 /nfs/dbraw/zinc/98/82/26/933988226.db2.gz OCJHJXQNEASFCO-GOSISDBHSA-N 1 1 358.442 3.761 20 5 FHBDMO Cc1nn(C)cc1[C@H]1CCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000610729568 933988230 /nfs/dbraw/zinc/98/82/30/933988230.db2.gz OCJHJXQNEASFCO-GOSISDBHSA-N 1 1 358.442 3.761 20 5 FHBDMO CCO[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)C1 ZINC000610930440 934626115 /nfs/dbraw/zinc/62/61/15/934626115.db2.gz DGOZUQMUSYQEMR-OAHLLOKOSA-N 1 1 360.410 3.864 20 5 FHBDMO COc1cc(C[N@H+]2C[C@@H](C)C[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000538738432 934899306 /nfs/dbraw/zinc/89/93/06/934899306.db2.gz VPLNOFDNUGYCSR-QWRGUYRKSA-N 1 1 362.348 3.775 20 5 FHBDMO CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)[C@H](C)[C@H]1C ZINC000538917603 934948022 /nfs/dbraw/zinc/94/80/22/934948022.db2.gz CLQFDYDAFMINAY-ZIAGYGMSSA-N 1 1 365.499 3.508 20 5 FHBDMO CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)[C@H](C)[C@H]1C ZINC000538917603 934948024 /nfs/dbraw/zinc/94/80/24/934948024.db2.gz CLQFDYDAFMINAY-ZIAGYGMSSA-N 1 1 365.499 3.508 20 5 FHBDMO Cc1cnc(C2CC[NH+](Cc3nc4cc([N+](=O)[O-])ccc4o3)CC2)s1 ZINC000277321320 934949206 /nfs/dbraw/zinc/94/92/06/934949206.db2.gz DJUJYFSFQIHLPD-UHFFFAOYSA-N 1 1 358.423 3.881 20 5 FHBDMO COc1cc(C[N@H+]2CC[C@H]3CCC[C@@H]32)c([N+](=O)[O-])cc1OCC(F)F ZINC000426526465 945081517 /nfs/dbraw/zinc/08/15/17/945081517.db2.gz SYTSXBMVNQLWHP-YPMHNXCESA-N 1 1 356.369 3.622 20 5 FHBDMO C[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[S@]1=O ZINC000277445658 935184056 /nfs/dbraw/zinc/18/40/56/935184056.db2.gz JPJVZOKIGICMLC-RKNYENMMSA-N 1 1 364.492 3.666 20 5 FHBDMO C[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[S@]1=O ZINC000277445658 935184058 /nfs/dbraw/zinc/18/40/58/935184058.db2.gz JPJVZOKIGICMLC-RKNYENMMSA-N 1 1 364.492 3.666 20 5 FHBDMO O=[N+]([O-])c1ccc(N2CC[C@@H](n3c[nH+]c4c3CCCC4)C2)c2ccncc21 ZINC000548661527 935194348 /nfs/dbraw/zinc/19/43/48/935194348.db2.gz HXMLCDUSKBUBRA-CQSZACIVSA-N 1 1 363.421 3.670 20 5 FHBDMO C[C@@H](c1ccncc1)[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000091989725 935198971 /nfs/dbraw/zinc/19/89/71/935198971.db2.gz RZIQDPJSSATBFN-AWEZNQCLSA-N 1 1 352.394 3.880 20 5 FHBDMO Cc1ccc(F)cc1NC(=O)[C@@H](C)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511073384 935256488 /nfs/dbraw/zinc/25/64/88/935256488.db2.gz OWLPWCWGMNQPIO-CQSZACIVSA-N 1 1 359.401 3.544 20 5 FHBDMO Cc1ccc(F)cc1NC(=O)[C@@H](C)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511073384 935256491 /nfs/dbraw/zinc/25/64/91/935256491.db2.gz OWLPWCWGMNQPIO-CQSZACIVSA-N 1 1 359.401 3.544 20 5 FHBDMO Cc1c([C@@H](C)[NH2+]Cc2ccn(Cc3ccccc3)n2)cccc1[N+](=O)[O-] ZINC000551563381 935311704 /nfs/dbraw/zinc/31/17/04/935311704.db2.gz GIAGXBLCTZHFMJ-MRXNPFEDSA-N 1 1 350.422 3.999 20 5 FHBDMO Cn1cc(C[N@H+]2CC3(CCC3)[C@@H]2C2CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000582273238 935477689 /nfs/dbraw/zinc/47/76/89/935477689.db2.gz GTFQFAFUGCEXFZ-IBGZPJMESA-N 1 1 352.438 3.760 20 5 FHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@@H](OCCCc3ccccc3)C2)cc1 ZINC001167567380 935587165 /nfs/dbraw/zinc/58/71/65/935587165.db2.gz FRXWRFIANXXSRM-OAQYLSRUSA-N 1 1 354.450 3.861 20 5 FHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])[C@H]1CCN(c2ccc(Cl)cc2)C1=O ZINC000511106214 935591106 /nfs/dbraw/zinc/59/11/06/935591106.db2.gz LPVHBYZQYBTDQS-SFHVURJKSA-N 1 1 373.840 3.528 20 5 FHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])[C@H]1CCN(c2ccc(Cl)cc2)C1=O ZINC000511106214 935591110 /nfs/dbraw/zinc/59/11/10/935591110.db2.gz LPVHBYZQYBTDQS-SFHVURJKSA-N 1 1 373.840 3.528 20 5 FHBDMO O=[N+]([O-])c1cnn(CC[N@H+](Cc2ccccc2C(F)(F)F)CC2CC2)c1 ZINC000511121404 935692795 /nfs/dbraw/zinc/69/27/95/935692795.db2.gz FTICVXWJVQLOBI-UHFFFAOYSA-N 1 1 368.359 3.722 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCN2c3ccccc3C[C@H]2C1 ZINC000562045915 935694058 /nfs/dbraw/zinc/69/40/58/935694058.db2.gz KDSVBPBTQDGQFV-IBGZPJMESA-N 1 1 367.449 3.631 20 5 FHBDMO C[C@H](c1nc(-c2ccccc2)no1)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511141455 935780954 /nfs/dbraw/zinc/78/09/54/935780954.db2.gz MGFWQMXMFZFSKI-CQSZACIVSA-N 1 1 352.394 3.880 20 5 FHBDMO C[C@H](c1nc(-c2ccccc2)no1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511141455 935780957 /nfs/dbraw/zinc/78/09/57/935780957.db2.gz MGFWQMXMFZFSKI-CQSZACIVSA-N 1 1 352.394 3.880 20 5 FHBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000479189704 935816667 /nfs/dbraw/zinc/81/66/67/935816667.db2.gz GJNALCJOZXVRAL-INIZCTEOSA-N 1 1 367.449 3.899 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000158562733 935839621 /nfs/dbraw/zinc/83/96/21/935839621.db2.gz LJTUCBOGWHJXFE-MAUKXSAKSA-N 1 1 372.469 3.692 20 5 FHBDMO Cc1ccc([C@H]2CCCCC[N@H+]2Cc2ccc(C(N)=O)cc2[N+](=O)[O-])o1 ZINC000158655991 935887486 /nfs/dbraw/zinc/88/74/86/935887486.db2.gz LYFXTDFANZBTRY-MRXNPFEDSA-N 1 1 357.410 3.712 20 5 FHBDMO NC(=O)c1ccc(C[N@H+]2CCC[C@@H]2Cc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000140531258 945135949 /nfs/dbraw/zinc/13/59/49/945135949.db2.gz JCOFWJLSGPLGGT-MRXNPFEDSA-N 1 1 373.840 3.554 20 5 FHBDMO C[C@@H]([NH2+]C1CCN(CCc2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000178643957 936024655 /nfs/dbraw/zinc/02/46/55/936024655.db2.gz SZEDUXMONHQCJS-QGZVFWFLSA-N 1 1 353.466 3.953 20 5 FHBDMO Cc1nn(C)c(NCc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)c1[N+](=O)[O-] ZINC000076772038 936033643 /nfs/dbraw/zinc/03/36/43/936033643.db2.gz JEJDDLQQTUIPPC-CQSZACIVSA-N 1 1 357.458 3.623 20 5 FHBDMO CC[C@@H]1C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC[C@@H]1c1ccccc1 ZINC000472262296 936140490 /nfs/dbraw/zinc/14/04/90/936140490.db2.gz URDGWTCBDNHDDW-BEFAXECRSA-N 1 1 367.449 3.709 20 5 FHBDMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000277918205 936174019 /nfs/dbraw/zinc/17/40/19/936174019.db2.gz PQSWSPQOHIABKK-HNNXBMFYSA-N 1 1 363.461 3.698 20 5 FHBDMO COCC[N@@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)Cc1scnc1C ZINC000426547286 945153419 /nfs/dbraw/zinc/15/34/19/945153419.db2.gz ZPCFXJRZRIXSFU-ZROIWOOFSA-N 1 1 361.467 3.912 20 5 FHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@H](O)Cc1ccccc1C(F)(F)F ZINC000179001145 938465207 /nfs/dbraw/zinc/46/52/07/938465207.db2.gz UUCCQKKLJIJOGF-OAHLLOKOSA-N 1 1 368.355 3.649 20 5 FHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](Cc2ccccc2)[C@H]1C ZINC000472308464 938490954 /nfs/dbraw/zinc/49/09/54/938490954.db2.gz AABVJPZXPLEQOH-JFIYKMOQSA-N 1 1 367.449 3.875 20 5 FHBDMO CN(C(=O)C[N@H+](C)Cc1csc2ccccc12)c1ccc([N+](=O)[O-])cc1 ZINC000052805988 938605189 /nfs/dbraw/zinc/60/51/89/938605189.db2.gz DGYYKCJJKVUJTQ-UHFFFAOYSA-N 1 1 369.446 3.904 20 5 FHBDMO CN(C(=O)C[N@@H+](C)Cc1csc2ccccc12)c1ccc([N+](=O)[O-])cc1 ZINC000052805988 938605190 /nfs/dbraw/zinc/60/51/90/938605190.db2.gz DGYYKCJJKVUJTQ-UHFFFAOYSA-N 1 1 369.446 3.904 20 5 FHBDMO Cc1c(NC(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C)cccc1[N+](=O)[O-] ZINC000584191557 938636878 /nfs/dbraw/zinc/63/68/78/938636878.db2.gz MICLLDJMCXUWRS-YJBOKZPZSA-N 1 1 368.437 3.688 20 5 FHBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)C[N@@H+](C)Cc1ccccc1 ZINC000584440345 938887619 /nfs/dbraw/zinc/88/76/19/938887619.db2.gz OAQRAKKMQIPBOK-OAHLLOKOSA-N 1 1 370.453 3.799 20 5 FHBDMO COc1ccc([N+](=O)[O-])c(N2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)c1 ZINC000409637619 938978741 /nfs/dbraw/zinc/97/87/41/938978741.db2.gz YTQJJAIPIUDDIT-CQSZACIVSA-N 1 1 356.426 3.520 20 5 FHBDMO C[C@@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@@H]1c1cccc(F)c1 ZINC000472344992 939006148 /nfs/dbraw/zinc/00/61/48/939006148.db2.gz BNTUFKKTUDHFKZ-VLIAUNLRSA-N 1 1 371.412 3.780 20 5 FHBDMO C[C@@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@@H]1c1cccc(F)c1 ZINC000472344992 939006149 /nfs/dbraw/zinc/00/61/49/939006149.db2.gz BNTUFKKTUDHFKZ-VLIAUNLRSA-N 1 1 371.412 3.780 20 5 FHBDMO C[N@H+](Cc1c[nH]nc1-c1c(F)cccc1F)Cc1ccccc1[N+](=O)[O-] ZINC000179315327 939079630 /nfs/dbraw/zinc/07/96/30/939079630.db2.gz MCQZUDNUKXRKQJ-UHFFFAOYSA-N 1 1 358.348 3.895 20 5 FHBDMO C[N@@H+](Cc1c[nH]nc1-c1c(F)cccc1F)Cc1ccccc1[N+](=O)[O-] ZINC000179315327 939079634 /nfs/dbraw/zinc/07/96/34/939079634.db2.gz MCQZUDNUKXRKQJ-UHFFFAOYSA-N 1 1 358.348 3.895 20 5 FHBDMO CC[C@H](C)[N@@H+](C)Cc1cc(OC)c(OCC(F)(F)F)cc1[N+](=O)[O-] ZINC000179323867 939086014 /nfs/dbraw/zinc/08/60/14/939086014.db2.gz KLMAXHOXGDKJEX-JTQLQIEISA-N 1 1 350.337 3.775 20 5 FHBDMO O=C(C[N@H+]1C[C@H](c2ccccc2)[C@@H]2CCC[C@H]21)Nc1ccccc1[N+](=O)[O-] ZINC000511845873 945265938 /nfs/dbraw/zinc/26/59/38/945265938.db2.gz XUFOPIZIRRQYCI-YQVWRLOYSA-N 1 1 365.433 3.801 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1 ZINC000179518471 939876548 /nfs/dbraw/zinc/87/65/48/939876548.db2.gz YTSSKPGYOMZYJG-CYBMUJFWSA-N 1 1 361.833 3.623 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1 ZINC000179518471 939876550 /nfs/dbraw/zinc/87/65/50/939876550.db2.gz YTSSKPGYOMZYJG-CYBMUJFWSA-N 1 1 361.833 3.623 20 5 FHBDMO COc1ccc(NC(=O)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000179519224 939876667 /nfs/dbraw/zinc/87/66/67/939876667.db2.gz OPDGWMCLNRGVQO-UHFFFAOYSA-N 1 1 369.421 3.597 20 5 FHBDMO C[C@@H]1C[C@H](c2cccnc2)[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000364105316 939904506 /nfs/dbraw/zinc/90/45/06/939904506.db2.gz VUVRZWLISGEFJA-CXAGYDPISA-N 1 1 365.393 3.623 20 5 FHBDMO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000364105316 939904511 /nfs/dbraw/zinc/90/45/11/939904511.db2.gz VUVRZWLISGEFJA-CXAGYDPISA-N 1 1 365.393 3.623 20 5 FHBDMO Cc1cccc(NC2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3)CC2)[nH+]1 ZINC000364745621 939992367 /nfs/dbraw/zinc/99/23/67/939992367.db2.gz ZBGYCEHBMUXOAM-UHFFFAOYSA-N 1 1 374.828 3.668 20 5 FHBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000065881373 940018749 /nfs/dbraw/zinc/01/87/49/940018749.db2.gz SFUKYXOJRSOQOH-UHFFFAOYSA-N 1 1 361.829 3.630 20 5 FHBDMO Cc1nc([C@H]2CCC[N@H+]2CCC(=O)Nc2ccc([N+](=O)[O-])cc2)cs1 ZINC000411554590 940062057 /nfs/dbraw/zinc/06/20/57/940062057.db2.gz LKXLKJCKZXTQBS-MRXNPFEDSA-N 1 1 360.439 3.525 20 5 FHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1nnc(-c2ccc(Cl)cc2)o1 ZINC000548934423 940095569 /nfs/dbraw/zinc/09/55/69/940095569.db2.gz FKKWXCQEGTZYPW-UHFFFAOYSA-N 1 1 372.812 3.973 20 5 FHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1nnc(-c2ccc(Cl)cc2)o1 ZINC000548934423 940095571 /nfs/dbraw/zinc/09/55/71/940095571.db2.gz FKKWXCQEGTZYPW-UHFFFAOYSA-N 1 1 372.812 3.973 20 5 FHBDMO C[C@@H]1CC[S@@](=O)CC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000365478207 940171936 /nfs/dbraw/zinc/17/19/36/940171936.db2.gz RZVWHIBLKYRJME-YEBMWUKDSA-N 1 1 364.492 3.666 20 5 FHBDMO C[C@@H]1CC[S@@](=O)CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000365478207 940171939 /nfs/dbraw/zinc/17/19/39/940171939.db2.gz RZVWHIBLKYRJME-YEBMWUKDSA-N 1 1 364.492 3.666 20 5 FHBDMO C[C@@H]1CC[S@](=O)CC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000365478204 940172011 /nfs/dbraw/zinc/17/20/11/940172011.db2.gz RZVWHIBLKYRJME-OZAJXLCCSA-N 1 1 364.492 3.666 20 5 FHBDMO C[C@@H]1CC[S@](=O)CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000365478204 940172014 /nfs/dbraw/zinc/17/20/14/940172014.db2.gz RZVWHIBLKYRJME-OZAJXLCCSA-N 1 1 364.492 3.666 20 5 FHBDMO O=[N+]([O-])c1cccc([C@H]([NH2+]C2CCN(C3CC3)CC2)c2ccccc2)c1 ZINC000180029061 940276706 /nfs/dbraw/zinc/27/67/06/940276706.db2.gz PCZGDZGKGKQQAZ-OAQYLSRUSA-N 1 1 351.450 3.901 20 5 FHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CC3(CCOCC3)[C@H]2c2ccccc2)c1 ZINC000412003160 940328740 /nfs/dbraw/zinc/32/87/40/940328740.db2.gz WMYZZZHIILWDEL-HXUWFJFHSA-N 1 1 368.433 3.827 20 5 FHBDMO C/C(=C\c1nc(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)no1)c1ccc([N+](=O)[O-])cc1 ZINC000612955409 940358695 /nfs/dbraw/zinc/35/86/95/940358695.db2.gz YTJVMNPDXXRPRD-BDHPRHBFSA-N 1 1 354.410 3.879 20 5 FHBDMO CC(C)[C@H](C)NC(=O)C1CC[NH+](Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000163513742 940500033 /nfs/dbraw/zinc/50/00/33/940500033.db2.gz ROLBSBQLWDMLQY-ZDUSSCGKSA-N 1 1 367.877 3.621 20 5 FHBDMO COc1cc(C[N@@H+]2CCCO[C@H](c3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC000613379023 940650576 /nfs/dbraw/zinc/65/05/76/940650576.db2.gz VHYTWRJQRKGZKX-IBGZPJMESA-N 1 1 360.385 3.706 20 5 FHBDMO COc1cc(C[N@H+]2CCCO[C@H](c3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC000613379023 940650578 /nfs/dbraw/zinc/65/05/78/940650578.db2.gz VHYTWRJQRKGZKX-IBGZPJMESA-N 1 1 360.385 3.706 20 5 FHBDMO Cc1oc2ccccc2c1C[NH2+]Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000613426362 940693290 /nfs/dbraw/zinc/69/32/90/940693290.db2.gz FZVHCGGFCFRGHI-UHFFFAOYSA-N 1 1 354.362 3.710 20 5 FHBDMO COc1ccc(NC(=O)CC[N@@H+](C)CCC2CCCCC2)c([N+](=O)[O-])c1 ZINC000507583651 945341480 /nfs/dbraw/zinc/34/14/80/945341480.db2.gz JHVKRYMVUCKPFJ-UHFFFAOYSA-N 1 1 363.458 3.834 20 5 FHBDMO CC[C@@H](CO)[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccccc1 ZINC000613477548 940748402 /nfs/dbraw/zinc/74/84/02/940748402.db2.gz VURHAFUAMDERRI-HNNXBMFYSA-N 1 1 355.394 3.509 20 5 FHBDMO COc1ccc2c(c1)ncc([N+](=O)[O-])c2N1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000582646865 940789602 /nfs/dbraw/zinc/78/96/02/940789602.db2.gz MBQKQHXRVLUTOC-UHFFFAOYSA-N 1 1 372.469 3.708 20 5 FHBDMO C[C@@H](O)[C@@H]1CCC[N@@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000540962420 940990032 /nfs/dbraw/zinc/99/00/32/940990032.db2.gz VJPZCPREILYAPD-SJLPKXTDSA-N 1 1 369.465 3.956 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCO[C@H]([C@@H]4CCCO4)C3)s2)cc1 ZINC000180560486 941047703 /nfs/dbraw/zinc/04/77/03/941047703.db2.gz PEBJPJWBMVFBRH-ROUUACIJSA-N 1 1 374.462 3.703 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCO[C@H]([C@@H]4CCCO4)C3)s2)cc1 ZINC000180560486 941047706 /nfs/dbraw/zinc/04/77/06/941047706.db2.gz PEBJPJWBMVFBRH-ROUUACIJSA-N 1 1 374.462 3.703 20 5 FHBDMO CN(C(=O)C[N@H+](Cc1ccco1)C1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000053140408 941243855 /nfs/dbraw/zinc/24/38/55/941243855.db2.gz WNCPDRZTUQRNAU-UHFFFAOYSA-N 1 1 357.410 3.595 20 5 FHBDMO CN(C(=O)C[N@@H+](Cc1ccco1)C1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000053140408 941243856 /nfs/dbraw/zinc/24/38/56/941243856.db2.gz WNCPDRZTUQRNAU-UHFFFAOYSA-N 1 1 357.410 3.595 20 5 FHBDMO CC(C)[C@H]1[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC12CCOCC2 ZINC000414521688 941371541 /nfs/dbraw/zinc/37/15/41/941371541.db2.gz FGSCNQBLCNCPDO-MRXNPFEDSA-N 1 1 370.396 3.833 20 5 FHBDMO CC(C)[C@H]1[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC12CCOCC2 ZINC000414521688 941371543 /nfs/dbraw/zinc/37/15/43/941371543.db2.gz FGSCNQBLCNCPDO-MRXNPFEDSA-N 1 1 370.396 3.833 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C\CNC[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1 ZINC000414996460 941533850 /nfs/dbraw/zinc/53/38/50/941533850.db2.gz GIWNKDPFSGBDCU-JTAPILCXSA-N 1 1 369.440 3.730 20 5 FHBDMO Cc1csc([C@H](C)[NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)n1 ZINC000892854302 941621852 /nfs/dbraw/zinc/62/18/52/941621852.db2.gz BJOOLVXWYGCSRY-LBPRGKRZSA-N 1 1 357.439 3.611 20 5 FHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCS[C@H]3COCC[C@@H]32)o1 ZINC000091856040 941793108 /nfs/dbraw/zinc/79/31/08/941793108.db2.gz GVBFRMSTRKDSHX-WMZOPIPTSA-N 1 1 360.435 3.561 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@@H](C)C[C@H]1c1ccccc1 ZINC000513275781 941825980 /nfs/dbraw/zinc/82/59/80/941825980.db2.gz KCCOKIHWRSJJKU-LIRRHRJNSA-N 1 1 353.422 3.925 20 5 FHBDMO CC(C)[N@H+](CC(=O)NCCC1=CCCCC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000513410220 941893708 /nfs/dbraw/zinc/89/37/08/941893708.db2.gz BDNOFAHTDAPMBW-UHFFFAOYSA-N 1 1 359.470 3.812 20 5 FHBDMO CC(C)[N@@H+](CC(=O)NCCC1=CCCCC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000513410220 941893712 /nfs/dbraw/zinc/89/37/12/941893712.db2.gz BDNOFAHTDAPMBW-UHFFFAOYSA-N 1 1 359.470 3.812 20 5 FHBDMO Cc1nc(C)n(C[C@H]2CCC[N@H+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC000182756779 941965856 /nfs/dbraw/zinc/96/58/56/941965856.db2.gz NJOSELNDUSCYDR-YOEHRIQHSA-N 1 1 357.458 3.585 20 5 FHBDMO Cc1c(NC(=O)NC[C@H]2CC[N@H+](C)[C@@H]2c2cccs2)cccc1[N+](=O)[O-] ZINC000377772856 941980561 /nfs/dbraw/zinc/98/05/61/941980561.db2.gz QNLGXDZECLWOHJ-DYVFJYSZSA-N 1 1 374.466 3.779 20 5 FHBDMO CN(c1ccccc1)c1ccc(CNC[C@@H](C2CC2)[NH+](C)C)cc1[N+](=O)[O-] ZINC000513648190 942063785 /nfs/dbraw/zinc/06/37/85/942063785.db2.gz OFGQHVKAGPFHNW-NRFANRHFSA-N 1 1 368.481 3.793 20 5 FHBDMO CCS(=O)(=O)c1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)s1 ZINC000279990204 942084655 /nfs/dbraw/zinc/08/46/55/942084655.db2.gz FGJFEPFRVQYQGX-LBPRGKRZSA-N 1 1 368.480 3.609 20 5 FHBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cc(Cl)ccc1F ZINC000501901252 942106349 /nfs/dbraw/zinc/10/63/49/942106349.db2.gz SGQRCYYEFKZMRY-UHFFFAOYSA-N 1 1 365.792 3.848 20 5 FHBDMO CCN(C(=O)c1ccc([N+](=O)[O-])s1)[C@@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000501953168 942136184 /nfs/dbraw/zinc/13/61/84/942136184.db2.gz ZCWHETAAZVDRJY-GDBMZVCRSA-N 1 1 373.478 3.954 20 5 FHBDMO O=[N+]([O-])c1cc2ccccc2nc1N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000473535358 942170090 /nfs/dbraw/zinc/17/00/90/942170090.db2.gz XSKDHLCCVXVXOG-CRAIPNDOSA-N 1 1 352.438 3.596 20 5 FHBDMO O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC(c2cnc[nH]2)CC1 ZINC000378074940 942251014 /nfs/dbraw/zinc/25/10/14/942251014.db2.gz JYNGGOYEKFXENV-UHFFFAOYSA-N 1 1 356.407 3.552 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@H](CC(F)(F)F)C3)o2)cc1 ZINC000420954732 942274200 /nfs/dbraw/zinc/27/42/00/942274200.db2.gz VBWYKCRJCJTYRQ-LLVKDONJSA-N 1 1 370.331 3.809 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@H](CC(F)(F)F)C3)o2)cc1 ZINC000420954732 942274203 /nfs/dbraw/zinc/27/42/03/942274203.db2.gz VBWYKCRJCJTYRQ-LLVKDONJSA-N 1 1 370.331 3.809 20 5 FHBDMO CC(C)c1[nH+]ccn1[C@H]1CCCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000378107031 942276143 /nfs/dbraw/zinc/27/61/43/942276143.db2.gz ZZCVQHIKLBGBKT-AWEZNQCLSA-N 1 1 360.389 3.531 20 5 FHBDMO C[C@H]1[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2Cl)CC[N@H+]1Cc1ccccc1 ZINC000312024070 942284770 /nfs/dbraw/zinc/28/47/70/942284770.db2.gz WYOWHLKUPHVCRY-BBRMVZONSA-N 1 1 373.840 3.641 20 5 FHBDMO O=C(CC[N@H+]1CC[C@H](c2cccc(F)c2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000501138283 942325651 /nfs/dbraw/zinc/32/56/51/942325651.db2.gz XOOZZQYNVJAKAN-HNNXBMFYSA-N 1 1 357.385 3.552 20 5 FHBDMO COCC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](C)c1ccccc1 ZINC000501162805 942332087 /nfs/dbraw/zinc/33/20/87/942332087.db2.gz KMVXVKZZIMZPOI-MRXNPFEDSA-N 1 1 371.437 3.633 20 5 FHBDMO Cc1nn(-c2ccccc2)cc1C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000549410081 942508608 /nfs/dbraw/zinc/50/86/08/942508608.db2.gz NVXSSTDPJPRTSK-UHFFFAOYSA-N 1 1 350.422 3.763 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C(C)C ZINC000120208773 942508818 /nfs/dbraw/zinc/50/88/18/942508818.db2.gz KLGAOJSFIQOJNA-CVEARBPZSA-N 1 1 360.458 3.691 20 5 FHBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@H](O)CC34CCC4)o2)c([N+](=O)[O-])c1 ZINC000421370531 942521937 /nfs/dbraw/zinc/52/19/37/942521937.db2.gz JRAFISIWYXOTAN-AWEZNQCLSA-N 1 1 372.421 3.743 20 5 FHBDMO COc1cc(C[N@@H+]2CCC[C@H](CC(F)(F)F)C2)c([N+](=O)[O-])cc1OC ZINC000421395744 942546126 /nfs/dbraw/zinc/54/61/26/942546126.db2.gz VFLXIBAXECDADX-LLVKDONJSA-N 1 1 362.348 3.776 20 5 FHBDMO COc1cc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)c([N+](=O)[O-])cc1OC ZINC000421395744 942546130 /nfs/dbraw/zinc/54/61/30/942546130.db2.gz VFLXIBAXECDADX-LLVKDONJSA-N 1 1 362.348 3.776 20 5 FHBDMO COc1cccc([C@H]2[C@@H](Nc3ncc([N+](=O)[O-])cc3F)CC[N@H+]2C2CC2)c1 ZINC000413246425 942561062 /nfs/dbraw/zinc/56/10/62/942561062.db2.gz ZNDRTHQCHVRMNN-ROUUACIJSA-N 1 1 372.400 3.527 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1C[C@@H]2CCC[N@H+]2Cc2ccccc21 ZINC000421438039 942573859 /nfs/dbraw/zinc/57/38/59/942573859.db2.gz UCMAAQUKEQAAFU-KRWDZBQOSA-N 1 1 365.433 3.836 20 5 FHBDMO Cc1c[nH+]ccc1OC1CCN(c2ccc([N+](=O)[O-])c3ncccc23)CC1 ZINC000413267242 942585662 /nfs/dbraw/zinc/58/56/62/942585662.db2.gz NAPCTORCVUURKH-UHFFFAOYSA-N 1 1 364.405 3.894 20 5 FHBDMO Cc1cc(C(=O)Nc2nc3c(s2)C[N@H+](C(C)(C)C)CC3)cc([N+](=O)[O-])c1 ZINC000425082724 942688239 /nfs/dbraw/zinc/68/82/39/942688239.db2.gz OVJAXWORPKYUOW-UHFFFAOYSA-N 1 1 374.466 3.769 20 5 FHBDMO COc1ccc([C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC)C2CC2)c(F)c1 ZINC000421824684 942833265 /nfs/dbraw/zinc/83/32/65/942833265.db2.gz JURRYMGJBCNOEJ-IBGZPJMESA-N 1 1 360.385 3.992 20 5 FHBDMO Cc1ccc([C@]2(C)CC[N@@H+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)C2)cc1 ZINC000434744332 942936998 /nfs/dbraw/zinc/93/69/98/942936998.db2.gz HXDQZBFMPBYTNY-OAQYLSRUSA-N 1 1 368.433 3.933 20 5 FHBDMO O=[N+]([O-])c1ccc2oc(CN3CCC[N@@H+](CC4CCCCC4)CC3)nc2c1 ZINC000434829631 942982705 /nfs/dbraw/zinc/98/27/05/942982705.db2.gz GPWZMXBRPNXLRB-UHFFFAOYSA-N 1 1 372.469 3.824 20 5 FHBDMO C[C@H]1[C@H](c2ccccc2)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000434899527 943037170 /nfs/dbraw/zinc/03/71/70/943037170.db2.gz IJWZAHIHZXAQMA-HNAYVOBHSA-N 1 1 353.422 3.801 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](c2ccccc2)[C@@H]1C ZINC000434906337 943043151 /nfs/dbraw/zinc/04/31/51/943043151.db2.gz UABCDNBGRRDXQY-YJBOKZPZSA-N 1 1 353.422 3.720 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H](c2ccccc2)[C@H]1C ZINC000434906334 943043361 /nfs/dbraw/zinc/04/33/61/943043361.db2.gz UABCDNBGRRDXQY-CRAIPNDOSA-N 1 1 353.422 3.720 20 5 FHBDMO COCC[N@@H+](C)CC[C@@H](Nc1ccc(F)cc1[N+](=O)[O-])c1ccccc1 ZINC000505577198 943068966 /nfs/dbraw/zinc/06/89/66/943068966.db2.gz RPWXIPMJHFVYJN-QGZVFWFLSA-N 1 1 361.417 3.855 20 5 FHBDMO O=C(NC[C@@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1)Nc1ccccc1 ZINC000058754099 943145953 /nfs/dbraw/zinc/14/59/53/943145953.db2.gz JZQRUSMHLWEGMA-IBGZPJMESA-N 1 1 368.437 3.771 20 5 FHBDMO O=C(NC[C@@H]1CCCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1)Nc1ccccc1 ZINC000058754099 943145959 /nfs/dbraw/zinc/14/59/59/943145959.db2.gz JZQRUSMHLWEGMA-IBGZPJMESA-N 1 1 368.437 3.771 20 5 FHBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000503401474 943163723 /nfs/dbraw/zinc/16/37/23/943163723.db2.gz CKRQPCNFKYHUQA-UONOGXRCSA-N 1 1 365.499 3.652 20 5 FHBDMO CCOC(=O)[C@@H]1CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000435234967 943271536 /nfs/dbraw/zinc/27/15/36/943271536.db2.gz BPORYYRMFIMZIU-OAHLLOKOSA-N 1 1 358.394 3.630 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@H](c4nnc[nH]4)C3)o2)c(Cl)c1 ZINC000425358788 943364878 /nfs/dbraw/zinc/36/48/78/943364878.db2.gz RMSTZLPGMRSNCW-LLVKDONJSA-N 1 1 373.800 3.616 20 5 FHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H]([C@@H](O)C(F)(F)F)C1 ZINC000514910372 943381305 /nfs/dbraw/zinc/38/13/05/943381305.db2.gz SHMSUYZMGSEKLC-MEJTZIMASA-N 1 1 358.360 3.633 20 5 FHBDMO C[C@H](N[C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000423144748 943406434 /nfs/dbraw/zinc/40/64/34/943406434.db2.gz HVJJMIKVMFFNCZ-BOUXLOLZSA-N 1 1 353.422 3.501 20 5 FHBDMO C[NH+]1CCC(C)(CNCc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000503952664 943435156 /nfs/dbraw/zinc/43/51/56/943435156.db2.gz ONUZREGYMZQRCF-UHFFFAOYSA-N 1 1 360.483 3.540 20 5 FHBDMO C[C@@H]1CN(c2cccc3cnccc32)CC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000515123889 943516136 /nfs/dbraw/zinc/51/61/36/943516136.db2.gz MAHFUJOHQBCJLL-MRXNPFEDSA-N 1 1 362.433 3.854 20 5 FHBDMO C[C@@H]1CN(c2cccc3cnccc32)CC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000515123889 943516139 /nfs/dbraw/zinc/51/61/39/943516139.db2.gz MAHFUJOHQBCJLL-MRXNPFEDSA-N 1 1 362.433 3.854 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C\CN1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000435771624 943601678 /nfs/dbraw/zinc/60/16/78/943601678.db2.gz MJENNCFFCBXXQO-WDZFZDKYSA-N 1 1 351.450 3.816 20 5 FHBDMO C[C@@H](c1ccccc1)N(C)C(=O)C[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000504590206 943701178 /nfs/dbraw/zinc/70/11/78/943701178.db2.gz QLAARRGQTBDYJZ-VEMDQMBVSA-N 1 1 367.449 3.759 20 5 FHBDMO C[C@@H](c1ccccc1)N(C)C(=O)C[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000504590206 943701182 /nfs/dbraw/zinc/70/11/82/943701182.db2.gz QLAARRGQTBDYJZ-VEMDQMBVSA-N 1 1 367.449 3.759 20 5 FHBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)[N@@H+](CC)C[C@H]1C ZINC000504591736 943703539 /nfs/dbraw/zinc/70/35/39/943703539.db2.gz JOTWUUMGKWQYFQ-UONOGXRCSA-N 1 1 365.499 3.652 20 5 FHBDMO CC[C@@H](C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1 ZINC000516897921 943814165 /nfs/dbraw/zinc/81/41/65/943814165.db2.gz KMQXBXIYIMGSNI-LPHOPBHVSA-N 1 1 369.465 3.991 20 5 FHBDMO CC[C@H](C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1 ZINC000516897922 943814400 /nfs/dbraw/zinc/81/44/00/943814400.db2.gz KMQXBXIYIMGSNI-QFBILLFUSA-N 1 1 369.465 3.991 20 5 FHBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000425416289 943858294 /nfs/dbraw/zinc/85/82/94/943858294.db2.gz GBWAEGAYXHIQSH-TZMCWYRMSA-N 1 1 369.259 3.606 20 5 FHBDMO CC[N@@H+](CCc1nccs1)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425419319 943863971 /nfs/dbraw/zinc/86/39/71/943863971.db2.gz KVKPZQDGOCGOPA-UHFFFAOYSA-N 1 1 370.272 3.878 20 5 FHBDMO CCCCO[C@@H]1C[C@H]([N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1(C)C ZINC001167960082 943935898 /nfs/dbraw/zinc/93/58/98/943935898.db2.gz RXWDNEDQBXIXKS-OKZBNKHCSA-N 1 1 350.459 3.544 20 5 FHBDMO C[C@@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000312614934 943980260 /nfs/dbraw/zinc/98/02/60/943980260.db2.gz ZYYRLKLZOPDTNP-ZBFHGGJFSA-N 1 1 370.409 3.826 20 5 FHBDMO C[C@H](NC(=O)NC[C@H]1CCC[N@H+]1C1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000437637342 944004219 /nfs/dbraw/zinc/00/42/19/944004219.db2.gz VHJVWOCNTPETQW-HNAYVOBHSA-N 1 1 374.485 3.752 20 5 FHBDMO CC[C@H]1CCC[N@@H+]1CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000436097791 944028967 /nfs/dbraw/zinc/02/89/67/944028967.db2.gz IMZAZOTVPADXAZ-ZDUSSCGKSA-N 1 1 360.439 3.531 20 5 FHBDMO CC[C@H]1CCC[N@H+]1CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000436097791 944028970 /nfs/dbraw/zinc/02/89/70/944028970.db2.gz IMZAZOTVPADXAZ-ZDUSSCGKSA-N 1 1 360.439 3.531 20 5 FHBDMO O=C(CC[N@H+]1CCC[C@@H](Cc2ccccc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000500103009 944099794 /nfs/dbraw/zinc/09/97/94/944099794.db2.gz GXWGAZWDWDAGGS-SFHVURJKSA-N 1 1 367.449 3.878 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@](C)(c2ccccc2)C1 ZINC000500182723 944219239 /nfs/dbraw/zinc/21/92/39/944219239.db2.gz KMFXSATVYCZTAN-NRFANRHFSA-N 1 1 367.449 3.895 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@](C)(c2ccccc2)C1 ZINC000500182723 944219242 /nfs/dbraw/zinc/21/92/42/944219242.db2.gz KMFXSATVYCZTAN-NRFANRHFSA-N 1 1 367.449 3.895 20 5 FHBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CC3(CCC3)[C@@H]2C2CCOCC2)c(F)c1 ZINC000425546484 944307896 /nfs/dbraw/zinc/30/78/96/944307896.db2.gz DXRBMXCSCPPZRD-KRWDZBQOSA-N 1 1 352.381 3.654 20 5 FHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CC3(CCC3)[C@@H]2C2CCOCC2)c(F)c1 ZINC000425546484 944307907 /nfs/dbraw/zinc/30/79/07/944307907.db2.gz DXRBMXCSCPPZRD-KRWDZBQOSA-N 1 1 352.381 3.654 20 5 FHBDMO Cc1ccc(C[C@@H]2CCC[N@H+]2CC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000500233464 944312879 /nfs/dbraw/zinc/31/28/79/944312879.db2.gz GHPIFBRQVLFZQU-KRWDZBQOSA-N 1 1 353.422 3.549 20 5 FHBDMO COCC[N@@H+](CCOc1ccc(F)cc1)Cc1cccc([N+](=O)[O-])c1C ZINC000517521967 944359297 /nfs/dbraw/zinc/35/92/97/944359297.db2.gz JARBQYDXQHZAKX-UHFFFAOYSA-N 1 1 362.401 3.570 20 5 FHBDMO C[C@H]1CCCC[N@H+]1CCCNc1nc(C2CC2)nc(Cl)c1[N+](=O)[O-] ZINC001167752434 944363740 /nfs/dbraw/zinc/36/37/40/944363740.db2.gz VSQXUTSFZFNFII-NSHDSACASA-N 1 1 353.854 3.592 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1CCCNc1cnc(Oc2ccc([N+](=O)[O-])cc2)nc1 ZINC001167754104 944375745 /nfs/dbraw/zinc/37/57/45/944375745.db2.gz VAWXPRZGSPOJMS-OAHLLOKOSA-N 1 1 371.441 3.854 20 5 FHBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCNc1cccc(C)[nH+]1 ZINC000506500084 944391354 /nfs/dbraw/zinc/39/13/54/944391354.db2.gz OAQAGIGKHMIDJA-UHFFFAOYSA-N 1 1 374.466 3.642 20 5 FHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC[C@@H]2[C@H](O)C(F)(F)F)o1 ZINC000123703682 944412227 /nfs/dbraw/zinc/41/22/27/944412227.db2.gz SCJXZVSRZKSHAR-ZBFHGGJFSA-N 1 1 370.327 3.742 20 5 FHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC2(C1)Oc1ccccc1O2 ZINC000516073986 944466072 /nfs/dbraw/zinc/46/60/72/944466072.db2.gz HTPKCTRACHEEDE-RVDMUPIBSA-N 1 1 352.390 3.872 20 5 FHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC2(C1)Oc1ccccc1O2 ZINC000516073986 944466077 /nfs/dbraw/zinc/46/60/77/944466077.db2.gz HTPKCTRACHEEDE-RVDMUPIBSA-N 1 1 352.390 3.872 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCC[C@H](Oc2ncccc2F)C1 ZINC000425999923 944577745 /nfs/dbraw/zinc/57/77/45/944577745.db2.gz QPSDDDHOXVKAEB-OUOZUETKSA-N 1 1 357.385 3.686 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@H](Oc2ncccc2F)C1 ZINC000425999923 944577750 /nfs/dbraw/zinc/57/77/50/944577750.db2.gz QPSDDDHOXVKAEB-OUOZUETKSA-N 1 1 357.385 3.686 20 5 FHBDMO C[C@H]1C[C@H]1[N@H+]1CCN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C[C@@H](C)C1 ZINC000516190645 944579589 /nfs/dbraw/zinc/57/95/89/944579589.db2.gz BZIKNDVROHFMCM-IIYDPXPESA-N 1 1 371.403 3.776 20 5 FHBDMO CC(C)c1ccc(C(=O)NCCCC[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000439417428 944591130 /nfs/dbraw/zinc/59/11/30/944591130.db2.gz BSUVZDDKSYLPRR-MRXNPFEDSA-N 1 1 361.486 3.960 20 5 FHBDMO COc1nc2ccccc2cc1C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000517782297 944608640 /nfs/dbraw/zinc/60/86/40/944608640.db2.gz DCCGDTNYFWVINI-UHFFFAOYSA-N 1 1 351.406 3.826 20 5 FHBDMO CCc1oc(C(=O)OC)cc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000426401551 944671815 /nfs/dbraw/zinc/67/18/15/944671815.db2.gz GLRSBGSJDUDLER-UHFFFAOYSA-N 1 1 360.410 3.947 20 5 FHBDMO CCc1oc(C(=O)OC)cc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000426401551 944671832 /nfs/dbraw/zinc/67/18/32/944671832.db2.gz GLRSBGSJDUDLER-UHFFFAOYSA-N 1 1 360.410 3.947 20 5 FHBDMO C[N@H+]1CC[C@H](NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)[C@H]1c1ccccc1 ZINC000536261095 944672243 /nfs/dbraw/zinc/67/22/43/944672243.db2.gz BENVAAWMCKZWRI-QFBILLFUSA-N 1 1 365.389 3.516 20 5 FHBDMO CC(C)[C@@H]1CC[N@@H+](CC(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)C1 ZINC000438491647 944683829 /nfs/dbraw/zinc/68/38/29/944683829.db2.gz NEFKQRCJNKGYDS-CQSZACIVSA-N 1 1 374.466 3.635 20 5 FHBDMO C[C@H](CNC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)[N@H+]1CCCC[C@@H]1C ZINC000426031536 944694435 /nfs/dbraw/zinc/69/44/35/944694435.db2.gz YHKBEMJBKAKXGS-JKSUJKDBSA-N 1 1 374.485 3.532 20 5 FHBDMO Cc1ccccc1OCCC[N@@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000053720385 944746436 /nfs/dbraw/zinc/74/64/36/944746436.db2.gz GXZZXDNPGCOKHA-UHFFFAOYSA-N 1 1 371.437 3.551 20 5 FHBDMO Cc1ccccc1OCCC[N@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000053720385 944746438 /nfs/dbraw/zinc/74/64/38/944746438.db2.gz GXZZXDNPGCOKHA-UHFFFAOYSA-N 1 1 371.437 3.551 20 5 FHBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000426772055 944789946 /nfs/dbraw/zinc/78/99/46/944789946.db2.gz HVKFVOBHURFYAI-OAHLLOKOSA-N 1 1 370.453 3.507 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)[N@@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000500424132 944856432 /nfs/dbraw/zinc/85/64/32/944856432.db2.gz MIXSDCMVRMXSQM-SJORKVTESA-N 1 1 367.449 3.638 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)[N@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000500424132 944856441 /nfs/dbraw/zinc/85/64/41/944856441.db2.gz MIXSDCMVRMXSQM-SJORKVTESA-N 1 1 367.449 3.638 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CCC([N@@H+]2CCC[C@H]2C)CC1 ZINC000092929194 944881588 /nfs/dbraw/zinc/88/15/88/944881588.db2.gz DIPNPUBJYDQLEF-OAHLLOKOSA-N 1 1 359.470 3.609 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H]2CO)ccc1Oc1ccccc1Cl ZINC000511664019 944892171 /nfs/dbraw/zinc/89/21/71/944892171.db2.gz FNXQSVIISUSUNB-AWEZNQCLSA-N 1 1 362.813 3.997 20 5 FHBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000426498588 945007035 /nfs/dbraw/zinc/00/70/35/945007035.db2.gz HVKFVOBHURFYAI-HNNXBMFYSA-N 1 1 370.453 3.507 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@@H]1CNCC[C@@H]1c1ccc(F)c(F)c1 ZINC000414948941 945018465 /nfs/dbraw/zinc/01/84/65/945018465.db2.gz MXRQDQXRMQCFIA-FIXKIMANSA-N 1 1 373.403 3.622 20 5 FHBDMO CN(c1ccccc1)c1ccc(C[N@H+]2CC[C@](O)(C3CC3)C2)cc1[N+](=O)[O-] ZINC000426504576 945021272 /nfs/dbraw/zinc/02/12/72/945021272.db2.gz OHTPWNNRRGZMOF-OAQYLSRUSA-N 1 1 367.449 3.710 20 5 FHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCCC[C@H]1c1ccc(F)cc1F ZINC001167772675 945408351 /nfs/dbraw/zinc/40/83/51/945408351.db2.gz WQLSJQONTQPKNC-INIZCTEOSA-N 1 1 350.369 3.605 20 5 FHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCCC[C@H]1c1ccc(F)cc1F ZINC001167772675 945408353 /nfs/dbraw/zinc/40/83/53/945408353.db2.gz WQLSJQONTQPKNC-INIZCTEOSA-N 1 1 350.369 3.605 20 5 FHBDMO CSCC[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1nnc2ccccn21 ZINC000164294534 945709045 /nfs/dbraw/zinc/70/90/45/945709045.db2.gz YDYWOJNFQQMSRB-BBRMVZONSA-N 1 1 371.466 3.783 20 5 FHBDMO C[N@@H+](Cc1cc([O-])ccc1[N+](=O)[O-])[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000519749622 945715263 /nfs/dbraw/zinc/71/52/63/945715263.db2.gz XJLXQNVITAPNQQ-VQIMIIECSA-N 1 1 360.385 3.792 20 5 FHBDMO CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ncc([N+](=O)[O-])cc1Cl ZINC000439698185 945941745 /nfs/dbraw/zinc/94/17/45/945941745.db2.gz XEVLICWPZHEWPL-MRXNPFEDSA-N 1 1 374.872 3.992 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000487354430 946096160 /nfs/dbraw/zinc/09/61/60/946096160.db2.gz MEHHIFSZBVSROT-FUHWJXTLSA-N 1 1 367.449 3.544 20 5 FHBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](C[C@H]3CCC4(CCCCCC4)O3)C2)nc1 ZINC001167778385 946097453 /nfs/dbraw/zinc/09/74/53/946097453.db2.gz FLCIWFUAHVYBEA-FUHWJXTLSA-N 1 1 374.485 3.748 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@@H](C)c1ccc(C)cc1 ZINC000052907272 946195656 /nfs/dbraw/zinc/19/56/56/946195656.db2.gz JDWTWKMEALHHKO-AWEZNQCLSA-N 1 1 357.410 3.543 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@@H](C)c1ccc(C)cc1 ZINC000052907272 946195660 /nfs/dbraw/zinc/19/56/60/946195660.db2.gz JDWTWKMEALHHKO-AWEZNQCLSA-N 1 1 357.410 3.543 20 5 FHBDMO C/C(=C\C(=O)NCCCC[N@@H+]1CCC[C@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000785283394 946226207 /nfs/dbraw/zinc/22/62/07/946226207.db2.gz RUABKALSFNFVJK-WUVIJCSQSA-N 1 1 359.470 3.626 20 5 FHBDMO COc1ccc(Br)cc1C[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000052926154 946258184 /nfs/dbraw/zinc/25/81/84/946258184.db2.gz IVBXEEVXTZAJAT-UHFFFAOYSA-N 1 1 351.200 3.656 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@](C)(c2ccccc2)C1 ZINC000438489749 946307001 /nfs/dbraw/zinc/30/70/01/946307001.db2.gz JXIDBIMBVGLWMZ-FQEVSTJZSA-N 1 1 353.422 3.505 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@](C)(c2ccccc2)C1 ZINC000438489749 946307014 /nfs/dbraw/zinc/30/70/14/946307014.db2.gz JXIDBIMBVGLWMZ-FQEVSTJZSA-N 1 1 353.422 3.505 20 5 FHBDMO Cc1cc(C(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)ccc1[N+](=O)[O-] ZINC000109564751 946339825 /nfs/dbraw/zinc/33/98/25/946339825.db2.gz APOKLOJDPKVUJT-OAHLLOKOSA-N 1 1 373.478 3.607 20 5 FHBDMO COc1ccc(-c2ccc(C[N@@H+](CCCCO)C3CC3)o2)c([N+](=O)[O-])c1 ZINC000093383195 946410813 /nfs/dbraw/zinc/41/08/13/946410813.db2.gz AAZIKNNXYZFMNH-UHFFFAOYSA-N 1 1 360.410 3.600 20 5 FHBDMO CC[C@]1(CO)CCC[N@H+]1Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000475129442 946434665 /nfs/dbraw/zinc/43/46/65/946434665.db2.gz QGLUBFRCPMXTNW-LJQANCHMSA-N 1 1 360.410 3.600 20 5 FHBDMO C[C@]1(c2ccccc2)CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000438505721 946887070 /nfs/dbraw/zinc/88/70/70/946887070.db2.gz NYJWIWSUNIOFEZ-FQEVSTJZSA-N 1 1 353.422 3.587 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C\CN1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000475336232 946902275 /nfs/dbraw/zinc/90/22/75/946902275.db2.gz UCSJJSDZQDZMEZ-WRZRBREKSA-N 1 1 363.461 3.672 20 5 FHBDMO COc1ccc(-c2ccc(C[N@H+]3CCC[C@](C)(O)CC3)o2)c([N+](=O)[O-])c1 ZINC000475344597 946915063 /nfs/dbraw/zinc/91/50/63/946915063.db2.gz XAODSUMFTZPLEI-IBGZPJMESA-N 1 1 360.410 3.600 20 5 FHBDMO COc1cccc(C2CC[NH+](Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)c1 ZINC000444620875 947053020 /nfs/dbraw/zinc/05/30/20/947053020.db2.gz QGPMYHJFSWILQC-UHFFFAOYSA-N 1 1 366.421 3.859 20 5 FHBDMO COc1cccc(N2CCC[N@@H+](CCCc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000475431008 947080513 /nfs/dbraw/zinc/08/05/13/947080513.db2.gz YTFOEEGWKPJSOF-UHFFFAOYSA-N 1 1 369.465 3.748 20 5 FHBDMO Cc1c(NC(=O)[C@H](C)[N@@H+](C)CC2(c3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000444670277 947095423 /nfs/dbraw/zinc/09/54/23/947095423.db2.gz GKYJOTZBXOAXRL-INIZCTEOSA-N 1 1 367.449 3.894 20 5 FHBDMO CN(C)c1cccc([C@@H]2CCC[N@H+]2CCOc2ccc([N+](=O)[O-])cc2)c1 ZINC000441431944 947157237 /nfs/dbraw/zinc/15/72/37/947157237.db2.gz DSQNGUYJOCXXCJ-FQEVSTJZSA-N 1 1 355.438 3.877 20 5 FHBDMO Cc1c(C(=O)N(C)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000074448264 947170739 /nfs/dbraw/zinc/17/07/39/947170739.db2.gz WYCFXMPJSDSISO-GOSISDBHSA-N 1 1 367.449 3.640 20 5 FHBDMO CC(C)[C@@H]1CCC[N@@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000444771295 947207460 /nfs/dbraw/zinc/20/74/60/947207460.db2.gz OQVJZXFIXSFPAG-CHWSQXEVSA-N 1 1 353.850 3.943 20 5 FHBDMO CC(C)[C@@H]1CCC[N@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000444771295 947207469 /nfs/dbraw/zinc/20/74/69/947207469.db2.gz OQVJZXFIXSFPAG-CHWSQXEVSA-N 1 1 353.850 3.943 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@@H+]2C[C@H](O)C3(CC3)C2)ccc1Oc1ccccc1Cl ZINC000428379687 947236865 /nfs/dbraw/zinc/23/68/65/947236865.db2.gz KGUQOWSLAWGGIU-SFHVURJKSA-N 1 1 374.824 3.997 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@H+]2C[C@H](O)C3(CC3)C2)ccc1Oc1ccccc1Cl ZINC000428379687 947236853 /nfs/dbraw/zinc/23/68/53/947236853.db2.gz KGUQOWSLAWGGIU-SFHVURJKSA-N 1 1 374.824 3.997 20 5 FHBDMO COc1ccc(OCC[N@@H+]2CCc3c(Cl)cccc3C2)c([N+](=O)[O-])c1 ZINC000441447199 947484669 /nfs/dbraw/zinc/48/46/69/947484669.db2.gz ZPMFGTWLCXPRBX-UHFFFAOYSA-N 1 1 362.813 3.694 20 5 FHBDMO COc1ccc(OCC[N@H+]2CCc3c(Cl)cccc3C2)c([N+](=O)[O-])c1 ZINC000441447199 947484673 /nfs/dbraw/zinc/48/46/73/947484673.db2.gz ZPMFGTWLCXPRBX-UHFFFAOYSA-N 1 1 362.813 3.694 20 5 FHBDMO COC(=O)[C@@H](C)[C@@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000152073946 947519133 /nfs/dbraw/zinc/51/91/33/947519133.db2.gz ZSZDTDUDXLLJAP-YVEFUNNKSA-N 1 1 362.813 3.888 20 5 FHBDMO C[C@H]1C[C@@H](NC(=O)c2ccc(F)cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000150781193 947540846 /nfs/dbraw/zinc/54/08/46/947540846.db2.gz ZVILIDPPHKKONY-YOEHRIQHSA-N 1 1 371.412 3.517 20 5 FHBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000072837914 947570086 /nfs/dbraw/zinc/57/00/86/947570086.db2.gz SIKSWPLBCHTDJV-QWHCGFSZSA-N 1 1 371.890 3.793 20 5 FHBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000072837921 947570333 /nfs/dbraw/zinc/57/03/33/947570333.db2.gz SIKSWPLBCHTDJV-OLZOCXBDSA-N 1 1 371.890 3.793 20 5 FHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)CCc1ccccc1 ZINC000053047725 947989923 /nfs/dbraw/zinc/98/99/23/947989923.db2.gz YYRQLCUDCZRGLX-CYBMUJFWSA-N 1 1 361.829 3.750 20 5 FHBDMO CCC[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)C1 ZINC001167808568 948002495 /nfs/dbraw/zinc/00/24/95/948002495.db2.gz SAUBNMNBVIFGOA-HNNXBMFYSA-N 1 1 369.421 3.601 20 5 FHBDMO O=[N+]([O-])c1cccc2c(N3CC[C@H]4[C@@H](CCC[N@H+]4C4CC4)C3)ccnc21 ZINC000432341331 948165097 /nfs/dbraw/zinc/16/50/97/948165097.db2.gz WGMIKDAXUBKGHF-YOEHRIQHSA-N 1 1 352.438 3.596 20 5 FHBDMO C[C@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000512101888 948418590 /nfs/dbraw/zinc/41/85/90/948418590.db2.gz VTRKPMVQFRRXRA-GJZGRUSLSA-N 1 1 369.421 3.552 20 5 FHBDMO C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000512101888 948418596 /nfs/dbraw/zinc/41/85/96/948418596.db2.gz VTRKPMVQFRRXRA-GJZGRUSLSA-N 1 1 369.421 3.552 20 5 FHBDMO CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@H+](C)C[C@H]1C ZINC000512122401 948479216 /nfs/dbraw/zinc/47/92/16/948479216.db2.gz LMRHMHBXTGSWSA-ZIAGYGMSSA-N 1 1 365.499 3.508 20 5 FHBDMO CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@@H+](C)C[C@H]1C ZINC000512122401 948479222 /nfs/dbraw/zinc/47/92/22/948479222.db2.gz LMRHMHBXTGSWSA-ZIAGYGMSSA-N 1 1 365.499 3.508 20 5 FHBDMO Cc1c(C[N@@H+](C)CCc2nc(-c3ccccc3)no2)cccc1[N+](=O)[O-] ZINC000512151975 948563075 /nfs/dbraw/zinc/56/30/75/948563075.db2.gz JQPCOPGWGKKPPQ-UHFFFAOYSA-N 1 1 352.394 3.628 20 5 FHBDMO COc1ccc(CN2CCC[C@@H](C[N@H+]3CCCC[C@@H]3C)C2)cc1[N+](=O)[O-] ZINC000512182458 948706186 /nfs/dbraw/zinc/70/61/86/948706186.db2.gz SHAGMLVOVHCWFU-FUHWJXTLSA-N 1 1 361.486 3.690 20 5 FHBDMO CCSCC[C@H](C)[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000072900950 568056837 /nfs/dbraw/zinc/05/68/37/568056837.db2.gz RYTSVLJFMRVTMV-NSHDSACASA-N 1 1 359.879 3.650 20 5 FHBDMO O=[N+]([O-])c1ccc(C[NH+]2C[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@H]3C2)cc1 ZINC000389114158 568213793 /nfs/dbraw/zinc/21/37/93/568213793.db2.gz LUJYJCLWKOYFSR-PMACEKPBSA-N 1 1 351.450 3.549 20 5 FHBDMO Cc1cc2[nH]c(C[N@H+]3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)cc2c(C)c1 ZINC000482006406 568226382 /nfs/dbraw/zinc/22/63/82/568226382.db2.gz HLVGAZIZETYYJT-HNNXBMFYSA-N 1 1 365.437 3.774 20 5 FHBDMO COCOc1ccc(OC)cc1C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000291646811 568240697 /nfs/dbraw/zinc/24/06/97/568240697.db2.gz CHFITWSJHJPBQD-UHFFFAOYSA-N 1 1 360.410 3.611 20 5 FHBDMO Cn1ccnc1[C@@H]([NH2+]CCCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000568910297 568251942 /nfs/dbraw/zinc/25/19/42/568251942.db2.gz OZAOAUOGVUKWSU-IBGZPJMESA-N 1 1 350.422 3.640 20 5 FHBDMO C[C@@H]1CC[C@]2(CC[N@H+](CC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)C2)C1 ZINC000541949698 568271902 /nfs/dbraw/zinc/27/19/02/568271902.db2.gz VBOZPAFPNUHIDU-PXAZEXFGSA-N 1 1 351.834 3.699 20 5 FHBDMO C[C@@H]1CC[C@]2(CC[N@@H+](CC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)C2)C1 ZINC000541949698 568271903 /nfs/dbraw/zinc/27/19/03/568271903.db2.gz VBOZPAFPNUHIDU-PXAZEXFGSA-N 1 1 351.834 3.699 20 5 FHBDMO CC[N@@H+](CCn1cc([N+](=O)[O-])cn1)C(c1ccccc1)c1ccccc1 ZINC000569181448 568305004 /nfs/dbraw/zinc/30/50/04/568305004.db2.gz KATXNSTWRHRRAN-UHFFFAOYSA-N 1 1 350.422 3.903 20 5 FHBDMO C[C@@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)[N@@H+]1CCC[C@H]1C ZINC000178724323 936323119 /nfs/dbraw/zinc/32/31/19/936323119.db2.gz RJEGCNOHMGIACC-NEPJUHHUSA-N 1 1 360.439 3.530 20 5 FHBDMO C[C@@H](C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)[N@H+]1CCC[C@H]1C ZINC000178724323 936323125 /nfs/dbraw/zinc/32/31/25/936323125.db2.gz RJEGCNOHMGIACC-NEPJUHHUSA-N 1 1 360.439 3.530 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccc2c(c1)OCCCO2 ZINC000178729233 936327072 /nfs/dbraw/zinc/32/70/72/936327072.db2.gz ATPIESMBVINKEM-CYBMUJFWSA-N 1 1 358.394 3.616 20 5 FHBDMO C[C@H]1C[C@@H](O)CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000430141012 927212578 /nfs/dbraw/zinc/21/25/78/927212578.db2.gz WBCNAFISYIVQHF-AAEUAGOBSA-N 1 1 350.802 3.853 20 5 FHBDMO CSc1cccc(C(=O)N[C@H](C)C[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000186969478 927686224 /nfs/dbraw/zinc/68/62/24/927686224.db2.gz BYPXNQJXXSZAPX-CQSZACIVSA-N 1 1 373.478 3.567 20 5 FHBDMO C[C@H]1C[C@@H](CCNC(=O)c2ccccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000510083413 927939021 /nfs/dbraw/zinc/93/90/21/927939021.db2.gz HRBWTPGIMDQVAC-FUHWJXTLSA-N 1 1 367.449 3.625 20 5 FHBDMO C[C@@H]1C[C@H](CCNC(=O)c2ccc([N+](=O)[O-])cc2)C[N@H+]1Cc1ccccc1 ZINC000510084870 927945516 /nfs/dbraw/zinc/94/55/16/927945516.db2.gz GQYJLGVIELKJPQ-AEFFLSMTSA-N 1 1 367.449 3.625 20 5 FHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@](O)(C(F)(F)F)CC1 ZINC000285626307 927987463 /nfs/dbraw/zinc/98/74/63/927987463.db2.gz QXLQCYUMOVFTNF-CYBMUJFWSA-N 1 1 352.740 3.528 20 5 FHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@](O)(C(F)(F)F)CC1 ZINC000285626307 927987476 /nfs/dbraw/zinc/98/74/76/927987476.db2.gz QXLQCYUMOVFTNF-CYBMUJFWSA-N 1 1 352.740 3.528 20 5 FHBDMO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2OC)cc1OC ZINC000430222756 928275938 /nfs/dbraw/zinc/27/59/38/928275938.db2.gz WUDRGJZCFKQJPW-KRWDZBQOSA-N 1 1 372.421 3.958 20 5 FHBDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2OC)cc1OC ZINC000430222756 928275957 /nfs/dbraw/zinc/27/59/57/928275957.db2.gz WUDRGJZCFKQJPW-KRWDZBQOSA-N 1 1 372.421 3.958 20 5 FHBDMO COc1cc(C[NH2+][C@H]2CCc3sc(Cl)cc32)c([N+](=O)[O-])cc1O ZINC000583232861 937262718 /nfs/dbraw/zinc/26/27/18/937262718.db2.gz HCKJIQUSHILJFI-JTQLQIEISA-N 1 1 354.815 3.801 20 5 FHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](C(=O)N(C)c2ccccc2)C1 ZINC000430294685 929355422 /nfs/dbraw/zinc/35/54/22/929355422.db2.gz BLFKUKXVPKGCQL-CVEARBPZSA-N 1 1 353.422 3.641 20 5 FHBDMO Cc1cc(C(=O)NCC[C@H](C)[N@@H+](C)Cc2ccccc2)cc([N+](=O)[O-])c1 ZINC000471460891 929747979 /nfs/dbraw/zinc/74/79/79/929747979.db2.gz UTURQMSPFVEFKJ-INIZCTEOSA-N 1 1 355.438 3.544 20 5 FHBDMO O=C(c1ccc(F)cc1)[C@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000610004461 929772332 /nfs/dbraw/zinc/77/23/32/929772332.db2.gz LHYSZWHJOSJHSF-KRWDZBQOSA-N 1 1 356.397 3.871 20 5 FHBDMO Cn1ccnc1[C@H]([NH2+][C@H]1CCO[C@@H](C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000560546566 929886064 /nfs/dbraw/zinc/88/60/64/929886064.db2.gz VWMNBTPUYDWKEO-CGTJXYLNSA-N 1 1 372.469 3.601 20 5 FHBDMO C[C@@H]1CCC[C@H](C)[N@H+]1CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC001167337636 929993473 /nfs/dbraw/zinc/99/34/73/929993473.db2.gz VCKMQOODHUPGPS-BETUJISGSA-N 1 1 374.466 3.920 20 5 FHBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC001167337636 929993477 /nfs/dbraw/zinc/99/34/77/929993477.db2.gz VCKMQOODHUPGPS-BETUJISGSA-N 1 1 374.466 3.920 20 5 FHBDMO C[C@@H]1C[C@H](N(C)C(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)CC[N@H+]1C ZINC000275754772 930155928 /nfs/dbraw/zinc/15/59/28/930155928.db2.gz JQQYDDBAJCRGHN-GDBMZVCRSA-N 1 1 363.461 3.648 20 5 FHBDMO COc1ccc(OCC[N@@H+]2CCc3cc(F)ccc3[C@@H]2C)c([N+](=O)[O-])c1 ZINC000610369817 930172651 /nfs/dbraw/zinc/17/26/51/930172651.db2.gz JCNHKPXZAMLADN-ZDUSSCGKSA-N 1 1 360.385 3.741 20 5 FHBDMO COc1ccc(OCC[N@H+]2CCc3cc(F)ccc3[C@@H]2C)c([N+](=O)[O-])c1 ZINC000610369817 930172663 /nfs/dbraw/zinc/17/26/63/930172663.db2.gz JCNHKPXZAMLADN-ZDUSSCGKSA-N 1 1 360.385 3.741 20 5 FHBDMO Cn1cc([C@@H]([NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])c2ccc(F)cc2)cn1 ZINC000580216150 930372761 /nfs/dbraw/zinc/37/27/61/930372761.db2.gz OMGIXFXJQZVHJL-QUCCMNQESA-N 1 1 366.396 3.834 20 5 FHBDMO Cc1ccc(C(=O)N2CC[N@H+](Cc3ccccc3)CC[C@@H]2C)cc1[N+](=O)[O-] ZINC000610445637 930808721 /nfs/dbraw/zinc/80/87/21/930808721.db2.gz AHGPHUXVPDKYGX-KRWDZBQOSA-N 1 1 367.449 3.640 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](Cc2ccccc2)CC[C@H]1C ZINC000610446414 930818318 /nfs/dbraw/zinc/81/83/18/930818318.db2.gz XXRJZMNYFALSJQ-QGZVFWFLSA-N 1 1 367.449 3.640 20 5 FHBDMO CC[N@@H+](C)Cc1cccc(CNc2ncnc3sc([N+](=O)[O-])cc32)c1 ZINC000561154030 930999856 /nfs/dbraw/zinc/99/98/56/930999856.db2.gz NTQGSMUMOQIVBV-UHFFFAOYSA-N 1 1 357.439 3.663 20 5 FHBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000610475797 931545547 /nfs/dbraw/zinc/54/55/47/931545547.db2.gz MMWCBRGZDNFWCR-INIZCTEOSA-N 1 1 368.437 3.723 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000610476739 931558230 /nfs/dbraw/zinc/55/82/30/931558230.db2.gz ZIUMYVSWFWZOQJ-FQEVSTJZSA-N 1 1 356.422 3.957 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000610476739 931558231 /nfs/dbraw/zinc/55/82/31/931558231.db2.gz ZIUMYVSWFWZOQJ-FQEVSTJZSA-N 1 1 356.422 3.957 20 5 FHBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)C1 ZINC000610281769 931946183 /nfs/dbraw/zinc/94/61/83/931946183.db2.gz JMVWPFBZJXLZRQ-LJQANCHMSA-N 1 1 362.433 3.854 20 5 FHBDMO O=C([C@@H]1CC[N@H+](C2CCCCC2)C1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000135189780 932042276 /nfs/dbraw/zinc/04/22/76/932042276.db2.gz AZSIWLKPXSSRIQ-QGZVFWFLSA-N 1 1 371.481 3.740 20 5 FHBDMO CC[C@H](O)C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccccc1 ZINC000134501887 932141165 /nfs/dbraw/zinc/14/11/65/932141165.db2.gz ULKCRZXYMYXPHS-INIZCTEOSA-N 1 1 355.394 3.509 20 5 FHBDMO CC[C@H](O)C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccccc1 ZINC000134501887 932141168 /nfs/dbraw/zinc/14/11/68/932141168.db2.gz ULKCRZXYMYXPHS-INIZCTEOSA-N 1 1 355.394 3.509 20 5 FHBDMO O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000022610890 932585612 /nfs/dbraw/zinc/58/56/12/932585612.db2.gz GMFKSIVCSCHHCN-UHFFFAOYSA-N 1 1 373.840 3.596 20 5 FHBDMO Cc1c(C(=O)NC[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)cccc1[N+](=O)[O-] ZINC000247367688 932611110 /nfs/dbraw/zinc/61/11/10/932611110.db2.gz KODLQUZKRXPLOA-RDTXWAMCSA-N 1 1 373.478 3.778 20 5 FHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@H]2c2ccc3c(c2)OCO3)cc1 ZINC000477516019 932665593 /nfs/dbraw/zinc/66/55/93/932665593.db2.gz XZGLGQHYBUWZIA-KRWDZBQOSA-N 1 1 356.378 3.539 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](n2ncc3ccccc32)C1 ZINC000510471362 932800433 /nfs/dbraw/zinc/80/04/33/932800433.db2.gz LAKZRLUVFJZXLK-GOSISDBHSA-N 1 1 366.421 3.790 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)n1 ZINC000178221675 932911324 /nfs/dbraw/zinc/91/13/24/932911324.db2.gz DFWGKYAYSJLTRU-AYHJJNSGSA-N 1 1 352.438 3.906 20 5 FHBDMO CCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000610582659 933335542 /nfs/dbraw/zinc/33/55/42/933335542.db2.gz ILRJHZUTSFKOMY-MORSLUCNSA-N 1 1 359.426 3.762 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@@H](Cn1cccn1)c1ccccc1 ZINC000610582744 933358418 /nfs/dbraw/zinc/35/84/18/933358418.db2.gz UMGJUULGTQOXPP-KRWDZBQOSA-N 1 1 356.813 3.976 20 5 FHBDMO COc1ccc(-c2ccc(C[N@@H+]3CCO[C@@H]4CCC[C@@H]43)o2)c([N+](=O)[O-])c1 ZINC000510693843 933441773 /nfs/dbraw/zinc/44/17/73/933441773.db2.gz UBQRXOPFDIWEES-QFBILLFUSA-N 1 1 358.394 3.617 20 5 FHBDMO COc1ccc(-c2ccc(C[N@H+]3CCO[C@@H]4CCC[C@@H]43)o2)c([N+](=O)[O-])c1 ZINC000510693843 933441777 /nfs/dbraw/zinc/44/17/77/933441777.db2.gz UBQRXOPFDIWEES-QFBILLFUSA-N 1 1 358.394 3.617 20 5 FHBDMO CC[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H](C)c1cccc(O)c1 ZINC000178374938 933676149 /nfs/dbraw/zinc/67/61/49/933676149.db2.gz DEBCFDIPRSLSLX-CYBMUJFWSA-N 1 1 358.394 3.750 20 5 FHBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H](C)c1cccc(O)c1 ZINC000178374938 933676150 /nfs/dbraw/zinc/67/61/50/933676150.db2.gz DEBCFDIPRSLSLX-CYBMUJFWSA-N 1 1 358.394 3.750 20 5 FHBDMO Cc1nn(C)cc1[C@@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000610729569 933987911 /nfs/dbraw/zinc/98/79/11/933987911.db2.gz OCJHJXQNEASFCO-SFHVURJKSA-N 1 1 358.442 3.761 20 5 FHBDMO Cc1nn(C)cc1[C@@H]1CCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000610729569 933987914 /nfs/dbraw/zinc/98/79/14/933987914.db2.gz OCJHJXQNEASFCO-SFHVURJKSA-N 1 1 358.442 3.761 20 5 FHBDMO Cc1c(NC(=O)[C@@H]2C[N@H+](C(C)(C)C)C[C@H]2C(F)(F)F)cccc1[N+](=O)[O-] ZINC000431249854 934250046 /nfs/dbraw/zinc/25/00/46/934250046.db2.gz UYOLBLYURDQBDW-VXGBXAGGSA-N 1 1 373.375 3.751 20 5 FHBDMO CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NCC[C@H]1CCC[N@@H+](C)C1 ZINC000458212035 934381636 /nfs/dbraw/zinc/38/16/36/934381636.db2.gz LPEWTRXDBUBDBG-CQSZACIVSA-N 1 1 365.499 3.557 20 5 FHBDMO Cc1[nH+]ccn1-c1ccc([C@H](C)NC(=O)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000176190683 934559191 /nfs/dbraw/zinc/55/91/91/934559191.db2.gz ZHQMPZONIFXXLR-LBPRGKRZSA-N 1 1 368.368 3.719 20 5 FHBDMO O=[N+]([O-])c1ccn(CC[N@@H+]2CCC[C@H]2c2ccc(Cl)c(Cl)c2)n1 ZINC000176212277 934606516 /nfs/dbraw/zinc/60/65/16/934606516.db2.gz LSNSURQSVWFQCY-AWEZNQCLSA-N 1 1 355.225 3.935 20 5 FHBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@H]2c2ccc(Cl)c(Cl)c2)n1 ZINC000176212277 934606521 /nfs/dbraw/zinc/60/65/21/934606521.db2.gz LSNSURQSVWFQCY-AWEZNQCLSA-N 1 1 355.225 3.935 20 5 FHBDMO COC(=O)[C@@H](C)[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccccc1 ZINC000176225407 934647136 /nfs/dbraw/zinc/64/71/36/934647136.db2.gz MBMNHNKDVJRYEF-SJCJKPOMSA-N 1 1 362.813 3.888 20 5 FHBDMO CCC[C@@H]1CN(C(=O)c2csc([N+](=O)[O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC000538338019 934830256 /nfs/dbraw/zinc/83/02/56/934830256.db2.gz WAKJWGVYNZBJOD-QGZVFWFLSA-N 1 1 373.478 3.783 20 5 FHBDMO CCC[C@@H]1CN(C(=O)c2csc([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000538338019 934830259 /nfs/dbraw/zinc/83/02/59/934830259.db2.gz WAKJWGVYNZBJOD-QGZVFWFLSA-N 1 1 373.478 3.783 20 5 FHBDMO COc1cc(C[N@H+]2CC[C@@H]3CCC[C@H]32)c([N+](=O)[O-])cc1OCC(F)F ZINC000426526464 945081242 /nfs/dbraw/zinc/08/12/42/945081242.db2.gz SYTSXBMVNQLWHP-WCQYABFASA-N 1 1 356.369 3.622 20 5 FHBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)Nc1ncnc2sc([N+](=O)[O-])cc21 ZINC000381200608 935258894 /nfs/dbraw/zinc/25/88/94/935258894.db2.gz OVAWZDAZASICLC-GFCCVEGCSA-N 1 1 357.439 3.532 20 5 FHBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)c1ccccc1[N+](=O)[O-] ZINC000511788845 945120081 /nfs/dbraw/zinc/12/00/81/945120081.db2.gz RYLGLTDGOPIGBI-IBGZPJMESA-N 1 1 367.449 3.625 20 5 FHBDMO C[C@@H](c1nc(-c2ccccc2)no1)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511141454 935781038 /nfs/dbraw/zinc/78/10/38/935781038.db2.gz MGFWQMXMFZFSKI-AWEZNQCLSA-N 1 1 352.394 3.880 20 5 FHBDMO C[C@@H](c1nc(-c2ccccc2)no1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511141454 935781039 /nfs/dbraw/zinc/78/10/39/935781039.db2.gz MGFWQMXMFZFSKI-AWEZNQCLSA-N 1 1 352.394 3.880 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000158562852 935839610 /nfs/dbraw/zinc/83/96/10/935839610.db2.gz LJTUCBOGWHJXFE-YJBOKZPZSA-N 1 1 372.469 3.692 20 5 FHBDMO COc1cc(C[NH2+][C@H](C)c2cnn(CC3CCC3)c2)c([N+](=O)[O-])cc1F ZINC000934562485 935890793 /nfs/dbraw/zinc/89/07/93/935890793.db2.gz QLQUTUWXJYVSGT-GFCCVEGCSA-N 1 1 362.405 3.590 20 5 FHBDMO Cc1ccc(C[N@H+]2CCC[C@H](CNC(=O)c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000092783951 935921711 /nfs/dbraw/zinc/92/17/11/935921711.db2.gz IPVWIBOSYIUJKH-GOSISDBHSA-N 1 1 367.449 3.545 20 5 FHBDMO COc1cc(C[N@H+](C)[C@@H]2CC2(C)C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000426543996 945139753 /nfs/dbraw/zinc/13/97/53/945139753.db2.gz LJBNXACXJJDHDP-CQSZACIVSA-N 1 1 362.348 3.775 20 5 FHBDMO COc1cc(C[N@@H+](C)[C@@H]2CC2(C)C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000426543996 945139755 /nfs/dbraw/zinc/13/97/55/945139755.db2.gz LJBNXACXJJDHDP-CQSZACIVSA-N 1 1 362.348 3.775 20 5 FHBDMO Cc1c(C[N@H+]2CCC[C@H]2Cn2cnc3ccccc32)cccc1[N+](=O)[O-] ZINC000536069090 938302561 /nfs/dbraw/zinc/30/25/61/938302561.db2.gz SSVVTCOKMSPCJF-KRWDZBQOSA-N 1 1 350.422 3.918 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H]2CCCC[C@H]21 ZINC000245858155 938318303 /nfs/dbraw/zinc/31/83/03/938318303.db2.gz PIWUYWLBSGDVHY-RHSMWYFYSA-N 1 1 361.442 3.587 20 5 FHBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)c1csc([N+](=O)[O-])c1 ZINC000511810472 945180151 /nfs/dbraw/zinc/18/01/51/945180151.db2.gz XIVIEDWAQCJKPC-MRXNPFEDSA-N 1 1 373.478 3.687 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)CCCc1ccccc1 ZINC000052802804 938595025 /nfs/dbraw/zinc/59/50/25/938595025.db2.gz SIMSGKRLLJBIAX-UHFFFAOYSA-N 1 1 355.438 3.796 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000278684310 938648751 /nfs/dbraw/zinc/64/87/51/938648751.db2.gz IZGAVHZJVUAWSV-GFCCVEGCSA-N 1 1 359.348 3.506 20 5 FHBDMO CCCC[N@@H+](C)CC1CCN(C(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000511284671 938984295 /nfs/dbraw/zinc/98/42/95/938984295.db2.gz KCBKAYWHNHLLTO-UHFFFAOYSA-N 1 1 362.474 3.879 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](Cc2ccccc2)[C@H]1C ZINC000472352522 939015899 /nfs/dbraw/zinc/01/58/99/939015899.db2.gz ZPMLZUMIXUQGGH-SJLPKXTDSA-N 1 1 367.449 3.795 20 5 FHBDMO C[N@H+](Cc1ccc(Oc2cnccn2)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000179316553 939080168 /nfs/dbraw/zinc/08/01/68/939080168.db2.gz SBVJOVFMMQFNNQ-UHFFFAOYSA-N 1 1 350.378 3.809 20 5 FHBDMO C[N@@H+](Cc1ccc(Oc2cnccn2)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000179316553 939080172 /nfs/dbraw/zinc/08/01/72/939080172.db2.gz SBVJOVFMMQFNNQ-UHFFFAOYSA-N 1 1 350.378 3.809 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1C[C@H](O)c1ccco1 ZINC000177129660 939943297 /nfs/dbraw/zinc/94/32/97/939943297.db2.gz WKTWZWSSMFEGEZ-WBVHZDCISA-N 1 1 360.410 3.675 20 5 FHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1N(C)C(=O)c1csc([N+](=O)[O-])c1 ZINC000364822556 940006349 /nfs/dbraw/zinc/00/63/49/940006349.db2.gz XZNZMGJWPLOYET-PBHICJAKSA-N 1 1 373.478 3.639 20 5 FHBDMO CC(=O)c1ccc([N+](=O)[O-])cc1N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000516595521 940013661 /nfs/dbraw/zinc/01/36/61/940013661.db2.gz ITVILVPTRXBYHA-UHFFFAOYSA-N 1 1 353.422 3.510 20 5 FHBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000411298421 940024563 /nfs/dbraw/zinc/02/45/63/940024563.db2.gz NSHOFJIPVBXRGS-JKSUJKDBSA-N 1 1 351.472 3.529 20 5 FHBDMO Cc1c(-c2nc([C@H]3C[N@@H+](C4CCCCC4)CCO3)no2)cccc1[N+](=O)[O-] ZINC000364993272 940034690 /nfs/dbraw/zinc/03/46/90/940034690.db2.gz GZCMKFRHGNXTMN-QGZVFWFLSA-N 1 1 372.425 3.659 20 5 FHBDMO Cc1c(-c2nc([C@H]3C[N@H+](C4CCCCC4)CCO3)no2)cccc1[N+](=O)[O-] ZINC000364993272 940034692 /nfs/dbraw/zinc/03/46/92/940034692.db2.gz GZCMKFRHGNXTMN-QGZVFWFLSA-N 1 1 372.425 3.659 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]([C@H](C)c1ccco1)C1CC1 ZINC000411396859 940037516 /nfs/dbraw/zinc/03/75/16/940037516.db2.gz YFPFUDBCNSPISH-CYBMUJFWSA-N 1 1 373.409 3.751 20 5 FHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000612432571 940065634 /nfs/dbraw/zinc/06/56/34/940065634.db2.gz ZXDOGILXFSFZFA-KRWDZBQOSA-N 1 1 355.438 3.842 20 5 FHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccn(-c2ccc(F)cc2F)n1 ZINC000548933856 940090359 /nfs/dbraw/zinc/09/03/59/940090359.db2.gz JXFNLRLNOYVSQJ-UHFFFAOYSA-N 1 1 372.375 3.733 20 5 FHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccn(-c2ccc(F)cc2F)n1 ZINC000548933856 940090363 /nfs/dbraw/zinc/09/03/63/940090363.db2.gz JXFNLRLNOYVSQJ-UHFFFAOYSA-N 1 1 372.375 3.733 20 5 FHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@H](O)Cc1ccc2ccccc2c1 ZINC000548934098 940099624 /nfs/dbraw/zinc/09/96/24/940099624.db2.gz REGKNMPEOWWQGC-JOCHJYFZSA-N 1 1 364.445 3.826 20 5 FHBDMO CC(C)(C)NC(=O)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000236653981 940122613 /nfs/dbraw/zinc/12/26/13/940122613.db2.gz UBXYHHWGQRQLDE-UHFFFAOYSA-N 1 1 365.817 3.513 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@@H]1CC[N@H+](C)[C@@H]1c1ccccc1 ZINC000180008677 940221422 /nfs/dbraw/zinc/22/14/22/940221422.db2.gz GIKYQGIKDCERCE-YLJYHZDGSA-N 1 1 367.449 3.695 20 5 FHBDMO Cc1cnn([C@H]2CC[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C2)c1 ZINC000584501901 940295658 /nfs/dbraw/zinc/29/56/58/940295658.db2.gz ZZVIBOCSSKMMJE-KRWDZBQOSA-N 1 1 352.394 3.807 20 5 FHBDMO O=[N+]([O-])c1ccc2c(cnn2C[NH+]2CCC(OC3CCCCC3)CC2)c1 ZINC000124740682 945317505 /nfs/dbraw/zinc/31/75/05/945317505.db2.gz GBXKPENFXJLQGI-UHFFFAOYSA-N 1 1 358.442 3.716 20 5 FHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cnc(-c2ccncc2)s1 ZINC000580011541 940430505 /nfs/dbraw/zinc/43/05/05/940430505.db2.gz JKENAVMRWBGKEJ-UHFFFAOYSA-N 1 1 354.435 3.788 20 5 FHBDMO O=[N+]([O-])c1cccc([C@@H](NC[C@@H]2CC[N@H+](C3CC3)C2)c2ccccc2)c1 ZINC000180095145 940468338 /nfs/dbraw/zinc/46/83/38/940468338.db2.gz QWLJLZDONMSOLU-KKSFZXQISA-N 1 1 351.450 3.758 20 5 FHBDMO Cc1cc(C(=O)N2CC[C@H](C)[N@H+](Cc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000173508540 940632702 /nfs/dbraw/zinc/63/27/02/940632702.db2.gz ALMGVMZZZLIXND-KRWDZBQOSA-N 1 1 367.449 3.640 20 5 FHBDMO CC(C)c1ccc(C(=O)N2CCC[N@@H+](CC3CCC3)CC2)cc1[N+](=O)[O-] ZINC000582381400 940662467 /nfs/dbraw/zinc/66/24/67/940662467.db2.gz PIQQCQBRZJARFD-UHFFFAOYSA-N 1 1 359.470 3.666 20 5 FHBDMO NC(=O)c1ccc(C[N@H+](Cc2ccc(Cl)cc2)C2CC2)c([N+](=O)[O-])c1 ZINC000053128596 940825274 /nfs/dbraw/zinc/82/52/74/940825274.db2.gz XAQFBEHGNXAXGA-UHFFFAOYSA-N 1 1 359.813 3.512 20 5 FHBDMO NC(=O)c1ccc(C[N@@H+](Cc2ccc(Cl)cc2)C2CC2)c([N+](=O)[O-])c1 ZINC000053128596 940825278 /nfs/dbraw/zinc/82/52/78/940825278.db2.gz XAQFBEHGNXAXGA-UHFFFAOYSA-N 1 1 359.813 3.512 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+](C)CCC1CCCCC1 ZINC000507605612 945352660 /nfs/dbraw/zinc/35/26/60/945352660.db2.gz AYWQQTVJALHTHO-CQSZACIVSA-N 1 1 363.458 3.833 20 5 FHBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1nnc(C2CC2)s1 ZINC000414327909 940977761 /nfs/dbraw/zinc/97/77/61/940977761.db2.gz PEZNJQZPGJVWSC-LBPRGKRZSA-N 1 1 364.496 3.984 20 5 FHBDMO Cc1nn(C)c(C)c1C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180364710 940989514 /nfs/dbraw/zinc/98/95/14/940989514.db2.gz YOBJIOIMAWDPRW-FQEVSTJZSA-N 1 1 350.422 3.824 20 5 FHBDMO C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])CCc1nc(-c2ccccc2)no1 ZINC000583051260 941013663 /nfs/dbraw/zinc/01/36/63/941013663.db2.gz HHTDGCLZWUKYGP-YRNVUSSQSA-N 1 1 364.405 3.833 20 5 FHBDMO COCCn1cc2c(n1)[C@H]([NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1)CCC2 ZINC000376504798 941092342 /nfs/dbraw/zinc/09/23/42/941092342.db2.gz IPALDUSZPQHINB-GOSISDBHSA-N 1 1 372.469 3.728 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2c(N)cccc2[N+](=O)[O-])cc1 ZINC000180937808 941094062 /nfs/dbraw/zinc/09/40/62/941094062.db2.gz DXHBIHMCTWTDTK-CQSZACIVSA-N 1 1 368.437 3.804 20 5 FHBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2c(N)cccc2[N+](=O)[O-])cc1 ZINC000180937829 941094070 /nfs/dbraw/zinc/09/40/70/941094070.db2.gz DXHBIHMCTWTDTK-AWEZNQCLSA-N 1 1 368.437 3.804 20 5 FHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)CC1(c2ccccc2)CC1 ZINC000189287050 941155361 /nfs/dbraw/zinc/15/53/61/941155361.db2.gz JQDQCXLKCMJQKT-OAHLLOKOSA-N 1 1 353.422 3.585 20 5 FHBDMO CCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](C)[N@H+]1CCCC[C@H]1C ZINC000480700695 941300892 /nfs/dbraw/zinc/30/08/92/941300892.db2.gz IZAPIOMBEHGTDB-KGLIPLIRSA-N 1 1 365.499 3.700 20 5 FHBDMO Cc1c(C[NH+]2CCC(C(=O)c3ccc(O)cc3)CC2)cccc1[N+](=O)[O-] ZINC000122249340 941306884 /nfs/dbraw/zinc/30/68/84/941306884.db2.gz KLQCOAMLUOIOGC-UHFFFAOYSA-N 1 1 354.406 3.704 20 5 FHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1nccc(C(F)(F)F)n1 ZINC000414511057 941369740 /nfs/dbraw/zinc/36/97/40/941369740.db2.gz WXTUWCSVIYMRNT-YRNVUSSQSA-N 1 1 352.316 3.597 20 5 FHBDMO Cc1c[nH+]cn1C1CCN(c2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000376741839 941407318 /nfs/dbraw/zinc/40/73/18/941407318.db2.gz JYPKPHUMDNKFGS-UHFFFAOYSA-N 1 1 365.231 3.704 20 5 FHBDMO Cc1c([N+](=O)[O-])ccc(F)c1NC(=O)N1CCC([N@@H+]2CCC[C@H]2C)CC1 ZINC000377282687 941616950 /nfs/dbraw/zinc/61/69/50/941616950.db2.gz IERZFERVAUQGMB-GFCCVEGCSA-N 1 1 364.421 3.523 20 5 FHBDMO CCc1ccc(C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000549195062 941624666 /nfs/dbraw/zinc/62/46/66/941624666.db2.gz ROACTSKKQXARNA-FQEVSTJZSA-N 1 1 370.449 3.562 20 5 FHBDMO O=[N+]([O-])c1cc2c(cc1C[NH+]1CCC(c3ccsc3)CC1)OCCO2 ZINC000614456464 941737134 /nfs/dbraw/zinc/73/71/34/941737134.db2.gz VZKHWBWHMDZHRV-UHFFFAOYSA-N 1 1 360.435 3.807 20 5 FHBDMO C[N@@H+](CCCNC(=O)c1cc([N+](=O)[O-])ccc1Cl)C1CCCCC1 ZINC000122522652 941788982 /nfs/dbraw/zinc/78/89/82/941788982.db2.gz NZYWGKPIWVTQOX-UHFFFAOYSA-N 1 1 353.850 3.633 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H](C)C[C@H]1c1ccccc1 ZINC000513275780 941826133 /nfs/dbraw/zinc/82/61/33/941826133.db2.gz KCCOKIHWRSJJKU-KUHUBIRLSA-N 1 1 353.422 3.925 20 5 FHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCCN(c4ccccc4F)CC3)nc2c1 ZINC000513375833 941884198 /nfs/dbraw/zinc/88/41/98/941884198.db2.gz KTLYUAGGUNKMOS-UHFFFAOYSA-N 1 1 370.384 3.587 20 5 FHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCCN(c4ccccc4F)CC3)nc2c1 ZINC000513375833 941884201 /nfs/dbraw/zinc/88/42/01/941884201.db2.gz KTLYUAGGUNKMOS-UHFFFAOYSA-N 1 1 370.384 3.587 20 5 FHBDMO COc1ccc(C[N@@H+](C)Cc2ccccc2N2CCCC2)cc1[N+](=O)[O-] ZINC000051120081 941895231 /nfs/dbraw/zinc/89/52/31/941895231.db2.gz UQZCXPPAKTYZRX-UHFFFAOYSA-N 1 1 355.438 3.836 20 5 FHBDMO CCc1ccc([C@@H]2CCC[N@@H+](Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C2)cc1 ZINC000513400102 941895569 /nfs/dbraw/zinc/89/55/69/941895569.db2.gz AWCUHOFTASWZEH-GOSISDBHSA-N 1 1 367.449 3.636 20 5 FHBDMO CC(C)[N@H+](CC(=O)N1CCC[C@H]2CCCC[C@H]21)Cc1ccc([N+](=O)[O-])cc1 ZINC000513405272 941899470 /nfs/dbraw/zinc/89/94/70/941899470.db2.gz FVVMCOACRVHKQX-UYAOXDASSA-N 1 1 373.497 3.986 20 5 FHBDMO CC(C)[N@@H+](CC(=O)N1CCC[C@H]2CCCC[C@H]21)Cc1ccc([N+](=O)[O-])cc1 ZINC000513405272 941899472 /nfs/dbraw/zinc/89/94/72/941899472.db2.gz FVVMCOACRVHKQX-UYAOXDASSA-N 1 1 373.497 3.986 20 5 FHBDMO Cc1cc(C(=O)N2CCC[C@H]2Cn2cc[nH+]c2C(C)C)ccc1[N+](=O)[O-] ZINC000377794762 941998811 /nfs/dbraw/zinc/99/88/11/941998811.db2.gz MAXHACLGVVTFFH-INIZCTEOSA-N 1 1 356.426 3.528 20 5 FHBDMO Cn1nccc1-c1ccccc1C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000513555255 942010342 /nfs/dbraw/zinc/01/03/42/942010342.db2.gz VTHZRZUTTRECLI-UHFFFAOYSA-N 1 1 350.422 3.670 20 5 FHBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccc(F)c(Cl)c1 ZINC000501849294 942076852 /nfs/dbraw/zinc/07/68/52/942076852.db2.gz MAQMWFRKPJAIHT-UHFFFAOYSA-N 1 1 365.792 3.848 20 5 FHBDMO CCN(C(=O)c1ccc([N+](=O)[O-])s1)[C@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000501953169 942136722 /nfs/dbraw/zinc/13/67/22/942136722.db2.gz ZCWHETAAZVDRJY-ZBFHGGJFSA-N 1 1 373.478 3.954 20 5 FHBDMO CCC(=O)c1ccc(NC2CC[NH+](Cc3ccccn3)CC2)c([N+](=O)[O-])c1 ZINC000280711574 942237294 /nfs/dbraw/zinc/23/72/94/942237294.db2.gz LIROTYGNJZRUKA-UHFFFAOYSA-N 1 1 368.437 3.659 20 5 FHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420955299 942274547 /nfs/dbraw/zinc/27/45/47/942274547.db2.gz WEWXKOZEMIEEIP-RYUDHWBXSA-N 1 1 359.348 3.586 20 5 FHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420955299 942274551 /nfs/dbraw/zinc/27/45/51/942274551.db2.gz WEWXKOZEMIEEIP-RYUDHWBXSA-N 1 1 359.348 3.586 20 5 FHBDMO C[C@@H]1[C@H](NC(=O)c2cccc([N+](=O)[O-])c2Cl)CC[N@H+]1Cc1ccccc1 ZINC000312024085 942284460 /nfs/dbraw/zinc/28/44/60/942284460.db2.gz WYOWHLKUPHVCRY-CZUORRHYSA-N 1 1 373.840 3.641 20 5 FHBDMO C[C@H]1[C@H](NC(=O)c2cccc([N+](=O)[O-])c2Cl)CC[N@H+]1Cc1ccccc1 ZINC000312024090 942284648 /nfs/dbraw/zinc/28/46/48/942284648.db2.gz WYOWHLKUPHVCRY-XJKSGUPXSA-N 1 1 373.840 3.641 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C1CC1)C1CCC(C)CC1 ZINC000053170356 942292112 /nfs/dbraw/zinc/29/21/12/942292112.db2.gz BFFJSYCMRLPSED-UHFFFAOYSA-N 1 1 361.442 3.585 20 5 FHBDMO Cc1cccc(N2CCC(Nc3ccc([N+](=O)[O-])c4ncccc34)CC2)[nH+]1 ZINC000413137301 942336887 /nfs/dbraw/zinc/33/68/87/942336887.db2.gz CDUSARWPBSMNQI-UHFFFAOYSA-N 1 1 363.421 3.927 20 5 FHBDMO CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@H](C)c1cccc(OC)c1 ZINC000072577578 942360840 /nfs/dbraw/zinc/36/08/40/942360840.db2.gz FYWLFCKAJFHSDD-OAHLLOKOSA-N 1 1 371.437 3.933 20 5 FHBDMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@H](C)c1cccc(OC)c1 ZINC000072577578 942360843 /nfs/dbraw/zinc/36/08/43/942360843.db2.gz FYWLFCKAJFHSDD-OAHLLOKOSA-N 1 1 371.437 3.933 20 5 FHBDMO C[C@@H]1CCC[N@H+]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 ZINC000366458969 942376578 /nfs/dbraw/zinc/37/65/78/942376578.db2.gz VJOYUJVXKTXUDM-CYBMUJFWSA-N 1 1 373.478 3.898 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CC[C@@H](O)CC34CCC4)cs2)c1 ZINC000421377595 942528086 /nfs/dbraw/zinc/52/80/86/942528086.db2.gz TZQYDHXQRNJGOW-MRXNPFEDSA-N 1 1 359.451 3.598 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CC[C@@H](O)CC34CCC4)cs2)c1 ZINC000421377595 942528091 /nfs/dbraw/zinc/52/80/91/942528091.db2.gz TZQYDHXQRNJGOW-MRXNPFEDSA-N 1 1 359.451 3.598 20 5 FHBDMO COc1cc(C[N@@H+](C)[C@@H]2CC[C@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000429590657 942566775 /nfs/dbraw/zinc/56/67/75/942566775.db2.gz PHZWKFLHWGATMX-WCQYABFASA-N 1 1 358.385 3.868 20 5 FHBDMO O=C(NC[C@@H]1CCCC[N@H+]1C1CC1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000434427048 942654802 /nfs/dbraw/zinc/65/48/02/942654802.db2.gz YADORGGGVQREAO-HNNXBMFYSA-N 1 1 359.451 3.556 20 5 FHBDMO C[N@H+](Cc1cccnc1)C[C@H]1CCN(Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000434495429 942712574 /nfs/dbraw/zinc/71/25/74/942712574.db2.gz VRLSBJIKRBJGPO-MRXNPFEDSA-N 1 1 374.872 3.597 20 5 FHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(F)(c3ccccc3)CC2)c2c(c1)COCO2 ZINC000434501112 942727042 /nfs/dbraw/zinc/72/70/42/942727042.db2.gz FOQKKMALCYPNEW-UHFFFAOYSA-N 1 1 372.396 3.922 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc2c(s1)C[N@H+](C(C)(C)C)CC2 ZINC000425091272 942748925 /nfs/dbraw/zinc/74/89/25/942748925.db2.gz YMFWJNKVDKSUPI-UHFFFAOYSA-N 1 1 374.466 3.769 20 5 FHBDMO CCOc1ccc(NC(=O)C[N@H+](C)Cc2ccc(CC)cc2)c([N+](=O)[O-])c1 ZINC000016564386 942855509 /nfs/dbraw/zinc/85/55/09/942855509.db2.gz HJJXSGCYPKHCLV-UHFFFAOYSA-N 1 1 371.437 3.626 20 5 FHBDMO CCOc1ccc(NC(=O)C[N@@H+](C)Cc2ccc(CC)cc2)c([N+](=O)[O-])c1 ZINC000016564386 942855511 /nfs/dbraw/zinc/85/55/11/942855511.db2.gz HJJXSGCYPKHCLV-UHFFFAOYSA-N 1 1 371.437 3.626 20 5 FHBDMO C[N@H+](CCOc1ccccc1Cl)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000434836279 942993032 /nfs/dbraw/zinc/99/30/32/942993032.db2.gz LPDYJINUYHJDAQ-UHFFFAOYSA-N 1 1 361.785 3.900 20 5 FHBDMO C[N@@H+](CCOc1ccccc1Cl)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000434836279 942993035 /nfs/dbraw/zinc/99/30/35/942993035.db2.gz LPDYJINUYHJDAQ-UHFFFAOYSA-N 1 1 361.785 3.900 20 5 FHBDMO C[C@@H]1[C@@H](c2ccccc2)CC[N@H+]1[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000434892328 943022248 /nfs/dbraw/zinc/02/22/48/943022248.db2.gz QJXMTNJSLLAQLB-UIAACRFSSA-N 1 1 365.433 3.578 20 5 FHBDMO COc1ccc(C(=O)C2CC[NH+](Cc3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000014326225 943026287 /nfs/dbraw/zinc/02/62/87/943026287.db2.gz CWJWVFOVWIQULT-UHFFFAOYSA-N 1 1 354.406 3.698 20 5 FHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](c2ccccc2)[C@@H]1C ZINC000434895770 943033979 /nfs/dbraw/zinc/03/39/79/943033979.db2.gz NBGOYQORBFCDCA-ZMSDIMECSA-N 1 1 353.422 3.800 20 5 FHBDMO O=[N+]([O-])c1cnn(CC[N@@H+](Cc2cc(F)ccc2F)C2CCCC2)c1 ZINC000434906524 943044011 /nfs/dbraw/zinc/04/40/11/943044011.db2.gz NKXXTNGONHNDNH-UHFFFAOYSA-N 1 1 350.369 3.514 20 5 FHBDMO Cc1cc(N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302144813 943100740 /nfs/dbraw/zinc/10/07/40/943100740.db2.gz GJTPVUCFYOPYMC-WBVHZDCISA-N 1 1 354.454 3.903 20 5 FHBDMO Cc1cc(N2CC[C@H]3CC[C@@H](C2)[N@@H+]3C(C)C)c2cc([N+](=O)[O-])ccc2n1 ZINC000302144813 943100746 /nfs/dbraw/zinc/10/07/46/943100746.db2.gz GJTPVUCFYOPYMC-WBVHZDCISA-N 1 1 354.454 3.903 20 5 FHBDMO Cc1cc(N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)c2cc([N+](=O)[O-])ccc2n1 ZINC000302144813 943100750 /nfs/dbraw/zinc/10/07/50/943100750.db2.gz GJTPVUCFYOPYMC-WBVHZDCISA-N 1 1 354.454 3.903 20 5 FHBDMO COc1cc(N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000312298649 943122071 /nfs/dbraw/zinc/12/20/71/943122071.db2.gz NGPRZZAERKTZGE-ZBFHGGJFSA-N 1 1 371.437 3.687 20 5 FHBDMO CN(c1ccccc1)c1ccc(C[N@@H+](C)CCCCCO)cc1[N+](=O)[O-] ZINC000435053698 943126313 /nfs/dbraw/zinc/12/63/13/943126313.db2.gz UXRTYVNAHJEYBG-UHFFFAOYSA-N 1 1 357.454 3.957 20 5 FHBDMO Cc1ccc([C@H](C)N[C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1[N+](=O)[O-] ZINC000422916669 943330083 /nfs/dbraw/zinc/33/00/83/943330083.db2.gz BIAFHIPNTWNMDW-RRMPHLOHSA-N 1 1 367.449 3.810 20 5 FHBDMO CC[C@H]([NH2+][C@@H]1CNCC[C@H]1c1ccc(OC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000423328553 943481301 /nfs/dbraw/zinc/48/13/01/943481301.db2.gz KUVQLFDOSNGKIR-PCCBWWKXSA-N 1 1 369.465 3.790 20 5 FHBDMO CCc1ccc([C@@H](NCCC2=CC[NH2+]CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423541205 943552722 /nfs/dbraw/zinc/55/27/22/943552722.db2.gz RLEURTVUVFWEQF-FQEVSTJZSA-N 1 1 355.438 3.739 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H]1c1ccccc1C ZINC000053279171 943577617 /nfs/dbraw/zinc/57/76/17/943577617.db2.gz AVKJYGYDLRVRCG-GOSISDBHSA-N 1 1 369.421 3.687 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H]1c1ccccc1C ZINC000053279171 943577622 /nfs/dbraw/zinc/57/76/22/943577622.db2.gz AVKJYGYDLRVRCG-GOSISDBHSA-N 1 1 369.421 3.687 20 5 FHBDMO COc1ccc([C@H]2CC[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000504501772 943647285 /nfs/dbraw/zinc/64/72/85/943647285.db2.gz BHALSLARKOAPOK-KRWDZBQOSA-N 1 1 356.422 3.862 20 5 FHBDMO C[C@H]1CCCC[N@H+]1CCCCNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000516844642 943764766 /nfs/dbraw/zinc/76/47/66/943764766.db2.gz RZIJKMXBUJMKAF-AWEZNQCLSA-N 1 1 359.426 3.725 20 5 FHBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000425411987 943836556 /nfs/dbraw/zinc/83/65/56/943836556.db2.gz BLJJGPOWLNYKKU-MRXNPFEDSA-N 1 1 369.259 3.750 20 5 FHBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000425411987 943836561 /nfs/dbraw/zinc/83/65/61/943836561.db2.gz BLJJGPOWLNYKKU-MRXNPFEDSA-N 1 1 369.259 3.750 20 5 FHBDMO Cc1ccsc1[C@@H](CO)[NH2+]Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425432432 943907443 /nfs/dbraw/zinc/90/74/43/943907443.db2.gz KPDCSTAAHCKTDO-GFCCVEGCSA-N 1 1 371.256 3.550 20 5 FHBDMO CCOc1ccc([C@H](C)NC[C@H](Cc2ccccc2)[NH+](C)C)cc1[N+](=O)[O-] ZINC000504912352 943908728 /nfs/dbraw/zinc/90/87/28/943908728.db2.gz VBRAGELXKYYOQT-LPHOPBHVSA-N 1 1 371.481 3.817 20 5 FHBDMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Br)[C@H](C)C(C)C ZINC000120273746 943957768 /nfs/dbraw/zinc/95/77/68/943957768.db2.gz HWYMNEPXEBRRSP-LLVKDONJSA-N 1 1 372.263 3.662 20 5 FHBDMO C[C@H]1C[C@@H](c2ccc(F)cc2)C[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500126386 944141244 /nfs/dbraw/zinc/14/12/44/944141244.db2.gz RZXVNNFEZGRGKB-GOEBONIOSA-N 1 1 371.412 3.941 20 5 FHBDMO C[C@@H]1[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1Cc1ccccc1 ZINC000382118472 944180786 /nfs/dbraw/zinc/18/07/86/944180786.db2.gz WHPUQBONQMIPHN-ACJLOTCBSA-N 1 1 373.840 3.641 20 5 FHBDMO CCCC[N@@H+](C)CC1CCN(c2cc(C(F)(F)F)ncc2[N+](=O)[O-])CC1 ZINC000436307541 944190256 /nfs/dbraw/zinc/19/02/56/944190256.db2.gz KXNDXHLCBOHQLR-UHFFFAOYSA-N 1 1 374.407 3.957 20 5 FHBDMO COc1cc(C[N@@H+](CCCO)[C@H]2CCc3ccccc32)c([N+](=O)[O-])cc1F ZINC000184231469 944288240 /nfs/dbraw/zinc/28/82/40/944288240.db2.gz ULYCEXXUGYGBHR-SFHVURJKSA-N 1 1 374.412 3.614 20 5 FHBDMO COc1cc(C[NH+]2CCC(OCC3CCCC3)CC2)c([N+](=O)[O-])cc1F ZINC000184233354 944289259 /nfs/dbraw/zinc/28/92/59/944289259.db2.gz FKFZFLHKSDJDDR-UHFFFAOYSA-N 1 1 366.433 3.914 20 5 FHBDMO O=C(CC[N@H+](Cc1cccc(O)c1)CC1CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000436451636 944313633 /nfs/dbraw/zinc/31/36/33/944313633.db2.gz ATISMEPBSABZNP-UHFFFAOYSA-N 1 1 369.421 3.541 20 5 FHBDMO CC1(C)C[C@@H](c2ccccc2)[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000425550472 944317366 /nfs/dbraw/zinc/31/73/66/944317366.db2.gz ZKJWDYUZXCUNNA-SFHVURJKSA-N 1 1 353.422 3.667 20 5 FHBDMO C[C@H]1CCCC[N@H+]1CCCNc1nc2cc([N+](=O)[O-])ccc2nc1Cl ZINC001167752444 944363834 /nfs/dbraw/zinc/36/38/34/944363834.db2.gz VXLXZHUWEPFSKY-LBPRGKRZSA-N 1 1 363.849 3.868 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCC[C@H]3[C@H](O)C(F)(F)F)o2)c1 ZINC000123720116 944414084 /nfs/dbraw/zinc/41/40/84/944414084.db2.gz NAPJIGXQRHYSSW-HOCLYGCPSA-N 1 1 370.327 3.742 20 5 FHBDMO CN(c1ccccc1)c1ccc(C[N@H+]2CC[C@H](O)C(C)(C)C2)cc1[N+](=O)[O-] ZINC000438325621 944509743 /nfs/dbraw/zinc/50/97/43/944509743.db2.gz NJSJBNMBPPUNFI-FQEVSTJZSA-N 1 1 369.465 3.956 20 5 FHBDMO Cc1ccc2c(c1)[C@@H]1C[N@@H+](C)CC[C@H]1N2C(=O)c1cc(C)cc([N+](=O)[O-])c1 ZINC000843740253 944627711 /nfs/dbraw/zinc/62/77/11/944627711.db2.gz QMMILNRJTWTHNC-AZUAARDMSA-N 1 1 365.433 3.660 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@](C)(c2ccccc2)C1 ZINC000438482127 944663022 /nfs/dbraw/zinc/66/30/22/944663022.db2.gz KGKGINGPDNQEDF-NRFANRHFSA-N 1 1 367.449 3.895 20 5 FHBDMO Cc1nc2ccc(C[N@H+]3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)cc2s1 ZINC000426401935 944678804 /nfs/dbraw/zinc/67/88/04/944678804.db2.gz PWWHKHFNKMZXFJ-AWEZNQCLSA-N 1 1 369.450 3.594 20 5 FHBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@](C)(c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000438502353 944699635 /nfs/dbraw/zinc/69/96/35/944699635.db2.gz VZRGSXSQYBQZNK-HRAATJIYSA-N 1 1 367.449 3.894 20 5 FHBDMO C[C@H](CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)[N@H+]1CCC[C@@H](C)C1 ZINC000506259769 944711097 /nfs/dbraw/zinc/71/10/97/944711097.db2.gz NLMPPJOUOJEGFP-CHWSQXEVSA-N 1 1 361.467 3.660 20 5 FHBDMO CN(C(=O)C[N@@H+]1CCC[C@@H]1c1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000053718299 944747508 /nfs/dbraw/zinc/74/75/08/944747508.db2.gz SPOQRJWWCMXSGP-GOSISDBHSA-N 1 1 357.385 3.534 20 5 FHBDMO CN(C(=O)C[N@H+]1CCC[C@@H]1c1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000053718299 944747516 /nfs/dbraw/zinc/74/75/16/944747516.db2.gz SPOQRJWWCMXSGP-GOSISDBHSA-N 1 1 357.385 3.534 20 5 FHBDMO CCC[N@H+]1CC[C@@H](CNc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C1 ZINC000506993816 944844446 /nfs/dbraw/zinc/84/44/46/944844446.db2.gz ADOXZTZTDPPLGS-INIZCTEOSA-N 1 1 367.449 3.970 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](C)[N@@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000500424129 944857117 /nfs/dbraw/zinc/85/71/17/944857117.db2.gz MIXSDCMVRMXSQM-DLBZAZTESA-N 1 1 367.449 3.638 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](C)[N@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000500424129 944857122 /nfs/dbraw/zinc/85/71/22/944857122.db2.gz MIXSDCMVRMXSQM-DLBZAZTESA-N 1 1 367.449 3.638 20 5 FHBDMO CC[N@@H+]1CCCC[C@@H]1CNCc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000518981179 945004078 /nfs/dbraw/zinc/00/40/78/945004078.db2.gz NAZAZSZTOHKNHX-OAHLLOKOSA-N 1 1 373.453 3.827 20 5 FHBDMO CC[N@H+]1CCCC[C@@H]1CNCc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000518981179 945004086 /nfs/dbraw/zinc/00/40/86/945004086.db2.gz NAZAZSZTOHKNHX-OAHLLOKOSA-N 1 1 373.453 3.827 20 5 FHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)c(F)c1 ZINC000511754840 945024600 /nfs/dbraw/zinc/02/46/00/945024600.db2.gz JMEAFVSQKQVWJK-WRWLIDTKSA-N 1 1 374.387 3.878 20 5 FHBDMO O=C(NC[C@H]1CCC[N@H+]1C1CCCCC1)c1ccc([N+](=O)[O-])cc1Cl ZINC000437848305 945035642 /nfs/dbraw/zinc/03/56/42/945035642.db2.gz WFGYJVPTXRLRFV-OAHLLOKOSA-N 1 1 365.861 3.775 20 5 FHBDMO Cc1ccccc1[C@H]1CC[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000507208471 945041288 /nfs/dbraw/zinc/04/12/88/945041288.db2.gz QLQFBAAYCZAFDG-INIZCTEOSA-N 1 1 353.422 3.640 20 5 FHBDMO Cc1ccccc1[C@@H]1CC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000507210882 945043014 /nfs/dbraw/zinc/04/30/14/945043014.db2.gz UFAGOBYCBWQGQJ-CQSZACIVSA-N 1 1 373.840 3.985 20 5 FHBDMO Cc1ccccc1[C@@H]1CC[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000507210882 945043022 /nfs/dbraw/zinc/04/30/22/945043022.db2.gz UFAGOBYCBWQGQJ-CQSZACIVSA-N 1 1 373.840 3.985 20 5 FHBDMO C[C@H]([NH2+]Cc1ccncc1OCC(F)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000281825179 945872239 /nfs/dbraw/zinc/87/22/39/945872239.db2.gz KKNGYWMLZIGMIZ-NSHDSACASA-N 1 1 355.316 3.782 20 5 FHBDMO CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ncc(C)cc1[N+](=O)[O-] ZINC000439693201 945883593 /nfs/dbraw/zinc/88/35/93/945883593.db2.gz LYUHTHHAEKRXAS-SFHVURJKSA-N 1 1 354.454 3.647 20 5 FHBDMO CCCO[C@@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000108397139 945952152 /nfs/dbraw/zinc/95/21/52/945952152.db2.gz FZQRJNRHBNTPQY-QGZVFWFLSA-N 1 1 363.458 3.513 20 5 FHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](C[C@H]3CCC4(CCCCCC4)O3)C2)nc1 ZINC001167778386 946097625 /nfs/dbraw/zinc/09/76/25/946097625.db2.gz FLCIWFUAHVYBEA-SJLPKXTDSA-N 1 1 374.485 3.748 20 5 FHBDMO CCC[C@@H](C)NC(=O)[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000783555347 946250998 /nfs/dbraw/zinc/25/09/98/946250998.db2.gz PGELJIMXVZXIPT-HIFRSBDPSA-N 1 1 367.877 3.765 20 5 FHBDMO CCC[C@@H](C)NC(=O)[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000783555347 946251009 /nfs/dbraw/zinc/25/10/09/946251009.db2.gz PGELJIMXVZXIPT-HIFRSBDPSA-N 1 1 367.877 3.765 20 5 FHBDMO CC(C)[N@@H+](C)CCNC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000438494956 946374939 /nfs/dbraw/zinc/37/49/39/946374939.db2.gz YDGJNXWHSYPHFQ-UHFFFAOYSA-N 1 1 372.425 3.849 20 5 FHBDMO Cc1cc(Cl)c(C(=O)N[C@H]2CC[N@@H+](CC3CCCC3)C2)cc1[N+](=O)[O-] ZINC001126597161 946387282 /nfs/dbraw/zinc/38/72/82/946387282.db2.gz KYVIRSQASCEUHM-AWEZNQCLSA-N 1 1 365.861 3.551 20 5 FHBDMO COc1ccc(OCC[N@H+](Cc2cccc(O)c2)CC2CC2)c([N+](=O)[O-])c1 ZINC000441388588 946541894 /nfs/dbraw/zinc/54/18/94/946541894.db2.gz SMPOIENGEMSHNW-UHFFFAOYSA-N 1 1 372.421 3.600 20 5 FHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000441395412 946549865 /nfs/dbraw/zinc/54/98/65/946549865.db2.gz MLQQQZSJKVFQJN-JXFKEZNVSA-N 1 1 373.497 3.831 20 5 FHBDMO CC[N@@H+](CCc1ccccc1)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000052970484 946552582 /nfs/dbraw/zinc/55/25/82/946552582.db2.gz IDZJCRNWQOVMJD-UHFFFAOYSA-N 1 1 352.394 3.709 20 5 FHBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@H]1CCC[N@H+](CC(C)C)C1 ZINC000475557668 946631615 /nfs/dbraw/zinc/63/16/15/946631615.db2.gz AQBLCSMUPLDUPM-MRXNPFEDSA-N 1 1 362.474 3.701 20 5 FHBDMO CCS[C@H]1CCCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000112089801 946659815 /nfs/dbraw/zinc/65/98/15/946659815.db2.gz RSPQRVOSWBHOAJ-AWEZNQCLSA-N 1 1 351.472 3.531 20 5 FHBDMO COc1ccc(-c2ccc(C[N@H+]3CCC[C@](C)(OC)C3)o2)c([N+](=O)[O-])c1 ZINC000475269433 946785471 /nfs/dbraw/zinc/78/54/71/946785471.db2.gz LNNQPDZRQKUZDK-IBGZPJMESA-N 1 1 360.410 3.864 20 5 FHBDMO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000475278424 946796612 /nfs/dbraw/zinc/79/66/12/946796612.db2.gz WARHBNODKHYXQT-XHDPSFHLSA-N 1 1 368.359 3.768 20 5 FHBDMO Cc1c(C(=O)NC[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)cccc1[N+](=O)[O-] ZINC000129765487 946909241 /nfs/dbraw/zinc/90/92/41/946909241.db2.gz KODLQUZKRXPLOA-KSSFIOAISA-N 1 1 373.478 3.778 20 5 FHBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@@H]1C ZINC000475361240 946952998 /nfs/dbraw/zinc/95/29/98/946952998.db2.gz FSHXZAHSXCTMIA-SUMWQHHRSA-N 1 1 374.462 3.954 20 5 FHBDMO C[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1OC(F)F ZINC000444673648 947098338 /nfs/dbraw/zinc/09/83/38/947098338.db2.gz IHGFVJGDISDFED-JTQLQIEISA-N 1 1 362.336 3.923 20 5 FHBDMO CC[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@@]2(CCOC2)O1 ZINC000475624991 947611766 /nfs/dbraw/zinc/61/17/66/947611766.db2.gz LTADRPBIGRDERJ-MGPUTAFESA-N 1 1 372.421 3.625 20 5 FHBDMO CC[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@]2(CCOC2)O1 ZINC000475624994 947611815 /nfs/dbraw/zinc/61/18/15/947611815.db2.gz LTADRPBIGRDERJ-YWZLYKJASA-N 1 1 372.421 3.625 20 5 FHBDMO Cc1ccccc1[C@H]1C[N@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@@H](C)CO1 ZINC000441472390 947792010 /nfs/dbraw/zinc/79/20/10/947792010.db2.gz XKPZOYOJJCRRPD-OXJNMPFZSA-N 1 1 356.422 3.744 20 5 FHBDMO Cc1ccccc1[C@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@@H](C)CO1 ZINC000441472390 947792019 /nfs/dbraw/zinc/79/20/19/947792019.db2.gz XKPZOYOJJCRRPD-OXJNMPFZSA-N 1 1 356.422 3.744 20 5 FHBDMO O=[N+]([O-])c1cccc(Cl)c1NCc1ccc(C[NH+]2CCOCC2)cc1 ZINC000432313024 947920950 /nfs/dbraw/zinc/92/09/50/947920950.db2.gz LNXUYCKVKOZHEL-UHFFFAOYSA-N 1 1 361.829 3.693 20 5 FHBDMO O=[N+]([O-])c1cccc(Cl)c1NCc1ccccc1C[NH+]1CCOCC1 ZINC000432314552 947933070 /nfs/dbraw/zinc/93/30/70/947933070.db2.gz WVGVVCPVTVNMTB-UHFFFAOYSA-N 1 1 361.829 3.693 20 5 FHBDMO CCN(CC)C(=O)[C@@H]1CCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000512067102 948351393 /nfs/dbraw/zinc/35/13/93/948351393.db2.gz KOAYHMMKCYRLLJ-SFHVURJKSA-N 1 1 371.437 3.688 20 5 FHBDMO C[C@@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000512101890 948418790 /nfs/dbraw/zinc/41/87/90/948418790.db2.gz VTRKPMVQFRRXRA-LSDHHAIUSA-N 1 1 369.421 3.552 20 5 FHBDMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000512101890 948418794 /nfs/dbraw/zinc/41/87/94/948418794.db2.gz VTRKPMVQFRRXRA-LSDHHAIUSA-N 1 1 369.421 3.552 20 5 FHBDMO CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)[N@H+](C)C[C@@H]1C ZINC000512122391 948479327 /nfs/dbraw/zinc/47/93/27/948479327.db2.gz LMRHMHBXTGSWSA-KBPBESRZSA-N 1 1 365.499 3.508 20 5 FHBDMO CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)[N@@H+](C)C[C@@H]1C ZINC000512122391 948479330 /nfs/dbraw/zinc/47/93/30/948479330.db2.gz LMRHMHBXTGSWSA-KBPBESRZSA-N 1 1 365.499 3.508 20 5 FHBDMO CCCC[N@@H+](C)CC1CCN(C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000071943356 221389189 /nfs/dbraw/zinc/38/91/89/221389189.db2.gz GDUCEWYWKWSOEP-UHFFFAOYSA-N 1 1 362.474 3.879 20 5 FHBDMO CC[C@@H]1[C@H](C)CC[N@H+]1CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000481375839 567868405 /nfs/dbraw/zinc/86/84/05/567868405.db2.gz QUMGOQBMUGOXPB-MLGOLLRUSA-N 1 1 374.466 3.777 20 5 FHBDMO COc1ccc(CN2C[C@H]3CCC[N@H+]3Cc3ccccc32)cc1[N+](=O)[O-] ZINC000568148603 567946760 /nfs/dbraw/zinc/94/67/60/567946760.db2.gz DUZZFBFRGHSQFD-QGZVFWFLSA-N 1 1 353.422 3.588 20 5 FHBDMO C[C@@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000481738699 568099846 /nfs/dbraw/zinc/09/98/46/568099846.db2.gz FGOMTDQPCFBJCX-QMTHXVAHSA-N 1 1 360.332 3.624 20 5 FHBDMO C[C@@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000481738699 568099847 /nfs/dbraw/zinc/09/98/47/568099847.db2.gz FGOMTDQPCFBJCX-QMTHXVAHSA-N 1 1 360.332 3.624 20 5 FHBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](c2ccccc2F)C1 ZINC000569345244 568395713 /nfs/dbraw/zinc/39/57/13/568395713.db2.gz LHPANDPUTYHYHS-UONOGXRCSA-N 1 1 357.385 3.550 20 5 FHBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](c2ccccc2F)C1 ZINC000569345244 568395714 /nfs/dbraw/zinc/39/57/14/568395714.db2.gz LHPANDPUTYHYHS-UONOGXRCSA-N 1 1 357.385 3.550 20 5 FHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](c2ccccc2F)C1 ZINC000569345243 568395719 /nfs/dbraw/zinc/39/57/19/568395719.db2.gz LHPANDPUTYHYHS-KGLIPLIRSA-N 1 1 357.385 3.550 20 5 FHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](c2ccccc2F)C1 ZINC000569345243 568395720 /nfs/dbraw/zinc/39/57/20/568395720.db2.gz LHPANDPUTYHYHS-KGLIPLIRSA-N 1 1 357.385 3.550 20 5 FHBDMO Cc1nc(N2CCC[C@@]3(CC[N@H+]3Cc3cccc(F)c3)C2)ccc1[N+](=O)[O-] ZINC001164995770 722191815 /nfs/dbraw/zinc/19/18/15/722191815.db2.gz XVSQODHHKPHIDQ-HXUWFJFHSA-N 1 1 370.428 3.682 20 5 FHBDMO Cc1ccc(C(=O)NC[C@H](c2ccccc2Cl)[NH+](C)C)cc1[N+](=O)[O-] ZINC000049409416 927035027 /nfs/dbraw/zinc/03/50/27/927035027.db2.gz DKCYIGRWQFQPEU-QGZVFWFLSA-N 1 1 361.829 3.589 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCCCC[N@@H+]1CCC[C@H](C)C1 ZINC000120068854 927038432 /nfs/dbraw/zinc/03/84/32/927038432.db2.gz YSMWHVHMCUHYBZ-AWEZNQCLSA-N 1 1 362.474 3.845 20 5 FHBDMO CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1ccccc1[N+](=O)[O-] ZINC000175275445 927243989 /nfs/dbraw/zinc/24/39/89/927243989.db2.gz GEMALXNAMPLVPH-GOSISDBHSA-N 1 1 367.449 3.579 20 5 FHBDMO C[C@H]1C[C@@H](O)CC[N@H+]1Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000430155616 927380006 /nfs/dbraw/zinc/38/00/06/927380006.db2.gz ZVSYXZZJAMTSAM-YJBOKZPZSA-N 1 1 355.438 3.708 20 5 FHBDMO Cc1cc(N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)c2cccc([N+](=O)[O-])c2n1 ZINC000302000808 927404552 /nfs/dbraw/zinc/40/45/52/927404552.db2.gz IYHPMADMFRCEGD-CVEARBPZSA-N 1 1 354.454 3.903 20 5 FHBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@H+](C)[C@@H]2CCCOC2)cc1OC ZINC000510077269 927790994 /nfs/dbraw/zinc/79/09/94/927790994.db2.gz BORDWRQBNTWHSO-GDBMZVCRSA-N 1 1 366.458 3.639 20 5 FHBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+](C)[C@@H]2CCCOC2)cc1OC ZINC000510077269 927791003 /nfs/dbraw/zinc/79/10/03/927791003.db2.gz BORDWRQBNTWHSO-GDBMZVCRSA-N 1 1 366.458 3.639 20 5 FHBDMO COc1ccc(C[N@H+]2CCC[C@@H]2C[C@@H](O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000246873234 927858576 /nfs/dbraw/zinc/85/85/76/927858576.db2.gz QDKUIFOMHVCKBW-IEBWSBKVSA-N 1 1 374.412 3.831 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](CCCO)Cc1cccc(Cl)c1 ZINC000430198851 927929382 /nfs/dbraw/zinc/92/93/82/927929382.db2.gz AKFJYIRQJFSSEH-UHFFFAOYSA-N 1 1 364.829 3.641 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](CCCO)Cc1cccc(Cl)c1 ZINC000430198851 927929383 /nfs/dbraw/zinc/92/93/83/927929383.db2.gz AKFJYIRQJFSSEH-UHFFFAOYSA-N 1 1 364.829 3.641 20 5 FHBDMO C[C@H]1C[C@H](CCNC(=O)c2ccccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000510083416 927939226 /nfs/dbraw/zinc/93/92/26/927939226.db2.gz HRBWTPGIMDQVAC-WMZOPIPTSA-N 1 1 367.449 3.625 20 5 FHBDMO C[C@H]1CCCC[N@H+]1CCCCNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000510096422 928221679 /nfs/dbraw/zinc/22/16/79/928221679.db2.gz ZOQXGPQSJDBDRX-AWEZNQCLSA-N 1 1 360.458 3.546 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C)c1cnn(Cc2ccccc2)c1 ZINC000430216950 928239681 /nfs/dbraw/zinc/23/96/81/928239681.db2.gz JSNJRHZDMJQSOP-HNNXBMFYSA-N 1 1 366.421 3.699 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1CN(C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000430235593 928373796 /nfs/dbraw/zinc/37/37/96/928373796.db2.gz DYQSWYOTJGVAGS-SFHVURJKSA-N 1 1 369.465 3.557 20 5 FHBDMO COC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1OC)c1ccc(Cl)cc1 ZINC000430238396 928392309 /nfs/dbraw/zinc/39/23/09/928392309.db2.gz HQPHIBRPRKBKJL-INIZCTEOSA-N 1 1 350.802 3.734 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)Cc1ccc(F)c(F)c1 ZINC000044438858 937280132 /nfs/dbraw/zinc/28/01/32/937280132.db2.gz VHEMNWFUMHYTDB-UHFFFAOYSA-N 1 1 363.364 3.642 20 5 FHBDMO Cc1c(NC(=O)CC[N@H+]2CCc3ccc(Cl)cc3C2)cccc1[N+](=O)[O-] ZINC000535615804 928988677 /nfs/dbraw/zinc/98/86/77/928988677.db2.gz GNNDFFAQWYEJCJ-UHFFFAOYSA-N 1 1 373.840 3.944 20 5 FHBDMO O=[N+]([O-])c1ccccc1N1CC[NH+](Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000015115741 929293561 /nfs/dbraw/zinc/29/35/61/929293561.db2.gz FMDOFURLJBCZOE-UHFFFAOYSA-N 1 1 365.355 3.936 20 5 FHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H](c2ccncn2)C1 ZINC001167100852 929377447 /nfs/dbraw/zinc/37/74/47/929377447.db2.gz OMBLZRWYIDLZTL-OAHLLOKOSA-N 1 1 356.426 3.552 20 5 FHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](c2ccncn2)C1 ZINC001167100852 929377454 /nfs/dbraw/zinc/37/74/54/929377454.db2.gz OMBLZRWYIDLZTL-OAHLLOKOSA-N 1 1 356.426 3.552 20 5 FHBDMO CN(C(=O)[C@@H]1CC[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1)c1ccccc1 ZINC000430303309 929616100 /nfs/dbraw/zinc/61/61/00/929616100.db2.gz MVNNUAGSIIDWOD-CQSZACIVSA-N 1 1 373.840 3.733 20 5 FHBDMO COc1ccccc1O[C@H]1CCC[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000583325934 937347845 /nfs/dbraw/zinc/34/78/45/937347845.db2.gz DWECIZGMRNKCNG-KRWDZBQOSA-N 1 1 356.422 3.955 20 5 FHBDMO C[C@@H](c1nnc(-c2ccccc2)o1)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000375626779 929716999 /nfs/dbraw/zinc/71/69/99/929716999.db2.gz ZAMHPTNJAKOJCW-AWEZNQCLSA-N 1 1 352.394 3.880 20 5 FHBDMO C[C@@H](c1nnc(-c2ccccc2)o1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000375626779 929717002 /nfs/dbraw/zinc/71/70/02/929717002.db2.gz ZAMHPTNJAKOJCW-AWEZNQCLSA-N 1 1 352.394 3.880 20 5 FHBDMO CC(=O)NC[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000155557134 929992630 /nfs/dbraw/zinc/99/26/30/929992630.db2.gz GBJRGILZEFTIKF-HNNXBMFYSA-N 1 1 373.478 3.671 20 5 FHBDMO CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)C[C@@H]1CCN(Cc2ccccc2)C1 ZINC000610372100 930178778 /nfs/dbraw/zinc/17/87/78/930178778.db2.gz KARWVPYHUIGFEH-NRFANRHFSA-N 1 1 367.493 3.981 20 5 FHBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C[C@@H]1CCN(Cc2ccccc2)C1 ZINC000610372100 930178783 /nfs/dbraw/zinc/17/87/83/930178783.db2.gz KARWVPYHUIGFEH-NRFANRHFSA-N 1 1 367.493 3.981 20 5 FHBDMO O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1C[C@H]2CCC[N@H+]2Cc2ccccc21 ZINC000118986532 930498642 /nfs/dbraw/zinc/49/86/42/930498642.db2.gz BGWSCYZPVPLWNP-MRXNPFEDSA-N 1 1 371.824 3.873 20 5 FHBDMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CCC[C@@H](C(C)C)CC2)c([N+](=O)[O-])c1 ZINC001167424391 930940506 /nfs/dbraw/zinc/94/05/06/930940506.db2.gz HZOOFHALJXFVFX-LSDHHAIUSA-N 1 1 363.458 3.689 20 5 FHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC001167430204 931010541 /nfs/dbraw/zinc/01/05/41/931010541.db2.gz VNZXOABSIGWNCU-OAHLLOKOSA-N 1 1 359.857 3.955 20 5 FHBDMO CC(C)[N@H+]1CCC[C@H](NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C1 ZINC000275986352 931182191 /nfs/dbraw/zinc/18/21/91/931182191.db2.gz PNUCNZGCMXXYMH-INIZCTEOSA-N 1 1 363.461 3.696 20 5 FHBDMO CC(=O)c1cc(N[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000561236468 931340937 /nfs/dbraw/zinc/34/09/37/931340937.db2.gz RNFGTHNBQFUIEY-RDTXWAMCSA-N 1 1 353.422 3.872 20 5 FHBDMO Cn1cc(C[N@@H+](C)CCc2ccccc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000126445061 931831628 /nfs/dbraw/zinc/83/16/28/931831628.db2.gz XIJACSJHLORPPC-UHFFFAOYSA-N 1 1 350.422 3.670 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@@H]3c3ccc(O)cc3)o2)cc1 ZINC000610390104 932009613 /nfs/dbraw/zinc/00/96/13/932009613.db2.gz HOTPLGYUMCLHDU-QGZVFWFLSA-N 1 1 366.377 3.688 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@@H]3c3ccc(O)cc3)o2)cc1 ZINC000610390104 932009626 /nfs/dbraw/zinc/00/96/26/932009626.db2.gz HOTPLGYUMCLHDU-QGZVFWFLSA-N 1 1 366.377 3.688 20 5 FHBDMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1CCCn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000610391305 932011998 /nfs/dbraw/zinc/01/19/98/932011998.db2.gz ROVFNMWXUOUCOX-IJEWVQPXSA-N 1 1 359.426 3.546 20 5 FHBDMO COc1cccc(NC(=O)CC[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000135239098 932079220 /nfs/dbraw/zinc/07/92/20/932079220.db2.gz PRJDYSAWIVZWNB-UHFFFAOYSA-N 1 1 369.421 3.597 20 5 FHBDMO COc1ccccc1C[N@H+](CCn1cc([N+](=O)[O-])cn1)Cc1cccs1 ZINC000157386645 932420744 /nfs/dbraw/zinc/42/07/44/932420744.db2.gz XUDTXAFIWYPMMK-UHFFFAOYSA-N 1 1 372.450 3.564 20 5 FHBDMO COc1ccccc1C[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1cccs1 ZINC000157386645 932420746 /nfs/dbraw/zinc/42/07/46/932420746.db2.gz XUDTXAFIWYPMMK-UHFFFAOYSA-N 1 1 372.450 3.564 20 5 FHBDMO Cn1nccc1[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000510616171 933297681 /nfs/dbraw/zinc/29/76/81/933297681.db2.gz FFDPMDAEEOBKSB-INIZCTEOSA-N 1 1 366.421 3.968 20 5 FHBDMO Cc1cccc(NCCNc2ccc(Br)cc2[N+](=O)[O-])[nH+]1 ZINC000510650698 933368478 /nfs/dbraw/zinc/36/84/78/933368478.db2.gz SWZADBVDRLBJBN-UHFFFAOYSA-N 1 1 351.204 3.585 20 5 FHBDMO COc1cc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)cc(OC)c1OC ZINC000060774026 933446710 /nfs/dbraw/zinc/44/67/10/933446710.db2.gz FNBDPESPKIQTNV-UHFFFAOYSA-N 1 1 366.801 3.564 20 5 FHBDMO Cc1ccc(N2CCC(C(=O)Nc3c(C)ccc([N+](=O)[O-])c3C)CC2)[nH+]c1 ZINC000610664456 933681486 /nfs/dbraw/zinc/68/14/86/933681486.db2.gz MCCZBXDCTOFVKB-UHFFFAOYSA-N 1 1 368.437 3.770 20 5 FHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H]2C[C@H](O)c2ccc(F)cc2)c(F)c1 ZINC000134812890 934337977 /nfs/dbraw/zinc/33/79/77/934337977.db2.gz JCYFSBAJHLSNBO-APWZRJJASA-N 1 1 362.376 3.961 20 5 FHBDMO CC[C@@H]1C[N@@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)C[C@H]1O ZINC000535810287 934418790 /nfs/dbraw/zinc/41/87/90/934418790.db2.gz BOOOBWONVHBRJP-OXQOHEQNSA-N 1 1 355.438 3.565 20 5 FHBDMO O=C(C[N@@H+]1CCCC[C@@H]1Cc1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000110001842 934806828 /nfs/dbraw/zinc/80/68/28/934806828.db2.gz JRPBZCIGVJYDFR-QGZVFWFLSA-N 1 1 353.422 3.631 20 5 FHBDMO O=C(C[N@H+]1CCCC[C@@H]1Cc1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000110001842 934806831 /nfs/dbraw/zinc/80/68/31/934806831.db2.gz JRPBZCIGVJYDFR-QGZVFWFLSA-N 1 1 353.422 3.631 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1CN[C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000380702555 934879823 /nfs/dbraw/zinc/87/98/23/934879823.db2.gz HBHLHMRYSQRFSH-SJLPKXTDSA-N 1 1 369.465 3.604 20 5 FHBDMO COc1cc(C[N@H+]2CC=C(C)CC2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000538725552 934893543 /nfs/dbraw/zinc/89/35/43/934893543.db2.gz DTXIZIGZNIDOAW-UHFFFAOYSA-N 1 1 360.332 3.697 20 5 FHBDMO COc1cc(C[N@@H+]2CC=C(C)CC2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000538725552 934893548 /nfs/dbraw/zinc/89/35/48/934893548.db2.gz DTXIZIGZNIDOAW-UHFFFAOYSA-N 1 1 360.332 3.697 20 5 FHBDMO O=[N+]([O-])c1ccc(OC2CC[NH+](Cc3cnn(C4CCC4)c3)CC2)cc1 ZINC000892109594 935013909 /nfs/dbraw/zinc/01/39/09/935013909.db2.gz CBGHMPXBHMOLCU-UHFFFAOYSA-N 1 1 356.426 3.560 20 5 FHBDMO CCN(Cc1ccccc1)C(=O)[C@@H](C)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511062219 935196915 /nfs/dbraw/zinc/19/69/15/935196915.db2.gz CQEDDUBDQYBZAW-QGZVFWFLSA-N 1 1 369.465 3.506 20 5 FHBDMO CCN(Cc1ccccc1)C(=O)[C@@H](C)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511062219 935196916 /nfs/dbraw/zinc/19/69/16/935196916.db2.gz CQEDDUBDQYBZAW-QGZVFWFLSA-N 1 1 369.465 3.506 20 5 FHBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCCCC[C@@H]1/C=C/c1ccccc1 ZINC000551269968 935237557 /nfs/dbraw/zinc/23/75/57/935237557.db2.gz AIBWCRCIIOVAAB-GNISGLHKSA-N 1 1 367.449 3.715 20 5 FHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](c2ncccc2C)C(C)(C)C)c1 ZINC000934287456 935255101 /nfs/dbraw/zinc/25/51/01/935255101.db2.gz LCFABKWKMXTDLM-GOSISDBHSA-N 1 1 371.437 3.962 20 5 FHBDMO Cc1ccc(NC(=O)[C@H](C)[N@H+](C)CCc2ccccc2[N+](=O)[O-])cc1F ZINC000511073399 935256536 /nfs/dbraw/zinc/25/65/36/935256536.db2.gz PCJGEFJAIJQRMT-AWEZNQCLSA-N 1 1 359.401 3.544 20 5 FHBDMO Cc1ccc(NC(=O)[C@H](C)[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1F ZINC000511073399 935256539 /nfs/dbraw/zinc/25/65/39/935256539.db2.gz PCJGEFJAIJQRMT-AWEZNQCLSA-N 1 1 359.401 3.544 20 5 FHBDMO COCC[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@H]1CCOC1 ZINC000426531391 945093702 /nfs/dbraw/zinc/09/37/02/945093702.db2.gz SJBYLDWFUHANBT-AWEZNQCLSA-N 1 1 362.451 3.561 20 5 FHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CC[C@@H](OCCCc3ccccc3)C2)cc1 ZINC001167568082 935585393 /nfs/dbraw/zinc/58/53/93/935585393.db2.gz MWVPLQGUWUVXLW-OAQYLSRUSA-N 1 1 370.449 3.697 20 5 FHBDMO CCOc1ccc(C(C)=O)cc1C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511135387 935762834 /nfs/dbraw/zinc/76/28/34/935762834.db2.gz FORJXVBXQBWIEI-UHFFFAOYSA-N 1 1 356.422 3.871 20 5 FHBDMO CCOc1ccc(C(C)=O)cc1C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511135387 935762835 /nfs/dbraw/zinc/76/28/35/935762835.db2.gz FORJXVBXQBWIEI-UHFFFAOYSA-N 1 1 356.422 3.871 20 5 FHBDMO Cc1ccc(-c2nnc(C[N@H+](C)CCc3ccccc3[N+](=O)[O-])o2)cc1 ZINC000511137151 935767234 /nfs/dbraw/zinc/76/72/34/935767234.db2.gz BUVVAMVNRHFNNA-UHFFFAOYSA-N 1 1 352.394 3.628 20 5 FHBDMO Cc1ccc(-c2nnc(C[N@@H+](C)CCc3ccccc3[N+](=O)[O-])o2)cc1 ZINC000511137151 935767236 /nfs/dbraw/zinc/76/72/36/935767236.db2.gz BUVVAMVNRHFNNA-UHFFFAOYSA-N 1 1 352.394 3.628 20 5 FHBDMO CCC(=O)c1ccc(N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000479851216 935905041 /nfs/dbraw/zinc/90/50/41/935905041.db2.gz KOHOOQGSWBHPMF-QGZVFWFLSA-N 1 1 353.422 3.874 20 5 FHBDMO Cc1ccccc1OCCC[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000052457712 938312653 /nfs/dbraw/zinc/31/26/53/938312653.db2.gz WZAUSSPIDPSUFZ-UHFFFAOYSA-N 1 1 372.421 3.671 20 5 FHBDMO Cc1ccccc1OCCC[N@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000052457712 938312655 /nfs/dbraw/zinc/31/26/55/938312655.db2.gz WZAUSSPIDPSUFZ-UHFFFAOYSA-N 1 1 372.421 3.671 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H]1c2sccc2OC(C)(C)[C@@H]1O ZINC000583680811 938358717 /nfs/dbraw/zinc/35/87/17/938358717.db2.gz PWHGBDSEHDYLMO-XQAQDONZSA-N 1 1 362.451 3.889 20 5 FHBDMO C[C@H](NC(=O)N[C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000458638187 938359613 /nfs/dbraw/zinc/35/96/13/938359613.db2.gz SVNRFKGNYGMUOA-ZOBUZTSGSA-N 1 1 374.485 3.608 20 5 FHBDMO CCCCNC(=O)[C@@H]1CC[C@H](C)[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000543853325 938398899 /nfs/dbraw/zinc/39/88/99/938398899.db2.gz NIMMXZSJMJTOJO-DZGCQCFKSA-N 1 1 367.877 3.765 20 5 FHBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C[C@@H]1C ZINC000437260267 945174543 /nfs/dbraw/zinc/17/45/43/945174543.db2.gz SXLIOFPPOQULSH-SMDDNHRTSA-N 1 1 373.375 3.558 20 5 FHBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@@H](CO)c1ccccc1 ZINC000584007119 938535325 /nfs/dbraw/zinc/53/53/25/938535325.db2.gz IHTUTPGREANUCT-INIZCTEOSA-N 1 1 354.328 3.779 20 5 FHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@@H](CO)c1ccccc1 ZINC000584007119 938535327 /nfs/dbraw/zinc/53/53/27/938535327.db2.gz IHTUTPGREANUCT-INIZCTEOSA-N 1 1 354.328 3.779 20 5 FHBDMO Cc1c(NC(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000584191556 938636981 /nfs/dbraw/zinc/63/69/81/938636981.db2.gz MICLLDJMCXUWRS-QAPCUYQASA-N 1 1 368.437 3.688 20 5 FHBDMO CCC[N@@H+](C)C[C@H]1CCN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C1 ZINC000090100070 938876026 /nfs/dbraw/zinc/87/60/26/938876026.db2.gz XTZVZKDFTFTLAV-MRXNPFEDSA-N 1 1 354.454 3.825 20 5 FHBDMO CC[C@@H](OC(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC001267375063 938914280 /nfs/dbraw/zinc/91/42/80/938914280.db2.gz ZOBMADSBPKBHSK-CRAIPNDOSA-N 1 1 352.406 3.802 20 5 FHBDMO CCOc1c(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c(C)nn1CC(C)C ZINC000480446437 938941188 /nfs/dbraw/zinc/94/11/88/938941188.db2.gz RWTPGCUEVXLPKI-UHFFFAOYSA-N 1 1 360.458 3.753 20 5 FHBDMO COc1c(O)cccc1C[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000278776053 938965926 /nfs/dbraw/zinc/96/59/26/938965926.db2.gz UURVPSTUTRRKML-UHFFFAOYSA-N 1 1 356.300 3.618 20 5 FHBDMO COc1ccc([N+](=O)[O-])c(N2CCC[C@H](c3[nH+]cc4n3CCCC4)C2)c1 ZINC000409637617 938978760 /nfs/dbraw/zinc/97/87/60/938978760.db2.gz YTQJJAIPIUDDIT-AWEZNQCLSA-N 1 1 356.426 3.520 20 5 FHBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1cc(Br)cs1 ZINC000603849128 939006210 /nfs/dbraw/zinc/00/62/10/939006210.db2.gz HXAICEVIWQHCCO-UHFFFAOYSA-N 1 1 371.256 3.930 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H](Cc2ccccc2)[C@H]1C ZINC000472352520 939015958 /nfs/dbraw/zinc/01/59/58/939015958.db2.gz ZPMLZUMIXUQGGH-AEFFLSMTSA-N 1 1 367.449 3.795 20 5 FHBDMO COc1cc(OC)c(OC)cc1C[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000892419791 939016469 /nfs/dbraw/zinc/01/64/69/939016469.db2.gz IZTHEYXVKZQSOK-UHFFFAOYSA-N 1 1 366.801 3.564 20 5 FHBDMO CSc1cccc(C(=O)NCC(C)(C)[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-] ZINC000188079407 939017720 /nfs/dbraw/zinc/01/77/20/939017720.db2.gz UUNDXEAPDPIJQK-CYBMUJFWSA-N 1 1 365.499 3.557 20 5 FHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccc(Br)cn2)C2CC2)cc1 ZINC000179521648 939877188 /nfs/dbraw/zinc/87/71/88/939877188.db2.gz BLBMSLCNELPIDE-UHFFFAOYSA-N 1 1 362.227 3.917 20 5 FHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccc(Br)cn2)C2CC2)cc1 ZINC000179521648 939877191 /nfs/dbraw/zinc/87/71/91/939877191.db2.gz BLBMSLCNELPIDE-UHFFFAOYSA-N 1 1 362.227 3.917 20 5 FHBDMO Cn1cc(C[N@H+]2CCC[C@@H]2c2cccn2C)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000179704141 939924190 /nfs/dbraw/zinc/92/41/90/939924190.db2.gz LOBYWDGPYKAEKC-LJQANCHMSA-N 1 1 365.437 3.671 20 5 FHBDMO CC[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@@H](C)c1ccc(F)cc1 ZINC000053088524 939963356 /nfs/dbraw/zinc/96/33/56/939963356.db2.gz NSPGKMATUHSSQO-AWEZNQCLSA-N 1 1 359.401 3.780 20 5 FHBDMO CC[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@@H](C)c1ccc(F)cc1 ZINC000053088524 939963360 /nfs/dbraw/zinc/96/33/60/939963360.db2.gz NSPGKMATUHSSQO-AWEZNQCLSA-N 1 1 359.401 3.780 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@H](n2cc[nH+]c2C(C)C)C1 ZINC000375930466 940073723 /nfs/dbraw/zinc/07/37/23/940073723.db2.gz GDQHNKXOKDSHOC-HNNXBMFYSA-N 1 1 356.426 3.700 20 5 FHBDMO Cc1[nH]c2ccccc2c1C(=O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548933628 940092055 /nfs/dbraw/zinc/09/20/55/940092055.db2.gz IHBVQCUPGVCJPR-UHFFFAOYSA-N 1 1 351.406 3.742 20 5 FHBDMO Cc1[nH]c2ccccc2c1C(=O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548933628 940092060 /nfs/dbraw/zinc/09/20/60/940092060.db2.gz IHBVQCUPGVCJPR-UHFFFAOYSA-N 1 1 351.406 3.742 20 5 FHBDMO C[C@@H](C(=O)Nc1ccc(Cl)cc1)[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548934751 940097893 /nfs/dbraw/zinc/09/78/93/940097893.db2.gz QVNHFFKPJNGAOC-ZDUSSCGKSA-N 1 1 361.829 3.750 20 5 FHBDMO C[C@@H](C(=O)Nc1ccc(Cl)cc1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548934751 940097894 /nfs/dbraw/zinc/09/78/94/940097894.db2.gz QVNHFFKPJNGAOC-ZDUSSCGKSA-N 1 1 361.829 3.750 20 5 FHBDMO CCOC(=O)C1CCC([N@@H+](CC)Cc2ccc(OC)c([N+](=O)[O-])c2)CC1 ZINC000548939492 940144707 /nfs/dbraw/zinc/14/47/07/940144707.db2.gz GKMBAFPTIDKILB-UHFFFAOYSA-N 1 1 364.442 3.547 20 5 FHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@]2(C1)CC(=O)c1ccccc1O2 ZINC000411984785 940173290 /nfs/dbraw/zinc/17/32/90/940173290.db2.gz NFFSGKGRNMXNFI-VLIAUNLRSA-N 1 1 352.390 3.766 20 5 FHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@]2(C1)CC(=O)c1ccccc1O2 ZINC000411984785 940173292 /nfs/dbraw/zinc/17/32/92/940173292.db2.gz NFFSGKGRNMXNFI-VLIAUNLRSA-N 1 1 352.390 3.766 20 5 FHBDMO Cc1c(OC(=O)c2cnn(-c3cc[nH+]cc3)c2C(F)F)cccc1[N+](=O)[O-] ZINC000782698073 940500844 /nfs/dbraw/zinc/50/08/44/940500844.db2.gz VUQRRKQPTYQLHX-UHFFFAOYSA-N 1 1 374.303 3.641 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](O)CC2)ccc1Oc1ccc(F)cc1 ZINC000581623601 940508459 /nfs/dbraw/zinc/50/84/59/940508459.db2.gz UIBGLNSMFYFEMS-INIZCTEOSA-N 1 1 360.385 3.873 20 5 FHBDMO CCC[C@]1(CO)CC[N@@H+](Cc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)C1 ZINC000582328339 940666414 /nfs/dbraw/zinc/66/64/14/940666414.db2.gz UYAAYUZSPXUCNC-FQEVSTJZSA-N 1 1 374.437 3.848 20 5 FHBDMO C[C@@H]([NH2+]CC(=O)Nc1nc2ccc(F)cc2s1)c1cccc([N+](=O)[O-])c1 ZINC000180425687 941012956 /nfs/dbraw/zinc/01/29/56/941012956.db2.gz DIJDDWAXSSGGMO-SNVBAGLBSA-N 1 1 374.397 3.633 20 5 FHBDMO C[C@H]([NH2+]CC(=O)Nc1nc(-c2ccco2)cs1)c1cccc([N+](=O)[O-])c1 ZINC000180433518 941014339 /nfs/dbraw/zinc/01/43/39/941014339.db2.gz YFLARMCGZIGUQZ-NSHDSACASA-N 1 1 372.406 3.601 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCS[C@H]4COCC[C@@H]43)o2)cc1 ZINC000180454505 941022882 /nfs/dbraw/zinc/02/28/82/941022882.db2.gz ZASZDWAABGYXCU-WMZOPIPTSA-N 1 1 360.435 3.561 20 5 FHBDMO Cc1cc(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000176579862 941062252 /nfs/dbraw/zinc/06/22/52/941062252.db2.gz NTNPXKOKJFSYJF-APWZRJJASA-N 1 1 367.449 3.686 20 5 FHBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000177075176 941096934 /nfs/dbraw/zinc/09/69/34/941096934.db2.gz RGDMYNOVRCCCPY-JKSUJKDBSA-N 1 1 372.469 3.822 20 5 FHBDMO CN(C(=O)c1cc(Cl)ccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311464362 941301722 /nfs/dbraw/zinc/30/17/22/941301722.db2.gz MUGQGEPPJRMSNN-MRXNPFEDSA-N 1 1 373.840 3.595 20 5 FHBDMO CCc1ccc(C(=O)N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1[N+](=O)[O-] ZINC000181480981 941330880 /nfs/dbraw/zinc/33/08/80/941330880.db2.gz GWUZLWIVVRXCMB-PBHICJAKSA-N 1 1 359.470 3.540 20 5 FHBDMO COC(=O)C[C@@](C)([NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1)c1ccncc1 ZINC000190020881 941346727 /nfs/dbraw/zinc/34/67/27/941346727.db2.gz LIVWPYCXOWBKNR-HXUWFJFHSA-N 1 1 371.437 3.681 20 5 FHBDMO C[C@H](NC(=O)[C@H]1CCC[N@@H+]1Cc1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000452180288 941364876 /nfs/dbraw/zinc/36/48/76/941364876.db2.gz CJQYGWRGXBOPRS-IFXJQAMLSA-N 1 1 371.412 3.576 20 5 FHBDMO C[C@H](NC(=O)[C@H]1CCC[N@H+]1Cc1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000452180288 941364880 /nfs/dbraw/zinc/36/48/80/941364880.db2.gz CJQYGWRGXBOPRS-IFXJQAMLSA-N 1 1 371.412 3.576 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC000377185971 941542221 /nfs/dbraw/zinc/54/22/21/941542221.db2.gz UWGQXEHJZIMHDZ-SJLPKXTDSA-N 1 1 367.449 3.544 20 5 FHBDMO CCOc1ccc(C(C)=O)cc1C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000549156837 941547922 /nfs/dbraw/zinc/54/79/22/941547922.db2.gz OHLOHHRVODVKQS-UHFFFAOYSA-N 1 1 356.422 3.871 20 5 FHBDMO CCOc1ccc(C(C)=O)cc1C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000549156837 941547925 /nfs/dbraw/zinc/54/79/25/941547925.db2.gz OHLOHHRVODVKQS-UHFFFAOYSA-N 1 1 356.422 3.871 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2ccc(CN3CCCC[C@@H]3[C@@H]3CC[NH2+]C3)o2)c1 ZINC000415057759 941570667 /nfs/dbraw/zinc/57/06/67/941570667.db2.gz URVPNIATTPQHPE-VQIMIIECSA-N 1 1 355.438 3.819 20 5 FHBDMO CC[C@@H](Cc1ccccc1)[N@@H+](CC)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000120679143 941764617 /nfs/dbraw/zinc/76/46/17/941764617.db2.gz LCBITXOUYRDZHO-SFHVURJKSA-N 1 1 355.438 3.537 20 5 FHBDMO COc1ccccc1O[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000513370775 941879672 /nfs/dbraw/zinc/87/96/72/941879672.db2.gz KTUFLSSBJGFJIB-QGZVFWFLSA-N 1 1 372.421 3.655 20 5 FHBDMO COc1ccccc1O[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000513370775 941879676 /nfs/dbraw/zinc/87/96/76/941879676.db2.gz KTUFLSSBJGFJIB-QGZVFWFLSA-N 1 1 372.421 3.655 20 5 FHBDMO Cc1ccc([C@]2(C)CC[N@@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000501875669 942099168 /nfs/dbraw/zinc/09/91/68/942099168.db2.gz SAMLZIHXWIZWIM-OAQYLSRUSA-N 1 1 367.449 3.895 20 5 FHBDMO C[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccccc1-n1cccn1 ZINC000183152607 942184951 /nfs/dbraw/zinc/18/49/51/942184951.db2.gz PQYCCMVIQYVDHA-CYBMUJFWSA-N 1 1 363.377 3.773 20 5 FHBDMO Cc1c(NC(=O)CC[N@H+](C)C2CC(OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000421020713 942308197 /nfs/dbraw/zinc/30/81/97/942308197.db2.gz ZZDDJCZFXDMECQ-UHFFFAOYSA-N 1 1 363.458 3.510 20 5 FHBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCCN(C(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC000366759334 942328014 /nfs/dbraw/zinc/32/80/14/942328014.db2.gz SMVIAHYJBJQMJX-GOSISDBHSA-N 1 1 367.449 3.722 20 5 FHBDMO C[C@H]1C[C@H](N(C)c2ncc([N+](=O)[O-])cc2F)CC[N@H+]1Cc1ccccc1 ZINC000413153665 942351987 /nfs/dbraw/zinc/35/19/87/942351987.db2.gz HUWJUKVEAKEMKX-GOEBONIOSA-N 1 1 358.417 3.618 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000502311264 942359306 /nfs/dbraw/zinc/35/93/06/942359306.db2.gz SWBSJTMFHJQLLT-QGZVFWFLSA-N 1 1 354.454 3.816 20 5 FHBDMO CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@@H](C)c1cccc(OC)c1 ZINC000072577577 942360924 /nfs/dbraw/zinc/36/09/24/942360924.db2.gz FYWLFCKAJFHSDD-HNNXBMFYSA-N 1 1 371.437 3.933 20 5 FHBDMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@@H](C)c1cccc(OC)c1 ZINC000072577577 942360927 /nfs/dbraw/zinc/36/09/27/942360927.db2.gz FYWLFCKAJFHSDD-HNNXBMFYSA-N 1 1 371.437 3.933 20 5 FHBDMO C[C@H]1CCC[N@H+]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 ZINC000366458970 942376547 /nfs/dbraw/zinc/37/65/47/942376547.db2.gz VJOYUJVXKTXUDM-ZDUSSCGKSA-N 1 1 373.478 3.898 20 5 FHBDMO Cn1ccnc1[C@@H]([NH2+]C[C@H]1CC12CCSCC2)c1cccc([N+](=O)[O-])c1 ZINC000421375366 942527046 /nfs/dbraw/zinc/52/70/46/942527046.db2.gz IMHQIFUOUCTJCP-WBVHZDCISA-N 1 1 372.494 3.541 20 5 FHBDMO C[N@@H+](CCOc1ccccc1)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000104661932 942566705 /nfs/dbraw/zinc/56/67/05/942566705.db2.gz RWRCTQUWWHNOLM-UHFFFAOYSA-N 1 1 367.405 3.803 20 5 FHBDMO CCCn1cc[nH+]c1CCCN(C)c1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC000413258979 942569635 /nfs/dbraw/zinc/56/96/35/942569635.db2.gz HDKLFXJAGRBLCZ-UHFFFAOYSA-N 1 1 371.363 3.684 20 5 FHBDMO Cc1[nH+]c(CNCc2ccc(-c3ccccc3[N+](=O)[O-])o2)c2n1CCCC2 ZINC000378397216 942715904 /nfs/dbraw/zinc/71/59/04/942715904.db2.gz PYSGLJVKGZJUJE-UHFFFAOYSA-N 1 1 366.421 3.986 20 5 FHBDMO CC(C)[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000434621145 942793648 /nfs/dbraw/zinc/79/36/48/942793648.db2.gz POBVPDGIWNIWFC-SFHVURJKSA-N 1 1 359.401 3.662 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCc2cc(F)cc(C)c2C1 ZINC000502876164 942807554 /nfs/dbraw/zinc/80/75/54/942807554.db2.gz HDZYSXZIOXDCSZ-UHFFFAOYSA-N 1 1 371.412 3.738 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000421770952 942814307 /nfs/dbraw/zinc/81/43/07/942814307.db2.gz LDFSHFZDLGRBKQ-MSOLQXFVSA-N 1 1 373.497 3.938 20 5 FHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)C[C@@H]1CC=CCC1 ZINC000544110073 942843739 /nfs/dbraw/zinc/84/37/39/942843739.db2.gz JVFFXAJTHKJNBN-CHWSQXEVSA-N 1 1 351.834 3.863 20 5 FHBDMO O=[N+]([O-])c1cccc(C[NH2+][C@H](CCO)c2ccccc2Br)c1 ZINC000514246011 942861141 /nfs/dbraw/zinc/86/11/41/942861141.db2.gz GIMGOEVZCCSDHR-MRXNPFEDSA-N 1 1 365.227 3.571 20 5 FHBDMO CC[N@H+]1CCC[C@@H](Nc2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000584449863 942923170 /nfs/dbraw/zinc/92/31/70/942923170.db2.gz LDKRXMHVQDAHHV-SECBINFHSA-N 1 1 368.306 3.540 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2nc(CNC[C@H]3CCCC[N@H+]3C3CC3)cs2)c1 ZINC000434782729 942961706 /nfs/dbraw/zinc/96/17/06/942961706.db2.gz DNKHFCZPYJOEQX-GOSISDBHSA-N 1 1 372.494 3.825 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]C[C@H]3CCCCN3C3CC3)cs2)c1 ZINC000434782729 942961710 /nfs/dbraw/zinc/96/17/10/942961710.db2.gz DNKHFCZPYJOEQX-GOSISDBHSA-N 1 1 372.494 3.825 20 5 FHBDMO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1noc(-c2ccccc2F)n1 ZINC000435031247 943114256 /nfs/dbraw/zinc/11/42/56/943114256.db2.gz ZFSHAZDLPRWHIU-ZDUSSCGKSA-N 1 1 370.384 3.895 20 5 FHBDMO C[N@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H](c1ccc(Cl)cc1)c1ccccn1 ZINC000365840389 943139954 /nfs/dbraw/zinc/13/99/54/943139954.db2.gz MWSZRNJIYBMQFT-SFHVURJKSA-N 1 1 371.828 3.561 20 5 FHBDMO C[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H](c1ccc(Cl)cc1)c1ccccn1 ZINC000365840389 943139970 /nfs/dbraw/zinc/13/99/70/943139970.db2.gz MWSZRNJIYBMQFT-SFHVURJKSA-N 1 1 371.828 3.561 20 5 FHBDMO COc1cc(C[N@H+]2CCC[C@@H](c3ncc4n3CCCC4)C2)ccc1[N+](=O)[O-] ZINC000503371504 943145407 /nfs/dbraw/zinc/14/54/07/943145407.db2.gz BRNLQBACBQSYLB-MRXNPFEDSA-N 1 1 370.453 3.516 20 5 FHBDMO CC[C@H]([NH2+][C@H]1CNCC[C@H]1c1ccc(OC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000423328551 943481401 /nfs/dbraw/zinc/48/14/01/943481401.db2.gz KUVQLFDOSNGKIR-ACRUOGEOSA-N 1 1 369.465 3.790 20 5 FHBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1nccn1CC(F)(F)F)CCCC2 ZINC000417301689 943495161 /nfs/dbraw/zinc/49/51/61/943495161.db2.gz BUERSPVTBQLDLC-OAHLLOKOSA-N 1 1 368.359 3.911 20 5 FHBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)[N@@H+](CC)C[C@@H]1C ZINC000504591729 943703207 /nfs/dbraw/zinc/70/32/07/943703207.db2.gz JOTWUUMGKWQYFQ-KBPBESRZSA-N 1 1 365.499 3.652 20 5 FHBDMO CCOc1ccc([C@@H](C)NC[C@@H](Cc2ccccc2)[NH+](C)C)cc1[N+](=O)[O-] ZINC000504912354 943908566 /nfs/dbraw/zinc/90/85/66/943908566.db2.gz VBRAGELXKYYOQT-VQIMIIECSA-N 1 1 371.481 3.817 20 5 FHBDMO COCC[C@H]([NH2+]Cc1ccc(Br)cc1[N+](=O)[O-])c1ccco1 ZINC000425433016 943909762 /nfs/dbraw/zinc/90/97/62/943909762.db2.gz MQXKYPLRIIEMJV-ZDUSSCGKSA-N 1 1 369.215 3.818 20 5 FHBDMO COC[C@H]([NH2+]Cc1ccc(Br)cc1[N+](=O)[O-])c1ccccc1 ZINC000425438106 943938648 /nfs/dbraw/zinc/93/86/48/943938648.db2.gz ANRDUVHRVGZOSU-HNNXBMFYSA-N 1 1 365.227 3.835 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1CN1CCC[N@@H+](CC2CCCCC2)CC1 ZINC000515510824 943943403 /nfs/dbraw/zinc/94/34/03/943943403.db2.gz WSSKCTVTPHNEOE-UHFFFAOYSA-N 1 1 361.486 3.691 20 5 FHBDMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](C)C(C)C ZINC000120273586 943958157 /nfs/dbraw/zinc/95/81/57/943958157.db2.gz HWYMNEPXEBRRSP-NSHDSACASA-N 1 1 372.263 3.662 20 5 FHBDMO O=[N+]([O-])c1cc(Br)ccc1C[NH+]1CCC2(CCOCC2)CC1 ZINC000425449929 943969031 /nfs/dbraw/zinc/96/90/31/943969031.db2.gz XODKQLCSVDOUPT-UHFFFAOYSA-N 1 1 369.259 3.750 20 5 FHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2C[C@H](c3ccccc3)[C@@H]3COCC[C@H]32)cc1 ZINC000511645233 943992607 /nfs/dbraw/zinc/99/26/07/943992607.db2.gz FXOAJAGLMSSOBW-QHAWAJNXSA-N 1 1 352.434 3.642 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21 ZINC000511645709 944001928 /nfs/dbraw/zinc/00/19/28/944001928.db2.gz GXTWPSXOPTZQFT-AABGKKOBSA-N 1 1 368.433 3.608 20 5 FHBDMO C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](c2ccco2)C1 ZINC000500069611 944052890 /nfs/dbraw/zinc/05/28/90/944052890.db2.gz ISDZTBXJDGBVPP-RHSMWYFYSA-N 1 1 357.410 3.990 20 5 FHBDMO O=C(CC[N@@H+](CCc1cccc(F)c1)C1CC1)Nc1ccccc1[N+](=O)[O-] ZINC000500088658 944076062 /nfs/dbraw/zinc/07/60/62/944076062.db2.gz FFVNNENRUBGENW-UHFFFAOYSA-N 1 1 371.412 3.770 20 5 FHBDMO COc1ccc(Br)cc1C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000014924278 944078917 /nfs/dbraw/zinc/07/89/17/944078917.db2.gz ODVSAXWQTJOUEZ-UHFFFAOYSA-N 1 1 365.227 3.998 20 5 FHBDMO COc1ccc(Br)cc1C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000014924278 944078924 /nfs/dbraw/zinc/07/89/24/944078924.db2.gz ODVSAXWQTJOUEZ-UHFFFAOYSA-N 1 1 365.227 3.998 20 5 FHBDMO CC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](C)c1cccc(O)c1 ZINC000500092036 944082861 /nfs/dbraw/zinc/08/28/61/944082861.db2.gz ORLYEKBBWJANKZ-CQSZACIVSA-N 1 1 357.410 3.712 20 5 FHBDMO CCO[C@@H]1CC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C[C@@H]1C ZINC000425492138 944111320 /nfs/dbraw/zinc/11/13/20/944111320.db2.gz MVVFCPBCZXGOCK-XHDPSFHLSA-N 1 1 357.248 3.604 20 5 FHBDMO CCO[C@@H]1CC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C[C@@H]1C ZINC000425492138 944111323 /nfs/dbraw/zinc/11/13/23/944111323.db2.gz MVVFCPBCZXGOCK-XHDPSFHLSA-N 1 1 357.248 3.604 20 5 FHBDMO C[C@H]1[C@H](Cc2ccccc2)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500113232 944128558 /nfs/dbraw/zinc/12/85/58/944128558.db2.gz FPNQWWITSFDMRB-WMZOPIPTSA-N 1 1 367.449 3.877 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1CCC[N@H+]1C1CCCCC1 ZINC000436261787 944154142 /nfs/dbraw/zinc/15/41/42/944154142.db2.gz KRGOXLYGZIVXOR-QGZVFWFLSA-N 1 1 360.458 3.822 20 5 FHBDMO C[C@@H]1CCC[N@@H+](CCCCNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000436324204 944201452 /nfs/dbraw/zinc/20/14/52/944201452.db2.gz VBXDNHDNUIIDGI-GFCCVEGCSA-N 1 1 360.380 3.933 20 5 FHBDMO Cc1cc(C(=O)Nc2ccc([C@H](C)[NH+]3CCOCC3)cc2)ccc1[N+](=O)[O-] ZINC000517342062 944220712 /nfs/dbraw/zinc/22/07/12/944220712.db2.gz OVJALUIVMRMTQM-HNNXBMFYSA-N 1 1 369.421 3.549 20 5 FHBDMO CC(C)C[N@H+]1CCC[C@H](CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000436398549 944274707 /nfs/dbraw/zinc/27/47/07/944274707.db2.gz GDMCOIFDBFABEE-GFCCVEGCSA-N 1 1 360.380 3.789 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](CCc1cccc(F)c1)C1CC1 ZINC000436412613 944284380 /nfs/dbraw/zinc/28/43/80/944284380.db2.gz NXMAVIKMIOGYPN-UHFFFAOYSA-N 1 1 371.412 3.688 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](CCc1cccc(F)c1)C1CC1 ZINC000436412613 944284386 /nfs/dbraw/zinc/28/43/86/944284386.db2.gz NXMAVIKMIOGYPN-UHFFFAOYSA-N 1 1 371.412 3.688 20 5 FHBDMO C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CCc1ccc(Cl)cc1 ZINC000500238651 944311096 /nfs/dbraw/zinc/31/10/96/944311096.db2.gz UYKJPXKMRFMYIO-UHFFFAOYSA-N 1 1 361.829 3.751 20 5 FHBDMO CC1(C)C[C@H](c2ccccc2)[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000425550471 944317590 /nfs/dbraw/zinc/31/75/90/944317590.db2.gz ZKJWDYUZXCUNNA-GOSISDBHSA-N 1 1 353.422 3.667 20 5 FHBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3ccc(F)cc3C(F)(F)F)CC2)n1 ZINC000425968656 944464128 /nfs/dbraw/zinc/46/41/28/944464128.db2.gz UVIPQFBJDXZRDG-UHFFFAOYSA-N 1 1 372.322 3.786 20 5 FHBDMO CC(C)c1[nH+]c(CNCCOc2ccc([N+](=O)[O-])cc2)c2ccccn21 ZINC000518544933 944480571 /nfs/dbraw/zinc/48/05/71/944480571.db2.gz PRSBYZBZCVKRGP-UHFFFAOYSA-N 1 1 354.410 3.535 20 5 FHBDMO COc1ccc([C@@H](C)[NH2+]Cc2cc(OC)c(F)cc2[N+](=O)[O-])cc1F ZINC000184299777 944535759 /nfs/dbraw/zinc/53/57/59/944535759.db2.gz QIRBUKLLRCAGQH-SNVBAGLBSA-N 1 1 352.337 3.741 20 5 FHBDMO Cc1cc(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c(Br)cc1[N+](=O)[O-] ZINC000322698139 944578126 /nfs/dbraw/zinc/57/81/26/944578126.db2.gz LAOAPKCITHVIDR-YOGCLGLASA-N 1 1 354.248 3.703 20 5 FHBDMO CCc1[nH+]ccn1[C@@H](C)CC(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000843759758 944625404 /nfs/dbraw/zinc/62/54/04/944625404.db2.gz WXDARFVZSZJSKC-LBPRGKRZSA-N 1 1 364.833 3.617 20 5 FHBDMO Cc1ccc(CN2CCC[N@@H+](Cc3ccc(F)cc3)CC2)cc1[N+](=O)[O-] ZINC000506294903 944846994 /nfs/dbraw/zinc/84/69/94/944846994.db2.gz MDCCTZZTGLQBMG-UHFFFAOYSA-N 1 1 357.429 3.750 20 5 FHBDMO Cc1ccc(C[N@@H+]2CCCN(Cc3ccc(F)cc3)CC2)cc1[N+](=O)[O-] ZINC000506294903 944847003 /nfs/dbraw/zinc/84/70/03/944847003.db2.gz MDCCTZZTGLQBMG-UHFFFAOYSA-N 1 1 357.429 3.750 20 5 FHBDMO Cc1ccc(C[N@H+]2CCCN(Cc3ccc(F)cc3)CC2)cc1[N+](=O)[O-] ZINC000506294903 944847010 /nfs/dbraw/zinc/84/70/10/944847010.db2.gz MDCCTZZTGLQBMG-UHFFFAOYSA-N 1 1 357.429 3.750 20 5 FHBDMO O=C(Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)[C@@H]1CCC[N@H+]1C1CC1 ZINC000426880393 944901648 /nfs/dbraw/zinc/90/16/48/944901648.db2.gz BSOYDYXRXOKLEQ-IBGZPJMESA-N 1 1 367.405 3.952 20 5 FHBDMO Cc1c(C(=O)N[C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000487340943 944906910 /nfs/dbraw/zinc/90/69/10/944906910.db2.gz CJXJFPBNBNRDIU-FUHWJXTLSA-N 1 1 367.449 3.544 20 5 FHBDMO Cc1ccccc1[C@@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000507176683 945007313 /nfs/dbraw/zinc/00/73/13/945007313.db2.gz DUSHDWASSINIBW-MRXNPFEDSA-N 1 1 364.405 3.943 20 5 FHBDMO Cc1ccccc1[C@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000507184185 945015236 /nfs/dbraw/zinc/01/52/36/945015236.db2.gz TUNIGVBABPUJAA-INIZCTEOSA-N 1 1 364.405 3.943 20 5 FHBDMO COc1c(C)cc(C[N@H+](C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])cc1C ZINC000507649589 945400254 /nfs/dbraw/zinc/40/02/54/945400254.db2.gz RZYRFICSYAYYNJ-UHFFFAOYSA-N 1 1 371.437 3.599 20 5 FHBDMO COc1c(C)cc(C[N@@H+](C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])cc1C ZINC000507649589 945400257 /nfs/dbraw/zinc/40/02/57/945400257.db2.gz RZYRFICSYAYYNJ-UHFFFAOYSA-N 1 1 371.437 3.599 20 5 FHBDMO COc1cc(C[N@H+]2CC[C@H](Cc3ccccc3)C2)c([N+](=O)[O-])cc1OC ZINC000507671369 945422705 /nfs/dbraw/zinc/42/27/05/945422705.db2.gz ZRSBEUNRXGFOHA-MRXNPFEDSA-N 1 1 356.422 3.677 20 5 FHBDMO CC[C@H](C)[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000507680290 945444781 /nfs/dbraw/zinc/44/47/81/945444781.db2.gz YULCVSQURXKUPR-INIZCTEOSA-N 1 1 355.438 3.858 20 5 FHBDMO COc1cc(C[N@H+]2CC[C@@H](COc3ccccc3)C2)c([N+](=O)[O-])cc1OC ZINC000507712636 945485772 /nfs/dbraw/zinc/48/57/72/945485772.db2.gz DKKHMLMSLCVYIZ-OAHLLOKOSA-N 1 1 372.421 3.513 20 5 FHBDMO Cc1nn(C(C)C)cc1C[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000281277940 945579667 /nfs/dbraw/zinc/57/96/67/945579667.db2.gz HVWVIFYATUAOIQ-UHFFFAOYSA-N 1 1 356.348 3.989 20 5 FHBDMO C[C@H]1C[C@@H](C(=O)N(Cc2ccc([N+](=O)[O-])cc2)c2ccccc2)CC[N@H+]1C ZINC001126494037 945644567 /nfs/dbraw/zinc/64/45/67/945644567.db2.gz YIJCDFTUAWVCHP-WMZOPIPTSA-N 1 1 367.449 3.858 20 5 FHBDMO CSCC[C@@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)c1nnc2ccccn21 ZINC000164294798 945708723 /nfs/dbraw/zinc/70/87/23/945708723.db2.gz YDYWOJNFQQMSRB-CZUORRHYSA-N 1 1 371.466 3.783 20 5 FHBDMO C[N@@H+](Cc1cc([O-])ccc1[N+](=O)[O-])[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000519749582 945716041 /nfs/dbraw/zinc/71/60/41/945716041.db2.gz XJLXQNVITAPNQQ-APWZRJJASA-N 1 1 360.385 3.792 20 5 FHBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1cc(Br)cs1 ZINC000107700091 945761291 /nfs/dbraw/zinc/76/12/91/945761291.db2.gz LZURYCXSYIJSOW-UHFFFAOYSA-N 1 1 371.256 3.930 20 5 FHBDMO COc1cc(N2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)ccc1[N+](=O)[O-] ZINC000281834641 945881954 /nfs/dbraw/zinc/88/19/54/945881954.db2.gz IMWPSVZDERRNIO-CQSZACIVSA-N 1 1 356.426 3.520 20 5 FHBDMO COc1c(O)ccc(C[N@@H+](C)[C@H]2CC[C@@H](C(F)(F)F)CC2)c1[N+](=O)[O-] ZINC000894526212 945912033 /nfs/dbraw/zinc/91/20/33/945912033.db2.gz MDLWQQKPRDDPBE-TXEJJXNPSA-N 1 1 362.348 3.862 20 5 FHBDMO Cc1c(NC(=O)CC[N@@H+](Cc2ccccc2)C2CC2)cccc1[N+](=O)[O-] ZINC000109093959 946137505 /nfs/dbraw/zinc/13/75/05/946137505.db2.gz ISJNUDKBUJMHPO-UHFFFAOYSA-N 1 1 353.422 3.896 20 5 FHBDMO C[C@@]1(c2ccccc2)CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000438484261 946300187 /nfs/dbraw/zinc/30/01/87/946300187.db2.gz QMQBKBAMSMCTIG-HXUWFJFHSA-N 1 1 364.405 3.808 20 5 FHBDMO COCC[N@@H+](C)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000127174302 946334910 /nfs/dbraw/zinc/33/49/10/946334910.db2.gz HLFHMUMDDQZUDW-UHFFFAOYSA-N 1 1 366.421 3.526 20 5 FHBDMO Cc1ccccc1C[NH+]1CCN(C(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000043149688 946397745 /nfs/dbraw/zinc/39/77/45/946397745.db2.gz POFZNQKMMSGMII-UHFFFAOYSA-N 1 1 368.437 3.561 20 5 FHBDMO CCc1ccc(C[NH+]2CCN(c3cccc(OC)c3[N+](=O)[O-])CC2)s1 ZINC000475499096 946499171 /nfs/dbraw/zinc/49/91/71/946499171.db2.gz SDFYMUNFAAYBRN-UHFFFAOYSA-N 1 1 361.467 3.550 20 5 FHBDMO COc1ccc(OCC[N@H+]2C[C@H](c3ccc(F)cc3)C[C@H]2C)c([N+](=O)[O-])c1 ZINC000441395901 946551550 /nfs/dbraw/zinc/55/15/50/946551550.db2.gz NYMUMGAJKCORBX-GDBMZVCRSA-N 1 1 374.412 3.999 20 5 FHBDMO Cc1cc(C(=O)N[C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000487386680 946564437 /nfs/dbraw/zinc/56/44/37/946564437.db2.gz HDOGKKOBVISNMI-LPHOPBHVSA-N 1 1 367.449 3.544 20 5 FHBDMO COC(=O)COc1ccc(C[N@@H+](C(C)C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000475565910 946675475 /nfs/dbraw/zinc/67/54/75/946675475.db2.gz XUFUFOZWVDIPDZ-UHFFFAOYSA-N 1 1 364.442 3.690 20 5 FHBDMO COc1ccc(-c2ccc(C[N@@H+]3CCOCC34CCC4)o2)c([N+](=O)[O-])c1 ZINC000093510203 946707153 /nfs/dbraw/zinc/70/71/53/946707153.db2.gz WZBNWWIWIUJQIH-UHFFFAOYSA-N 1 1 358.394 3.618 20 5 FHBDMO COc1ccc(-c2ccc(C[N@H+]3CCOCC34CCC4)o2)c([N+](=O)[O-])c1 ZINC000093510203 946707156 /nfs/dbraw/zinc/70/71/56/946707156.db2.gz WZBNWWIWIUJQIH-UHFFFAOYSA-N 1 1 358.394 3.618 20 5 FHBDMO CCC1CCC([N@@H+](C)Cc2ccc(OCC(=O)OC)c([N+](=O)[O-])c2)CC1 ZINC000475581790 946747232 /nfs/dbraw/zinc/74/72/32/946747232.db2.gz HDLHUYSWUQBUIX-UHFFFAOYSA-N 1 1 364.442 3.547 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475285429 946821557 /nfs/dbraw/zinc/82/15/57/946821557.db2.gz LZXLIFPLZDEULR-FUKWUPMWSA-N 1 1 351.450 3.720 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C\CNC[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475285429 946821565 /nfs/dbraw/zinc/82/15/65/946821565.db2.gz LZXLIFPLZDEULR-FUKWUPMWSA-N 1 1 351.450 3.720 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C\CNC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475285429 946821575 /nfs/dbraw/zinc/82/15/75/946821575.db2.gz LZXLIFPLZDEULR-FUKWUPMWSA-N 1 1 351.450 3.720 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@H]1CCN(Cc2ccccc2)C1 ZINC000475285429 946821591 /nfs/dbraw/zinc/82/15/91/946821591.db2.gz LZXLIFPLZDEULR-FUKWUPMWSA-N 1 1 351.450 3.720 20 5 FHBDMO C[C@@H]1OCC[C@]12C[N@@H+](Cc1ccc(-c3ccc([N+](=O)[O-])cc3)s1)CCO2 ZINC000475289425 946827846 /nfs/dbraw/zinc/82/78/46/946827846.db2.gz AHKCWLUQTIXERJ-LIRRHRJNSA-N 1 1 374.462 3.703 20 5 FHBDMO C[C@H]1OCC[C@@]12C[N@@H+](Cc1ccc(-c3ccc([N+](=O)[O-])cc3)s1)CCO2 ZINC000475289420 946828106 /nfs/dbraw/zinc/82/81/06/946828106.db2.gz AHKCWLUQTIXERJ-AUUYWEPGSA-N 1 1 374.462 3.703 20 5 FHBDMO CCc1ccc([C@H](NCC2=CC[N@@H+](C)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544380643 946867685 /nfs/dbraw/zinc/86/76/85/946867685.db2.gz QYQOUIWOJHVYPJ-HXUWFJFHSA-N 1 1 355.438 3.691 20 5 FHBDMO Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NCc1ccccc1C[N@H+](C)C(C)C ZINC000843767727 946882291 /nfs/dbraw/zinc/88/22/91/946882291.db2.gz LOGJSXOIVJECSW-UHFFFAOYSA-N 1 1 373.428 3.813 20 5 FHBDMO COc1ccc(-c2ccc(C[N@H+]3CCC[C@@](C)(O)CC3)o2)c([N+](=O)[O-])c1 ZINC000475344598 946915565 /nfs/dbraw/zinc/91/55/65/946915565.db2.gz XAODSUMFTZPLEI-LJQANCHMSA-N 1 1 360.410 3.600 20 5 FHBDMO CC[C@@H](C)[C@H](C)[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC)C1CC1 ZINC000112600075 946917659 /nfs/dbraw/zinc/91/76/59/946917659.db2.gz MZIKSXRJCUJWAU-KGLIPLIRSA-N 1 1 363.458 3.831 20 5 FHBDMO COc1cccc(NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)c1[N+](=O)[O-] ZINC000475356032 946937478 /nfs/dbraw/zinc/93/74/78/946937478.db2.gz XSMKJMASMOSHQH-AWEZNQCLSA-N 1 1 361.467 3.989 20 5 FHBDMO COC(=O)[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@@H]1C ZINC000475361811 946953858 /nfs/dbraw/zinc/95/38/58/946953858.db2.gz KMUAUHQSUQNRBX-ZFWWWQNUSA-N 1 1 374.462 3.954 20 5 FHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)CCc1cccs1 ZINC000072800881 947042880 /nfs/dbraw/zinc/04/28/80/947042880.db2.gz ZPKRSOFSIKGZJZ-LLVKDONJSA-N 1 1 367.858 3.811 20 5 FHBDMO COCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H](C)c1ccccc1 ZINC000444620607 947053194 /nfs/dbraw/zinc/05/31/94/947053194.db2.gz OKXNKXNCWUOIFX-CQSZACIVSA-N 1 1 354.410 3.681 20 5 FHBDMO COCC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H](C)c1ccccc1 ZINC000444620607 947053182 /nfs/dbraw/zinc/05/31/82/947053182.db2.gz OKXNKXNCWUOIFX-CQSZACIVSA-N 1 1 354.410 3.681 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N(C)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000074446254 947068148 /nfs/dbraw/zinc/06/81/48/947068148.db2.gz DZCINNLKZWNAHI-LJQANCHMSA-N 1 1 367.449 3.640 20 5 FHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CC[C@H](COCc4ccccc4)C3)nc2c1 ZINC000444650134 947071718 /nfs/dbraw/zinc/07/17/18/947071718.db2.gz NMUVDDQCZXMFAS-INIZCTEOSA-N 1 1 366.421 3.510 20 5 FHBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@H](COCc4ccccc4)C3)nc2c1 ZINC000444650134 947071729 /nfs/dbraw/zinc/07/17/29/947071729.db2.gz NMUVDDQCZXMFAS-INIZCTEOSA-N 1 1 366.421 3.510 20 5 FHBDMO CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC)[C@@H]1CCCC[C@@H]1C ZINC000444679483 947104645 /nfs/dbraw/zinc/10/46/45/947104645.db2.gz VBVGKNGKXOVCGB-WMLDXEAASA-N 1 1 363.458 3.833 20 5 FHBDMO Cc1ccc(F)c(C[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1 ZINC000444738698 947153424 /nfs/dbraw/zinc/15/34/24/947153424.db2.gz CSMJAPXKEOHLMS-UHFFFAOYSA-N 1 1 359.401 3.811 20 5 FHBDMO CC(C)c1ccc(C[N@@H+](C)C[C@@H](O)COCc2ccccc2)cc1[N+](=O)[O-] ZINC000511959229 947170784 /nfs/dbraw/zinc/17/07/84/947170784.db2.gz XZMODKCMHNAZJW-LJQANCHMSA-N 1 1 372.465 3.728 20 5 FHBDMO CC(C)[C@H]1CCC[N@@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000444771296 947207764 /nfs/dbraw/zinc/20/77/64/947207764.db2.gz OQVJZXFIXSFPAG-OLZOCXBDSA-N 1 1 353.850 3.943 20 5 FHBDMO CC(C)[C@H]1CCC[N@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000444771296 947207771 /nfs/dbraw/zinc/20/77/71/947207771.db2.gz OQVJZXFIXSFPAG-OLZOCXBDSA-N 1 1 353.850 3.943 20 5 FHBDMO CC[C@H](C)[N@@H+](C)CCNCc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000236882299 947416511 /nfs/dbraw/zinc/41/65/11/947416511.db2.gz KWTZCGMOALYQSX-AWEZNQCLSA-N 1 1 361.442 3.683 20 5 FHBDMO COc1cc(C[NH2+]C(C)(C)c2nc3ccccc3n2C)ccc1[N+](=O)[O-] ZINC000473164071 947510042 /nfs/dbraw/zinc/51/00/42/947510042.db2.gz UWKJYLLODIYVCK-UHFFFAOYSA-N 1 1 354.410 3.515 20 5 FHBDMO Cc1c(NC(=O)N[C@H]2C[N@H+](Cc3ccccc3)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000248400406 947913522 /nfs/dbraw/zinc/91/35/22/947913522.db2.gz XPKWUYQQPDWUQC-KDOFPFPSSA-N 1 1 368.437 3.545 20 5 FHBDMO O=[N+]([O-])c1cccc(Cl)c1NCc1cccc(C[NH+]2CCOCC2)c1 ZINC000432337741 948151658 /nfs/dbraw/zinc/15/16/58/948151658.db2.gz UQEZDADAEXPFJN-UHFFFAOYSA-N 1 1 361.829 3.693 20 5 FHBDMO O=[N+]([O-])c1cccc2c(N3CC[C@H]4[C@H](CCC[N@H+]4C4CC4)C3)ccnc21 ZINC000432341328 948164440 /nfs/dbraw/zinc/16/44/40/948164440.db2.gz WGMIKDAXUBKGHF-PBHICJAKSA-N 1 1 352.438 3.596 20 5 FHBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3C[N@H+]2Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000574796813 948518352 /nfs/dbraw/zinc/51/83/52/948518352.db2.gz LVWLHNIMHIGAJJ-KISNFGTJSA-N 1 1 371.462 3.574 20 5 FHBDMO CC[N@@H+](CCc1ccccc1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728898006 948673936 /nfs/dbraw/zinc/67/39/36/948673936.db2.gz SPDCDRQCMAOXHK-UHFFFAOYSA-N 1 1 350.422 3.980 20 5 FHBDMO Cc1ccc(C[N@@H+](CCO)Cc2cc([N+](=O)[O-])ccc2OC(C)C)cc1 ZINC000543989151 948695053 /nfs/dbraw/zinc/69/50/53/948695053.db2.gz WZXLVLKIRIITKG-UHFFFAOYSA-N 1 1 358.438 3.685 20 5 FHBDMO Cc1ccc(C[N@H+](CCO)Cc2cc([N+](=O)[O-])ccc2OC(C)C)cc1 ZINC000543989151 948695059 /nfs/dbraw/zinc/69/50/59/948695059.db2.gz WZXLVLKIRIITKG-UHFFFAOYSA-N 1 1 358.438 3.685 20 5 FHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C1 ZINC000536481625 948726213 /nfs/dbraw/zinc/72/62/13/948726213.db2.gz LMTJOKHROZDTSD-QLFBSQMISA-N 1 1 370.453 3.554 20 5 FHBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@@H]2c2ccc3c(c2)OCCO3)c1 ZINC000071906179 221386775 /nfs/dbraw/zinc/38/67/75/221386775.db2.gz XPZKZNPPTDKJGZ-GOSISDBHSA-N 1 1 370.405 3.582 20 5 FHBDMO C[C@@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000097592202 222194080 /nfs/dbraw/zinc/19/40/80/222194080.db2.gz DJMKNMFHMKDZBA-CQSZACIVSA-N 1 1 373.840 3.595 20 5 FHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000097592202 222194082 /nfs/dbraw/zinc/19/40/82/222194082.db2.gz DJMKNMFHMKDZBA-CQSZACIVSA-N 1 1 373.840 3.595 20 5 FHBDMO CC[C@H]1[C@H](C)CC[N@H+]1CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000481375841 567862920 /nfs/dbraw/zinc/86/29/20/567862920.db2.gz QUMGOQBMUGOXPB-WBMJQRKESA-N 1 1 374.466 3.777 20 5 FHBDMO COc1ccc(C[N@@H+](Cc2ccccc2)CC2(O)CCCC2)cc1[N+](=O)[O-] ZINC000568102951 567883443 /nfs/dbraw/zinc/88/34/43/567883443.db2.gz XIEGSWSDIRPYFR-UHFFFAOYSA-N 1 1 370.449 3.911 20 5 FHBDMO Nc1c(Cl)cc(Cl)cc1C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000602640433 568002974 /nfs/dbraw/zinc/00/29/74/568002974.db2.gz OASJFKSIUNAFNK-UHFFFAOYSA-N 1 1 370.240 3.517 20 5 FHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCC[C@@]4(C3)OCc3ccccc34)nc2c1 ZINC000481686645 568089133 /nfs/dbraw/zinc/08/91/33/568089133.db2.gz JHDXVQTUXDIJIK-FQEVSTJZSA-N 1 1 365.389 3.758 20 5 FHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@@]4(C3)OCc3ccccc34)nc2c1 ZINC000481686645 568089134 /nfs/dbraw/zinc/08/91/34/568089134.db2.gz JHDXVQTUXDIJIK-FQEVSTJZSA-N 1 1 365.389 3.758 20 5 FHBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+](C)C2CCOCC2)cc1OC ZINC000541986185 568313726 /nfs/dbraw/zinc/31/37/26/568313726.db2.gz JDKJUNOSNSAQHM-AWEZNQCLSA-N 1 1 366.458 3.639 20 5 FHBDMO CSc1ccc(C(=O)NCCC[N@@H+](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000031144644 568325531 /nfs/dbraw/zinc/32/55/31/568325531.db2.gz YLIPQKPGYKPFQQ-UHFFFAOYSA-N 1 1 365.499 3.701 20 5 FHBDMO Cc1sc(C(=O)N2CCC[N@@H+](Cc3ccccc3C)CC2)cc1[N+](=O)[O-] ZINC000031765283 568339195 /nfs/dbraw/zinc/33/91/95/568339195.db2.gz VFWHHIKZBRAONK-UHFFFAOYSA-N 1 1 373.478 3.621 20 5 FHBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC000569298011 568344358 /nfs/dbraw/zinc/34/43/58/568344358.db2.gz NWHFQAFVSPINJL-QZTJIDSGSA-N 1 1 356.422 3.562 20 5 FHBDMO COc1ccccc1[C@@H](CO)[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000569908214 568435814 /nfs/dbraw/zinc/43/58/14/568435814.db2.gz SLRKULOYJYWWDY-ZWKOTPCHSA-N 1 1 356.422 3.649 20 5 FHBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NC[C@H]1CCC[N@H+](CC(C)C)C1 ZINC000570153777 568455215 /nfs/dbraw/zinc/45/52/15/568455215.db2.gz OGICLCPRHRBLBF-CQSZACIVSA-N 1 1 367.877 3.654 20 5 FHBDMO CC(C)(C)C1=CC[N@@H+](CCNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)CC1 ZINC000570081773 568457548 /nfs/dbraw/zinc/45/75/48/568457548.db2.gz VTLFAXBUAAELHP-UHFFFAOYSA-N 1 1 372.469 3.570 20 5 FHBDMO C[C@]1(NC(=O)Nc2ccc([N+](=O)[O-])cc2F)CC[N@@H+](Cc2ccccc2)C1 ZINC000584723876 568550190 /nfs/dbraw/zinc/55/01/90/568550190.db2.gz PHANVOUKRMEFRC-IBGZPJMESA-N 1 1 372.400 3.520 20 5 FHBDMO CC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@H](C)c1ccc(-c2nn[nH]n2)cc1 ZINC000825434862 608549712 /nfs/dbraw/zinc/54/97/12/608549712.db2.gz HXKGUZMOTRSUFV-CQSZACIVSA-N 1 1 366.425 3.666 20 5 FHBDMO O=[N+]([O-])c1cnc(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c(Cl)c1 ZINC001164624673 719055236 /nfs/dbraw/zinc/05/52/36/719055236.db2.gz OUGUICJUVQIIQE-CRAIPNDOSA-N 1 1 372.856 3.744 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)n1 ZINC001164623612 719082673 /nfs/dbraw/zinc/08/26/73/719082673.db2.gz JXYCFZIVGROJFT-OALUTQOASA-N 1 1 366.465 3.707 20 5 FHBDMO C[C@H]1CCCC[N@H+]1CCC1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000157508028 927774540 /nfs/dbraw/zinc/77/45/40/927774540.db2.gz MSTFRLKPVNFHQZ-INIZCTEOSA-N 1 1 359.470 3.712 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](CC(=O)OC(C)C)c1ccccc1 ZINC000430209429 928088321 /nfs/dbraw/zinc/08/83/21/928088321.db2.gz XUNKOSOWYCOJKL-SFHVURJKSA-N 1 1 372.421 3.776 20 5 FHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H]2CCc2ccccc2)c1 ZINC001167070769 928211848 /nfs/dbraw/zinc/21/18/48/928211848.db2.gz IUUGCTSLWDKDOG-LJQANCHMSA-N 1 1 368.433 3.979 20 5 FHBDMO COc1ccc([C@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2OC)cc1OC ZINC000430222758 928276225 /nfs/dbraw/zinc/27/62/25/928276225.db2.gz WUDRGJZCFKQJPW-QGZVFWFLSA-N 1 1 372.421 3.958 20 5 FHBDMO COc1ccc([C@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2OC)cc1OC ZINC000430222758 928276236 /nfs/dbraw/zinc/27/62/36/928276236.db2.gz WUDRGJZCFKQJPW-QGZVFWFLSA-N 1 1 372.421 3.958 20 5 FHBDMO C[C@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2F)CC[N@H+]1Cc1ccccc1 ZINC000176583789 937276288 /nfs/dbraw/zinc/27/62/88/937276288.db2.gz HMNCLZXOQFCYQK-HOCLYGCPSA-N 1 1 371.412 3.517 20 5 FHBDMO CCOCCC[N@H+]1CC[C@H](N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000248170125 937281391 /nfs/dbraw/zinc/28/13/91/937281391.db2.gz UPEHRAHVRLIMRY-LNLFQRSKSA-N 1 1 363.502 3.691 20 5 FHBDMO CCOCCCN1CC[C@H]([NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000248170125 937281396 /nfs/dbraw/zinc/28/13/96/937281396.db2.gz UPEHRAHVRLIMRY-LNLFQRSKSA-N 1 1 363.502 3.691 20 5 FHBDMO C[C@@H]([NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000165333935 929510042 /nfs/dbraw/zinc/51/00/42/929510042.db2.gz KCLXVJUSCIGDQE-IEBWSBKVSA-N 1 1 353.466 3.810 20 5 FHBDMO CN(C(=O)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1)c1ccccc1 ZINC000430303162 929626568 /nfs/dbraw/zinc/62/65/68/929626568.db2.gz SOHJFLJUIXWCRI-OAHLLOKOSA-N 1 1 373.840 3.733 20 5 FHBDMO Cc1ccc2c(c1)[C@@H]1C[N@@H+](C)CC[C@@H]1N2C(=O)c1ccc([N+](=O)[O-])cc1C ZINC000134014469 929639915 /nfs/dbraw/zinc/63/99/15/929639915.db2.gz UFWSWYKWNVBLOH-ICSRJNTNSA-N 1 1 365.433 3.660 20 5 FHBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275676377 929834733 /nfs/dbraw/zinc/83/47/33/929834733.db2.gz BTYXXPYWCKLNBV-VLIAUNLRSA-N 1 1 363.461 3.506 20 5 FHBDMO CC[C@@H](C(=O)N(C)CCc1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000560993313 930269694 /nfs/dbraw/zinc/26/96/94/930269694.db2.gz PEASODOQZDTZJP-IBGZPJMESA-N 1 1 369.465 3.506 20 5 FHBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@](C)(c2ccccc2)C1 ZINC001167367139 930354159 /nfs/dbraw/zinc/35/41/59/930354159.db2.gz BSGUWVCTCXTQIT-IERDGZPVSA-N 1 1 367.449 3.976 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1 ZINC000247259489 930529522 /nfs/dbraw/zinc/52/95/22/930529522.db2.gz DXZDRMUGYPQHPQ-KBXCAEBGSA-N 1 1 373.478 3.778 20 5 FHBDMO CCc1cnc(C[N@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)s1 ZINC000177763895 930669956 /nfs/dbraw/zinc/66/99/56/930669956.db2.gz JPFSCRUETFCSPE-UHFFFAOYSA-N 1 1 372.450 3.943 20 5 FHBDMO CCc1cnc(C[N@@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)s1 ZINC000177763895 930669961 /nfs/dbraw/zinc/66/99/61/930669961.db2.gz JPFSCRUETFCSPE-UHFFFAOYSA-N 1 1 372.450 3.943 20 5 FHBDMO COc1ccc([C@H](CN(C)C)[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000580459159 930700534 /nfs/dbraw/zinc/70/05/34/930700534.db2.gz FDHPIHWMFOVECZ-KXBFYZLASA-N 1 1 357.454 3.865 20 5 FHBDMO Cc1cccc(C(=O)N2CC[N@H+](Cc3ccccc3)CC[C@H]2C)c1[N+](=O)[O-] ZINC000610445941 930788748 /nfs/dbraw/zinc/78/87/48/930788748.db2.gz KXNHMYBRIHIALS-QGZVFWFLSA-N 1 1 367.449 3.640 20 5 FHBDMO CCc1ccccc1NC(=O)[C@@H](C)[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000580880758 931295878 /nfs/dbraw/zinc/29/58/78/931295878.db2.gz FAIIVIADEJVIPU-OAHLLOKOSA-N 1 1 355.438 3.659 20 5 FHBDMO CCc1ccccc1NC(=O)[C@@H](C)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000580880758 931295891 /nfs/dbraw/zinc/29/58/91/931295891.db2.gz FAIIVIADEJVIPU-OAHLLOKOSA-N 1 1 355.438 3.659 20 5 FHBDMO Cc1ccccc1C[N@H+]1CCCN(Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000610476210 931540026 /nfs/dbraw/zinc/54/00/26/931540026.db2.gz WECIOBSHJSNGJM-UHFFFAOYSA-N 1 1 357.429 3.750 20 5 FHBDMO CC(=O)c1ccc(NCc2cc(C)[nH+]c(N3CCCC3)c2)c([N+](=O)[O-])c1 ZINC000581223661 931703603 /nfs/dbraw/zinc/70/36/03/931703603.db2.gz PZDOCWMLBNWQFJ-UHFFFAOYSA-N 1 1 354.410 3.713 20 5 FHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000477045897 931739928 /nfs/dbraw/zinc/73/99/28/931739928.db2.gz FZCARQMPEVTKBD-AUUYWEPGSA-N 1 1 372.425 3.598 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H](c2nccs2)C1 ZINC000157013217 931774220 /nfs/dbraw/zinc/77/42/20/931774220.db2.gz SAKNLNYYPFNHIF-CQSZACIVSA-N 1 1 374.466 3.568 20 5 FHBDMO O=C(CC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1)Nc1cccc(F)c1 ZINC000135219370 932054902 /nfs/dbraw/zinc/05/49/02/932054902.db2.gz GBQUTZBJDFCFOD-UHFFFAOYSA-N 1 1 357.385 3.727 20 5 FHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](OCc2c(C)noc2C)C1 ZINC000581456161 932089634 /nfs/dbraw/zinc/08/96/34/932089634.db2.gz SHWNALZQUFYSCG-CECLQJIQSA-N 1 1 371.437 3.894 20 5 FHBDMO COc1cccc(NC(=O)CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000178075336 932312199 /nfs/dbraw/zinc/31/21/99/932312199.db2.gz JGOITNKGRUAUIM-UHFFFAOYSA-N 1 1 369.421 3.597 20 5 FHBDMO CO[C@@]1(C)C[C@H]([N@@H+](C)Cc2ccc(Br)cc2[N+](=O)[O-])C1(C)C ZINC001167490566 933076320 /nfs/dbraw/zinc/07/63/20/933076320.db2.gz DMLOYNAVVPSAIF-HOCLYGCPSA-N 1 1 371.275 3.993 20 5 FHBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C1 ZINC000610604699 933512755 /nfs/dbraw/zinc/51/27/55/933512755.db2.gz HCKDWJOMUINFPV-AOOOYVTPSA-N 1 1 372.265 3.646 20 5 FHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C1 ZINC000610604699 933512762 /nfs/dbraw/zinc/51/27/62/933512762.db2.gz HCKDWJOMUINFPV-AOOOYVTPSA-N 1 1 372.265 3.646 20 5 FHBDMO Cc1noc([C@H]2CCC[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C2)n1 ZINC000091832682 933678569 /nfs/dbraw/zinc/67/85/69/933678569.db2.gz BXPZTDXOJHIPLZ-AWEZNQCLSA-N 1 1 368.393 3.926 20 5 FHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](CCc1ccccc1)Cc1ccccc1 ZINC000610664862 933700321 /nfs/dbraw/zinc/70/03/21/933700321.db2.gz FLJXKXKGQWMXGH-UHFFFAOYSA-N 1 1 364.449 3.845 20 5 FHBDMO CCc1nnc([C@@H](C)[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[nH]1 ZINC000535685114 934278525 /nfs/dbraw/zinc/27/85/25/934278525.db2.gz CYLZEYPQEZXWCX-LLVKDONJSA-N 1 1 357.439 3.855 20 5 FHBDMO C[N@H+]1CCC[C@@H]2CN(Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)CC[C@H]21 ZINC000535806324 934412858 /nfs/dbraw/zinc/41/28/58/934412858.db2.gz QQLHUSWLNNSLRM-CRAIPNDOSA-N 1 1 355.438 3.771 20 5 FHBDMO COc1cc(N[C@@H]2CCC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)cc(OC)c1 ZINC000610865327 934540754 /nfs/dbraw/zinc/54/07/54/934540754.db2.gz NFGKXUQLBKHZDM-MRXNPFEDSA-N 1 1 371.437 3.689 20 5 FHBDMO Cc1[nH+]ccn1-c1ccc([C@@H](C)NC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000176187340 934557067 /nfs/dbraw/zinc/55/70/67/934557067.db2.gz DIETTXLYEPDHBI-CQSZACIVSA-N 1 1 364.405 3.509 20 5 FHBDMO CCO[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)C1 ZINC000610930439 934626328 /nfs/dbraw/zinc/62/63/28/934626328.db2.gz DGOZUQMUSYQEMR-HNNXBMFYSA-N 1 1 360.410 3.864 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1CN[C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000380702550 934879503 /nfs/dbraw/zinc/87/95/03/934879503.db2.gz HBHLHMRYSQRFSH-AEFFLSMTSA-N 1 1 369.465 3.604 20 5 FHBDMO O=C(NC[C@H]1CCCC[N@H+]1Cc1ccccc1[N+](=O)[O-])Nc1ccccc1 ZINC000071887178 934938079 /nfs/dbraw/zinc/93/80/79/934938079.db2.gz QVLGAOXALQPACZ-GOSISDBHSA-N 1 1 368.437 3.771 20 5 FHBDMO O=C(NC[C@H]1CCCC[N@@H+]1Cc1ccccc1[N+](=O)[O-])Nc1ccccc1 ZINC000071887178 934938083 /nfs/dbraw/zinc/93/80/83/934938083.db2.gz QVLGAOXALQPACZ-GOSISDBHSA-N 1 1 368.437 3.771 20 5 FHBDMO Cc1cc(C(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)cc([N+](=O)[O-])c1 ZINC000119670573 934995825 /nfs/dbraw/zinc/99/58/25/934995825.db2.gz SALKMTGIIBSWGR-HNNXBMFYSA-N 1 1 373.478 3.607 20 5 FHBDMO C[C@H](CNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[N@H+]1CCCC[C@@H]1C ZINC000437151491 945070768 /nfs/dbraw/zinc/07/07/68/945070768.db2.gz GOXASQLLTOWSQT-NWDGAFQWSA-N 1 1 373.375 3.606 20 5 FHBDMO C[C@@H](C(=O)Nc1ccccc1Cl)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511073661 935251186 /nfs/dbraw/zinc/25/11/86/935251186.db2.gz PZEFYCIKMFMFNG-ZDUSSCGKSA-N 1 1 361.829 3.750 20 5 FHBDMO C[C@@H](C(=O)Nc1ccccc1Cl)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511073661 935251188 /nfs/dbraw/zinc/25/11/88/935251188.db2.gz PZEFYCIKMFMFNG-ZDUSSCGKSA-N 1 1 361.829 3.750 20 5 FHBDMO Cc1cc(C)cc(NC(=O)[C@H](C)[N@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511075494 935275282 /nfs/dbraw/zinc/27/52/82/935275282.db2.gz ZGQASBLEWUOADP-INIZCTEOSA-N 1 1 355.438 3.713 20 5 FHBDMO Cc1cc(C)cc(NC(=O)[C@H](C)[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511075494 935275285 /nfs/dbraw/zinc/27/52/85/935275285.db2.gz ZGQASBLEWUOADP-INIZCTEOSA-N 1 1 355.438 3.713 20 5 FHBDMO Cc1cc(C)cc(NC(=O)[C@@H](C)[N@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511075495 935275452 /nfs/dbraw/zinc/27/54/52/935275452.db2.gz ZGQASBLEWUOADP-MRXNPFEDSA-N 1 1 355.438 3.713 20 5 FHBDMO Cc1cc(C)cc(NC(=O)[C@@H](C)[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511075495 935275456 /nfs/dbraw/zinc/27/54/56/935275456.db2.gz ZGQASBLEWUOADP-MRXNPFEDSA-N 1 1 355.438 3.713 20 5 FHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])[C@@H]1CCN(c2cccc(Cl)c2)C1=O ZINC000511104675 935578178 /nfs/dbraw/zinc/57/81/78/935578178.db2.gz ICDRAEMLKZATLI-GOSISDBHSA-N 1 1 373.840 3.528 20 5 FHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])[C@@H]1CCN(c2cccc(Cl)c2)C1=O ZINC000511104675 935578182 /nfs/dbraw/zinc/57/81/82/935578182.db2.gz ICDRAEMLKZATLI-GOSISDBHSA-N 1 1 373.840 3.528 20 5 FHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc(OC[C@@H]2CCCO2)cc1 ZINC000511104629 935578919 /nfs/dbraw/zinc/57/89/19/935578919.db2.gz FNYQPMSKJIXDFY-FQEVSTJZSA-N 1 1 370.449 3.827 20 5 FHBDMO C[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[S@@](=O)C1 ZINC000277599699 935704306 /nfs/dbraw/zinc/70/43/06/935704306.db2.gz VNUNYYQFMIYSFM-RKNYENMMSA-N 1 1 364.492 3.524 20 5 FHBDMO C[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[S@@](=O)C1 ZINC000277599699 935704312 /nfs/dbraw/zinc/70/43/12/935704312.db2.gz VNUNYYQFMIYSFM-RKNYENMMSA-N 1 1 364.492 3.524 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])c(N2CCC[N@@H+](Cc3ccccc3C)CC2)n1 ZINC000611615892 935814139 /nfs/dbraw/zinc/81/41/39/935814139.db2.gz KOMILYXFDYFKNY-UHFFFAOYSA-N 1 1 354.454 3.627 20 5 FHBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000277733912 935865709 /nfs/dbraw/zinc/86/57/09/935865709.db2.gz OKRNNNOABYUILK-OAHLLOKOSA-N 1 1 363.461 3.507 20 5 FHBDMO Cc1ccc(C)n1C1CC[NH+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000507322186 945141995 /nfs/dbraw/zinc/14/19/95/945141995.db2.gz AJPMRPILUHMRGP-UHFFFAOYSA-N 1 1 370.453 3.597 20 5 FHBDMO C[C@@H](Nc1ncnc2ccc([N+](=O)[O-])cc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000611713907 936075822 /nfs/dbraw/zinc/07/58/22/936075822.db2.gz LGZQLGOLEXVYSL-KGLIPLIRSA-N 1 1 355.442 3.603 20 5 FHBDMO O=[N+]([O-])c1cnn(CC[N@@H+](CCc2ccccc2)Cc2ccccc2)c1 ZINC000472263419 936146475 /nfs/dbraw/zinc/14/64/75/936146475.db2.gz UERSIFFGKUYLFS-UHFFFAOYSA-N 1 1 350.422 3.536 20 5 FHBDMO Cc1c[nH+]ccc1OC1CCN(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC000277909204 936149755 /nfs/dbraw/zinc/14/97/55/936149755.db2.gz FTWZXXMZTGVIBI-UHFFFAOYSA-N 1 1 370.409 3.682 20 5 FHBDMO COCC[N@@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)Cc1scnc1C ZINC000426547284 945152981 /nfs/dbraw/zinc/15/29/81/945152981.db2.gz ZPCFXJRZRIXSFU-NTEUORMPSA-N 1 1 361.467 3.912 20 5 FHBDMO COc1ccc(-n2ccc(C[NH2+][C@@H](C)c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000178712838 936279574 /nfs/dbraw/zinc/27/95/74/936279574.db2.gz LFFZZQGSPMFUBQ-AWEZNQCLSA-N 1 1 352.394 3.640 20 5 FHBDMO Cc1[nH+]ccn1-c1ccccc1CNC(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000612611303 936283106 /nfs/dbraw/zinc/28/31/06/936283106.db2.gz IRWBLRUITJMHMH-UHFFFAOYSA-N 1 1 369.356 3.550 20 5 FHBDMO Cc1c(NC(=O)CC[N@H+]2CCS[C@@H]3CCCC[C@H]32)cccc1[N+](=O)[O-] ZINC000246085410 938337702 /nfs/dbraw/zinc/33/77/02/938337702.db2.gz GBFOBFFVUKUUKD-IAGOWNOFSA-N 1 1 363.483 3.592 20 5 FHBDMO Cc1ccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c(-c2cnn(C)c2)c1 ZINC000584041228 938564935 /nfs/dbraw/zinc/56/49/35/938564935.db2.gz HAQSYRGUYJHRQH-UHFFFAOYSA-N 1 1 350.422 3.936 20 5 FHBDMO Cc1csc(NC2CC[NH+](C/C=C/c3ccccc3[N+](=O)[O-])CC2)n1 ZINC000473076544 945186957 /nfs/dbraw/zinc/18/69/57/945186957.db2.gz SSRRCMAUYDKIMG-GQCTYLIASA-N 1 1 358.467 3.949 20 5 FHBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+](C)CCCc2ccccc2)cccc1[N+](=O)[O-] ZINC000052802822 938595862 /nfs/dbraw/zinc/59/58/62/938595862.db2.gz WOFIWXNNOXVGJJ-MRXNPFEDSA-N 1 1 355.438 3.795 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000278684316 938648883 /nfs/dbraw/zinc/64/88/83/938648883.db2.gz IZGAVHZJVUAWSV-LBPRGKRZSA-N 1 1 359.348 3.506 20 5 FHBDMO Cc1c(CNC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000708540178 938815943 /nfs/dbraw/zinc/81/59/43/938815943.db2.gz SWEYEAQMSPPPKI-OXJNMPFZSA-N 1 1 353.466 3.761 20 5 FHBDMO Cc1c(CNC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000708540178 938815947 /nfs/dbraw/zinc/81/59/47/938815947.db2.gz SWEYEAQMSPPPKI-OXJNMPFZSA-N 1 1 353.466 3.761 20 5 FHBDMO CC[N@H+]1CCC[C@H](Nc2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000584449864 938903162 /nfs/dbraw/zinc/90/31/62/938903162.db2.gz LDKRXMHVQDAHHV-VIFPVBQESA-N 1 1 368.306 3.540 20 5 FHBDMO O=C(CC[N@@H+](Cc1cccc(F)c1)C1CC1)Nc1ccccc1[N+](=O)[O-] ZINC000409859500 938997364 /nfs/dbraw/zinc/99/73/64/938997364.db2.gz MNMJYOYIRAAVSL-UHFFFAOYSA-N 1 1 357.385 3.727 20 5 FHBDMO CCC[N@H+]1CC[C@@H](CNCc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)C1 ZINC000102424112 939018559 /nfs/dbraw/zinc/01/85/59/939018559.db2.gz MSFZDCFLCSNSCH-HNNXBMFYSA-N 1 1 373.453 3.685 20 5 FHBDMO COc1ccc(-c2n[nH]cc2C[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000179316689 939080085 /nfs/dbraw/zinc/08/00/85/939080085.db2.gz VHVWJSHXWRULNC-UHFFFAOYSA-N 1 1 352.394 3.626 20 5 FHBDMO COc1ccc(-c2n[nH]cc2C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000179316689 939080087 /nfs/dbraw/zinc/08/00/87/939080087.db2.gz VHVWJSHXWRULNC-UHFFFAOYSA-N 1 1 352.394 3.626 20 5 FHBDMO C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCc2ccccc21 ZINC000073741559 945231927 /nfs/dbraw/zinc/23/19/27/945231927.db2.gz ADOGSPXZKBENHJ-KRWDZBQOSA-N 1 1 350.378 3.764 20 5 FHBDMO C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCc2ccccc21 ZINC000073741559 945231936 /nfs/dbraw/zinc/23/19/36/945231936.db2.gz ADOGSPXZKBENHJ-KRWDZBQOSA-N 1 1 350.378 3.764 20 5 FHBDMO COc1cc(C[N@H+]2CCC[C@H]3CCC[C@@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000511844854 945261738 /nfs/dbraw/zinc/26/17/38/945261738.db2.gz TVUGWBPCKSFLNP-YPMHNXCESA-N 1 1 356.369 3.969 20 5 FHBDMO COc1ccc([C@@H](C)[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000411125041 940005497 /nfs/dbraw/zinc/00/54/97/940005497.db2.gz JKKWWAAKLWYZOM-CQSZACIVSA-N 1 1 357.410 3.625 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000411124754 940005556 /nfs/dbraw/zinc/00/55/56/940005556.db2.gz ILIXCIWUWDJGFA-GOSISDBHSA-N 1 1 369.421 3.769 20 5 FHBDMO CCC[N@@H+](C[C@H]1CCCCO1)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000411370490 940036505 /nfs/dbraw/zinc/03/65/05/940036505.db2.gz UIZZMGTUBWMRRS-JKSUJKDBSA-N 1 1 363.458 3.511 20 5 FHBDMO Cc1cccc(-c2noc(C[N@H+](C)CCc3cccc([N+](=O)[O-])c3)n2)c1 ZINC000548928758 940049797 /nfs/dbraw/zinc/04/97/97/940049797.db2.gz UFFFYQAWEYCCGH-UHFFFAOYSA-N 1 1 352.394 3.628 20 5 FHBDMO Cc1cccc(-c2noc(C[N@@H+](C)CCc3cccc([N+](=O)[O-])c3)n2)c1 ZINC000548928758 940049801 /nfs/dbraw/zinc/04/98/01/940049801.db2.gz UFFFYQAWEYCCGH-UHFFFAOYSA-N 1 1 352.394 3.628 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCC1([NH+]2CCCCC2)CCOCC1 ZINC000537978764 940094765 /nfs/dbraw/zinc/09/47/65/940094765.db2.gz GDTDUJBISNVNGN-QGZVFWFLSA-N 1 1 361.486 3.589 20 5 FHBDMO C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000411737912 940098164 /nfs/dbraw/zinc/09/81/64/940098164.db2.gz RKCJYWDWVPMUIM-XBXGTLAGSA-N 1 1 373.375 3.976 20 5 FHBDMO C[C@H]1CC[S@](=O)CC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000365478206 940171679 /nfs/dbraw/zinc/17/16/79/940171679.db2.gz RZVWHIBLKYRJME-RZFZLAGVSA-N 1 1 364.492 3.666 20 5 FHBDMO C[C@H]1CC[S@](=O)CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000365478206 940171689 /nfs/dbraw/zinc/17/16/89/940171689.db2.gz RZVWHIBLKYRJME-RZFZLAGVSA-N 1 1 364.492 3.666 20 5 FHBDMO Cc1cc(NC[C@H]2CC[N@H+](C3CC3)C2)c(Br)cc1[N+](=O)[O-] ZINC000235969996 940336245 /nfs/dbraw/zinc/33/62/45/940336245.db2.gz FBRKGBBCXMXHGW-LLVKDONJSA-N 1 1 354.248 3.562 20 5 FHBDMO Cc1ccnc(-c2n[nH]c([C@H](C)[NH2+][C@H](C)c3cc([N+](=O)[O-])ccc3C)n2)c1 ZINC000580511417 940477593 /nfs/dbraw/zinc/47/75/93/940477593.db2.gz FHNNORMDPQEDDD-KGLIPLIRSA-N 1 1 366.425 3.804 20 5 FHBDMO CC(=O)c1ccc(Nc2cccc([C@@H](C)[NH+]3CCOCC3)c2)c([N+](=O)[O-])c1 ZINC000511456408 940488705 /nfs/dbraw/zinc/48/87/05/940488705.db2.gz XSVRTAOARSFODC-CQSZACIVSA-N 1 1 369.421 3.934 20 5 FHBDMO Cc1cccc(C(=O)N2CC[C@H](C)[N@H+](Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000173509636 940632986 /nfs/dbraw/zinc/63/29/86/940632986.db2.gz ZBVFAMBJOAYIKE-KRWDZBQOSA-N 1 1 367.449 3.640 20 5 FHBDMO O=[N+]([O-])c1cnc(NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c(Cl)c1 ZINC000310926896 941011317 /nfs/dbraw/zinc/01/13/17/941011317.db2.gz SGRZLXNSQHMCPS-HNNXBMFYSA-N 1 1 360.845 3.967 20 5 FHBDMO CC(=O)N1CC[C@H](C[N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000180823854 941081862 /nfs/dbraw/zinc/08/18/62/941081862.db2.gz BINYBPADMCFHGK-OAHLLOKOSA-N 1 1 373.478 3.624 20 5 FHBDMO CC(=O)N1CC[C@H](C[N@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000180825816 941082028 /nfs/dbraw/zinc/08/20/28/941082028.db2.gz SFYYZPZBIQUAJK-OAHLLOKOSA-N 1 1 373.478 3.624 20 5 FHBDMO C[C@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccc(N2CCCC2=O)cc1 ZINC000181354894 941131927 /nfs/dbraw/zinc/13/19/27/941131927.db2.gz XMTXMFWUVDIOGD-ZDUSSCGKSA-N 1 1 357.385 3.712 20 5 FHBDMO C[C@@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccc(N2CCCC2=O)cc1 ZINC000181354915 941132001 /nfs/dbraw/zinc/13/20/01/941132001.db2.gz XMTXMFWUVDIOGD-CYBMUJFWSA-N 1 1 357.385 3.712 20 5 FHBDMO CC[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@@H](O)C(F)(F)F ZINC000189865265 941294542 /nfs/dbraw/zinc/29/45/42/941294542.db2.gz NROKPTXSLKGVEP-OAHLLOKOSA-N 1 1 358.316 3.600 20 5 FHBDMO CC[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@@H](O)C(F)(F)F ZINC000189865265 941294544 /nfs/dbraw/zinc/29/45/44/941294544.db2.gz NROKPTXSLKGVEP-OAHLLOKOSA-N 1 1 358.316 3.600 20 5 FHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H](O)Cc1ccccc1C(F)(F)F ZINC000179001159 941329854 /nfs/dbraw/zinc/32/98/54/941329854.db2.gz UUCCQKKLJIJOGF-HNNXBMFYSA-N 1 1 368.355 3.649 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1ccccc1OCC[NH+](C)C ZINC000122340614 941549933 /nfs/dbraw/zinc/54/99/33/941549933.db2.gz VJLAQNKXMZSRPJ-MRXNPFEDSA-N 1 1 357.454 3.694 20 5 FHBDMO C[C@H]1[C@@H](NC(=O)c2cccc(Cl)c2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000311929197 941659274 /nfs/dbraw/zinc/65/92/74/941659274.db2.gz FYFDVNYPJJGVNA-GUYCJALGSA-N 1 1 373.840 3.641 20 5 FHBDMO Cc1cc(N2CC[C@H](C3CC[NH+](C)CC3)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000543046976 941764812 /nfs/dbraw/zinc/76/48/12/941764812.db2.gz SCMGGWPJDILZMA-INIZCTEOSA-N 1 1 354.454 3.620 20 5 FHBDMO CO[C@H](C)C[N@H+](C)[C@@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000513261803 941814950 /nfs/dbraw/zinc/81/49/50/941814950.db2.gz POCKKXRNSVBWOG-DNVCBOLYSA-N 1 1 371.437 3.550 20 5 FHBDMO CO[C@H](C)C[N@@H+](C)[C@@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000513261803 941814955 /nfs/dbraw/zinc/81/49/55/941814955.db2.gz POCKKXRNSVBWOG-DNVCBOLYSA-N 1 1 371.437 3.550 20 5 FHBDMO COc1ccc(C[N@H+](Cc2ccnc(OC(C)C)c2)C2CC2)cc1[N+](=O)[O-] ZINC000513309310 941839817 /nfs/dbraw/zinc/83/98/17/941839817.db2.gz AJUBIJRDCRPWQV-UHFFFAOYSA-N 1 1 371.437 3.950 20 5 FHBDMO COc1ccc(C[N@@H+](Cc2ccnc(OC(C)C)c2)C2CC2)cc1[N+](=O)[O-] ZINC000513309310 941839820 /nfs/dbraw/zinc/83/98/20/941839820.db2.gz AJUBIJRDCRPWQV-UHFFFAOYSA-N 1 1 371.437 3.950 20 5 FHBDMO COc1ccccc1O[C@H]1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000513361368 941869558 /nfs/dbraw/zinc/86/95/58/941869558.db2.gz JNSFQIXHMFTEKZ-SFHVURJKSA-N 1 1 372.421 3.526 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182931261 942009712 /nfs/dbraw/zinc/00/97/12/942009712.db2.gz WDROLWPSPLLOIP-LSDHHAIUSA-N 1 1 360.458 3.678 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182931283 942009861 /nfs/dbraw/zinc/00/98/61/942009861.db2.gz WDROLWPSPLLOIP-HUUCEWRRSA-N 1 1 360.458 3.678 20 5 FHBDMO C[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F)[N@H+]1CCCC[C@@H]1C ZINC000549365741 942060344 /nfs/dbraw/zinc/06/03/44/942060344.db2.gz CCVFDRAJUWRFKD-NWDGAFQWSA-N 1 1 373.375 3.606 20 5 FHBDMO Cc1c(NC(=O)NC(C)(C)C[N@@H+](C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000513671699 942067440 /nfs/dbraw/zinc/06/74/40/942067440.db2.gz LCMROTHZYDLJBK-UHFFFAOYSA-N 1 1 370.453 3.935 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NC(C)(C)C[N@@H+](C)Cc1ccccc1 ZINC000513660975 942070632 /nfs/dbraw/zinc/07/06/32/942070632.db2.gz OWUJYYSEPBQWTR-UHFFFAOYSA-N 1 1 370.453 3.935 20 5 FHBDMO Cc1ccc([C@@]2(C)CC[N@@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000501875667 942098875 /nfs/dbraw/zinc/09/88/75/942098875.db2.gz SAMLZIHXWIZWIM-NRFANRHFSA-N 1 1 367.449 3.895 20 5 FHBDMO CO[C@]1(C)CCC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000280572640 942209768 /nfs/dbraw/zinc/20/97/68/942209768.db2.gz SCIMHMYOSYWRNW-FZKQIMNGSA-N 1 1 360.414 3.597 20 5 FHBDMO CC(C)(C)c1ccc(NC(=O)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000501086744 942291501 /nfs/dbraw/zinc/29/15/01/942291501.db2.gz XAGXIHZBJFVAKI-HUUCEWRRSA-N 1 1 360.458 3.641 20 5 FHBDMO CSc1cccc(C(=O)NCCCC[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-] ZINC000188060088 942318000 /nfs/dbraw/zinc/31/80/00/942318000.db2.gz BHXOZUOEUGVYHQ-CQSZACIVSA-N 1 1 365.499 3.559 20 5 FHBDMO C[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C1CCC(CO)CC1 ZINC000290659694 942337191 /nfs/dbraw/zinc/33/71/91/942337191.db2.gz ZNXYKSPVTWBKEZ-UHFFFAOYSA-N 1 1 361.467 3.701 20 5 FHBDMO O=[N+]([O-])c1cnc(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c(F)c1 ZINC000413131749 942342354 /nfs/dbraw/zinc/34/23/54/942342354.db2.gz AIJCBZLWPBHSPV-MQVJKMGUSA-N 1 1 356.401 3.736 20 5 FHBDMO Cn1ccnc1[C@@H]([NH2+]CCc1cccc(F)c1F)c1cccc([N+](=O)[O-])c1 ZINC000513708733 942348192 /nfs/dbraw/zinc/34/81/92/942348192.db2.gz WOEDNNRAZFOGBU-SFHVURJKSA-N 1 1 372.375 3.528 20 5 FHBDMO CCOCc1cc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)ccc1OC ZINC000549408315 942474804 /nfs/dbraw/zinc/47/48/04/942474804.db2.gz NKSNCHRPVZZJLS-UHFFFAOYSA-N 1 1 358.438 3.814 20 5 FHBDMO O=[N+]([O-])c1cccc(C[N@@H+](CCO)Cc2ccc(Cl)c(Cl)c2)c1 ZINC000502549364 942526949 /nfs/dbraw/zinc/52/69/49/942526949.db2.gz WYDITNHWYPYHOH-UHFFFAOYSA-N 1 1 355.221 3.896 20 5 FHBDMO O=[N+]([O-])c1cccc(C[N@H+](CCO)Cc2ccc(Cl)c(Cl)c2)c1 ZINC000502549364 942526955 /nfs/dbraw/zinc/52/69/55/942526955.db2.gz WYDITNHWYPYHOH-UHFFFAOYSA-N 1 1 355.221 3.896 20 5 FHBDMO Cc1ccccc1CC[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000513755356 942748261 /nfs/dbraw/zinc/74/82/61/942748261.db2.gz RRVGXJFQFANYTO-IBGZPJMESA-N 1 1 350.422 3.558 20 5 FHBDMO Cc1ccc(C[C@@H]2CCC[N@H+]2Cc2cc([N+](=O)[O-])cc3c2OCOC3)cc1 ZINC000513754949 942756321 /nfs/dbraw/zinc/75/63/21/942756321.db2.gz OOXJPNMTOZQJKJ-IBGZPJMESA-N 1 1 368.433 3.977 20 5 FHBDMO Cc1cccc(C(=O)Nc2nc3c(s2)C[N@H+](C(C)(C)C)CC3)c1[N+](=O)[O-] ZINC000425091676 942765769 /nfs/dbraw/zinc/76/57/69/942765769.db2.gz ZFOYEFBQAFYRRZ-UHFFFAOYSA-N 1 1 374.466 3.769 20 5 FHBDMO CC(C)[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000434621144 942793880 /nfs/dbraw/zinc/79/38/80/942793880.db2.gz POBVPDGIWNIWFC-GOSISDBHSA-N 1 1 359.401 3.662 20 5 FHBDMO COc1ccc(OC)c([C@@H]2CCC[N@H+]2CCOc2cccc([N+](=O)[O-])c2)c1 ZINC000514230048 942839812 /nfs/dbraw/zinc/83/98/12/942839812.db2.gz HGLYYDNNFUVNPN-IBGZPJMESA-N 1 1 372.421 3.828 20 5 FHBDMO O=C(c1csc([N+](=O)[O-])c1)N1CC[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000378613919 942959837 /nfs/dbraw/zinc/95/98/37/942959837.db2.gz AHIPUMGSFVLPRX-SJORKVTESA-N 1 1 371.462 3.535 20 5 FHBDMO C[N@H+](CCOc1ccccc1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000434984279 943081261 /nfs/dbraw/zinc/08/12/61/943081261.db2.gz ZXVHTPGIQQNPIX-UHFFFAOYSA-N 1 1 352.337 3.707 20 5 FHBDMO C[N@@H+](CCOc1ccccc1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000434984279 943081274 /nfs/dbraw/zinc/08/12/74/943081274.db2.gz ZXVHTPGIQQNPIX-UHFFFAOYSA-N 1 1 352.337 3.707 20 5 FHBDMO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+]C1CCN(C2CCC2)CC1 ZINC000513789028 943192797 /nfs/dbraw/zinc/19/27/97/943192797.db2.gz BGYOBQOOJATQGF-UZLBHIALSA-N 1 1 357.498 3.913 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000417000741 943283241 /nfs/dbraw/zinc/28/32/41/943283241.db2.gz RSJJVMBCTHCHEO-MRXNPFEDSA-N 1 1 368.437 3.641 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000417000741 943283246 /nfs/dbraw/zinc/28/32/46/943283246.db2.gz RSJJVMBCTHCHEO-MRXNPFEDSA-N 1 1 368.437 3.641 20 5 FHBDMO C[C@H](O)C[N@@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549464172 943336711 /nfs/dbraw/zinc/33/67/11/943336711.db2.gz LGRPHRFIWDRTMZ-ZDUSSCGKSA-N 1 1 368.355 3.997 20 5 FHBDMO CCOc1ccc([C@@H](C)[NH2+]C[C@H](N)c2ccccc2CC)cc1[N+](=O)[O-] ZINC000423513084 943542156 /nfs/dbraw/zinc/54/21/56/943542156.db2.gz VAZADTYVRRBQMQ-KDOFPFPSSA-N 1 1 357.454 3.907 20 5 FHBDMO NC(=O)c1ccc(C[N@@H+]2CCC[C@@H]2c2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000053278720 943578007 /nfs/dbraw/zinc/57/80/07/943578007.db2.gz PGLGBUAVQJNRAH-MRXNPFEDSA-N 1 1 359.813 3.684 20 5 FHBDMO NC(=O)c1ccc(C[N@H+]2CCC[C@@H]2c2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000053278720 943578013 /nfs/dbraw/zinc/57/80/13/943578013.db2.gz PGLGBUAVQJNRAH-MRXNPFEDSA-N 1 1 359.813 3.684 20 5 FHBDMO CC(C)Oc1ccc([C@H](CNCc2csc([N+](=O)[O-])c2)[NH+](C)C)cc1 ZINC000515250259 943586223 /nfs/dbraw/zinc/58/62/23/943586223.db2.gz XTBMDCWJAUYQIP-KRWDZBQOSA-N 1 1 363.483 3.836 20 5 FHBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2NC[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000584790524 943610814 /nfs/dbraw/zinc/61/08/14/943610814.db2.gz QIFKAYXCBJFSNK-PXNSSMCTSA-N 1 1 351.450 3.694 20 5 FHBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000584790524 943610816 /nfs/dbraw/zinc/61/08/16/943610816.db2.gz QIFKAYXCBJFSNK-PXNSSMCTSA-N 1 1 351.450 3.694 20 5 FHBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C[C@@H]1CCN(Cc2ccccc2)C1 ZINC000584790524 943610821 /nfs/dbraw/zinc/61/08/21/943610821.db2.gz QIFKAYXCBJFSNK-PXNSSMCTSA-N 1 1 351.450 3.694 20 5 FHBDMO CC(C)[N@@H+](Cc1ccc(Br)cc1[N+](=O)[O-])C1CCOCC1 ZINC000425411781 943800322 /nfs/dbraw/zinc/80/03/22/943800322.db2.gz DLGGJGUSUWZXBQ-UHFFFAOYSA-N 1 1 357.248 3.747 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[N@@H+](C)C[C@H]1c1ccccc1 ZINC000515403156 943851110 /nfs/dbraw/zinc/85/11/10/943851110.db2.gz MTDHXDGHDNYQEM-IBGZPJMESA-N 1 1 368.437 3.732 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[N@H+](C)C[C@H]1c1ccccc1 ZINC000515403156 943851120 /nfs/dbraw/zinc/85/11/20/943851120.db2.gz MTDHXDGHDNYQEM-IBGZPJMESA-N 1 1 368.437 3.732 20 5 FHBDMO CCC[N@@H+](C)C[C@H]1CCN(Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425428827 943901936 /nfs/dbraw/zinc/90/19/36/943901936.db2.gz YCVOZBOQNIACOV-CYBMUJFWSA-N 1 1 370.291 3.521 20 5 FHBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CCN(CC2CC2)CC1 ZINC000504911713 943907123 /nfs/dbraw/zinc/90/71/23/943907123.db2.gz KHEQCCDEELDJNT-MRXNPFEDSA-N 1 1 363.527 3.930 20 5 FHBDMO O=[N+]([O-])c1cc(Br)ccc1C[NH+]1CCC([C@@H]2CCCO2)CC1 ZINC000425444242 943955782 /nfs/dbraw/zinc/95/57/82/943955782.db2.gz MCOUKBTWZCHIIT-INIZCTEOSA-N 1 1 369.259 3.748 20 5 FHBDMO C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000312614933 943980324 /nfs/dbraw/zinc/98/03/24/943980324.db2.gz ZYYRLKLZOPDTNP-HOCLYGCPSA-N 1 1 370.409 3.826 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21 ZINC000511645712 944001408 /nfs/dbraw/zinc/00/14/08/944001408.db2.gz GXTWPSXOPTZQFT-VAMGGRTRSA-N 1 1 368.433 3.608 20 5 FHBDMO O=[N+]([O-])c1cc(Br)ccc1C[NH2+][C@H](CCO)c1ccccc1 ZINC000425460739 944005572 /nfs/dbraw/zinc/00/55/72/944005572.db2.gz RKTJJOPNXSVZEN-OAHLLOKOSA-N 1 1 365.227 3.571 20 5 FHBDMO O=C(CC[N@H+]1CC[C@H](Cc2ccc(F)cc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000500113363 944128652 /nfs/dbraw/zinc/12/86/52/944128652.db2.gz GMTPFXNMVRFFIM-MRXNPFEDSA-N 1 1 371.412 3.627 20 5 FHBDMO C[C@H]1C[C@H](c2ccc(F)cc2)C[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500126387 944141497 /nfs/dbraw/zinc/14/14/97/944141497.db2.gz RZXVNNFEZGRGKB-HOCLYGCPSA-N 1 1 371.412 3.941 20 5 FHBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CC[C@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000437839598 944171742 /nfs/dbraw/zinc/17/17/42/944171742.db2.gz UZSWBAXAFLOTTN-WBVHZDCISA-N 1 1 353.422 3.547 20 5 FHBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000437839598 944171746 /nfs/dbraw/zinc/17/17/46/944171746.db2.gz UZSWBAXAFLOTTN-WBVHZDCISA-N 1 1 353.422 3.547 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]CCCNCc3cccnc3)o2)c1 ZINC000414881469 944200303 /nfs/dbraw/zinc/20/03/03/944200303.db2.gz RJQAATVSDMSODC-UHFFFAOYSA-N 1 1 366.421 3.519 20 5 FHBDMO Cc1ccc(C[C@H]2CCC[N@H+]2CC(=O)Nc2c(C)cccc2[N+](=O)[O-])cc1 ZINC000500182103 944223542 /nfs/dbraw/zinc/22/35/42/944223542.db2.gz QMIMHPHMVDCGTK-GOSISDBHSA-N 1 1 367.449 3.857 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC000436376802 944245802 /nfs/dbraw/zinc/24/58/02/944245802.db2.gz DAKLJHOASHYYPJ-KRWDZBQOSA-N 1 1 360.458 3.822 20 5 FHBDMO O=[N+]([O-])c1cnc(N2CC[C@@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)c(F)c1 ZINC000518336046 944282963 /nfs/dbraw/zinc/28/29/63/944282963.db2.gz OZHKIBZPKFHQFI-QFBILLFUSA-N 1 1 370.428 3.620 20 5 FHBDMO COC(=O)c1cc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cs1 ZINC000894579107 944284456 /nfs/dbraw/zinc/28/44/56/944284456.db2.gz DUQZYSPWBIDYSJ-UHFFFAOYSA-N 1 1 374.340 3.752 20 5 FHBDMO O=[N+]([O-])c1ccc(Cl)c(CNc2ccc(C[NH+]3CCOCC3)cc2)c1 ZINC000123269635 944322481 /nfs/dbraw/zinc/32/24/81/944322481.db2.gz RFUAGCSSGYHUOQ-UHFFFAOYSA-N 1 1 361.829 3.693 20 5 FHBDMO CN(C(=O)C[N@@H+]1CCC[C@H]1/C=C\c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000505825147 944332320 /nfs/dbraw/zinc/33/23/20/944332320.db2.gz KGFKFIKRCDUBNY-VJIACCKLSA-N 1 1 365.433 3.735 20 5 FHBDMO CN(C(=O)C[N@H+]1CCC[C@H]1/C=C\c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000505825147 944332328 /nfs/dbraw/zinc/33/23/28/944332328.db2.gz KGFKFIKRCDUBNY-VJIACCKLSA-N 1 1 365.433 3.735 20 5 FHBDMO C[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000518474000 944413532 /nfs/dbraw/zinc/41/35/32/944413532.db2.gz QZVGDWRBCGVSRC-DLBZAZTESA-N 1 1 367.232 3.992 20 5 FHBDMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000518474000 944413535 /nfs/dbraw/zinc/41/35/35/944413535.db2.gz QZVGDWRBCGVSRC-DLBZAZTESA-N 1 1 367.232 3.992 20 5 FHBDMO C[C@H]1[C@@H](CO)CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000425960791 944414357 /nfs/dbraw/zinc/41/43/57/944414357.db2.gz YWKAEBMJRIQEJL-NWDGAFQWSA-N 1 1 350.802 3.711 20 5 FHBDMO C[C@@H]1C[C@H](c2ccccc2)CC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000439324325 944537143 /nfs/dbraw/zinc/53/71/43/944537143.db2.gz RZIKNSXFMUZXKC-SJLPKXTDSA-N 1 1 367.449 3.826 20 5 FHBDMO C[C@H]1C[C@H](c2ccccc2)CC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000439324324 944537480 /nfs/dbraw/zinc/53/74/80/944537480.db2.gz RZIKNSXFMUZXKC-FUHWJXTLSA-N 1 1 367.449 3.826 20 5 FHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H]1CCCc2ccccc21 ZINC000015291597 944593146 /nfs/dbraw/zinc/59/31/46/944593146.db2.gz YUWUVQMTORNETA-IBGZPJMESA-N 1 1 354.406 3.971 20 5 FHBDMO C[C@H](C[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)c1ccccc1 ZINC000066853632 944636732 /nfs/dbraw/zinc/63/67/32/944636732.db2.gz GOIMDXGNUWZJMP-CQSZACIVSA-N 1 1 352.394 3.880 20 5 FHBDMO C[N@@H+](CCCOCc1ccccc1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000439482653 944682877 /nfs/dbraw/zinc/68/28/77/944682877.db2.gz XKWZWAWEBVJOKX-UHFFFAOYSA-N 1 1 355.394 3.775 20 5 FHBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@](C)(c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000438490133 944684338 /nfs/dbraw/zinc/68/43/38/944684338.db2.gz KNLWHRUPYALTHN-NRFANRHFSA-N 1 1 367.449 3.895 20 5 FHBDMO CC(C)[C@H]1CC[N@@H+](CC(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)C1 ZINC000438491645 944684386 /nfs/dbraw/zinc/68/43/86/944684386.db2.gz NEFKQRCJNKGYDS-AWEZNQCLSA-N 1 1 374.466 3.635 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@](C)(c2ccccc2)C1 ZINC000438498693 944694124 /nfs/dbraw/zinc/69/41/24/944694124.db2.gz FVFGJFBIQSNDGL-NRFANRHFSA-N 1 1 367.449 3.895 20 5 FHBDMO CC(C)[N@@H+](CCC(=O)Nc1cccc(F)c1)Cc1ccc([N+](=O)[O-])cc1 ZINC000517842323 944704780 /nfs/dbraw/zinc/70/47/80/944704780.db2.gz SWTYCLJHQPLRRP-UHFFFAOYSA-N 1 1 359.401 3.973 20 5 FHBDMO C[C@@]1(c2ccccc2)CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000438505723 944713531 /nfs/dbraw/zinc/71/35/31/944713531.db2.gz NYJWIWSUNIOFEZ-HXUWFJFHSA-N 1 1 353.422 3.587 20 5 FHBDMO Cc1ccc(NC(=O)N[C@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000506278903 944774828 /nfs/dbraw/zinc/77/48/28/944774828.db2.gz CKSLUBVUUINLSC-YJBOKZPZSA-N 1 1 368.437 3.860 20 5 FHBDMO CCOc1cccc(NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000388535084 944798379 /nfs/dbraw/zinc/79/83/79/944798379.db2.gz PINDLUSTXUJZAK-KRWDZBQOSA-N 1 1 355.438 3.928 20 5 FHBDMO COc1ccc(C[N@H+]2CC=C(c3c[nH]c4ncccc34)CC2)cc1[N+](=O)[O-] ZINC000506652942 944909070 /nfs/dbraw/zinc/90/90/70/944909070.db2.gz IIFKBSBKTZWQBL-UHFFFAOYSA-N 1 1 364.405 3.769 20 5 FHBDMO COc1ccc(C[N@@H+]2CC=C(c3c[nH]c4ncccc34)CC2)cc1[N+](=O)[O-] ZINC000506652942 944909076 /nfs/dbraw/zinc/90/90/76/944909076.db2.gz IIFKBSBKTZWQBL-UHFFFAOYSA-N 1 1 364.405 3.769 20 5 FHBDMO Cn1cc(C[N@H+](C)Cc2ccc(F)cc2F)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000506323287 944911094 /nfs/dbraw/zinc/91/10/94/944911094.db2.gz CHWCMGIPEBVYJX-UHFFFAOYSA-N 1 1 372.375 3.906 20 5 FHBDMO Cn1cc(C[N@@H+](C)Cc2ccc(F)cc2F)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000506323287 944911103 /nfs/dbraw/zinc/91/11/03/944911103.db2.gz CHWCMGIPEBVYJX-UHFFFAOYSA-N 1 1 372.375 3.906 20 5 FHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2cnn(CC(F)(F)F)c2)C2CC2)cc1 ZINC000507153895 945003081 /nfs/dbraw/zinc/00/30/81/945003081.db2.gz GBJFBLXBTIXDDZ-UHFFFAOYSA-N 1 1 354.332 3.518 20 5 FHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cnn(CC(F)(F)F)c2)C2CC2)cc1 ZINC000507153895 945003089 /nfs/dbraw/zinc/00/30/89/945003089.db2.gz GBJFBLXBTIXDDZ-UHFFFAOYSA-N 1 1 354.332 3.518 20 5 FHBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](C[N@@H+](C)CC)C1 ZINC000506701374 945033401 /nfs/dbraw/zinc/03/34/01/945033401.db2.gz YSKLXUAANZZHCJ-AWEZNQCLSA-N 1 1 365.499 3.511 20 5 FHBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](C[N@@H+](C)CC)C1 ZINC000506701375 945033778 /nfs/dbraw/zinc/03/37/78/945033778.db2.gz YSKLXUAANZZHCJ-CQSZACIVSA-N 1 1 365.499 3.511 20 5 FHBDMO COc1cc(C[N@H+]2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)ccc1[N+](=O)[O-] ZINC000511764167 945058907 /nfs/dbraw/zinc/05/89/07/945058907.db2.gz CTZRCGASKIFJDI-GUDVDZBRSA-N 1 1 368.433 3.608 20 5 FHBDMO Cc1cc(N2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549524982 945604875 /nfs/dbraw/zinc/60/48/75/945604875.db2.gz OYFYHCVGWNQEHN-TZMCWYRMSA-N 1 1 357.376 3.843 20 5 FHBDMO Cc1sc(C(=O)NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000067361450 945720868 /nfs/dbraw/zinc/72/08/68/945720868.db2.gz DDPSOYUGQMKQAJ-INIZCTEOSA-N 1 1 373.478 3.607 20 5 FHBDMO O=[N+]([O-])c1ccccc1OCCN1CCC(C[NH+]2CCCCCC2)CC1 ZINC000108103646 945860309 /nfs/dbraw/zinc/86/03/09/945860309.db2.gz PKZQVFCMEFYZQT-UHFFFAOYSA-N 1 1 361.486 3.562 20 5 FHBDMO COc1cc(N2CCC[C@H](c3[nH+]cc4n3CCCC4)C2)ccc1[N+](=O)[O-] ZINC000281834637 945882283 /nfs/dbraw/zinc/88/22/83/945882283.db2.gz IMWPSVZDERRNIO-AWEZNQCLSA-N 1 1 356.426 3.520 20 5 FHBDMO C[C@@H]1C[N@H+](CCCNc2ccc([N+](=O)[O-])cc2C(F)(F)F)C[C@H](C)O1 ZINC000108931074 946085537 /nfs/dbraw/zinc/08/55/37/946085537.db2.gz RWNXBGABIFRIRA-TXEJJXNPSA-N 1 1 361.364 3.525 20 5 FHBDMO CCOc1ccc(NC(=O)C[N@H+]2[C@H](C)C[C@H]3CCCC[C@@H]32)c([N+](=O)[O-])c1 ZINC000444240755 946117138 /nfs/dbraw/zinc/11/71/38/946117138.db2.gz DGGAWPPBKJCSDC-CPUCHLNUSA-N 1 1 361.442 3.585 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@H]1CCc2ccccc21 ZINC000109095075 946137398 /nfs/dbraw/zinc/13/73/98/946137398.db2.gz VAYVCOOURPUPOI-IBGZPJMESA-N 1 1 353.422 3.851 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)c1ccc(Br)cn1 ZINC000475500979 946502020 /nfs/dbraw/zinc/50/20/20/946502020.db2.gz IFAHDIBJSKNGNX-LLVKDONJSA-N 1 1 350.216 3.912 20 5 FHBDMO CC[C@H](Cc1ccc(C)cc1)[N@@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000441373794 946525427 /nfs/dbraw/zinc/52/54/27/946525427.db2.gz FKQDDZMRJSKOEA-UYAOXDASSA-N 1 1 372.465 3.596 20 5 FHBDMO COc1cc(OC)c(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)c(OC)c1 ZINC000164416270 946597758 /nfs/dbraw/zinc/59/77/58/946597758.db2.gz YKUYZOVMLZBAON-CYBMUJFWSA-N 1 1 360.410 3.780 20 5 FHBDMO CN(C(=O)c1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475544918 946628481 /nfs/dbraw/zinc/62/84/81/946628481.db2.gz WVIKEPPRPMBOTR-MRXNPFEDSA-N 1 1 373.840 3.595 20 5 FHBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCC(C)(C)[N@H+]1CCC[C@H](C)C1 ZINC000475544516 946628691 /nfs/dbraw/zinc/62/86/91/946628691.db2.gz GNFLIVXYOFLGKT-ZDUSSCGKSA-N 1 1 362.474 3.844 20 5 FHBDMO COc1cccc([C@@H](CNCc2cc([N+](=O)[O-])ccc2Cl)[NH+](C)C)c1 ZINC000237310114 946717156 /nfs/dbraw/zinc/71/71/56/946717156.db2.gz MJZBJDXRYDATLQ-GOSISDBHSA-N 1 1 363.845 3.649 20 5 FHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)[C@@H]1CCN(c2ccccc2F)C1=O ZINC000112360107 946861829 /nfs/dbraw/zinc/86/18/29/946861829.db2.gz GQMDPXGIZDQCIT-FZKQIMNGSA-N 1 1 357.385 3.532 20 5 FHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)[C@@H]1CCN(c2ccccc2F)C1=O ZINC000112360107 946861840 /nfs/dbraw/zinc/86/18/40/946861840.db2.gz GQMDPXGIZDQCIT-FZKQIMNGSA-N 1 1 357.385 3.532 20 5 FHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](CNC(=O)c2ccccc2)C1 ZINC000248368845 946874169 /nfs/dbraw/zinc/87/41/69/946874169.db2.gz VQJBPLNAMOLDAQ-IRXDYDNUSA-N 1 1 367.449 3.798 20 5 FHBDMO CN(C(=O)c1cc(Cl)cc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475314302 946874223 /nfs/dbraw/zinc/87/42/23/946874223.db2.gz SSANQFAQMWUNFJ-KRWDZBQOSA-N 1 1 373.840 3.595 20 5 FHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](CNC(=O)c2ccccc2)C1 ZINC000248368846 946874355 /nfs/dbraw/zinc/87/43/55/946874355.db2.gz VQJBPLNAMOLDAQ-SJORKVTESA-N 1 1 367.449 3.798 20 5 FHBDMO Cc1cc(C(=O)N[C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc([N+](=O)[O-])c1 ZINC000487386268 946919863 /nfs/dbraw/zinc/91/98/63/946919863.db2.gz GLKKGAOOGVUPJV-FUHWJXTLSA-N 1 1 367.449 3.544 20 5 FHBDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000523343649 947163330 /nfs/dbraw/zinc/16/33/30/947163330.db2.gz UGBDOZQSKYJMLW-AWEZNQCLSA-N 1 1 365.499 3.701 20 5 FHBDMO O=[N+]([O-])c1cccc(OCC[N@H+](Cc2ccccc2)CC2CCOCC2)c1 ZINC000523608402 947414005 /nfs/dbraw/zinc/41/40/05/947414005.db2.gz CRYKJHYXMJUJBN-UHFFFAOYSA-N 1 1 370.449 3.902 20 5 FHBDMO Cc1ccccc1[C@H]1C[N@H+](CCOc2cccc([N+](=O)[O-])c2)[C@@H](C)CO1 ZINC000441447939 947486210 /nfs/dbraw/zinc/48/62/10/947486210.db2.gz FIPLZFSSYGSQPV-OXJNMPFZSA-N 1 1 356.422 3.744 20 5 FHBDMO Cc1ccccc1[C@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)[C@@H](C)CO1 ZINC000441447939 947486219 /nfs/dbraw/zinc/48/62/19/947486219.db2.gz FIPLZFSSYGSQPV-OXJNMPFZSA-N 1 1 356.422 3.744 20 5 FHBDMO Cc1cccc(C(=O)N2C[C@@H](C)[N@@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000500437613 947536813 /nfs/dbraw/zinc/53/68/13/947536813.db2.gz APDQSCDPJRTGDP-SJORKVTESA-N 1 1 367.449 3.638 20 5 FHBDMO Cc1cccc(C(=O)N2C[C@@H](C)[N@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000500437613 947536819 /nfs/dbraw/zinc/53/68/19/947536819.db2.gz APDQSCDPJRTGDP-SJORKVTESA-N 1 1 367.449 3.638 20 5 FHBDMO C[C@H](O)C[C@@H]1CCCCC[N@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000567965799 947542936 /nfs/dbraw/zinc/54/29/36/947542936.db2.gz CBLIXRRLSGWJGE-KXBFYZLASA-N 1 1 372.469 3.511 20 5 FHBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000072837842 947570272 /nfs/dbraw/zinc/57/02/72/947570272.db2.gz FWTLPJGRGMSPPV-GDBMZVCRSA-N 1 1 365.499 3.838 20 5 FHBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000072837801 947570613 /nfs/dbraw/zinc/57/06/13/947570613.db2.gz UORBXCABYGZWPT-YPMHNXCESA-N 1 1 371.890 3.793 20 5 FHBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000072837797 947570716 /nfs/dbraw/zinc/57/07/16/947570716.db2.gz UORBXCABYGZWPT-DGCLKSJQSA-N 1 1 371.890 3.793 20 5 FHBDMO Cc1cc(C(=O)N2C[C@@H](C)[N@@H+](Cc3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000500441175 947803621 /nfs/dbraw/zinc/80/36/21/947803621.db2.gz XOQSSTCLYBLGGQ-IAGOWNOFSA-N 1 1 367.449 3.638 20 5 FHBDMO Cc1cc(C(=O)N2C[C@@H](C)[N@H+](Cc3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000500441175 947803628 /nfs/dbraw/zinc/80/36/28/947803628.db2.gz XOQSSTCLYBLGGQ-IAGOWNOFSA-N 1 1 367.449 3.638 20 5 FHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000278870514 947898862 /nfs/dbraw/zinc/89/88/62/947898862.db2.gz SOFUDTVCHFJJDT-QWRGUYRKSA-N 1 1 370.331 3.980 20 5 FHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000278870514 947898867 /nfs/dbraw/zinc/89/88/67/947898867.db2.gz SOFUDTVCHFJJDT-QWRGUYRKSA-N 1 1 370.331 3.980 20 5 FHBDMO CCc1ccc(C(=O)NC[C@H]2CCC[N@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC001126286502 948059364 /nfs/dbraw/zinc/05/93/64/948059364.db2.gz QKZAEHDHAMHWNN-LJQANCHMSA-N 1 1 367.449 3.552 20 5 FHBDMO O=[N+]([O-])c1cccc2c(N3CCC[N@@H+](Cc4ccccc4)CC3)ccnc21 ZINC000432339950 948163257 /nfs/dbraw/zinc/16/32/57/948163257.db2.gz VKMANLZIMYJYGQ-UHFFFAOYSA-N 1 1 362.433 3.855 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CCCCC[C@H]3CCO)cs2)c1 ZINC000585767832 948278765 /nfs/dbraw/zinc/27/87/65/948278765.db2.gz HVXQAWOCJVTQDD-INIZCTEOSA-N 1 1 361.467 3.845 20 5 FHBDMO CC[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)Cc1c[nH]c2ccccc12 ZINC000190463432 948456129 /nfs/dbraw/zinc/45/61/29/948456129.db2.gz AZDZMUARUBRJKE-UHFFFAOYSA-N 1 1 366.421 3.845 20 5 FHBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CCc1ccccc1O ZINC000574840689 948566620 /nfs/dbraw/zinc/56/66/20/948566620.db2.gz RQPVBOSJLGOMSZ-UHFFFAOYSA-N 1 1 367.405 3.672 20 5 FHBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C1 ZINC000090100066 948618136 /nfs/dbraw/zinc/61/81/36/948618136.db2.gz XTZVZKDFTFTLAV-INIZCTEOSA-N 1 1 354.454 3.825 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CC4C[C@@H]5CC3C[C@H](C4)C5)c2)cc1 ZINC000728898966 948724696 /nfs/dbraw/zinc/72/46/96/948724696.db2.gz AHDXPPFWHQWSEZ-OZSOSCRKSA-N 1 1 352.438 3.926 20 5 FHBDMO NC(=O)c1ccc(C[N@@H+]2CCC[C@@H]2c2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC000053157941 221042970 /nfs/dbraw/zinc/04/29/70/221042970.db2.gz FZXICKDDCQBNNA-MRXNPFEDSA-N 1 1 359.813 3.684 20 5 FHBDMO NC(=O)c1ccc(C[N@H+]2CCC[C@@H]2c2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC000053157941 221042972 /nfs/dbraw/zinc/04/29/72/221042972.db2.gz FZXICKDDCQBNNA-MRXNPFEDSA-N 1 1 359.813 3.684 20 5 FHBDMO C[N@H+]1CCCC[C@@H]1CCC(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000452853527 567819005 /nfs/dbraw/zinc/81/90/05/567819005.db2.gz NVSQNIFMPIVLTJ-QZTJIDSGSA-N 1 1 359.470 3.565 20 5 FHBDMO CC[C@@](C)([NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1nc(C)cs1 ZINC000072865013 567840997 /nfs/dbraw/zinc/84/09/97/567840997.db2.gz UHYDFCZLJSSTNS-QGZVFWFLSA-N 1 1 362.455 3.522 20 5 FHBDMO CC[C@@H]1[C@@H](C)CC[N@H+]1CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000481375836 567863547 /nfs/dbraw/zinc/86/35/47/567863547.db2.gz QUMGOQBMUGOXPB-BLLLJJGKSA-N 1 1 374.466 3.777 20 5 FHBDMO COc1ccc(CN2C[C@@H]3CCC[N@H+]3Cc3ccccc32)cc1[N+](=O)[O-] ZINC000568148602 567946762 /nfs/dbraw/zinc/94/67/62/567946762.db2.gz DUZZFBFRGHSQFD-KRWDZBQOSA-N 1 1 353.422 3.588 20 5 FHBDMO O=[N+]([O-])c1ccc(CN[C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)cc1 ZINC000568510377 568051713 /nfs/dbraw/zinc/05/17/13/568051713.db2.gz WDXYPODSNBRIIP-IBGZPJMESA-N 1 1 351.450 3.882 20 5 FHBDMO O=[N+]([O-])c1ccc(CN[C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)cc1 ZINC000568510377 568051714 /nfs/dbraw/zinc/05/17/14/568051714.db2.gz WDXYPODSNBRIIP-IBGZPJMESA-N 1 1 351.450 3.882 20 5 FHBDMO CCSCC[C@@H](C)[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000072900599 568056829 /nfs/dbraw/zinc/05/68/29/568056829.db2.gz UVQBKAOVLFWGPB-CQSZACIVSA-N 1 1 353.488 3.695 20 5 FHBDMO COc1cc(C[N@H+]2CCCC[C@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000481597703 568064151 /nfs/dbraw/zinc/06/41/51/568064151.db2.gz MSCCPZOLAIHALC-LBPRGKRZSA-N 1 1 358.385 3.869 20 5 FHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCC[C@]4(C3)OCc3ccccc34)nc2c1 ZINC000481686647 568089011 /nfs/dbraw/zinc/08/90/11/568089011.db2.gz JHDXVQTUXDIJIK-HXUWFJFHSA-N 1 1 365.389 3.758 20 5 FHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@]4(C3)OCc3ccccc34)nc2c1 ZINC000481686647 568089012 /nfs/dbraw/zinc/08/90/12/568089012.db2.gz JHDXVQTUXDIJIK-HXUWFJFHSA-N 1 1 365.389 3.758 20 5 FHBDMO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000481738701 568099855 /nfs/dbraw/zinc/09/98/55/568099855.db2.gz FGOMTDQPCFBJCX-YGRLFVJLSA-N 1 1 360.332 3.624 20 5 FHBDMO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000481738701 568099856 /nfs/dbraw/zinc/09/98/56/568099856.db2.gz FGOMTDQPCFBJCX-YGRLFVJLSA-N 1 1 360.332 3.624 20 5 FHBDMO NC(=O)c1ccc(C[N@H+]2CC=C(c3cccc(Cl)c3)CC2)c([N+](=O)[O-])c1 ZINC000481755631 568114076 /nfs/dbraw/zinc/11/40/76/568114076.db2.gz KYGAZELKSWGZIO-UHFFFAOYSA-N 1 1 371.824 3.636 20 5 FHBDMO NC(=O)c1ccc(C[N@@H+]2CC=C(c3cccc(Cl)c3)CC2)c([N+](=O)[O-])c1 ZINC000481755631 568114077 /nfs/dbraw/zinc/11/40/77/568114077.db2.gz KYGAZELKSWGZIO-UHFFFAOYSA-N 1 1 371.824 3.636 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(N2CC[C@@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)n1 ZINC000481990158 568215905 /nfs/dbraw/zinc/21/59/05/568215905.db2.gz IMRIFKHGDOQNAD-RTBURBONSA-N 1 1 366.465 3.789 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)Cc1c(F)cccc1F ZINC000568888291 568248224 /nfs/dbraw/zinc/24/82/24/568248224.db2.gz IEJCTCKHTTZVGO-UHFFFAOYSA-N 1 1 363.364 3.642 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)Cc1c(F)cccc1F ZINC000568888291 568248225 /nfs/dbraw/zinc/24/82/25/568248225.db2.gz IEJCTCKHTTZVGO-UHFFFAOYSA-N 1 1 363.364 3.642 20 5 FHBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CC([N@@H+](C)Cc2ccccc2)C1 ZINC000482134031 568278653 /nfs/dbraw/zinc/27/86/53/568278653.db2.gz VVGOWRMXRAPLLY-UHFFFAOYSA-N 1 1 368.437 3.560 20 5 FHBDMO CC(C)([NH2+]Cc1cncc(Br)c1)c1ccccc1[N+](=O)[O-] ZINC000291731785 568283174 /nfs/dbraw/zinc/28/31/74/568283174.db2.gz NXEKYVNICQEJER-UHFFFAOYSA-N 1 1 350.216 3.777 20 5 FHBDMO Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)[NH2+]Cc1cc([O-])ccc1[N+](=O)[O-] ZINC000569128270 568285397 /nfs/dbraw/zinc/28/53/97/568285397.db2.gz HSPWLPGELKPJRW-VIFPVBQESA-N 1 1 372.347 3.527 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])c(N2C[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@H]3C2)n1 ZINC000569635369 568411558 /nfs/dbraw/zinc/41/15/58/568411558.db2.gz ZXTKKOIPHFGFSW-OALUTQOASA-N 1 1 366.465 3.565 20 5 FHBDMO COc1ccccc1[C@@H](CO)[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000569908212 568435767 /nfs/dbraw/zinc/43/57/67/568435767.db2.gz SLRKULOYJYWWDY-QZTJIDSGSA-N 1 1 356.422 3.649 20 5 FHBDMO COc1ccc(-c2ccc(C[N@@H+](C)[C@@H](CO)CC(C)C)o2)c([N+](=O)[O-])c1 ZINC000570008898 568449425 /nfs/dbraw/zinc/44/94/25/568449425.db2.gz JXSMKXKNJBXBGU-CQSZACIVSA-N 1 1 362.426 3.702 20 5 FHBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NC[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000570153776 568455253 /nfs/dbraw/zinc/45/52/53/568455253.db2.gz OGICLCPRHRBLBF-AWEZNQCLSA-N 1 1 367.877 3.654 20 5 FHBDMO CC(=Cc1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1 ZINC000570248024 568466321 /nfs/dbraw/zinc/46/63/21/568466321.db2.gz HOEHNFIBCAIBQF-IDKBZEPQSA-N 1 1 367.453 3.873 20 5 FHBDMO CC(=Cc1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1 ZINC000570248024 568466322 /nfs/dbraw/zinc/46/63/22/568466322.db2.gz HOEHNFIBCAIBQF-IDKBZEPQSA-N 1 1 367.453 3.873 20 5 FHBDMO CC(=Cc1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1 ZINC000570248024 568466323 /nfs/dbraw/zinc/46/63/23/568466323.db2.gz HOEHNFIBCAIBQF-IDKBZEPQSA-N 1 1 367.453 3.873 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)cc(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)n1 ZINC001164626766 719072429 /nfs/dbraw/zinc/07/24/29/719072429.db2.gz PHEDDXDEBNGHOS-WBVHZDCISA-N 1 1 372.856 3.744 20 5 FHBDMO O=[N+]([O-])c1ccc(N2CC3(C2)CC[N@@H+](CC2CC2)C3)nc1-c1ccccc1 ZINC001164775021 721302626 /nfs/dbraw/zinc/30/26/26/721302626.db2.gz MRQDMZYMQHBKHB-UHFFFAOYSA-N 1 1 364.449 3.579 20 5 FHBDMO Cc1nc(N2CCC[C@]3(CC[N@H+]3Cc3cccc(F)c3)C2)ccc1[N+](=O)[O-] ZINC001164995769 722191859 /nfs/dbraw/zinc/19/18/59/722191859.db2.gz XVSQODHHKPHIDQ-FQEVSTJZSA-N 1 1 370.428 3.682 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)c1cccc(N2CCCC2=O)c1 ZINC000430193637 927781091 /nfs/dbraw/zinc/78/10/91/927781091.db2.gz GVVCCBAEGUFILR-CQSZACIVSA-N 1 1 369.421 3.581 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000430210617 928101217 /nfs/dbraw/zinc/10/12/17/928101217.db2.gz FAJHBEPGUOOGTD-QGZVFWFLSA-N 1 1 370.405 3.712 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000430210617 928101219 /nfs/dbraw/zinc/10/12/19/928101219.db2.gz FAJHBEPGUOOGTD-QGZVFWFLSA-N 1 1 370.405 3.712 20 5 FHBDMO COCCOc1cccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000126981517 928360880 /nfs/dbraw/zinc/36/08/80/928360880.db2.gz UPMLENLNMWGVAT-UHFFFAOYSA-N 1 1 356.422 3.785 20 5 FHBDMO COc1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c(OC)c1OC ZINC000127057391 928452834 /nfs/dbraw/zinc/45/28/34/928452834.db2.gz OBEITFPRSHVINV-UHFFFAOYSA-N 1 1 372.421 3.785 20 5 FHBDMO COc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c(OC)c1OC ZINC000127057391 928452838 /nfs/dbraw/zinc/45/28/38/928452838.db2.gz OBEITFPRSHVINV-UHFFFAOYSA-N 1 1 372.421 3.785 20 5 FHBDMO CC(C)Oc1cccc(C[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000535968140 937259418 /nfs/dbraw/zinc/25/94/18/937259418.db2.gz DUPAIXDXHADHFC-UHFFFAOYSA-N 1 1 371.437 3.843 20 5 FHBDMO CS[C@H]1CCCC[N@@H+]([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000134597044 929094574 /nfs/dbraw/zinc/09/45/74/929094574.db2.gz RVNDGOGIZPGLNN-YPMHNXCESA-N 1 1 371.890 3.793 20 5 FHBDMO CS[C@H]1CCCC[N@H+]([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000134597044 929094579 /nfs/dbraw/zinc/09/45/79/929094579.db2.gz RVNDGOGIZPGLNN-YPMHNXCESA-N 1 1 371.890 3.793 20 5 FHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](C(=O)N(C)c2ccccc2)C1 ZINC000430294688 929355289 /nfs/dbraw/zinc/35/52/89/929355289.db2.gz BLFKUKXVPKGCQL-JKSUJKDBSA-N 1 1 353.422 3.641 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1[C@H](C)C[C@H]2CCCC[C@@H]21 ZINC000118850477 929764030 /nfs/dbraw/zinc/76/40/30/929764030.db2.gz HXWGOGHTMDVQDL-CPUCHLNUSA-N 1 1 361.442 3.585 20 5 FHBDMO CC(=O)NC[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000155524480 929893081 /nfs/dbraw/zinc/89/30/81/929893081.db2.gz FONDTESGISPJMY-OAHLLOKOSA-N 1 1 373.478 3.671 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@H](n2cnc3c2CCCC3)C1 ZINC000548010745 929937026 /nfs/dbraw/zinc/93/70/26/929937026.db2.gz ZLMXMRYKPIIJSA-WBVHZDCISA-N 1 1 354.454 3.987 20 5 FHBDMO CC[C@@H]1c2ccccc2CC[N@@H+]1CCOc1ccc(OC)cc1[N+](=O)[O-] ZINC000610369660 930173302 /nfs/dbraw/zinc/17/33/02/930173302.db2.gz RLMLHTILDPKGHB-GOSISDBHSA-N 1 1 356.422 3.992 20 5 FHBDMO CCO[C@@H]1C[C@H]([N@@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1(C)C ZINC000536363696 930476785 /nfs/dbraw/zinc/47/67/85/930476785.db2.gz QUUZHSTYCIFTSX-DLBZAZTESA-N 1 1 359.426 3.885 20 5 FHBDMO C[N@H+]1CCC[C@@H]2CN(Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)CC[C@H]21 ZINC000247271722 930679351 /nfs/dbraw/zinc/67/93/51/930679351.db2.gz YCXAXBGOLZOCBW-CRAIPNDOSA-N 1 1 372.494 3.634 20 5 FHBDMO Cc1[nH+]ccn1-c1ccc([C@H](C)NC(=O)c2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000119310220 931068526 /nfs/dbraw/zinc/06/85/26/931068526.db2.gz XDIOCNYITSMVIG-LBPRGKRZSA-N 1 1 368.368 3.719 20 5 FHBDMO Cc1ccc([C@H](C)NC(=O)[C@@H]2CC[N@H+](C3CCCCC3)C2)cc1[N+](=O)[O-] ZINC000177837324 931266588 /nfs/dbraw/zinc/26/65/88/931266588.db2.gz JTFKNMDEOHLRBD-DOTOQJQBSA-N 1 1 359.470 3.735 20 5 FHBDMO O=C(c1ccc([O-])cc1)C1CCN(Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000610481356 931589904 /nfs/dbraw/zinc/58/99/04/931589904.db2.gz NQDFTBSXLJDARE-UHFFFAOYSA-N 1 1 358.369 3.534 20 5 FHBDMO Cc1ccccc1NC(=O)CC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000135236500 932085838 /nfs/dbraw/zinc/08/58/38/932085838.db2.gz JMAWZFHEQBUYJJ-UHFFFAOYSA-N 1 1 353.422 3.896 20 5 FHBDMO CC1(C)[C@H](C(F)(F)F)CC[N@@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000276228648 932114774 /nfs/dbraw/zinc/11/47/74/932114774.db2.gz KBFQMFSNHZCDLH-GFCCVEGCSA-N 1 1 370.331 3.808 20 5 FHBDMO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000276228648 932114780 /nfs/dbraw/zinc/11/47/80/932114780.db2.gz KBFQMFSNHZCDLH-GFCCVEGCSA-N 1 1 370.331 3.808 20 5 FHBDMO COc1cc(F)c([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])c(F)c2)cc1OC ZINC000276295369 932147661 /nfs/dbraw/zinc/14/76/61/932147661.db2.gz IUJANRZQQXXFQO-SNVBAGLBSA-N 1 1 352.337 3.741 20 5 FHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](c2nnc3ccccn32)C1 ZINC000076397372 932377281 /nfs/dbraw/zinc/37/72/81/932377281.db2.gz BOQWALBPCAAMPH-HOCLYGCPSA-N 1 1 351.410 3.578 20 5 FHBDMO CCC[N@H+](CC(=O)Nc1ccccc1OC)Cc1cccc([N+](=O)[O-])c1C ZINC000051255900 932761242 /nfs/dbraw/zinc/76/12/42/932761242.db2.gz UKTKXPUCQZUCFM-UHFFFAOYSA-N 1 1 371.437 3.763 20 5 FHBDMO CCC[N@@H+](CC(=O)Nc1ccccc1OC)Cc1cccc([N+](=O)[O-])c1C ZINC000051255900 932761246 /nfs/dbraw/zinc/76/12/46/932761246.db2.gz UKTKXPUCQZUCFM-UHFFFAOYSA-N 1 1 371.437 3.763 20 5 FHBDMO CCc1ccc([C@H]([NH2+]CCOCC(F)F)c2ccc([N+](=O)[O-])cc2)o1 ZINC000471763814 932827851 /nfs/dbraw/zinc/82/78/51/932827851.db2.gz XOWBROIZTDUOCV-QGZVFWFLSA-N 1 1 354.353 3.711 20 5 FHBDMO C[C@H]1C[C@@H](O)C[N@H+]1Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000471809714 932992523 /nfs/dbraw/zinc/99/25/23/932992523.db2.gz MKRIFOFYFKHGOI-SWLSCSKDSA-N 1 1 362.813 3.996 20 5 FHBDMO C[C@H]1C[C@H](O)C[N@H+]1Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000471809716 932992811 /nfs/dbraw/zinc/99/28/11/932992811.db2.gz MKRIFOFYFKHGOI-WFASDCNBSA-N 1 1 362.813 3.996 20 5 FHBDMO COc1ccc(-c2ccc(C[N@@H+]3CCO[C@@H]4CCC[C@H]43)o2)c([N+](=O)[O-])c1 ZINC000510693844 933441662 /nfs/dbraw/zinc/44/16/62/933441662.db2.gz UBQRXOPFDIWEES-VQIMIIECSA-N 1 1 358.394 3.617 20 5 FHBDMO COc1ccc(-c2ccc(C[N@H+]3CCO[C@@H]4CCC[C@H]43)o2)c([N+](=O)[O-])c1 ZINC000510693844 933441667 /nfs/dbraw/zinc/44/16/67/933441667.db2.gz UBQRXOPFDIWEES-VQIMIIECSA-N 1 1 358.394 3.617 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](OCCCc2ccccc2)C1 ZINC000430943000 933455776 /nfs/dbraw/zinc/45/57/76/933455776.db2.gz NUPASIHHSGGNKI-HXUWFJFHSA-N 1 1 370.449 3.827 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](OCCCc2ccccc2)C1 ZINC000430943000 933455778 /nfs/dbraw/zinc/45/57/78/933455778.db2.gz NUPASIHHSGGNKI-HXUWFJFHSA-N 1 1 370.449 3.827 20 5 FHBDMO O=[N+]([O-])c1ccccc1OCC[NH+]1C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C1 ZINC000610604700 933512893 /nfs/dbraw/zinc/51/28/93/933512893.db2.gz HCKDWJOMUINFPV-NXEZZACHSA-N 1 1 372.265 3.646 20 5 FHBDMO Cc1sc(C(=O)N[C@@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000065140460 934219441 /nfs/dbraw/zinc/21/94/41/934219441.db2.gz RZIXWSSWHAXWKH-IUODEOHRSA-N 1 1 359.451 3.530 20 5 FHBDMO C[N@H+](CCOCc1ccccc1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000535821364 934512423 /nfs/dbraw/zinc/51/24/23/934512423.db2.gz BBPYVDDXDDHQAI-UHFFFAOYSA-N 1 1 366.364 3.845 20 5 FHBDMO C[N@@H+](CCOCc1ccccc1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000535821364 934512426 /nfs/dbraw/zinc/51/24/26/934512426.db2.gz BBPYVDDXDDHQAI-UHFFFAOYSA-N 1 1 366.364 3.845 20 5 FHBDMO COc1c(O)ccc(C[N@H+](C)[C@H]2CCCc3nc(C)sc32)c1[N+](=O)[O-] ZINC000892035776 934865235 /nfs/dbraw/zinc/86/52/35/934865235.db2.gz NUYUJSYQWCPDRE-ZDUSSCGKSA-N 1 1 363.439 3.583 20 5 FHBDMO COc1c(O)ccc(C[N@@H+](C)[C@H]2CCCc3nc(C)sc32)c1[N+](=O)[O-] ZINC000892035776 934865240 /nfs/dbraw/zinc/86/52/40/934865240.db2.gz NUYUJSYQWCPDRE-ZDUSSCGKSA-N 1 1 363.439 3.583 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1CN[C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000380702553 934879699 /nfs/dbraw/zinc/87/96/99/934879699.db2.gz HBHLHMRYSQRFSH-FUHWJXTLSA-N 1 1 369.465 3.604 20 5 FHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)cc1 ZINC000538957618 934967529 /nfs/dbraw/zinc/96/75/29/934967529.db2.gz BJAQIYTWDVZLPM-HNNXBMFYSA-N 1 1 367.327 3.662 20 5 FHBDMO CCN(Cc1ccccc1)C(=O)[C@H](C)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511062218 935197016 /nfs/dbraw/zinc/19/70/16/935197016.db2.gz CQEDDUBDQYBZAW-KRWDZBQOSA-N 1 1 369.465 3.506 20 5 FHBDMO CCN(Cc1ccccc1)C(=O)[C@H](C)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511062218 935197020 /nfs/dbraw/zinc/19/70/20/935197020.db2.gz CQEDDUBDQYBZAW-KRWDZBQOSA-N 1 1 369.465 3.506 20 5 FHBDMO C[N@H+]1CCC[C@@]2(CCN(c3ccc([N+](=O)[O-])c(-c4ccc(F)cc4)n3)C2)C1 ZINC000582075257 935216160 /nfs/dbraw/zinc/21/61/60/935216160.db2.gz PDXRDTYNGMFPDE-HXUWFJFHSA-N 1 1 370.428 3.718 20 5 FHBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](c2ncccc2C)C(C)(C)C)c1 ZINC000934287464 935255084 /nfs/dbraw/zinc/25/50/84/935255084.db2.gz LCFABKWKMXTDLM-SFHVURJKSA-N 1 1 371.437 3.962 20 5 FHBDMO Cc1ccccc1[C@H](C)NC(=O)[C@H](C)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511074609 935266614 /nfs/dbraw/zinc/26/66/14/935266614.db2.gz VRDXLHVVONXUPK-IRXDYDNUSA-N 1 1 369.465 3.643 20 5 FHBDMO Cc1ccccc1[C@H](C)NC(=O)[C@H](C)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511074609 935266623 /nfs/dbraw/zinc/26/66/23/935266623.db2.gz VRDXLHVVONXUPK-IRXDYDNUSA-N 1 1 369.465 3.643 20 5 FHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccn(-c2ccc(F)cc2)n1 ZINC000511087920 935364851 /nfs/dbraw/zinc/36/48/51/935364851.db2.gz DAAHGDPFXFHLOM-UHFFFAOYSA-N 1 1 354.385 3.594 20 5 FHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccn(-c2ccc(F)cc2)n1 ZINC000511087920 935364858 /nfs/dbraw/zinc/36/48/58/935364858.db2.gz DAAHGDPFXFHLOM-UHFFFAOYSA-N 1 1 354.385 3.594 20 5 FHBDMO COc1cc(C[N@@H+]2CCS[C@@H](C)[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000118415215 935433297 /nfs/dbraw/zinc/43/32/97/935433297.db2.gz DNCNGGLOBKGGOS-ZJUUUORDSA-N 1 1 362.398 3.531 20 5 FHBDMO COc1cc(C[N@H+]2CCS[C@@H](C)[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000118415215 935433301 /nfs/dbraw/zinc/43/33/01/935433301.db2.gz DNCNGGLOBKGGOS-ZJUUUORDSA-N 1 1 362.398 3.531 20 5 FHBDMO Cc1cc(C)c(NC(=O)C[N@H+](C)CCc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000511110400 935614788 /nfs/dbraw/zinc/61/47/88/935614788.db2.gz YARKBPJBQMMIPV-UHFFFAOYSA-N 1 1 355.438 3.633 20 5 FHBDMO Cc1cc(C)c(NC(=O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000511110400 935614791 /nfs/dbraw/zinc/61/47/91/935614791.db2.gz YARKBPJBQMMIPV-UHFFFAOYSA-N 1 1 355.438 3.633 20 5 FHBDMO CCN(C(=O)[C@@H](C)[N@H+](C)CCc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000511126604 935715664 /nfs/dbraw/zinc/71/56/64/935715664.db2.gz ZILCRUGMKHBKSN-MRXNPFEDSA-N 1 1 361.486 3.639 20 5 FHBDMO CCN(C(=O)[C@@H](C)[N@@H+](C)CCc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000511126604 935715666 /nfs/dbraw/zinc/71/56/66/935715666.db2.gz ZILCRUGMKHBKSN-MRXNPFEDSA-N 1 1 361.486 3.639 20 5 FHBDMO CSc1ccccc1NC(=O)[C@@H](C)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511141983 935778445 /nfs/dbraw/zinc/77/84/45/935778445.db2.gz XYKZJHWGOYDKFU-CQSZACIVSA-N 1 1 373.478 3.818 20 5 FHBDMO CSc1ccccc1NC(=O)[C@@H](C)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511141983 935778446 /nfs/dbraw/zinc/77/84/46/935778446.db2.gz XYKZJHWGOYDKFU-CQSZACIVSA-N 1 1 373.478 3.818 20 5 FHBDMO COc1ccc(OCC[N@H+]2CC[C@@H](c3ccccc3)[C@@H]2C)c([N+](=O)[O-])c1 ZINC001167599143 935943069 /nfs/dbraw/zinc/94/30/69/935943069.db2.gz PMGROUILCMNQGY-MAUKXSAKSA-N 1 1 356.422 3.860 20 5 FHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@@H](c3cccnc3)C2)c1 ZINC000582724392 935990063 /nfs/dbraw/zinc/99/00/63/935990063.db2.gz RFIVUJILOIWPSS-CYBMUJFWSA-N 1 1 351.328 3.998 20 5 FHBDMO COc1cc(C[N@H+](C)[C@H]2CC2(C)C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000426543995 945139660 /nfs/dbraw/zinc/13/96/60/945139660.db2.gz LJBNXACXJJDHDP-AWEZNQCLSA-N 1 1 362.348 3.775 20 5 FHBDMO COc1cc(C[N@@H+](C)[C@H]2CC2(C)C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000426543995 945139664 /nfs/dbraw/zinc/13/96/64/945139664.db2.gz LJBNXACXJJDHDP-AWEZNQCLSA-N 1 1 362.348 3.775 20 5 FHBDMO C[C@@H]1C[C@H](N(C)C(=O)c2cccc3c(=O)c4ccccc4[nH]c23)CC[N@H+]1C ZINC000277876551 936076240 /nfs/dbraw/zinc/07/62/40/936076240.db2.gz CEMMSPXKJWZFNY-HUUCEWRRSA-N 1 1 363.461 3.648 20 5 FHBDMO Cc1ccc(C)n1C1CC[NH+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000507325415 945146711 /nfs/dbraw/zinc/14/67/11/945146711.db2.gz LLIWVPPHLUSFFT-UHFFFAOYSA-N 1 1 370.453 3.597 20 5 FHBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C[C@H]1C ZINC000437260264 945174467 /nfs/dbraw/zinc/17/44/67/945174467.db2.gz SXLIOFPPOQULSH-BXUZGUMPSA-N 1 1 373.375 3.558 20 5 FHBDMO CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000437261117 945176251 /nfs/dbraw/zinc/17/62/51/945176251.db2.gz GALZNQZLOXGBMN-AWEZNQCLSA-N 1 1 373.375 3.560 20 5 FHBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3ccc(OCC4CC4)cc3)nc2c1 ZINC000278653102 938619916 /nfs/dbraw/zinc/61/99/16/938619916.db2.gz JUEKYXWQOOAOQQ-UHFFFAOYSA-N 1 1 352.394 3.550 20 5 FHBDMO Cn1nccc1C1=CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000584259320 938659511 /nfs/dbraw/zinc/65/95/11/938659511.db2.gz IGMSOSUJEJWVGW-UHFFFAOYSA-N 1 1 364.405 3.878 20 5 FHBDMO C[N@H+]1CCC[C@H](CNCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000108428707 945207491 /nfs/dbraw/zinc/20/74/91/945207491.db2.gz IBDCOFDZXWUZGN-MRXNPFEDSA-N 1 1 373.428 3.958 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@]1(C)Cc1ccccc1 ZINC000467232443 945209264 /nfs/dbraw/zinc/20/92/64/945209264.db2.gz XAKGMSQTBULKRT-OAQYLSRUSA-N 1 1 367.449 3.939 20 5 FHBDMO CN(Cc1ccc([N+](=O)[O-])cc1C(F)(F)F)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000375749980 938871936 /nfs/dbraw/zinc/87/19/36/938871936.db2.gz IZOAVZUUCKSXFW-NNQSOWQGSA-N 1 1 357.376 3.671 20 5 FHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH+]2CCN(c3ccccn3)CC2)o1 ZINC000158889711 938964951 /nfs/dbraw/zinc/96/49/51/938964951.db2.gz LSPHGHOIHZNEHZ-UHFFFAOYSA-N 1 1 364.405 3.572 20 5 FHBDMO C[C@H]1c2c(F)cccc2CC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000548844612 938998348 /nfs/dbraw/zinc/99/83/48/938998348.db2.gz PHGPKSGAVSGSCN-ZDUSSCGKSA-N 1 1 357.385 3.682 20 5 FHBDMO O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000136205277 939014672 /nfs/dbraw/zinc/01/46/72/939014672.db2.gz LJSLZFOOMKZSIR-UHFFFAOYSA-N 1 1 373.840 3.596 20 5 FHBDMO CC(C)(C)[N@H+](Cc1ccccc1)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000612092586 939044359 /nfs/dbraw/zinc/04/43/59/939044359.db2.gz ALPUREZYWUFDHP-KRWDZBQOSA-N 1 1 358.438 3.635 20 5 FHBDMO COC[C@@H](C)[N@H+](C)Cc1cc(OC)c(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000179373403 939128486 /nfs/dbraw/zinc/12/84/86/939128486.db2.gz LDNDWZXJJSEEHS-OAHLLOKOSA-N 1 1 374.437 3.649 20 5 FHBDMO COC[C@@H](C)[N@@H+](C)Cc1cc(OC)c(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000179373403 939128488 /nfs/dbraw/zinc/12/84/88/939128488.db2.gz LDNDWZXJJSEEHS-OAHLLOKOSA-N 1 1 374.437 3.649 20 5 FHBDMO CC[N@@H+](CCNc1ccnc2c1cccc2[N+](=O)[O-])CCC(F)(F)F ZINC000432167474 945251116 /nfs/dbraw/zinc/25/11/16/945251116.db2.gz WJDFRSIJADKFNE-UHFFFAOYSA-N 1 1 356.348 3.829 20 5 FHBDMO O=[N+]([O-])c1cc(CN2CCC[N@@H+](CCCc3ccccc3)CC2)cs1 ZINC000507474948 945259479 /nfs/dbraw/zinc/25/94/79/945259479.db2.gz ZPMRHSKVAUCQHD-UHFFFAOYSA-N 1 1 359.495 3.797 20 5 FHBDMO COc1c(O)ccc(C[NH2+]Cc2ccc(C(F)(F)F)cc2)c1[N+](=O)[O-] ZINC000892473986 939907326 /nfs/dbraw/zinc/90/73/26/939907326.db2.gz YJXJEAWRILEFGR-UHFFFAOYSA-N 1 1 356.300 3.618 20 5 FHBDMO COc1c(O)ccc(C[NH2+][C@@H]2CCSc3ccc(F)cc32)c1[N+](=O)[O-] ZINC000892474734 939912195 /nfs/dbraw/zinc/91/21/95/939912195.db2.gz AFEZXCGBHWSVEM-CYBMUJFWSA-N 1 1 364.398 3.775 20 5 FHBDMO O=[N+]([O-])c1cnn([C@@H]2CCC[N@H+](Cc3ccc(CSC(F)F)o3)C2)c1 ZINC000364330434 939919468 /nfs/dbraw/zinc/91/94/68/939919468.db2.gz VMRLRZLECISQTQ-LLVKDONJSA-N 1 1 372.397 3.677 20 5 FHBDMO O=[N+]([O-])c1cnn([C@@H]2CCC[N@@H+](Cc3ccc(CSC(F)F)o3)C2)c1 ZINC000364330434 939919473 /nfs/dbraw/zinc/91/94/73/939919473.db2.gz VMRLRZLECISQTQ-LLVKDONJSA-N 1 1 372.397 3.677 20 5 FHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2ccccc2)C[C@H](O)c2ccco2)c1 ZINC000177150619 939964570 /nfs/dbraw/zinc/96/45/70/939964570.db2.gz URPXJMKTIVGEAF-IBGZPJMESA-N 1 1 352.390 3.924 20 5 FHBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1N(C)C(=O)c1ccc([N+](=O)[O-])s1 ZINC000364816523 940004333 /nfs/dbraw/zinc/00/43/33/940004333.db2.gz WHNYDIMSWDKKCL-GOEBONIOSA-N 1 1 373.478 3.639 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@@H](C)c1ccc(C)cc1 ZINC000411178053 940007165 /nfs/dbraw/zinc/00/71/65/940007165.db2.gz XCVAIHPCCPBWPF-HNNXBMFYSA-N 1 1 371.437 3.933 20 5 FHBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000411298413 940024581 /nfs/dbraw/zinc/02/45/81/940024581.db2.gz NSHOFJIPVBXRGS-CVEARBPZSA-N 1 1 351.472 3.529 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(c2ncnc3cccc([N+](=O)[O-])c32)C1 ZINC000612444842 940072876 /nfs/dbraw/zinc/07/28/76/940072876.db2.gz WSXNTSGQJGPOAB-HZPDHXFCSA-N 1 1 369.469 3.629 20 5 FHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CC3(CCOCC3)[C@H]2c2ccccc2)cc1 ZINC000411998699 940180181 /nfs/dbraw/zinc/18/01/81/940180181.db2.gz LNHMUUKNOXNRHB-HXUWFJFHSA-N 1 1 368.433 3.827 20 5 FHBDMO CC(C)c1[nH+]ccn1C[C@H]1CCCN1c1ncnc2sc([N+](=O)[O-])cc21 ZINC000376170516 940410562 /nfs/dbraw/zinc/41/05/62/940410562.db2.gz GFFFDIZYHNQUEV-GFCCVEGCSA-N 1 1 372.454 3.588 20 5 FHBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+](C)Cc1ccc(F)cc1 ZINC000003542035 940475747 /nfs/dbraw/zinc/47/57/47/940475747.db2.gz KNWXKBWWEYSWRD-LLVKDONJSA-N 1 1 365.792 3.846 20 5 FHBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)Cc1ccc(F)cc1 ZINC000003542035 940475749 /nfs/dbraw/zinc/47/57/49/940475749.db2.gz KNWXKBWWEYSWRD-LLVKDONJSA-N 1 1 365.792 3.846 20 5 FHBDMO Cc1ccnc(-c2n[nH]c([C@H](C)[NH2+][C@@H](C)c3cc([N+](=O)[O-])ccc3C)n2)c1 ZINC000580511416 940477514 /nfs/dbraw/zinc/47/75/14/940477514.db2.gz FHNNORMDPQEDDD-KBPBESRZSA-N 1 1 366.425 3.804 20 5 FHBDMO CCC[N@@H+]1Cc2cccc(NC(=O)CCOc3ccccc3[N+](=O)[O-])c2C1 ZINC000066514278 940593068 /nfs/dbraw/zinc/59/30/68/940593068.db2.gz CVOVLSVHWJUVRE-UHFFFAOYSA-N 1 1 369.421 3.728 20 5 FHBDMO CCC[N@H+]1Cc2cccc(NC(=O)CCOc3ccccc3[N+](=O)[O-])c2C1 ZINC000066514278 940593070 /nfs/dbraw/zinc/59/30/70/940593070.db2.gz CVOVLSVHWJUVRE-UHFFFAOYSA-N 1 1 369.421 3.728 20 5 FHBDMO CCc1[nH+]ccn1C[C@@H]1CCCN1C(=O)Nc1cc([N+](=O)[O-])ccc1CC ZINC000582635774 940781774 /nfs/dbraw/zinc/78/17/74/940781774.db2.gz CWNHIMOCAVUGED-INIZCTEOSA-N 1 1 371.441 3.613 20 5 FHBDMO C[N@H+](Cc1c(Cl)cccc1[N+](=O)[O-])C1CCN(CC(F)(F)F)CC1 ZINC000452034359 940872609 /nfs/dbraw/zinc/87/26/09/940872609.db2.gz SIWLSNSFZDQLCK-UHFFFAOYSA-N 1 1 365.783 3.707 20 5 FHBDMO C[N@@H+](Cc1c(Cl)cccc1[N+](=O)[O-])C1CCN(CC(F)(F)F)CC1 ZINC000452034359 940872615 /nfs/dbraw/zinc/87/26/15/940872615.db2.gz SIWLSNSFZDQLCK-UHFFFAOYSA-N 1 1 365.783 3.707 20 5 FHBDMO COc1cc(C[N@@H+](C)[C@H](C)C2(C)CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180260661 940891275 /nfs/dbraw/zinc/89/12/75/940891275.db2.gz OFAXHZWFXFYIIX-LLVKDONJSA-N 1 1 358.385 3.868 20 5 FHBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000507599570 945360454 /nfs/dbraw/zinc/36/04/54/945360454.db2.gz KEQHJNHRKBQJSG-CZUORRHYSA-N 1 1 373.840 3.814 20 5 FHBDMO CC(C)n1cnnc1[C@H]1CCC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000180628613 941057007 /nfs/dbraw/zinc/05/70/07/941057007.db2.gz KMUAEPFKBIBOLH-AWEZNQCLSA-N 1 1 363.849 3.800 20 5 FHBDMO CC(C)n1cnnc1[C@H]1CCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000180628613 941057009 /nfs/dbraw/zinc/05/70/09/941057009.db2.gz KMUAEPFKBIBOLH-AWEZNQCLSA-N 1 1 363.849 3.800 20 5 FHBDMO CC[C@@H](NCC1([NH+]2CCCCC2)CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000180741441 941070795 /nfs/dbraw/zinc/07/07/95/941070795.db2.gz QLTUIDADNNMCDA-LJQANCHMSA-N 1 1 361.486 3.671 20 5 FHBDMO C[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc(N2CCOC2=O)cc1 ZINC000181287842 941120202 /nfs/dbraw/zinc/12/02/02/941120202.db2.gz BDFWDAOEBISFEX-GFCCVEGCSA-N 1 1 359.357 3.541 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)CC1(c2ccccc2)CC1 ZINC000189292387 941155463 /nfs/dbraw/zinc/15/54/63/941155463.db2.gz CWJOYXRGWZQWEO-UHFFFAOYSA-N 1 1 353.422 3.505 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)CC1(c2ccccc2)CC1 ZINC000189292387 941155464 /nfs/dbraw/zinc/15/54/64/941155464.db2.gz CWJOYXRGWZQWEO-UHFFFAOYSA-N 1 1 353.422 3.505 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@H]1CC[N@H+](C)[C@@H]1c1ccccc1 ZINC000189783065 941276754 /nfs/dbraw/zinc/27/67/54/941276754.db2.gz UIHFGICMQLFUNF-QFBILLFUSA-N 1 1 368.437 3.779 20 5 FHBDMO Cc1ccc([C@@H]2C[C@H](C)[N@H+](Cn3c4cc([N+](=O)[O-])ccc4oc3=O)C2)cc1 ZINC000782954249 941331688 /nfs/dbraw/zinc/33/16/88/941331688.db2.gz LVJWEARFQWBSSY-GOEBONIOSA-N 1 1 367.405 3.647 20 5 FHBDMO Cc1nn(C)c(Cl)c1C[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000278809245 941371938 /nfs/dbraw/zinc/37/19/38/941371938.db2.gz SCWADGFYSVCNRW-UHFFFAOYSA-N 1 1 362.739 3.599 20 5 FHBDMO CC(C)NC(=O)[C@H](C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414548651 941377139 /nfs/dbraw/zinc/37/71/39/941377139.db2.gz YBURQJDYVBWHAX-NSHDSACASA-N 1 1 365.817 3.511 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]Cc3cnc4n3CCCC4)o2)cc1 ZINC000376726991 941386669 /nfs/dbraw/zinc/38/66/69/941386669.db2.gz BQGXKLUUDDXHSW-UHFFFAOYSA-N 1 1 352.394 3.677 20 5 FHBDMO [NH3+]C[C@H]1CCN(Cc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)C1 ZINC000414659552 941429285 /nfs/dbraw/zinc/42/92/85/941429285.db2.gz SXQCLGZWQAIJIF-CQSZACIVSA-N 1 1 361.829 3.821 20 5 FHBDMO [NH3+][C@@H]1CC[C@H]2CN(Cc3ccc(-c4ccc([N+](=O)[O-])cc4Cl)o3)C[C@H]12 ZINC000414675499 941433643 /nfs/dbraw/zinc/43/36/43/941433643.db2.gz TXSQTWOMSHIKSG-XNJJOIOASA-N 1 1 361.829 3.677 20 5 FHBDMO CC(=O)c1ccc([N+](=O)[O-])cc1N1CCC(Oc2cc[nH+]cc2C)CC1 ZINC000377173661 941541109 /nfs/dbraw/zinc/54/11/09/941541109.db2.gz ACRKNNURDWFRAO-UHFFFAOYSA-N 1 1 355.394 3.549 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(CN3CCCC[C@H]3[C@@H]3CC[NH2+]C3)o2)cc1 ZINC000415036617 941552503 /nfs/dbraw/zinc/55/25/03/941552503.db2.gz FPYALCNMILFWHJ-APWZRJJASA-N 1 1 355.438 3.819 20 5 FHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cn(-c2ccc(Cl)cc2)nn1 ZINC000549166978 941566513 /nfs/dbraw/zinc/56/65/13/941566513.db2.gz CDWNJDCSQCFZMB-UHFFFAOYSA-N 1 1 371.828 3.503 20 5 FHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cn(-c2ccc(Cl)cc2)nn1 ZINC000549166978 941566517 /nfs/dbraw/zinc/56/65/17/941566517.db2.gz CDWNJDCSQCFZMB-UHFFFAOYSA-N 1 1 371.828 3.503 20 5 FHBDMO CSc1cccc(NC(=O)[C@H](C)[N@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000549170052 941571768 /nfs/dbraw/zinc/57/17/68/941571768.db2.gz GDCQDTVHUPREAM-AWEZNQCLSA-N 1 1 373.478 3.818 20 5 FHBDMO CSc1cccc(NC(=O)[C@H](C)[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000549170052 941571772 /nfs/dbraw/zinc/57/17/72/941571772.db2.gz GDCQDTVHUPREAM-AWEZNQCLSA-N 1 1 373.478 3.818 20 5 FHBDMO CC(C)c1ccccc1NC(=O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000549174348 941587852 /nfs/dbraw/zinc/58/78/52/941587852.db2.gz XQFIOCQVCGEVNN-UHFFFAOYSA-N 1 1 355.438 3.831 20 5 FHBDMO CC(C)c1ccccc1NC(=O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000549174348 941587854 /nfs/dbraw/zinc/58/78/54/941587854.db2.gz XQFIOCQVCGEVNN-UHFFFAOYSA-N 1 1 355.438 3.831 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CC[C@@H](C4CCOCC4)C3)cs2)c1 ZINC000377247821 941592983 /nfs/dbraw/zinc/59/29/83/941592983.db2.gz CLKCZOMFXKIARZ-MRXNPFEDSA-N 1 1 373.478 3.967 20 5 FHBDMO CC(C)Oc1cccc(C[N@H+](C)[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000120657148 941727490 /nfs/dbraw/zinc/72/74/90/941727490.db2.gz RPVZGRHIJOCGFX-OAHLLOKOSA-N 1 1 371.437 3.841 20 5 FHBDMO CC(C)Oc1cccc(C[N@@H+](C)[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000120657148 941727491 /nfs/dbraw/zinc/72/74/91/941727491.db2.gz RPVZGRHIJOCGFX-OAHLLOKOSA-N 1 1 371.437 3.841 20 5 FHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(c2nc3ccccc3cc2[N+](=O)[O-])C1 ZINC000473521426 941743903 /nfs/dbraw/zinc/74/39/03/941743903.db2.gz OVGAQXSBOOAPIU-HLLBOEOZSA-N 1 1 354.454 3.985 20 5 FHBDMO C[C@@H]([NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc2n[nH]cc2c1 ZINC000513195496 941770838 /nfs/dbraw/zinc/77/08/38/941770838.db2.gz CQNILUPNWYFCRB-GFCCVEGCSA-N 1 1 363.377 3.977 20 5 FHBDMO Cn1cc[nH+]c1[C@@H]1CCN(c2c3cc(Cl)ccc3ncc2[N+](=O)[O-])C1 ZINC000892984680 941842997 /nfs/dbraw/zinc/84/29/97/941842997.db2.gz FLOGCKSLNAIIFH-LLVKDONJSA-N 1 1 357.801 3.524 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H](Oc2ccccc2OC)C1 ZINC000513378226 941875182 /nfs/dbraw/zinc/87/51/82/941875182.db2.gz ZYMZIBPTWBMSTC-KRWDZBQOSA-N 1 1 372.421 3.655 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](Oc2ccccc2OC)C1 ZINC000513378226 941875186 /nfs/dbraw/zinc/87/51/86/941875186.db2.gz ZYMZIBPTWBMSTC-KRWDZBQOSA-N 1 1 372.421 3.655 20 5 FHBDMO C[C@@H](c1ccco1)[N@@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)C1CC1 ZINC000119269573 941875528 /nfs/dbraw/zinc/87/55/28/941875528.db2.gz WGIKVJXXPLKBLH-ZDUSSCGKSA-N 1 1 371.393 3.711 20 5 FHBDMO COc1ccccc1O[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000513370774 941879566 /nfs/dbraw/zinc/87/95/66/941879566.db2.gz KTUFLSSBJGFJIB-KRWDZBQOSA-N 1 1 372.421 3.655 20 5 FHBDMO COc1ccccc1O[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000513370774 941879572 /nfs/dbraw/zinc/87/95/72/941879572.db2.gz KTUFLSSBJGFJIB-KRWDZBQOSA-N 1 1 372.421 3.655 20 5 FHBDMO CN(c1ccccc1)c1ccc(C[N@H+](C)Cc2cnn(C)c2)cc1[N+](=O)[O-] ZINC000119661053 941896355 /nfs/dbraw/zinc/89/63/55/941896355.db2.gz IMCVSZQSIJKUQK-UHFFFAOYSA-N 1 1 365.437 3.728 20 5 FHBDMO CN(c1ccccc1)c1ccc(C[N@@H+](C)Cc2cnn(C)c2)cc1[N+](=O)[O-] ZINC000119661053 941896357 /nfs/dbraw/zinc/89/63/57/941896357.db2.gz IMCVSZQSIJKUQK-UHFFFAOYSA-N 1 1 365.437 3.728 20 5 FHBDMO COc1ccccc1O[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000513410529 941909156 /nfs/dbraw/zinc/90/91/56/941909156.db2.gz CYVKQAOMBYDARP-INIZCTEOSA-N 1 1 372.421 3.655 20 5 FHBDMO COc1ccccc1O[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000513410529 941909158 /nfs/dbraw/zinc/90/91/58/941909158.db2.gz CYVKQAOMBYDARP-INIZCTEOSA-N 1 1 372.421 3.655 20 5 FHBDMO Cc1c(NC(=O)N2CCC[C@@H]2Cn2cc[nH+]c2C(C)C)cccc1[N+](=O)[O-] ZINC000377709281 941917833 /nfs/dbraw/zinc/91/78/33/941917833.db2.gz TTZZNFAWOKWFKP-OAHLLOKOSA-N 1 1 371.441 3.920 20 5 FHBDMO Cc1ccc(NC(=O)N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1[N+](=O)[O-] ZINC000182929695 942008819 /nfs/dbraw/zinc/00/88/19/942008819.db2.gz XAJJOZPHXUGESF-HUUCEWRRSA-N 1 1 360.458 3.678 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182931325 942009873 /nfs/dbraw/zinc/00/98/73/942009873.db2.gz WDROLWPSPLLOIP-CABCVRRESA-N 1 1 360.458 3.678 20 5 FHBDMO C[N@@H+](Cc1ccccc1)CC(C)(C)NC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000513670901 942066904 /nfs/dbraw/zinc/06/69/04/942066904.db2.gz CZKAYXNZGYUOLW-UHFFFAOYSA-N 1 1 356.426 3.627 20 5 FHBDMO C[C@@H](C[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000513684654 942075266 /nfs/dbraw/zinc/07/52/66/942075266.db2.gz UAARNEOPDKESJI-IFXJQAMLSA-N 1 1 368.412 3.950 20 5 FHBDMO CC[C@H](NCc1ccncc1OCCC[NH+](C)C)c1cccc([N+](=O)[O-])c1 ZINC000290408312 942098335 /nfs/dbraw/zinc/09/83/35/942098335.db2.gz UAGRVFBEYTXQCJ-IBGZPJMESA-N 1 1 372.469 3.561 20 5 FHBDMO CC[N@H+]1CCc2c(cccc2NC(=O)c2cc(SC)ccc2[N+](=O)[O-])C1 ZINC000366388412 942266330 /nfs/dbraw/zinc/26/63/30/942266330.db2.gz JYJNMLXUDXIYSX-UHFFFAOYSA-N 1 1 371.462 3.947 20 5 FHBDMO O=C(Nc1ccccc1)C1CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000103465444 942273426 /nfs/dbraw/zinc/27/34/26/942273426.db2.gz QOMDAZSPESNNBD-UHFFFAOYSA-N 1 1 357.385 3.585 20 5 FHBDMO CC(C)c1[nH+]ccn1[C@@H]1CCCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000378107032 942276241 /nfs/dbraw/zinc/27/62/41/942276241.db2.gz ZZCVQHIKLBGBKT-CQSZACIVSA-N 1 1 360.389 3.531 20 5 FHBDMO Cc1ccc([C@H](C)NC(=O)N2CCC([N@H+]3CCC[C@H]3C)CC2)cc1[N+](=O)[O-] ZINC000366433647 942335460 /nfs/dbraw/zinc/33/54/60/942335460.db2.gz DDPGGPHHNYSJNM-CVEARBPZSA-N 1 1 374.485 3.623 20 5 FHBDMO Cc1ccc([C@H](C)NC(=O)CC[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000416169252 942428620 /nfs/dbraw/zinc/42/86/20/942428620.db2.gz CYBLELSAKIAONP-INIZCTEOSA-N 1 1 367.449 3.529 20 5 FHBDMO CC[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2ccccc2C1 ZINC000501385419 942454297 /nfs/dbraw/zinc/45/42/97/942454297.db2.gz DHSZODAGZLVTJI-SFHVURJKSA-N 1 1 368.437 3.553 20 5 FHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cnc(-c2ccccn2)s1 ZINC000549408073 942475290 /nfs/dbraw/zinc/47/52/90/942475290.db2.gz KHKZANKNMZWRBQ-UHFFFAOYSA-N 1 1 354.435 3.788 20 5 FHBDMO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C1(c2noc(C(F)F)n2)CCC1 ZINC000366536440 942550891 /nfs/dbraw/zinc/55/08/91/942550891.db2.gz QVUJVXLRCKDCSY-LLVKDONJSA-N 1 1 366.368 3.906 20 5 FHBDMO CN(c1ccccc1)c1ccc(C[N@@H+]2CC[C@@]23CCOC3)cc1[N+](=O)[O-] ZINC000421404271 942555297 /nfs/dbraw/zinc/55/52/97/942555297.db2.gz YQXABOHMVAARCJ-FQEVSTJZSA-N 1 1 353.422 3.728 20 5 FHBDMO CN(c1ccccc1)c1ccc(C[N@H+]2CC[C@@]23CCOC3)cc1[N+](=O)[O-] ZINC000421404271 942555299 /nfs/dbraw/zinc/55/52/99/942555299.db2.gz YQXABOHMVAARCJ-FQEVSTJZSA-N 1 1 353.422 3.728 20 5 FHBDMO C[N@@H+](Cc1ccccc1)CC(C)(C)NC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000513871187 942568385 /nfs/dbraw/zinc/56/83/85/942568385.db2.gz MMILWRCPYKJRRY-UHFFFAOYSA-N 1 1 356.426 3.627 20 5 FHBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@H](c2ccccc2)CC1 ZINC000541347799 942625519 /nfs/dbraw/zinc/62/55/19/942625519.db2.gz PSDNCCDOTXEKBO-OALUTQOASA-N 1 1 370.449 3.604 20 5 FHBDMO C[N@H+](Cc1cccnc1)C[C@@H]1CCN(Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000434495428 942712397 /nfs/dbraw/zinc/71/23/97/942712397.db2.gz VRLSBJIKRBJGPO-INIZCTEOSA-N 1 1 374.872 3.597 20 5 FHBDMO Cn1ccnc1[C@H]([NH2+]CCCOC1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000514081037 942731828 /nfs/dbraw/zinc/73/18/28/942731828.db2.gz AFOXQOZLBKSGNQ-LJQANCHMSA-N 1 1 372.469 3.747 20 5 FHBDMO COc1ccc([C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC)C2CC2)c(F)c1 ZINC000421824685 942833628 /nfs/dbraw/zinc/83/36/28/942833628.db2.gz JURRYMGJBCNOEJ-LJQANCHMSA-N 1 1 360.385 3.992 20 5 FHBDMO CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(C)c2[nH+]ccn2c1 ZINC000502987763 942885675 /nfs/dbraw/zinc/88/56/75/942885675.db2.gz VBVHHPVNEFRJKD-HNNXBMFYSA-N 1 1 352.394 3.758 20 5 FHBDMO Cn1ccnc1[C@@H]([NH2+]CCc1cccc(Cl)c1)c1ccc([N+](=O)[O-])cc1 ZINC000513762058 942918408 /nfs/dbraw/zinc/91/84/08/942918408.db2.gz PNWKEJJNMOATSD-SFHVURJKSA-N 1 1 370.840 3.903 20 5 FHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cccc(-c3cccnc3)c2)c([N+](=O)[O-])c1 ZINC000365829694 943071033 /nfs/dbraw/zinc/07/10/33/943071033.db2.gz YITFFWGYPSBIOM-UHFFFAOYSA-N 1 1 364.361 3.855 20 5 FHBDMO COc1cc(C[N@@H+](C)[C@@H](C)C2CCC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000505589324 943112005 /nfs/dbraw/zinc/11/20/05/943112005.db2.gz ZZZJQXASTNLABR-NSHDSACASA-N 1 1 358.385 3.868 20 5 FHBDMO COc1cc(N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000312298641 943121150 /nfs/dbraw/zinc/12/11/50/943121150.db2.gz NGPRZZAERKTZGE-GDBMZVCRSA-N 1 1 371.437 3.687 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H](c3ccccc3F)C2)c2c(c1)COCO2 ZINC000503656153 943313494 /nfs/dbraw/zinc/31/34/94/943313494.db2.gz ZALBTOPFYPIEQP-CYBMUJFWSA-N 1 1 358.369 3.590 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000425368362 943381755 /nfs/dbraw/zinc/38/17/55/943381755.db2.gz FBFYKSIWRQTHME-IBGZPJMESA-N 1 1 360.454 3.775 20 5 FHBDMO Cc1nc(C[NH3+])ccc1[C@H](C)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000423085798 943388972 /nfs/dbraw/zinc/38/89/72/943388972.db2.gz KQBBNRUJNMOMLW-JTQLQIEISA-N 1 1 368.359 3.627 20 5 FHBDMO COc1cccc([C@H]2C[C@H](C)C[N@@H+]2CC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000544118555 943473939 /nfs/dbraw/zinc/47/39/39/943473939.db2.gz YBKQFBGBJXCCEM-IFXJQAMLSA-N 1 1 369.421 3.625 20 5 FHBDMO COc1cccc([C@H]2C[C@H](C)C[N@H+]2CC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000544118555 943473943 /nfs/dbraw/zinc/47/39/43/943473943.db2.gz YBKQFBGBJXCCEM-IFXJQAMLSA-N 1 1 369.421 3.625 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)C[C@H]1OCCc2ccccc21 ZINC000511621936 943563764 /nfs/dbraw/zinc/56/37/64/943563764.db2.gz BOXLNFRSVITPFV-HXUWFJFHSA-N 1 1 356.422 3.739 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C[C@H]1OCCc2ccccc21 ZINC000511621936 943563769 /nfs/dbraw/zinc/56/37/69/943563769.db2.gz BOXLNFRSVITPFV-HXUWFJFHSA-N 1 1 356.422 3.739 20 5 FHBDMO C[C@@H]1C[C@@H](c2cccnc2)[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000364105320 943566511 /nfs/dbraw/zinc/56/65/11/943566511.db2.gz VUVRZWLISGEFJA-DYVFJYSZSA-N 1 1 365.393 3.623 20 5 FHBDMO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000364105320 943566513 /nfs/dbraw/zinc/56/65/13/943566513.db2.gz VUVRZWLISGEFJA-DYVFJYSZSA-N 1 1 365.393 3.623 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H]1Cc1ccccc1 ZINC000303040730 943640773 /nfs/dbraw/zinc/64/07/73/943640773.db2.gz STSBXEWSXRUTFX-GOSISDBHSA-N 1 1 367.449 3.939 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@H](C)c1ccccc1Cl ZINC000008173437 943652835 /nfs/dbraw/zinc/65/28/35/943652835.db2.gz KACZBIJQIWSRKJ-LLVKDONJSA-N 1 1 363.801 3.546 20 5 FHBDMO Cn1c2ccccc2nc1[C@@H]1CCC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000437592481 943935828 /nfs/dbraw/zinc/93/58/28/943935828.db2.gz LUEZZZFKMIHKBK-IBGZPJMESA-N 1 1 366.421 3.697 20 5 FHBDMO Cn1c2ccccc2nc1[C@@H]1CCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000437592481 943935835 /nfs/dbraw/zinc/93/58/35/943935835.db2.gz LUEZZZFKMIHKBK-IBGZPJMESA-N 1 1 366.421 3.697 20 5 FHBDMO CC(C)[C@]1(CO)CCC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425478213 944076344 /nfs/dbraw/zinc/07/63/44/944076344.db2.gz MJNNKROBAVQWKE-MRXNPFEDSA-N 1 1 371.275 3.588 20 5 FHBDMO CC(C)[C@]1(CO)CCC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425478213 944076365 /nfs/dbraw/zinc/07/63/65/944076365.db2.gz MJNNKROBAVQWKE-MRXNPFEDSA-N 1 1 371.275 3.588 20 5 FHBDMO COc1cc2c(cc1C[N@@H+](C)CCc1ccccc1[N+](=O)[O-])O[C@H](C)C2 ZINC000517202981 944099689 /nfs/dbraw/zinc/09/96/89/944099689.db2.gz HDSIGOOGELNIPN-CQSZACIVSA-N 1 1 356.422 3.601 20 5 FHBDMO O=C(CC[N@H+](Cc1ccc(F)cc1)CC1CC1)Nc1ccccc1[N+](=O)[O-] ZINC000500119609 944134647 /nfs/dbraw/zinc/13/46/47/944134647.db2.gz VLLRLOXAFIWOSO-UHFFFAOYSA-N 1 1 371.412 3.975 20 5 FHBDMO O=C(NC[C@H]1CCC[N@H+]1C1CCCCC1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000437855824 944176412 /nfs/dbraw/zinc/17/64/12/944176412.db2.gz ZTEMAQMLMVGTOT-OAHLLOKOSA-N 1 1 365.861 3.775 20 5 FHBDMO CC[N@@H+](CCC1CCN(c2c3c(ccc2[N+](=O)[O-])NCC3)CC1)CC1CC1 ZINC000436412027 944284424 /nfs/dbraw/zinc/28/44/24/944284424.db2.gz NHULCSRLNCXYDC-UHFFFAOYSA-N 1 1 372.513 3.901 20 5 FHBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CC3(CCC3)[C@H]2C2CCOCC2)c(F)c1 ZINC000425546486 944308444 /nfs/dbraw/zinc/30/84/44/944308444.db2.gz DXRBMXCSCPPZRD-QGZVFWFLSA-N 1 1 352.381 3.654 20 5 FHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CC3(CCC3)[C@H]2C2CCOCC2)c(F)c1 ZINC000425546486 944308452 /nfs/dbraw/zinc/30/84/52/944308452.db2.gz DXRBMXCSCPPZRD-QGZVFWFLSA-N 1 1 352.381 3.654 20 5 FHBDMO CSCC[C@@H]([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)c1nnc2ccccn21 ZINC000123240606 944309842 /nfs/dbraw/zinc/30/98/42/944309842.db2.gz SULPNPYNOMUGIM-OAHLLOKOSA-N 1 1 371.466 3.530 20 5 FHBDMO Cc1ccc(C[C@H]2CCC[N@H+]2CC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000500233465 944313230 /nfs/dbraw/zinc/31/32/30/944313230.db2.gz GHPIFBRQVLFZQU-QGZVFWFLSA-N 1 1 353.422 3.549 20 5 FHBDMO CCC[N@@H+](CCc1cccc(F)c1)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000500234918 944313943 /nfs/dbraw/zinc/31/39/43/944313943.db2.gz XRGWGWGRSFSVFA-UHFFFAOYSA-N 1 1 373.428 3.651 20 5 FHBDMO CNC(=O)CC[C@@H]1CCCC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000515918635 944343087 /nfs/dbraw/zinc/34/30/87/944343087.db2.gz MRBKKVQTWPAFCW-INIZCTEOSA-N 1 1 371.437 3.736 20 5 FHBDMO CCn1c(=O)c2cc3ccccc3cc2nc1SC[C@@H]1CC[N@@H+](C)C1 ZINC000473781087 944444895 /nfs/dbraw/zinc/44/48/95/944444895.db2.gz MEMVIUFBWKBQGX-CQSZACIVSA-N 1 1 353.491 3.613 20 5 FHBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3ccc(F)c(C(F)(F)F)c3)CC2)n1 ZINC000425970651 944455070 /nfs/dbraw/zinc/45/50/70/944455070.db2.gz HUKPBFAZXTYJIT-UHFFFAOYSA-N 1 1 372.322 3.786 20 5 FHBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000426333731 944478460 /nfs/dbraw/zinc/47/84/60/944478460.db2.gz JBGHENUBDKTKBI-IYBDPMFKSA-N 1 1 374.485 3.532 20 5 FHBDMO COc1ccc([C@H](C)[NH2+]Cc2cc(OC)c(F)cc2[N+](=O)[O-])cc1F ZINC000184299754 944534771 /nfs/dbraw/zinc/53/47/71/944534771.db2.gz QIRBUKLLRCAGQH-JTQLQIEISA-N 1 1 352.337 3.741 20 5 FHBDMO O=c1[nH]ccc2c1C[N@@H+](Cc1ccc(-c3ccc([N+](=O)[O-])cc3)s1)CC2 ZINC000426383528 944621978 /nfs/dbraw/zinc/62/19/78/944621978.db2.gz BHCHETMUYGSMDU-UHFFFAOYSA-N 1 1 367.430 3.982 20 5 FHBDMO CCc1[nH+]ccn1[C@H](C)CC(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000843759757 944624861 /nfs/dbraw/zinc/62/48/61/944624861.db2.gz WXDARFVZSZJSKC-GFCCVEGCSA-N 1 1 364.833 3.617 20 5 FHBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000507599326 944664206 /nfs/dbraw/zinc/66/42/06/944664206.db2.gz XBEGFPOATQHMPL-UKRRQHHQSA-N 1 1 373.840 3.814 20 5 FHBDMO C[C@]1(c2ccccc2)CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000438484259 944666385 /nfs/dbraw/zinc/66/63/85/944666385.db2.gz QMQBKBAMSMCTIG-FQEVSTJZSA-N 1 1 364.405 3.808 20 5 FHBDMO C[N@H+]1CC[C@@H](NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)[C@H]1c1ccccc1 ZINC000536261096 944671949 /nfs/dbraw/zinc/67/19/49/944671949.db2.gz BENVAAWMCKZWRI-VQIMIIECSA-N 1 1 365.389 3.516 20 5 FHBDMO CN(CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC[C@H]1CCCC[N@H+]1C ZINC000072758969 944740805 /nfs/dbraw/zinc/74/08/05/944740805.db2.gz FBWXPGZUILUDIB-QGZVFWFLSA-N 1 1 372.469 3.599 20 5 FHBDMO O=C(C[N@H+]1CC[C@@H]2CCC[C@H]21)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000426455515 944839838 /nfs/dbraw/zinc/83/98/38/944839838.db2.gz TWROVJBEYWOWGE-BLLLJJGKSA-N 1 1 372.450 3.531 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@H+](CCO)C2CC2)ccc1Oc1ccccc1Cl ZINC000507132658 944975077 /nfs/dbraw/zinc/97/50/77/944975077.db2.gz OKRWTIRHDMSMRL-UHFFFAOYSA-N 1 1 362.813 3.997 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H](c2ccccc2C)C1 ZINC000507201146 945026214 /nfs/dbraw/zinc/02/62/14/945026214.db2.gz DPXSYJRDNSIDPR-MRXNPFEDSA-N 1 1 353.422 3.640 20 5 FHBDMO COc1cc(C[N@H+](C)Cc2ccccc2)c([N+](=O)[O-])cc1OC(F)F ZINC000053778418 945538873 /nfs/dbraw/zinc/53/88/73/945538873.db2.gz CIOZJCWPIUKLEV-UHFFFAOYSA-N 1 1 352.337 3.837 20 5 FHBDMO COc1cc(C[N@@H+](C)Cc2ccccc2)c([N+](=O)[O-])cc1OC(F)F ZINC000053778418 945538876 /nfs/dbraw/zinc/53/88/76/945538876.db2.gz CIOZJCWPIUKLEV-UHFFFAOYSA-N 1 1 352.337 3.837 20 5 FHBDMO CC[N@H+](Cc1ccc(Cl)cc1)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000519908722 945873976 /nfs/dbraw/zinc/87/39/76/945873976.db2.gz LYFGQXWOQMCDKO-KRWDZBQOSA-N 1 1 364.829 3.510 20 5 FHBDMO O=[N+]([O-])c1ccc(CN2CC[NH+](Cc3ccsc3)CC2)c(Cl)c1 ZINC000543854467 946081974 /nfs/dbraw/zinc/08/19/74/946081974.db2.gz QXOLPWQFURPBFE-UHFFFAOYSA-N 1 1 351.859 3.628 20 5 FHBDMO CC[N@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@H](C)c1cccc(OC)c1 ZINC000045806112 946160531 /nfs/dbraw/zinc/16/05/31/946160531.db2.gz HNJJLWANGAHRME-OAHLLOKOSA-N 1 1 371.437 3.933 20 5 FHBDMO CC[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@H](C)c1cccc(OC)c1 ZINC000045806112 946160539 /nfs/dbraw/zinc/16/05/39/946160539.db2.gz HNJJLWANGAHRME-OAHLLOKOSA-N 1 1 371.437 3.933 20 5 FHBDMO CC[N@@H+](CCNCc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1)C(C)C ZINC000236879132 946169296 /nfs/dbraw/zinc/16/92/96/946169296.db2.gz BMQFPYBYBKCGBM-UHFFFAOYSA-N 1 1 361.442 3.683 20 5 FHBDMO CCC[C@H](C)NC(=O)[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000783555346 946272468 /nfs/dbraw/zinc/27/24/68/946272468.db2.gz PGELJIMXVZXIPT-DZGCQCFKSA-N 1 1 367.877 3.765 20 5 FHBDMO CCC[C@H](C)NC(=O)[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000783555346 946272471 /nfs/dbraw/zinc/27/24/71/946272471.db2.gz PGELJIMXVZXIPT-DZGCQCFKSA-N 1 1 367.877 3.765 20 5 FHBDMO CC(C)c1ccc(C(=O)N2CC[C@H](C[N@@H+](C)CC3CC3)C2)cc1[N+](=O)[O-] ZINC000473904412 946604655 /nfs/dbraw/zinc/60/46/55/946604655.db2.gz XCGCOIZNZKJHPU-MRXNPFEDSA-N 1 1 359.470 3.522 20 5 FHBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCC[N@H+](C)Cc1ccc(F)cc1 ZINC000475555449 946639585 /nfs/dbraw/zinc/63/95/85/946639585.db2.gz MLKAMALXTUBHSW-UHFFFAOYSA-N 1 1 374.416 3.604 20 5 FHBDMO CC[N@H+]1C[C@@H](C)N(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[C@@H]1C ZINC000475194483 946678237 /nfs/dbraw/zinc/67/82/37/946678237.db2.gz QPACKDCEPGXPRS-WDEREUQCSA-N 1 1 374.363 3.560 20 5 FHBDMO Cc1ccc(C[NH2+][C@@H](CO)c2ccccc2OC(F)(F)F)cc1[N+](=O)[O-] ZINC000475566901 946679631 /nfs/dbraw/zinc/67/96/31/946679631.db2.gz JGHDJEFKGKIXQL-AWEZNQCLSA-N 1 1 370.327 3.625 20 5 FHBDMO COc1cc(C[N@H+]2CCCC3(CC3)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000186607860 946693484 /nfs/dbraw/zinc/69/34/84/946693484.db2.gz CSALXYUBZXGJBV-UHFFFAOYSA-N 1 1 374.359 3.921 20 5 FHBDMO COc1cc(C[N@@H+]2CCCC3(CC3)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000186607860 946693478 /nfs/dbraw/zinc/69/34/78/946693478.db2.gz CSALXYUBZXGJBV-UHFFFAOYSA-N 1 1 374.359 3.921 20 5 FHBDMO CCOC(=O)c1coc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1 ZINC000475196404 946694045 /nfs/dbraw/zinc/69/40/45/946694045.db2.gz VAEUQKWMHFCBEK-UHFFFAOYSA-N 1 1 372.299 3.673 20 5 FHBDMO CC(C)OC(=O)C[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000184452071 946697782 /nfs/dbraw/zinc/69/77/82/946697782.db2.gz GHJDVQYSRRMUFQ-CYBMUJFWSA-N 1 1 354.834 3.802 20 5 FHBDMO CC(C)OC(=O)C[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000184452071 946697794 /nfs/dbraw/zinc/69/77/94/946697794.db2.gz GHJDVQYSRRMUFQ-CYBMUJFWSA-N 1 1 354.834 3.802 20 5 FHBDMO CC[N@H+](Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-])CC1CCC1 ZINC000475581281 946747117 /nfs/dbraw/zinc/74/71/17/946747117.db2.gz NURRKTGSITUFAK-UHFFFAOYSA-N 1 1 358.385 3.869 20 5 FHBDMO CCCC[N@@H+](C)CC1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000112560657 946902756 /nfs/dbraw/zinc/90/27/56/946902756.db2.gz JZAQICRJGOYUET-UHFFFAOYSA-N 1 1 367.877 3.832 20 5 FHBDMO COc1ccc(C[NH2+]Cc2ccccc2Br)cc1[N+](=O)[O-] ZINC000048820868 946929587 /nfs/dbraw/zinc/92/95/87/946929587.db2.gz UAKDVYWYZBMZAX-UHFFFAOYSA-N 1 1 351.200 3.656 20 5 FHBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@H]1C ZINC000475361810 946954150 /nfs/dbraw/zinc/95/41/50/946954150.db2.gz KMUAUHQSUQNRBX-UKRRQHHQSA-N 1 1 374.462 3.954 20 5 FHBDMO CCCC[N@H+]1CCCC[C@@H]1CNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000523178707 946969573 /nfs/dbraw/zinc/96/95/73/946969573.db2.gz GRRBKFCEOSPLEU-OAHLLOKOSA-N 1 1 360.458 3.546 20 5 FHBDMO CCCC[N@@H+](C)CC1CCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000112918666 946992256 /nfs/dbraw/zinc/99/22/56/946992256.db2.gz IVHUKYISHGQSSX-UHFFFAOYSA-N 1 1 367.877 3.832 20 5 FHBDMO CC[C@@H]1CCCC[C@H]1[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000444667134 947094354 /nfs/dbraw/zinc/09/43/54/947094354.db2.gz AVMJRXBPSITRKX-RHSMWYFYSA-N 1 1 363.458 3.833 20 5 FHBDMO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444688358 947113502 /nfs/dbraw/zinc/11/35/02/947113502.db2.gz JFEKJKYEMOWJQL-LLVKDONJSA-N 1 1 356.430 3.582 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)Cc1cc(C)cc(C)c1 ZINC000444704421 947132702 /nfs/dbraw/zinc/13/27/02/947132702.db2.gz LBOJKZWXWJAYSB-UHFFFAOYSA-N 1 1 371.437 3.681 20 5 FHBDMO CC(C)[C@@H]1CCC[N@@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000444771297 947207380 /nfs/dbraw/zinc/20/73/80/947207380.db2.gz OQVJZXFIXSFPAG-QWHCGFSZSA-N 1 1 353.850 3.943 20 5 FHBDMO CC(C)[C@@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000444771297 947207388 /nfs/dbraw/zinc/20/73/88/947207388.db2.gz OQVJZXFIXSFPAG-QWHCGFSZSA-N 1 1 353.850 3.943 20 5 FHBDMO C[C@H](c1cc2ccccc2o1)[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248374643 947231020 /nfs/dbraw/zinc/23/10/20/947231020.db2.gz SERZMLUVYYJUGY-GDBMZVCRSA-N 1 1 370.405 3.774 20 5 FHBDMO Cc1ccc(C)c([C@@H](C)[N@@H+](C)C[C@H](O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000523438729 947268561 /nfs/dbraw/zinc/26/85/61/947268561.db2.gz NOURIPQRZBVXRG-AEFFLSMTSA-N 1 1 358.438 3.644 20 5 FHBDMO CCOC[C@H]1CC[N@@H+](Cc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)C1 ZINC000093839059 947368656 /nfs/dbraw/zinc/36/86/56/947368656.db2.gz WEFBPKIFMBPHMC-AWEZNQCLSA-N 1 1 360.410 3.722 20 5 FHBDMO COC(=O)[C@@H](C)[C@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000152073771 947519039 /nfs/dbraw/zinc/51/90/39/947519039.db2.gz ZSZDTDUDXLLJAP-SJCJKPOMSA-N 1 1 362.813 3.888 20 5 FHBDMO C[C@H]1C[C@H](NC(=O)c2ccc(F)cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000150781150 947531942 /nfs/dbraw/zinc/53/19/42/947531942.db2.gz ZVILIDPPHKKONY-WMLDXEAASA-N 1 1 371.412 3.517 20 5 FHBDMO CC[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@]2(CCOC2)O1 ZINC000475624992 947611687 /nfs/dbraw/zinc/61/16/87/947611687.db2.gz LTADRPBIGRDERJ-QRWLVFNGSA-N 1 1 372.421 3.625 20 5 FHBDMO Cc1c(C[NH2+][C@@H](c2cnn(C)c2)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000184606638 947838961 /nfs/dbraw/zinc/83/89/61/947838961.db2.gz IJJFYJCJROIGJM-LJQANCHMSA-N 1 1 354.385 3.655 20 5 FHBDMO C[NH+](C)[C@@H](CNc1nc2ccccn2c1[N+](=O)[O-])c1ccccc1Cl ZINC000105133297 947873795 /nfs/dbraw/zinc/87/37/95/947873795.db2.gz XMMRIZWSSSKLFZ-AWEZNQCLSA-N 1 1 359.817 3.611 20 5 FHBDMO CCC[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)C1 ZINC001167808569 948002955 /nfs/dbraw/zinc/00/29/55/948002955.db2.gz SAUBNMNBVIFGOA-OAHLLOKOSA-N 1 1 369.421 3.601 20 5 FHBDMO COc1ccc(-c2ccc(C[NH2+]Cc3cnc(C)s3)o2)c([N+](=O)[O-])c1 ZINC000105448495 948034148 /nfs/dbraw/zinc/03/41/48/948034148.db2.gz SKSDDTIVJHRFSN-UHFFFAOYSA-N 1 1 359.407 3.918 20 5 FHBDMO CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)C[N@@H+](C)Cc2ccccc2)c1 ZINC000182077267 948537148 /nfs/dbraw/zinc/53/71/48/948537148.db2.gz KZVJBYFHEDZAAO-CQSZACIVSA-N 1 1 373.478 3.567 20 5 FHBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3C[N@H+]2Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000571126212 948588425 /nfs/dbraw/zinc/58/84/25/948588425.db2.gz VOERSEVBRXXUDP-YURUWKFZSA-N 1 1 354.406 3.710 20 5 FHBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[N@H+](C2CCCC2)CC1 ZINC000571333375 948607722 /nfs/dbraw/zinc/60/77/22/948607722.db2.gz FVPORMGAKXJSPJ-UHFFFAOYSA-N 1 1 360.458 3.639 20 5 FHBDMO C[N@@H+](CCCNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)C1CCCCC1 ZINC000571479541 948623213 /nfs/dbraw/zinc/62/32/13/948623213.db2.gz PEBRGBZKNDWPJZ-UHFFFAOYSA-N 1 1 367.877 3.562 20 5 FHBDMO C[N@H+]1CCC[C@H]2CN(c3ccc([N+](=O)[O-])c(-c4ccccc4)n3)CC[C@@H]21 ZINC000090112785 948666654 /nfs/dbraw/zinc/66/66/54/948666654.db2.gz DOQNLBLJZWOFEU-IRXDYDNUSA-N 1 1 352.438 3.577 20 5 FHBDMO CCn1c(C)nc([N+](=O)[O-])c1N1CCC(CC[N@@H+](CC)CC(C)C)CC1 ZINC000568130131 567910857 /nfs/dbraw/zinc/91/08/57/567910857.db2.gz JQXIHVFKNVCSOG-UHFFFAOYSA-N 1 1 365.522 3.704 20 5 FHBDMO Cc1cnn([C@@H]2CC[N@H+](Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)C2)c1 ZINC000291013581 567958161 /nfs/dbraw/zinc/95/81/61/567958161.db2.gz XBZPVKQVARZTCZ-QGZVFWFLSA-N 1 1 369.450 3.670 20 5 FHBDMO Cc1cnn([C@@H]2CC[N@@H+](Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)C2)c1 ZINC000291013581 567958162 /nfs/dbraw/zinc/95/81/62/567958162.db2.gz XBZPVKQVARZTCZ-QGZVFWFLSA-N 1 1 369.450 3.670 20 5 FHBDMO Cc1sc(C(=O)N2CCC[C@H](C[N@@H+]3CCCC[C@H]3C)C2)cc1[N+](=O)[O-] ZINC000265004327 568060630 /nfs/dbraw/zinc/06/06/30/568060630.db2.gz FGYPQLXIQWPJTK-UKRRQHHQSA-N 1 1 365.499 3.691 20 5 FHBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@H+](C)C[C@@H]2CCCO2)cc1OC ZINC000481594595 568064079 /nfs/dbraw/zinc/06/40/79/568064079.db2.gz DUWOOQQYHVXIJT-ZBFHGGJFSA-N 1 1 366.458 3.639 20 5 FHBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+](C)C[C@@H]2CCCO2)cc1OC ZINC000481594595 568064080 /nfs/dbraw/zinc/06/40/80/568064080.db2.gz DUWOOQQYHVXIJT-ZBFHGGJFSA-N 1 1 366.458 3.639 20 5 FHBDMO COc1ccc([C@H](O)C2CC[NH+](Cc3csc([N+](=O)[O-])c3)CC2)cc1 ZINC000291192681 568073170 /nfs/dbraw/zinc/07/31/70/568073170.db2.gz GSWCNJFWCZDFFR-SFHVURJKSA-N 1 1 362.451 3.611 20 5 FHBDMO CS[C@@H](C[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)C(C)(C)C ZINC000568671656 568116861 /nfs/dbraw/zinc/11/68/61/568116861.db2.gz ITDBALRHUQSPBM-JKSUJKDBSA-N 1 1 362.499 3.785 20 5 FHBDMO Cc1cc(N2CCC[C@H](c3[nH]cc[nH+]3)C2)c(Br)cc1[N+](=O)[O-] ZINC000568706054 568132595 /nfs/dbraw/zinc/13/25/95/568132595.db2.gz XZAHJGORNNTSBB-NSHDSACASA-N 1 1 365.231 3.773 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(N2CC[C@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)n1 ZINC000481990156 568215895 /nfs/dbraw/zinc/21/58/95/568215895.db2.gz IMRIFKHGDOQNAD-OALUTQOASA-N 1 1 366.465 3.789 20 5 FHBDMO Cc1cc(Cc2noc([C@@]3(F)CC[N@@H+](C(C)(C)C)C3)n2)ccc1[N+](=O)[O-] ZINC000569159734 568300548 /nfs/dbraw/zinc/30/05/48/568300548.db2.gz XJBRHDYCOCEUGQ-GOSISDBHSA-N 1 1 362.405 3.546 20 5 FHBDMO Cc1cc(Cc2noc([C@@]3(F)CC[N@H+](C(C)(C)C)C3)n2)ccc1[N+](=O)[O-] ZINC000569159734 568300549 /nfs/dbraw/zinc/30/05/49/568300549.db2.gz XJBRHDYCOCEUGQ-GOSISDBHSA-N 1 1 362.405 3.546 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H](CC(=O)OC(C)(C)C)C1 ZINC000570232001 568463917 /nfs/dbraw/zinc/46/39/17/568463917.db2.gz MDAIHBSBLXAWFP-CQSZACIVSA-N 1 1 364.442 3.547 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](CC(=O)OC(C)(C)C)C1 ZINC000570232001 568463918 /nfs/dbraw/zinc/46/39/18/568463918.db2.gz MDAIHBSBLXAWFP-CQSZACIVSA-N 1 1 364.442 3.547 20 5 FHBDMO CC(=Cc1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](c2nnc(C3CC3)[nH]2)C1 ZINC000570248028 568466233 /nfs/dbraw/zinc/46/62/33/568466233.db2.gz HOEHNFIBCAIBQF-SHRNQRGKSA-N 1 1 367.453 3.873 20 5 FHBDMO CC(=Cc1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H](c2nc(C3CC3)n[nH]2)C1 ZINC000570248028 568466235 /nfs/dbraw/zinc/46/62/35/568466235.db2.gz HOEHNFIBCAIBQF-SHRNQRGKSA-N 1 1 367.453 3.873 20 5 FHBDMO CC(=Cc1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](c2nc(C3CC3)n[nH]2)C1 ZINC000570248028 568466237 /nfs/dbraw/zinc/46/62/37/568466237.db2.gz HOEHNFIBCAIBQF-SHRNQRGKSA-N 1 1 367.453 3.873 20 5 FHBDMO CC(C)c1ccc(C[N@@H+](C)Cc2ccc(-c3nn[nH]n3)cc2)cc1[N+](=O)[O-] ZINC000824347731 608526109 /nfs/dbraw/zinc/52/61/09/608526109.db2.gz LTUJXRXYWWGCLM-UHFFFAOYSA-N 1 1 366.425 3.530 20 5 FHBDMO O=[N+]([O-])c1cnc(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)c(Cl)c1 ZINC001164624680 719055511 /nfs/dbraw/zinc/05/55/11/719055511.db2.gz OUGUICJUVQIIQE-QAPCUYQASA-N 1 1 372.856 3.744 20 5 FHBDMO O=[N+]([O-])c1c(Cl)ccnc1N1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001164618863 719056532 /nfs/dbraw/zinc/05/65/32/719056532.db2.gz BZQUXJUVAZULQO-WBVHZDCISA-N 1 1 372.856 3.744 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)n1 ZINC001164623614 719083177 /nfs/dbraw/zinc/08/31/77/719083177.db2.gz JXYCFZIVGROJFT-RBUKOAKNSA-N 1 1 366.465 3.707 20 5 FHBDMO C[C@@H](CNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)[N@@H+](C)C1CC1 ZINC000110698459 945063963 /nfs/dbraw/zinc/06/39/63/945063963.db2.gz XMKZXPQYNIEUBB-AWEZNQCLSA-N 1 1 368.437 3.551 20 5 FHBDMO Cn1c2cc(Cl)ccc2nc1C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000559072586 927997506 /nfs/dbraw/zinc/99/75/06/927997506.db2.gz LPCIKPBWMLBELH-UHFFFAOYSA-N 1 1 358.829 3.809 20 5 FHBDMO Cn1c2cc(Cl)ccc2nc1C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000559072586 927997509 /nfs/dbraw/zinc/99/75/09/927997509.db2.gz LPCIKPBWMLBELH-UHFFFAOYSA-N 1 1 358.829 3.809 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CCC[C@H]3c3ccncc3)co2)cc1 ZINC000154041123 928011389 /nfs/dbraw/zinc/01/13/89/928011389.db2.gz NZLWDTKSCMEDMT-SFHVURJKSA-N 1 1 350.378 3.982 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@H]3c3ccncc3)co2)cc1 ZINC000154041123 928011416 /nfs/dbraw/zinc/01/14/16/928011416.db2.gz NZLWDTKSCMEDMT-SFHVURJKSA-N 1 1 350.378 3.982 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1Cn1cnc2ccccc21 ZINC000430209132 928090678 /nfs/dbraw/zinc/09/06/78/928090678.db2.gz XASVUWOPBIRQPC-QGZVFWFLSA-N 1 1 366.421 3.618 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H](C(=O)c2ccc(F)cc2)C1 ZINC000430215035 928203554 /nfs/dbraw/zinc/20/35/54/928203554.db2.gz CUOXSDFPGBDXDN-INIZCTEOSA-N 1 1 372.396 3.837 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](C(=O)c2ccc(F)cc2)C1 ZINC000430215035 928203565 /nfs/dbraw/zinc/20/35/65/928203565.db2.gz CUOXSDFPGBDXDN-INIZCTEOSA-N 1 1 372.396 3.837 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](COCc2ccccc2)C1 ZINC000430217779 928258113 /nfs/dbraw/zinc/25/81/13/928258113.db2.gz IJQUYZBAGDUBIC-KRWDZBQOSA-N 1 1 356.422 3.642 20 5 FHBDMO Cc1cccc(C[N@@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)n1 ZINC000471184869 928706358 /nfs/dbraw/zinc/70/63/58/928706358.db2.gz CMXUQNGNFCNSOU-UHFFFAOYSA-N 1 1 352.394 3.628 20 5 FHBDMO COc1ccc(NC(=O)CC[N@@H+](C)C[C@@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000066854663 929233828 /nfs/dbraw/zinc/23/38/28/929233828.db2.gz BZPJBQFLHPDSHM-OAHLLOKOSA-N 1 1 371.437 3.668 20 5 FHBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCCC[C@H]1CCCc1ccccc1 ZINC000535628474 929309881 /nfs/dbraw/zinc/30/98/81/929309881.db2.gz WBSXMXFDXSQESX-IBGZPJMESA-N 1 1 369.465 3.634 20 5 FHBDMO Cc1ccc2c(c1)[C@H]1C[N@@H+](C)CC[C@@H]1N2C(=O)c1ccc([N+](=O)[O-])cc1C ZINC000134014670 929639948 /nfs/dbraw/zinc/63/99/48/929639948.db2.gz UFWSWYKWNVBLOH-QUCCMNQESA-N 1 1 365.433 3.660 20 5 FHBDMO O=C(NC1CCCCC1)OC[C@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000796681990 937347444 /nfs/dbraw/zinc/34/74/44/937347444.db2.gz FZGITFWZOLVJKB-GOSISDBHSA-N 1 1 361.442 3.618 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1[C@H](C)C[C@@H]2CCCC[C@@H]21 ZINC000118850473 929763822 /nfs/dbraw/zinc/76/38/22/929763822.db2.gz HXWGOGHTMDVQDL-KEYYUXOJSA-N 1 1 361.442 3.585 20 5 FHBDMO COc1ccc(C[N@H+]2CCC[C@@H]2C[C@H](O)c2cccs2)cc1[N+](=O)[O-] ZINC000175851047 929968539 /nfs/dbraw/zinc/96/85/39/929968539.db2.gz LLQCAZKZUXKZGQ-ZBFHGGJFSA-N 1 1 362.451 3.753 20 5 FHBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3ccsc3)CC2)cc1C(F)(F)F ZINC000536012197 937415504 /nfs/dbraw/zinc/41/55/04/937415504.db2.gz REJYLOHBLACYEH-UHFFFAOYSA-N 1 1 371.384 3.997 20 5 FHBDMO CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](CC)C[C@H]1C ZINC000561146517 930872600 /nfs/dbraw/zinc/87/26/00/930872600.db2.gz BHHPDNYMOAVOHF-CQSZACIVSA-N 1 1 365.499 3.653 20 5 FHBDMO CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](CC)C[C@H]1C ZINC000561146517 930872607 /nfs/dbraw/zinc/87/26/07/930872607.db2.gz BHHPDNYMOAVOHF-CQSZACIVSA-N 1 1 365.499 3.653 20 5 FHBDMO COc1ccc(CN2CC[N@@H+](Cc3ccccc3)CC[C@@H]2C)cc1[N+](=O)[O-] ZINC000610451946 931018372 /nfs/dbraw/zinc/01/83/72/931018372.db2.gz PRTYLTXLSYCDLV-KRWDZBQOSA-N 1 1 369.465 3.700 20 5 FHBDMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC001167434214 931140180 /nfs/dbraw/zinc/14/01/80/931140180.db2.gz SQXMKFXKBGSAOM-TYNCELHUSA-N 1 1 351.834 3.840 20 5 FHBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)CCN1c1ncc([N+](=O)[O-])cc1Cl ZINC000610468832 931379264 /nfs/dbraw/zinc/37/92/64/931379264.db2.gz IGRCNLOXCRUILQ-CQSZACIVSA-N 1 1 360.845 3.744 20 5 FHBDMO O=C([C@H]1CC[N@H+](C2CCCCC2)C1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000126114179 931402431 /nfs/dbraw/zinc/40/24/31/931402431.db2.gz WGKLTCQHOOQNOM-KRWDZBQOSA-N 1 1 371.481 3.740 20 5 FHBDMO CC[N@@H+](C)[C@@H](C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccccc1 ZINC000177875428 931430797 /nfs/dbraw/zinc/43/07/97/931430797.db2.gz AOXBFOXNXIWJGZ-HNAYVOBHSA-N 1 1 355.438 3.773 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H](c2nccs2)C1 ZINC000157013819 931774497 /nfs/dbraw/zinc/77/44/97/931774497.db2.gz FHKWAZUECAGZIG-CQSZACIVSA-N 1 1 374.466 3.568 20 5 FHBDMO Cc1ccc(C[N@H+](C)[C@@H](C)c2ccc(-n3cncn3)cc2)cc1[N+](=O)[O-] ZINC000127175505 931864008 /nfs/dbraw/zinc/86/40/08/931864008.db2.gz NPPXZNRZTPZVRO-HNNXBMFYSA-N 1 1 351.410 3.677 20 5 FHBDMO COc1ccc(OCC[N@@H+]2CCc3cc(F)ccc3[C@H]2C)c([N+](=O)[O-])c1 ZINC000610369816 931992357 /nfs/dbraw/zinc/99/23/57/931992357.db2.gz JCNHKPXZAMLADN-CYBMUJFWSA-N 1 1 360.385 3.741 20 5 FHBDMO COc1ccc(OCC[N@H+]2CCc3cc(F)ccc3[C@H]2C)c([N+](=O)[O-])c1 ZINC000610369816 931992362 /nfs/dbraw/zinc/99/23/62/931992362.db2.gz JCNHKPXZAMLADN-CYBMUJFWSA-N 1 1 360.385 3.741 20 5 FHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2ccc(Br)cn2)C2CC2)c1 ZINC000178000331 932010638 /nfs/dbraw/zinc/01/06/38/932010638.db2.gz FGHULQARTJMTCL-UHFFFAOYSA-N 1 1 362.227 3.917 20 5 FHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccc(Br)cn2)C2CC2)c1 ZINC000178000331 932010645 /nfs/dbraw/zinc/01/06/45/932010645.db2.gz FGHULQARTJMTCL-UHFFFAOYSA-N 1 1 362.227 3.917 20 5 FHBDMO COc1ccc(NC(=O)CC[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000135227876 932078258 /nfs/dbraw/zinc/07/82/58/932078258.db2.gz SWCAFPKUDZZHBB-UHFFFAOYSA-N 1 1 369.421 3.597 20 5 FHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](OCc2c(C)noc2C)C1 ZINC000581456162 932089960 /nfs/dbraw/zinc/08/99/60/932089960.db2.gz SHWNALZQUFYSCG-JNMQVBFRSA-N 1 1 371.437 3.894 20 5 FHBDMO CCOc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)CCO2 ZINC000178072535 932269299 /nfs/dbraw/zinc/26/92/99/932269299.db2.gz VTIKHTLWBJLWQC-INIZCTEOSA-N 1 1 358.394 3.616 20 5 FHBDMO Cc1cc(N2CC[C@@]3(C2)CCC[N@H+](C)C3)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000581679246 932475930 /nfs/dbraw/zinc/47/59/30/932475930.db2.gz NXNXJPIUIQHFCV-INIZCTEOSA-N 1 1 357.376 3.844 20 5 FHBDMO COc1ccc(OC)c(C[N@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C2CC2)c1 ZINC000051184202 932536308 /nfs/dbraw/zinc/53/63/08/932536308.db2.gz QXNILFZFSJNBBJ-UHFFFAOYSA-N 1 1 372.421 3.785 20 5 FHBDMO COc1ccc(OC)c(C[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C2CC2)c1 ZINC000051184202 932536309 /nfs/dbraw/zinc/53/63/09/932536309.db2.gz QXNILFZFSJNBBJ-UHFFFAOYSA-N 1 1 372.421 3.785 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000430660554 932696692 /nfs/dbraw/zinc/69/66/92/932696692.db2.gz DSKJYRQMZDZCEX-WMZOPIPTSA-N 1 1 367.449 3.686 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCSC4(CCCCC4)C3)n2)cc1 ZINC000175965507 932921634 /nfs/dbraw/zinc/92/16/34/932921634.db2.gz ZZKONVXIMSNTKX-UHFFFAOYSA-N 1 1 374.466 3.897 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCSC4(CCCCC4)C3)n2)cc1 ZINC000175965507 932921641 /nfs/dbraw/zinc/92/16/41/932921641.db2.gz ZZKONVXIMSNTKX-UHFFFAOYSA-N 1 1 374.466 3.897 20 5 FHBDMO C[C@@H]([NH2+][C@@H](C)c1ncnn1C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000276709295 933009935 /nfs/dbraw/zinc/00/99/35/933009935.db2.gz WMILFGDCMQDGFB-NEPJUHHUSA-N 1 1 357.439 3.864 20 5 FHBDMO CN(C(=O)[C@@H]1CC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1)c1ccccc1 ZINC000430879223 933357897 /nfs/dbraw/zinc/35/78/97/933357897.db2.gz MXWBXLVXWVZGDG-YPLUBFQTSA-N 1 1 365.433 3.593 20 5 FHBDMO COc1ccc(-c2ccc(C[N@@H+]3CCO[C@H]4CCC[C@@H]43)o2)c([N+](=O)[O-])c1 ZINC000510693842 933441259 /nfs/dbraw/zinc/44/12/59/933441259.db2.gz UBQRXOPFDIWEES-LPHOPBHVSA-N 1 1 358.394 3.617 20 5 FHBDMO COc1ccc(-c2ccc(C[N@H+]3CCO[C@H]4CCC[C@@H]43)o2)c([N+](=O)[O-])c1 ZINC000510693842 933441265 /nfs/dbraw/zinc/44/12/65/933441265.db2.gz UBQRXOPFDIWEES-LPHOPBHVSA-N 1 1 358.394 3.617 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1CCCCNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000121607157 933652191 /nfs/dbraw/zinc/65/21/91/933652191.db2.gz UAVCIXIAOYFLOE-OAHLLOKOSA-N 1 1 374.485 3.554 20 5 FHBDMO CC(C)[N@H+](CC(=O)N[C@H](C)c1cccs1)Cc1ccc([N+](=O)[O-])cc1 ZINC000098135175 934302860 /nfs/dbraw/zinc/30/28/60/934302860.db2.gz CGZCIJUOLPNYJN-CQSZACIVSA-N 1 1 361.467 3.744 20 5 FHBDMO CC(C)[N@@H+](CC(=O)N[C@H](C)c1cccs1)Cc1ccc([N+](=O)[O-])cc1 ZINC000098135175 934302867 /nfs/dbraw/zinc/30/28/67/934302867.db2.gz CGZCIJUOLPNYJN-CQSZACIVSA-N 1 1 361.467 3.744 20 5 FHBDMO Cc1noc(C[C@H]([NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c2ccccc2)n1 ZINC000277040792 934463648 /nfs/dbraw/zinc/46/36/48/934463648.db2.gz GCXLRILENNXCIL-GUYCJALGSA-N 1 1 352.394 3.921 20 5 FHBDMO C[C@]1(O)CCC[N@@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000538718667 934897937 /nfs/dbraw/zinc/89/79/37/934897937.db2.gz GRQGBTMNVMOJRI-IBGZPJMESA-N 1 1 360.385 3.873 20 5 FHBDMO COc1cc(C[NH2+][C@H](C)c2cncs2)c([N+](=O)[O-])cc1OC(F)F ZINC000934203662 935005420 /nfs/dbraw/zinc/00/54/20/935005420.db2.gz YQWYMEWTRYDIQQ-MRVPVSSYSA-N 1 1 359.354 3.512 20 5 FHBDMO Cc1ccc(NC(=O)[C@@H](C)[N@H+](C)CCc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000511060380 935182650 /nfs/dbraw/zinc/18/26/50/935182650.db2.gz ROXMEAHEKDUDQA-MRXNPFEDSA-N 1 1 355.438 3.713 20 5 FHBDMO Cc1ccc(NC(=O)[C@@H](C)[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000511060380 935182651 /nfs/dbraw/zinc/18/26/51/935182651.db2.gz ROXMEAHEKDUDQA-MRXNPFEDSA-N 1 1 355.438 3.713 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC=C(c4ccco4)C3)n2)cc1 ZINC000511067847 935219444 /nfs/dbraw/zinc/21/94/44/935219444.db2.gz XFWCANUKJDXEHI-UHFFFAOYSA-N 1 1 352.350 3.527 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC=C(c4ccco4)C3)n2)cc1 ZINC000511067847 935219448 /nfs/dbraw/zinc/21/94/48/935219448.db2.gz XFWCANUKJDXEHI-UHFFFAOYSA-N 1 1 352.350 3.527 20 5 FHBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CCCN3c4ccccc4C[C@H]3C2)c(F)c1 ZINC000582091557 935241652 /nfs/dbraw/zinc/24/16/52/935241652.db2.gz XWUNOCBXWJBDOO-HNNXBMFYSA-N 1 1 359.376 3.510 20 5 FHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CCCN3c4ccccc4C[C@H]3C2)c(F)c1 ZINC000582091557 935241658 /nfs/dbraw/zinc/24/16/58/935241658.db2.gz XWUNOCBXWJBDOO-HNNXBMFYSA-N 1 1 359.376 3.510 20 5 FHBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@@H](c3cccc(C(F)(F)F)c3)C2)c1 ZINC000511080214 935314704 /nfs/dbraw/zinc/31/47/04/935314704.db2.gz HUGVMLURDGMEDP-CQSZACIVSA-N 1 1 368.359 3.690 20 5 FHBDMO CSc1cccc(NC(=O)[C@@H](C)[N@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511083386 935341099 /nfs/dbraw/zinc/34/10/99/935341099.db2.gz YUURSOGMJAOZLP-CQSZACIVSA-N 1 1 373.478 3.818 20 5 FHBDMO CSc1cccc(NC(=O)[C@@H](C)[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511083386 935341104 /nfs/dbraw/zinc/34/11/04/935341104.db2.gz YUURSOGMJAOZLP-CQSZACIVSA-N 1 1 373.478 3.818 20 5 FHBDMO O=[N+]([O-])c1c2cccnc2ccc1N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000051502430 935388312 /nfs/dbraw/zinc/38/83/12/935388312.db2.gz XGECIWCTQKHXFA-UHFFFAOYSA-N 1 1 362.433 3.855 20 5 FHBDMO C[C@@H](C(=O)Nc1ccc(Cl)cc1)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511105787 935582562 /nfs/dbraw/zinc/58/25/62/935582562.db2.gz KITCVKUXWHASGC-ZDUSSCGKSA-N 1 1 361.829 3.750 20 5 FHBDMO C[C@@H](C(=O)Nc1ccc(Cl)cc1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511105787 935582563 /nfs/dbraw/zinc/58/25/63/935582563.db2.gz KITCVKUXWHASGC-ZDUSSCGKSA-N 1 1 361.829 3.750 20 5 FHBDMO O=C(c1cc2ccccc2c2cccnc12)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000684845801 935604614 /nfs/dbraw/zinc/60/46/14/935604614.db2.gz UVYSQBASXGBMCP-PMACEKPBSA-N 1 1 363.436 3.646 20 5 FHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccn(-c2c(F)cccc2F)n1 ZINC000511137880 935768095 /nfs/dbraw/zinc/76/80/95/935768095.db2.gz MOJOVYHBAKBCNO-UHFFFAOYSA-N 1 1 372.375 3.733 20 5 FHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccn(-c2c(F)cccc2F)n1 ZINC000511137880 935768097 /nfs/dbraw/zinc/76/80/97/935768097.db2.gz MOJOVYHBAKBCNO-UHFFFAOYSA-N 1 1 372.375 3.733 20 5 FHBDMO COc1cc(C[NH2+][C@@H](C)c2cnn(CC3CCC3)c2)c([N+](=O)[O-])cc1F ZINC000934562486 935890722 /nfs/dbraw/zinc/89/07/22/935890722.db2.gz QLQUTUWXJYVSGT-LBPRGKRZSA-N 1 1 362.405 3.590 20 5 FHBDMO CCCCNC(=O)c1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000479885213 935912225 /nfs/dbraw/zinc/91/22/25/935912225.db2.gz HUPXNXSRQUZTCW-UHFFFAOYSA-N 1 1 359.401 3.554 20 5 FHBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 ZINC000176350241 935918695 /nfs/dbraw/zinc/91/86/95/935918695.db2.gz GVWGOUNRCPPTIP-CYBMUJFWSA-N 1 1 361.467 3.517 20 5 FHBDMO CCc1ccc(C[NH+]2CCN(c3nc(C)cc(C)c3[N+](=O)[O-])CC2)s1 ZINC000582744733 936067345 /nfs/dbraw/zinc/06/73/45/936067345.db2.gz BJCJYIPBLZBDDH-UHFFFAOYSA-N 1 1 360.483 3.553 20 5 FHBDMO COc1ccc(OCC[N@@H+](C)Cc2cc3ccccc3o2)c([N+](=O)[O-])c1 ZINC000472255594 936068085 /nfs/dbraw/zinc/06/80/85/936068085.db2.gz HFCQAOJMUXCVPO-UHFFFAOYSA-N 1 1 356.378 3.860 20 5 FHBDMO C[C@H](Nc1ncnc2ccc([N+](=O)[O-])cc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000611713908 936075667 /nfs/dbraw/zinc/07/56/67/936075667.db2.gz LGZQLGOLEXVYSL-UONOGXRCSA-N 1 1 355.442 3.603 20 5 FHBDMO C[C@H]1C[N@@H+](CC(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)C(C)(C)C1 ZINC000472269353 936206293 /nfs/dbraw/zinc/20/62/93/936206293.db2.gz VCCBZBPDCASUDE-GFCCVEGCSA-N 1 1 374.466 3.777 20 5 FHBDMO CCOc1cc(C[N@H+]2CC[C@@H]2Cc2ccc(OC)cc2)ccc1[N+](=O)[O-] ZINC001167636449 936274025 /nfs/dbraw/zinc/27/40/25/936274025.db2.gz SVMCEUOTZSPJET-QGZVFWFLSA-N 1 1 356.422 3.819 20 5 FHBDMO COc1ccc(-n2ccc(C[NH2+][C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)n2)cc1 ZINC000178711540 936280888 /nfs/dbraw/zinc/28/08/88/936280888.db2.gz FLOLRPKNRRXJPP-HNNXBMFYSA-N 1 1 366.421 3.948 20 5 FHBDMO C[C@H](C(=O)N1CCC[C@H]([N@@H+]2[C@H](C)CC[C@@H]2C)C1)c1cccc([N+](=O)[O-])c1 ZINC000583787052 938408424 /nfs/dbraw/zinc/40/84/24/938408424.db2.gz YOLLNAGSLIFXNE-RCJHGTSTSA-N 1 1 359.470 3.562 20 5 FHBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C[C@H]1C ZINC000437260266 945174622 /nfs/dbraw/zinc/17/46/22/945174622.db2.gz SXLIOFPPOQULSH-RISCZKNCSA-N 1 1 373.375 3.558 20 5 FHBDMO Cc1c[nH+]ccc1OC1CCN(c2ccnc3c2cccc3[N+](=O)[O-])CC1 ZINC000432140051 945179950 /nfs/dbraw/zinc/17/99/50/945179950.db2.gz OLOZWKCQWUVDIQ-UHFFFAOYSA-N 1 1 364.405 3.894 20 5 FHBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@H](CO)c1ccccc1 ZINC000584007120 938535223 /nfs/dbraw/zinc/53/52/23/938535223.db2.gz IHTUTPGREANUCT-MRXNPFEDSA-N 1 1 354.328 3.779 20 5 FHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@H](CO)c1ccccc1 ZINC000584007120 938535225 /nfs/dbraw/zinc/53/52/25/938535225.db2.gz IHTUTPGREANUCT-MRXNPFEDSA-N 1 1 354.328 3.779 20 5 FHBDMO Cc1csc(NC2CC[NH+](C/C=C\c3ccccc3[N+](=O)[O-])CC2)n1 ZINC000473076546 945186715 /nfs/dbraw/zinc/18/67/15/945186715.db2.gz SSRRCMAUYDKIMG-XQRVVYSFSA-N 1 1 358.467 3.949 20 5 FHBDMO Cn1cc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c(C(C)(C)C)n1 ZINC000278728537 938693123 /nfs/dbraw/zinc/69/31/23/938693123.db2.gz LNYOTIKLVFXYOW-UHFFFAOYSA-N 1 1 370.375 3.934 20 5 FHBDMO CC1(C)C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H]1[C@@H]1CCCO1 ZINC000289936110 938909317 /nfs/dbraw/zinc/90/93/17/938909317.db2.gz VKYJSOPIIQKAPB-QFBILLFUSA-N 1 1 371.437 3.682 20 5 FHBDMO C[C@@H](C(=O)NC[C@H]1CCC[N@H+]1C1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000573282384 938968853 /nfs/dbraw/zinc/96/88/53/938968853.db2.gz ICJPVOQQSIPMHK-DNVCBOLYSA-N 1 1 359.470 3.612 20 5 FHBDMO CC[C@@H](C)[N@@H+](C)Cc1cc(OC)c(OCC(F)(F)F)cc1[N+](=O)[O-] ZINC000179323860 939085933 /nfs/dbraw/zinc/08/59/33/939085933.db2.gz KLMAXHOXGDKJEX-SNVBAGLBSA-N 1 1 350.337 3.775 20 5 FHBDMO O=C(C[N@H+]1C[C@H](c2ccccc2)[C@H]2CCC[C@H]21)Nc1ccccc1[N+](=O)[O-] ZINC000511845874 945265961 /nfs/dbraw/zinc/26/59/61/945265961.db2.gz XUFOPIZIRRQYCI-ZHALLVOQSA-N 1 1 365.433 3.801 20 5 FHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@@H](Cn2cnc3ccccc32)C1 ZINC000614235856 939902175 /nfs/dbraw/zinc/90/21/75/939902175.db2.gz KVMRCZMCQMREOQ-OAHLLOKOSA-N 1 1 368.412 3.996 20 5 FHBDMO COc1c(O)ccc(C[NH2+][C@H]2CCSc3ccc(F)cc32)c1[N+](=O)[O-] ZINC000892474736 939912227 /nfs/dbraw/zinc/91/22/27/939912227.db2.gz AFEZXCGBHWSVEM-ZDUSSCGKSA-N 1 1 364.398 3.775 20 5 FHBDMO Cc1noc([C@H]2CCC[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2)n1 ZINC000179712358 939924684 /nfs/dbraw/zinc/92/46/84/939924684.db2.gz SOYNYNGOXJXHHZ-HNNXBMFYSA-N 1 1 368.393 3.926 20 5 FHBDMO COc1ccc(NC(=O)CC[N@@H+](C)[C@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000411140527 940002370 /nfs/dbraw/zinc/00/23/70/940002370.db2.gz XNINBSOKNMMUKT-CQSZACIVSA-N 1 1 357.410 3.625 20 5 FHBDMO Cc1cc(C(=O)C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)c(C)n1C1CC1 ZINC000548927693 940044790 /nfs/dbraw/zinc/04/47/90/940044790.db2.gz LCOXNVJWCFHZHB-UHFFFAOYSA-N 1 1 355.438 3.705 20 5 FHBDMO Cc1cc(C(=O)C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c(C)n1C1CC1 ZINC000548927693 940044794 /nfs/dbraw/zinc/04/47/94/940044794.db2.gz LCOXNVJWCFHZHB-UHFFFAOYSA-N 1 1 355.438 3.705 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@@H](n2cc[nH+]c2C(C)C)C1 ZINC000375930467 940073535 /nfs/dbraw/zinc/07/35/35/940073535.db2.gz GDQHNKXOKDSHOC-OAHLLOKOSA-N 1 1 356.426 3.700 20 5 FHBDMO CC(C)[C@H](NC(=O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000548933593 940091993 /nfs/dbraw/zinc/09/19/93/940091993.db2.gz HHYJMPKTQJMSSG-NRFANRHFSA-N 1 1 369.465 3.583 20 5 FHBDMO CC(C)[C@H](NC(=O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000548933593 940091997 /nfs/dbraw/zinc/09/19/97/940091997.db2.gz HHYJMPKTQJMSSG-NRFANRHFSA-N 1 1 369.465 3.583 20 5 FHBDMO C[C@H](C(=O)Nc1ccc(Cl)cc1)[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548934750 940097987 /nfs/dbraw/zinc/09/79/87/940097987.db2.gz QVNHFFKPJNGAOC-CYBMUJFWSA-N 1 1 361.829 3.750 20 5 FHBDMO C[C@H](C(=O)Nc1ccc(Cl)cc1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548934750 940097991 /nfs/dbraw/zinc/09/79/91/940097991.db2.gz QVNHFFKPJNGAOC-CYBMUJFWSA-N 1 1 361.829 3.750 20 5 FHBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCSC3(CCC3)CC2)cccc1[N+](=O)[O-] ZINC000411873256 940145735 /nfs/dbraw/zinc/14/57/35/940145735.db2.gz XRXSRIVOEUDMNG-CQSZACIVSA-N 1 1 363.483 3.592 20 5 FHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@H](O)C[C@@H]1c1ccccc1 ZINC000411947176 940161462 /nfs/dbraw/zinc/16/14/62/940161462.db2.gz OUZNTNHMCKIUKG-RTBURBONSA-N 1 1 356.422 3.690 20 5 FHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](O)C[C@@H]1c1ccccc1 ZINC000411947176 940161464 /nfs/dbraw/zinc/16/14/64/940161464.db2.gz OUZNTNHMCKIUKG-RTBURBONSA-N 1 1 356.422 3.690 20 5 FHBDMO COc1cc(C[N@@H+](C)C(C2CC2)C2CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180014954 940248614 /nfs/dbraw/zinc/24/86/14/940248614.db2.gz DCRVADDPAUDRQV-UHFFFAOYSA-N 1 1 370.396 3.868 20 5 FHBDMO C[C@@H](c1nc(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)no1)c1ccc([N+](=O)[O-])cc1F ZINC000612954627 940358103 /nfs/dbraw/zinc/35/81/03/940358103.db2.gz LWJPDURPTUTYMR-ODWCKFRGSA-N 1 1 360.389 3.609 20 5 FHBDMO Cc1ccccc1C[N@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000160516431 940494095 /nfs/dbraw/zinc/49/40/95/940494095.db2.gz QNYMAIYJFOVRGI-UHFFFAOYSA-N 1 1 350.422 3.936 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](O)CC2)ccc1Oc1ccc(F)cc1 ZINC000581623602 940508401 /nfs/dbraw/zinc/50/84/01/940508401.db2.gz UIBGLNSMFYFEMS-MRXNPFEDSA-N 1 1 360.385 3.873 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])c(NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)n1 ZINC000581962869 940635509 /nfs/dbraw/zinc/63/55/09/940635509.db2.gz BQMFMFZLYQEQPP-SFHVURJKSA-N 1 1 354.454 3.583 20 5 FHBDMO Cc1ccc([C@@H](C)[NH2+][C@H]2c3sccc3OC(C)(C)[C@@H]2O)cc1[N+](=O)[O-] ZINC000414184983 940726819 /nfs/dbraw/zinc/72/68/19/940726819.db2.gz PARBAFIMTNFXLV-XQAQDONZSA-N 1 1 362.451 3.889 20 5 FHBDMO Cc1sc(C(=O)N[C@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000507607230 945354464 /nfs/dbraw/zinc/35/44/64/945354464.db2.gz RZIXWSSWHAXWKH-DOMZBBRYSA-N 1 1 359.451 3.530 20 5 FHBDMO C[C@H]([NH2+]CC(=O)N(C)c1nc2ccccc2s1)c1cccc([N+](=O)[O-])c1 ZINC000180399182 941004220 /nfs/dbraw/zinc/00/42/20/941004220.db2.gz DDDMFHZRXWIIMD-LBPRGKRZSA-N 1 1 370.434 3.518 20 5 FHBDMO CCCCNC(=O)[C@@H]1CC[C@H](C)[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000511507694 941033774 /nfs/dbraw/zinc/03/37/74/941033774.db2.gz QXOIJGQPDCJCQZ-QJWRSFSASA-N 1 1 359.470 3.625 20 5 FHBDMO CC[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@H](O)C(F)(F)F ZINC000189876771 941292856 /nfs/dbraw/zinc/29/28/56/941292856.db2.gz XRVRGIOKRUAMPS-HNNXBMFYSA-N 1 1 358.316 3.600 20 5 FHBDMO CC[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@H](O)C(F)(F)F ZINC000189876771 941292860 /nfs/dbraw/zinc/29/28/60/941292860.db2.gz XRVRGIOKRUAMPS-HNNXBMFYSA-N 1 1 358.316 3.600 20 5 FHBDMO CC[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@@H](O)C(F)(F)F ZINC000189874868 941293064 /nfs/dbraw/zinc/29/30/64/941293064.db2.gz FSXMICDXFGEQHV-OAHLLOKOSA-N 1 1 358.316 3.600 20 5 FHBDMO CC[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@@H](O)C(F)(F)F ZINC000189874868 941293068 /nfs/dbraw/zinc/29/30/68/941293068.db2.gz FSXMICDXFGEQHV-OAHLLOKOSA-N 1 1 358.316 3.600 20 5 FHBDMO CN(C(=O)c1cccc([N+](=O)[O-])c1Cl)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311465243 941300747 /nfs/dbraw/zinc/30/07/47/941300747.db2.gz MYSRKQCZIKBVSM-HNNXBMFYSA-N 1 1 373.840 3.595 20 5 FHBDMO CN(C(=O)c1cc(Cl)ccc1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311464361 941301772 /nfs/dbraw/zinc/30/17/72/941301772.db2.gz MUGQGEPPJRMSNN-INIZCTEOSA-N 1 1 373.840 3.595 20 5 FHBDMO COc1cc(N2CC[NH+]([C@@H](C)c3ccccc3[N+](=O)[O-])CC2)ccc1F ZINC000549119335 941399807 /nfs/dbraw/zinc/39/98/07/941399807.db2.gz SDFQZVHFJNYBTM-AWEZNQCLSA-N 1 1 359.401 3.626 20 5 FHBDMO [NH3+][C@@H]1CCC[C@H](NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000414936267 941518109 /nfs/dbraw/zinc/51/81/09/941518109.db2.gz ZDZKSVQQOPUTOL-CVEARBPZSA-N 1 1 359.401 3.886 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@@H]1CNCC[C@@H]1c1ccc(F)c(F)c1 ZINC000414948943 941524661 /nfs/dbraw/zinc/52/46/61/941524661.db2.gz MXRQDQXRMQCFIA-IPHHBTQASA-N 1 1 373.403 3.622 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NCC[C@@H](C)[N@@H+](C)Cc1ccccc1 ZINC000472761588 941695420 /nfs/dbraw/zinc/69/54/20/941695420.db2.gz GBLUUWCLRDEDRD-MRXNPFEDSA-N 1 1 370.453 3.935 20 5 FHBDMO Cc1c(NC(=O)NCC[C@H](C)[N@@H+](C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000472767652 941721556 /nfs/dbraw/zinc/72/15/56/941721556.db2.gz WFMNVWKMQFDILM-HNNXBMFYSA-N 1 1 370.453 3.935 20 5 FHBDMO CCC[N@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C[C@@H]1CCCCO1 ZINC000093132319 941753818 /nfs/dbraw/zinc/75/38/18/941753818.db2.gz ZEPJURZQKYOQSS-IBGZPJMESA-N 1 1 372.469 3.776 20 5 FHBDMO COc1ccccc1O[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000513360973 941868227 /nfs/dbraw/zinc/86/82/27/941868227.db2.gz GUNRIHRERHKVHK-MRXNPFEDSA-N 1 1 360.385 3.786 20 5 FHBDMO COc1ccccc1O[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000513360973 941868230 /nfs/dbraw/zinc/86/82/30/941868230.db2.gz GUNRIHRERHKVHK-MRXNPFEDSA-N 1 1 360.385 3.786 20 5 FHBDMO Cc1cnn([C@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3C(F)(F)F)C2)c1 ZINC000377759663 941966566 /nfs/dbraw/zinc/96/65/66/941966566.db2.gz IAMOVFKVIKVZDF-AWEZNQCLSA-N 1 1 354.332 3.566 20 5 FHBDMO Cc1cnn([C@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3C(F)(F)F)C2)c1 ZINC000377759663 941966568 /nfs/dbraw/zinc/96/65/68/941966568.db2.gz IAMOVFKVIKVZDF-AWEZNQCLSA-N 1 1 354.332 3.566 20 5 FHBDMO COc1ccccc1-n1nccc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000430029369 941992945 /nfs/dbraw/zinc/99/29/45/941992945.db2.gz FQLONAXSLLGIKS-UHFFFAOYSA-N 1 1 372.812 3.732 20 5 FHBDMO Cc1ccc(NC(=O)N[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1[N+](=O)[O-] ZINC000182929714 942008672 /nfs/dbraw/zinc/00/86/72/942008672.db2.gz XAJJOZPHXUGESF-GJZGRUSLSA-N 1 1 360.458 3.678 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[NH+](Cc2ccccc2)CC1 ZINC000085620713 942022542 /nfs/dbraw/zinc/02/25/42/942022542.db2.gz NWXTXSBKPRBBHI-UHFFFAOYSA-N 1 1 368.437 3.561 20 5 FHBDMO O=C(NC[C@@H]1CCC[N@H+]1C1CCCCC1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000412311544 942149157 /nfs/dbraw/zinc/14/91/57/942149157.db2.gz OAVCZVYXAAEGQA-SLFFLAALSA-N 1 1 371.481 3.612 20 5 FHBDMO CO[C@@]1(C)CCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000280636413 942224254 /nfs/dbraw/zinc/22/42/54/942224254.db2.gz XUCHGMNWIOCNKL-IBGZPJMESA-N 1 1 359.426 3.683 20 5 FHBDMO CCC1(CC)C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CCS1 ZINC000501030063 942261959 /nfs/dbraw/zinc/26/19/59/942261959.db2.gz UACLJUIUGWHEJI-UHFFFAOYSA-N 1 1 351.472 3.531 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420938957 942264567 /nfs/dbraw/zinc/26/45/67/942264567.db2.gz BGOOVAHRQPNEPB-ZDUSSCGKSA-N 1 1 373.375 3.896 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@@H](CC(F)(F)F)C3)n2)cc1 ZINC000420952866 942272833 /nfs/dbraw/zinc/27/28/33/942272833.db2.gz SLBJGIZWQUJDGF-NSHDSACASA-N 1 1 370.331 3.809 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@@H](CC(F)(F)F)C3)n2)cc1 ZINC000420952866 942272835 /nfs/dbraw/zinc/27/28/35/942272835.db2.gz SLBJGIZWQUJDGF-NSHDSACASA-N 1 1 370.331 3.809 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420955620 942275328 /nfs/dbraw/zinc/27/53/28/942275328.db2.gz WRGAUXNDMODLAX-ZDUSSCGKSA-N 1 1 373.375 3.896 20 5 FHBDMO CCC[N@@H+](Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1)CC(C)(C)O ZINC000513707506 942318023 /nfs/dbraw/zinc/31/80/23/942318023.db2.gz DOTFMKFISDDJAK-UHFFFAOYSA-N 1 1 362.426 3.846 20 5 FHBDMO Cn1ccnc1[C@@H]([NH2+]CCc1cccc(F)c1F)c1ccc([N+](=O)[O-])cc1 ZINC000513708740 942348043 /nfs/dbraw/zinc/34/80/43/942348043.db2.gz WQJQKFWFSYBAQL-SFHVURJKSA-N 1 1 372.375 3.528 20 5 FHBDMO Cc1cc([NH+]2CCCC2)ccc1N[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000052774371 942505464 /nfs/dbraw/zinc/50/54/64/942505464.db2.gz BJBQPHPTYKMKNC-HNNXBMFYSA-N 1 1 368.437 3.943 20 5 FHBDMO C[C@@H]1CC[C@@H](O)C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000421365287 942517354 /nfs/dbraw/zinc/51/73/54/942517354.db2.gz BBEOGGDTYUOPQG-DGCLKSJQSA-N 1 1 350.802 3.853 20 5 FHBDMO CN(C(=O)C[NH+]1CCC(F)(c2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000434503121 942728653 /nfs/dbraw/zinc/72/86/53/942728653.db2.gz MXNSAWGLDFFUET-UHFFFAOYSA-N 1 1 371.412 3.518 20 5 FHBDMO COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C)c3[nH+]ccn3c2)cc1SC ZINC000502959581 942877380 /nfs/dbraw/zinc/87/73/80/942877380.db2.gz LKPPFSCFUWAZFC-UHFFFAOYSA-N 1 1 372.406 3.534 20 5 FHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000434733738 942900756 /nfs/dbraw/zinc/90/07/56/942900756.db2.gz CVOBMNWWNQFKRI-KNBMTAEXSA-N 1 1 354.454 3.676 20 5 FHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])N(C)C[C@@H]1CC[N@H+](C)[C@H]1c1cccnc1 ZINC000434733738 942900761 /nfs/dbraw/zinc/90/07/61/942900761.db2.gz CVOBMNWWNQFKRI-KNBMTAEXSA-N 1 1 354.454 3.676 20 5 FHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])N(C)C[C@@H]1CC[N@@H+](C)[C@H]1c1cccnc1 ZINC000434733738 942900764 /nfs/dbraw/zinc/90/07/64/942900764.db2.gz CVOBMNWWNQFKRI-KNBMTAEXSA-N 1 1 354.454 3.676 20 5 FHBDMO C[C@@H]1[C@H](c2ccccc2)CC[N@H+]1[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000434892327 943022391 /nfs/dbraw/zinc/02/23/91/943022391.db2.gz QJXMTNJSLLAQLB-CDHQVMDDSA-N 1 1 365.433 3.578 20 5 FHBDMO C[C@]1(CCc2ccccc2)CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000434910867 943046145 /nfs/dbraw/zinc/04/61/45/943046145.db2.gz WJVPVQZZZYLENP-NRFANRHFSA-N 1 1 367.449 3.539 20 5 FHBDMO C[C@@H](c1cccc(Nc2ncc(Cl)cc2[N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000434945714 943066506 /nfs/dbraw/zinc/06/65/06/943066506.db2.gz FPKAARYKMUOLID-LBPRGKRZSA-N 1 1 362.817 3.780 20 5 FHBDMO COc1cc(N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000312298644 943121241 /nfs/dbraw/zinc/12/12/41/943121241.db2.gz NGPRZZAERKTZGE-GOEBONIOSA-N 1 1 371.437 3.687 20 5 FHBDMO O=[N+]([O-])c1cccc2c1ccn2C[C@H]1C[N@@H+](Cc2ccccc2)CCCO1 ZINC000514635227 943166664 /nfs/dbraw/zinc/16/66/64/943166664.db2.gz NENOWJUAICTHQJ-GOSISDBHSA-N 1 1 365.433 3.841 20 5 FHBDMO O=[N+]([O-])c1ccc(CNc2cc[nH+]c3ccc(Br)cc23)cc1 ZINC000503542484 943238470 /nfs/dbraw/zinc/23/84/70/943238470.db2.gz XAXPYAJLMQGJHI-UHFFFAOYSA-N 1 1 358.195 3.940 20 5 FHBDMO CC[C@H](N[C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000422832880 943299609 /nfs/dbraw/zinc/29/96/09/943299609.db2.gz GMQHECFODFTOOD-ZJOUEHCJSA-N 1 1 367.449 3.891 20 5 FHBDMO Cc1ccc([C@H](C)N[C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1[N+](=O)[O-] ZINC000422916671 943330329 /nfs/dbraw/zinc/33/03/29/943330329.db2.gz BIAFHIPNTWNMDW-XERREHJYSA-N 1 1 367.449 3.810 20 5 FHBDMO NC(=O)c1ccc(C[N@@H+]2CCC[C@H]2c2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000053278719 943577225 /nfs/dbraw/zinc/57/72/25/943577225.db2.gz PGLGBUAVQJNRAH-INIZCTEOSA-N 1 1 359.813 3.684 20 5 FHBDMO NC(=O)c1ccc(C[N@H+]2CCC[C@H]2c2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000053278719 943577229 /nfs/dbraw/zinc/57/72/29/943577229.db2.gz PGLGBUAVQJNRAH-INIZCTEOSA-N 1 1 359.813 3.684 20 5 FHBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc[nH+]c(N(C)C)c1 ZINC000504541191 943664201 /nfs/dbraw/zinc/66/42/01/943664201.db2.gz ZHZWDBKWJXPDHJ-UHFFFAOYSA-N 1 1 360.439 3.810 20 5 FHBDMO CC[N@H+]1CC[C@@H](N(C)Cc2ccc(Br)cc2[N+](=O)[O-])C[C@H]1C ZINC000425422342 943880608 /nfs/dbraw/zinc/88/06/08/943880608.db2.gz NASWEWKOUNNZGK-IUODEOHRSA-N 1 1 370.291 3.662 20 5 FHBDMO COc1cccc(C[C@H]2CCC[N@H+]2CCOc2cccc([N+](=O)[O-])c2)c1 ZINC000515552708 943988513 /nfs/dbraw/zinc/98/85/13/943988513.db2.gz WIHXDDNYWDGVAW-QGZVFWFLSA-N 1 1 356.422 3.689 20 5 FHBDMO CC[C@@H](Cc1ccccc1)[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500098344 944094241 /nfs/dbraw/zinc/09/42/41/944094241.db2.gz LMEIFHXOYKPBDE-KRWDZBQOSA-N 1 1 355.438 3.877 20 5 FHBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000500116438 944124459 /nfs/dbraw/zinc/12/44/59/944124459.db2.gz OCYKLPUKLDXYNB-KGLIPLIRSA-N 1 1 351.472 3.529 20 5 FHBDMO COC(=O)c1cc(F)ccc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000505781261 944147954 /nfs/dbraw/zinc/14/79/54/944147954.db2.gz DZYSOAUTKARSGU-UHFFFAOYSA-N 1 1 360.385 3.931 20 5 FHBDMO COC(=O)c1cc(F)ccc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000505781261 944147958 /nfs/dbraw/zinc/14/79/58/944147958.db2.gz DZYSOAUTKARSGU-UHFFFAOYSA-N 1 1 360.385 3.931 20 5 FHBDMO C[C@H]1[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1Cc1ccccc1 ZINC000382118478 944180803 /nfs/dbraw/zinc/18/08/03/944180803.db2.gz WHPUQBONQMIPHN-SCLBCKFNSA-N 1 1 373.840 3.641 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC[C@@H]1[C@@H]1C[C@@H](C)CC[C@@H]1O ZINC000438999110 944255543 /nfs/dbraw/zinc/25/55/43/944255543.db2.gz LNPPODSVBBEYLJ-FZDIXFNVSA-N 1 1 362.470 3.755 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(CCOc2ccccc2[N+](=O)[O-])C1 ZINC000506474080 944300568 /nfs/dbraw/zinc/30/05/68/944300568.db2.gz LAXOAUKUYWJTCY-MSOLQXFVSA-N 1 1 361.486 3.560 20 5 FHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC4(CCC4)[C@H]3C3CCOCC3)nc2c1 ZINC000425558223 944337927 /nfs/dbraw/zinc/33/79/27/944337927.db2.gz XJQFGISEOSIIIL-GOSISDBHSA-N 1 1 357.410 3.517 20 5 FHBDMO COc1ccc([C@H]2CC[N@@H+](Cc3cc(OC)c(F)cc3[N+](=O)[O-])C2)cc1 ZINC000184259172 944355202 /nfs/dbraw/zinc/35/52/02/944355202.db2.gz UKGMASHPZDJGSU-AWEZNQCLSA-N 1 1 360.385 3.741 20 5 FHBDMO C[C@@H](NC(=O)[C@@H](c1cccc(Cl)c1)[NH+](C)C)c1cccc([N+](=O)[O-])c1 ZINC000518443808 944381760 /nfs/dbraw/zinc/38/17/60/944381760.db2.gz SDVIFEVQONEKIO-SJKOYZFVSA-N 1 1 361.829 3.728 20 5 FHBDMO Cc1cccc(C[N@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000506191650 944430916 /nfs/dbraw/zinc/43/09/16/944430916.db2.gz QUFHFMLFWQBCON-UHFFFAOYSA-N 1 1 350.422 3.936 20 5 FHBDMO CC(C)c1ccc(C[NH+]2CCC(Oc3cnccn3)CC2)cc1[N+](=O)[O-] ZINC000425982411 944499151 /nfs/dbraw/zinc/49/91/51/944499151.db2.gz WQNUPMPFUJCOJU-UHFFFAOYSA-N 1 1 356.426 3.552 20 5 FHBDMO CN(c1ccccc1)c1ccc(C[N@H+]2CC[C@@H](O)C(C)(C)C2)cc1[N+](=O)[O-] ZINC000438325624 944510179 /nfs/dbraw/zinc/51/01/79/944510179.db2.gz NJSJBNMBPPUNFI-HXUWFJFHSA-N 1 1 369.465 3.956 20 5 FHBDMO CC1(C)CN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000729469293 944517849 /nfs/dbraw/zinc/51/78/49/944517849.db2.gz CHOZDUNGONOMLE-UHFFFAOYSA-N 1 1 370.409 3.604 20 5 FHBDMO C[C@H]1C[C@H](c2ccccc2)CC[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000439315545 944521823 /nfs/dbraw/zinc/52/18/23/944521823.db2.gz JKCJOVRDEKBADC-DOTOQJQBSA-N 1 1 353.422 3.801 20 5 FHBDMO C[C@H]1C[C@H](c2ccccc2)CC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000439315545 944521827 /nfs/dbraw/zinc/52/18/27/944521827.db2.gz JKCJOVRDEKBADC-DOTOQJQBSA-N 1 1 353.422 3.801 20 5 FHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@@H](COc4ccccc4)C3)nc2c1 ZINC000505875342 944580772 /nfs/dbraw/zinc/58/07/72/944580772.db2.gz VILNLLFEKXMPMV-CQSZACIVSA-N 1 1 353.378 3.637 20 5 FHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@@H](COc4ccccc4)C3)nc2c1 ZINC000505875342 944580774 /nfs/dbraw/zinc/58/07/74/944580774.db2.gz VILNLLFEKXMPMV-CQSZACIVSA-N 1 1 353.378 3.637 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+](C)C[C@@H](C)c1ccccc1 ZINC000066854637 944639498 /nfs/dbraw/zinc/63/94/98/944639498.db2.gz OMZNJNLZNMEOBX-CABCVRRESA-N 1 1 371.437 3.666 20 5 FHBDMO CC[N@H+]1CCC[C@@H](CN(C)c2cccc(C)c2[N+](=O)[O-])[C@@H]1c1cnn(C)c1 ZINC000509606759 944754386 /nfs/dbraw/zinc/75/43/86/944754386.db2.gz CRPNVLRFVTVYAK-OXJNMPFZSA-N 1 1 371.485 3.546 20 5 FHBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000053749552 944853028 /nfs/dbraw/zinc/85/30/28/944853028.db2.gz AFFOJSCNKWILQL-YOEHRIQHSA-N 1 1 354.410 3.552 20 5 FHBDMO CC[C@@H]1CCCC[N@H+]1CCNc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000500426355 944876389 /nfs/dbraw/zinc/87/63/89/944876389.db2.gz VVRKCAKPQWQDAD-QGZVFWFLSA-N 1 1 374.485 3.507 20 5 FHBDMO CC[N@@H+]1CCCC[C@H]1CNCc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000518981178 945004736 /nfs/dbraw/zinc/00/47/36/945004736.db2.gz NAZAZSZTOHKNHX-HNNXBMFYSA-N 1 1 373.453 3.827 20 5 FHBDMO CC[N@H+]1CCCC[C@H]1CNCc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000518981178 945004742 /nfs/dbraw/zinc/00/47/42/945004742.db2.gz NAZAZSZTOHKNHX-HNNXBMFYSA-N 1 1 373.453 3.827 20 5 FHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2cnn(CC(F)(F)F)c2)C2CC2)c1 ZINC000507173477 945021891 /nfs/dbraw/zinc/02/18/91/945021891.db2.gz NDEJACUNMSVGBU-UHFFFAOYSA-N 1 1 354.332 3.518 20 5 FHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cnn(CC(F)(F)F)c2)C2CC2)c1 ZINC000507173477 945021902 /nfs/dbraw/zinc/02/19/02/945021902.db2.gz NDEJACUNMSVGBU-UHFFFAOYSA-N 1 1 354.332 3.518 20 5 FHBDMO C[NH+](C)[C@@H](CNC(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1Cl ZINC000018180697 945445664 /nfs/dbraw/zinc/44/56/64/945445664.db2.gz NFXQCFGHWUKWSU-INIZCTEOSA-N 1 1 362.817 3.673 20 5 FHBDMO CC[C@@H](C(=O)N[C@H](C)c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000519488683 945461002 /nfs/dbraw/zinc/46/10/02/945461002.db2.gz RXCNQWVYMHQSPN-QAPCUYQASA-N 1 1 355.438 3.683 20 5 FHBDMO O=C(NC[C@H]1CCC[N@H+]1C1CCCCC1)c1c(Cl)cccc1[N+](=O)[O-] ZINC000280940622 945470255 /nfs/dbraw/zinc/47/02/55/945470255.db2.gz JFROTLXRAWQYGX-CQSZACIVSA-N 1 1 365.861 3.775 20 5 FHBDMO CCN1CCC([N@H+](C)Cc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)CC1 ZINC000125245644 945690216 /nfs/dbraw/zinc/69/02/16/945690216.db2.gz FJZDBOBPYDUVPT-UHFFFAOYSA-N 1 1 373.453 3.780 20 5 FHBDMO CCN1CCC([N@@H+](C)Cc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)CC1 ZINC000125245644 945690221 /nfs/dbraw/zinc/69/02/21/945690221.db2.gz FJZDBOBPYDUVPT-UHFFFAOYSA-N 1 1 373.453 3.780 20 5 FHBDMO C[C@H]([NH2+]Cc1nccn1CCc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000164297813 945725110 /nfs/dbraw/zinc/72/51/10/945725110.db2.gz HJPMBEAJVVCNSZ-INIZCTEOSA-N 1 1 350.422 3.885 20 5 FHBDMO CSc1ccc([N+](=O)[O-])c(C(=O)NCCCC[N@H+]2CCCC[C@@H]2C)c1 ZINC000107602196 945736383 /nfs/dbraw/zinc/73/63/83/945736383.db2.gz LZPVKOPYOUIEEV-AWEZNQCLSA-N 1 1 365.499 3.701 20 5 FHBDMO C[N@@H+](CCNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)C1CCCCC1 ZINC000519995771 945993032 /nfs/dbraw/zinc/99/30/32/945993032.db2.gz OEBMLHNEQCQOIO-UHFFFAOYSA-N 1 1 361.467 3.804 20 5 FHBDMO COc1cccc(OC)c1OC1CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000520042748 946042112 /nfs/dbraw/zinc/04/21/12/946042112.db2.gz BYERDCWTMBVEDA-UHFFFAOYSA-N 1 1 372.421 3.655 20 5 FHBDMO O=C(N[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000522878096 946050660 /nfs/dbraw/zinc/05/06/60/946050660.db2.gz RTWWSWUEODYKKI-KRWDZBQOSA-N 1 1 373.840 3.643 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@H](c4cc[nH]n4)C3)o2)c1 ZINC000121239926 946102268 /nfs/dbraw/zinc/10/22/68/946102268.db2.gz PPTRQCPRLZYJEV-HNNXBMFYSA-N 1 1 352.394 3.958 20 5 FHBDMO C[C@H]1CCC[N@@H+](CCCCNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000045959999 946264224 /nfs/dbraw/zinc/26/42/24/946264224.db2.gz QZGYHCQIBRJPLD-ZDUSSCGKSA-N 1 1 368.865 3.882 20 5 FHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](n3cnc4c3CCCC4)C2)c(Cl)c1 ZINC000614740428 946390756 /nfs/dbraw/zinc/39/07/56/946390756.db2.gz BMBYZNAZJSNELJ-HNNXBMFYSA-N 1 1 360.845 3.771 20 5 FHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](n3cnc4c3CCCC4)C2)c(Cl)c1 ZINC000614740428 946390764 /nfs/dbraw/zinc/39/07/64/946390764.db2.gz BMBYZNAZJSNELJ-HNNXBMFYSA-N 1 1 360.845 3.771 20 5 FHBDMO CSc1cccc(C(=O)NC[C@H](C)[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000186485357 946396252 /nfs/dbraw/zinc/39/62/52/946396252.db2.gz BLUOLLWYMMSNGP-AWEZNQCLSA-N 1 1 373.478 3.567 20 5 FHBDMO CC[N@@H+](CCc1ccccc1)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000052968310 946462308 /nfs/dbraw/zinc/46/23/08/946462308.db2.gz SPHHXEVTYUGKAY-UHFFFAOYSA-N 1 1 361.829 3.751 20 5 FHBDMO CC(C)[C@@H]([NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)c1cnn(C)c1 ZINC000897081113 946571148 /nfs/dbraw/zinc/57/11/48/946571148.db2.gz KDTDYVHOQSIGCP-GFCCVEGCSA-N 1 1 373.276 3.639 20 5 FHBDMO CC[C@@H](NC(=O)N1CCC([N@H+]2CCC[C@@H]2C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000129510138 946585748 /nfs/dbraw/zinc/58/57/48/946585748.db2.gz UBBQBIXIRMBKMY-HNAYVOBHSA-N 1 1 374.485 3.704 20 5 FHBDMO O=C(c1ccccc1)C1CC[NH+](CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000051379552 946690511 /nfs/dbraw/zinc/69/05/11/946690511.db2.gz DKTFOFGIONUMGE-UHFFFAOYSA-N 1 1 354.406 3.569 20 5 FHBDMO CC[N@@H+](Cc1ccc(OC)c(OC)c1)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000051377076 946690862 /nfs/dbraw/zinc/69/08/62/946690862.db2.gz FJJHRIIHCDKLNF-UHFFFAOYSA-N 1 1 360.410 3.643 20 5 FHBDMO CCc1ccc([C@H]([NH2+][C@H](C)CC[S@](C)=O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544380946 946770621 /nfs/dbraw/zinc/77/06/21/946770621.db2.gz VLKCSGKFLQBVIO-RSNNCKTBSA-N 1 1 364.467 3.586 20 5 FHBDMO CCc1ccc([C@H]([NH2+][C@H](C)CC[S@@](C)=O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544380947 946770915 /nfs/dbraw/zinc/77/09/15/946770915.db2.gz VLKCSGKFLQBVIO-XMRYCRAHSA-N 1 1 364.467 3.586 20 5 FHBDMO CC[C@H](C)[C@@H](C)[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC)C1CC1 ZINC000112600073 946917956 /nfs/dbraw/zinc/91/79/56/946917956.db2.gz MZIKSXRJCUJWAU-UONOGXRCSA-N 1 1 363.458 3.831 20 5 FHBDMO Cc1cc(C(=O)N[C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc([N+](=O)[O-])c1 ZINC000487386272 946919643 /nfs/dbraw/zinc/91/96/43/946919643.db2.gz GLKKGAOOGVUPJV-WMZOPIPTSA-N 1 1 367.449 3.544 20 5 FHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](Cc3ccc(Cl)cc3Cl)C2)nc1 ZINC000112656699 946920033 /nfs/dbraw/zinc/92/00/33/946920033.db2.gz YJLPHBXSAJLANO-CYBMUJFWSA-N 1 1 367.236 3.983 20 5 FHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3ccc(Cl)cc3Cl)C2)nc1 ZINC000112656699 946920040 /nfs/dbraw/zinc/92/00/40/946920040.db2.gz YJLPHBXSAJLANO-CYBMUJFWSA-N 1 1 367.236 3.983 20 5 FHBDMO CCC[N@@H+](Cc1c([N+](=O)[O-])ncn1C)[C@@H]1C[C@@H](OCC)C12CCCCC2 ZINC000475356202 946937069 /nfs/dbraw/zinc/93/70/69/946937069.db2.gz SEDSLKGWPGXTKI-IAGOWNOFSA-N 1 1 364.490 3.668 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCCN(C(=O)c2ccccc2)CC1 ZINC000182624646 946959070 /nfs/dbraw/zinc/95/90/70/946959070.db2.gz DMRMUHFJHNSKRD-QGZVFWFLSA-N 1 1 367.449 3.812 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCCN(C(=O)c2ccccc2)CC1 ZINC000182624646 946959072 /nfs/dbraw/zinc/95/90/72/946959072.db2.gz DMRMUHFJHNSKRD-QGZVFWFLSA-N 1 1 367.449 3.812 20 5 FHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@H](CCO)c1ccccc1 ZINC000441429577 947089779 /nfs/dbraw/zinc/08/97/79/947089779.db2.gz OHQYSPNOAXSJQE-LJQANCHMSA-N 1 1 358.438 3.938 20 5 FHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H](CCO)c1ccccc1 ZINC000441429577 947089789 /nfs/dbraw/zinc/08/97/89/947089789.db2.gz OHQYSPNOAXSJQE-LJQANCHMSA-N 1 1 358.438 3.938 20 5 FHBDMO CC[C@](C)(O)C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1ccccc1 ZINC000444683973 947108304 /nfs/dbraw/zinc/10/83/04/947108304.db2.gz HESZVGQEQCAMNB-FQEVSTJZSA-N 1 1 368.437 3.634 20 5 FHBDMO CC[C@](C)(O)C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1ccccc1 ZINC000444683973 947108313 /nfs/dbraw/zinc/10/83/13/947108313.db2.gz HESZVGQEQCAMNB-FQEVSTJZSA-N 1 1 368.437 3.634 20 5 FHBDMO CN(C)c1cccc([C@H]2CCC[N@H+]2CCOc2ccc([N+](=O)[O-])cc2)c1 ZINC000441431945 947157395 /nfs/dbraw/zinc/15/73/95/947157395.db2.gz DSQNGUYJOCXXCJ-HXUWFJFHSA-N 1 1 355.438 3.877 20 5 FHBDMO COc1ccc(OC)c([C@@H]2CCC[N@H+]2CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000523701378 947526904 /nfs/dbraw/zinc/52/69/04/947526904.db2.gz NWTWZYMYVRPRID-IBGZPJMESA-N 1 1 356.422 3.992 20 5 FHBDMO COc1ccc(OCC[N@H+]2CC[C@H](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000441459193 947571473 /nfs/dbraw/zinc/57/14/73/947571473.db2.gz AFLLNBUVJWXPIK-QGZVFWFLSA-N 1 1 356.422 3.547 20 5 FHBDMO CC[N@@H+](CCNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)C1CC1 ZINC000523894341 947697848 /nfs/dbraw/zinc/69/78/48/947697848.db2.gz YZPBETUYGVKOCM-UHFFFAOYSA-N 1 1 368.437 3.553 20 5 FHBDMO Cc1ccccc1[C@@H]1C[N@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@H](C)CO1 ZINC000441472396 947791705 /nfs/dbraw/zinc/79/17/05/947791705.db2.gz XKPZOYOJJCRRPD-UZLBHIALSA-N 1 1 356.422 3.744 20 5 FHBDMO Cc1ccccc1[C@@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@H](C)CO1 ZINC000441472396 947791708 /nfs/dbraw/zinc/79/17/08/947791708.db2.gz XKPZOYOJJCRRPD-UZLBHIALSA-N 1 1 356.422 3.744 20 5 FHBDMO C[NH+](C)[C@H](CNc1nc2ccccn2c1[N+](=O)[O-])c1ccccc1Cl ZINC000105133303 947873807 /nfs/dbraw/zinc/87/38/07/947873807.db2.gz XMMRIZWSSSKLFZ-CQSZACIVSA-N 1 1 359.817 3.611 20 5 FHBDMO COc1ccc([N+](=O)[O-])c(N2CCC(c3[nH+]cc4n3CCCC4)CC2)c1 ZINC000278897279 948032621 /nfs/dbraw/zinc/03/26/21/948032621.db2.gz QKRIWKWUBYMVTE-UHFFFAOYSA-N 1 1 356.426 3.520 20 5 FHBDMO CCOc1ccc([C@@H](C)[NH2+]CCc2ccc3cn[nH]c3c2)cc1[N+](=O)[O-] ZINC000585765586 948277127 /nfs/dbraw/zinc/27/71/27/948277127.db2.gz XJJLRCNQVMBNNT-CYBMUJFWSA-N 1 1 354.410 3.763 20 5 FHBDMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)Cc1c[nH]c2ccccc12 ZINC000190454877 948314502 /nfs/dbraw/zinc/31/45/02/948314502.db2.gz FKXXEPANTWNZPG-UHFFFAOYSA-N 1 1 366.421 3.845 20 5 FHBDMO C[C@@H]1C[N@H+](C)[C@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000512101889 948418832 /nfs/dbraw/zinc/41/88/32/948418832.db2.gz VTRKPMVQFRRXRA-HUUCEWRRSA-N 1 1 369.421 3.552 20 5 FHBDMO C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000512101889 948418837 /nfs/dbraw/zinc/41/88/37/948418837.db2.gz VTRKPMVQFRRXRA-HUUCEWRRSA-N 1 1 369.421 3.552 20 5 FHBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2cc(Cl)c3c(c2)OCCCO3)cs1 ZINC000066989667 948505178 /nfs/dbraw/zinc/50/51/78/948505178.db2.gz YMYZBEFUQZDHCZ-UHFFFAOYSA-N 1 1 354.815 3.761 20 5 FHBDMO Cc1cc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc(N2CCCC2)[nH+]1 ZINC000520666690 948536208 /nfs/dbraw/zinc/53/62/08/948536208.db2.gz GOUWCGBKXREFAX-UHFFFAOYSA-N 1 1 369.425 3.529 20 5 FHBDMO CC(C)[C@]1(CO)CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000550433269 948615186 /nfs/dbraw/zinc/61/51/86/948615186.db2.gz HCKONCATVKHDFR-MRXNPFEDSA-N 1 1 360.376 3.844 20 5 FHBDMO CC(C)[C@]1(CO)CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000550433269 948615189 /nfs/dbraw/zinc/61/51/89/948615189.db2.gz HCKONCATVKHDFR-MRXNPFEDSA-N 1 1 360.376 3.844 20 5 FHBDMO C[C@@H](c1cccc(NCCc2ccc([N+](=O)[O-])cc2)c1)[NH+]1CCOCC1 ZINC000541799391 567861373 /nfs/dbraw/zinc/86/13/73/567861373.db2.gz GKJYYVVUPFMHGL-INIZCTEOSA-N 1 1 355.438 3.643 20 5 FHBDMO Cn1ncc2c1CCC[C@H]2[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000264975834 567947159 /nfs/dbraw/zinc/94/71/59/567947159.db2.gz RZAOBWLJLBJODV-MRXNPFEDSA-N 1 1 369.450 3.619 20 5 FHBDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC000541834962 567955210 /nfs/dbraw/zinc/95/52/10/567955210.db2.gz UYBFNPXBIYHCQL-CYBMUJFWSA-N 1 1 366.437 3.756 20 5 FHBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccc(N2CCCNC2=O)cc1 ZINC000291020976 567963261 /nfs/dbraw/zinc/96/32/61/567963261.db2.gz CPTJLHAHBDTAPY-CYBMUJFWSA-N 1 1 372.400 3.504 20 5 FHBDMO Cc1nc(C)c(C[NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)s1 ZINC000602572910 567996331 /nfs/dbraw/zinc/99/63/31/567996331.db2.gz ZCFOFAKLMDKYRR-UHFFFAOYSA-N 1 1 362.274 3.782 20 5 FHBDMO O=[N+]([O-])c1ccc2oc(C[NH+]3CCC(Cc4nccs4)CC3)nc2c1 ZINC000602735797 568026045 /nfs/dbraw/zinc/02/60/45/568026045.db2.gz YEGNCVMGWZCMDV-UHFFFAOYSA-N 1 1 358.423 3.647 20 5 FHBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+](C)C[C@@H]2CCCO2)cc1OC ZINC000481594594 568061577 /nfs/dbraw/zinc/06/15/77/568061577.db2.gz DUWOOQQYHVXIJT-HOCLYGCPSA-N 1 1 366.458 3.639 20 5 FHBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+](C)C[C@@H]2CCCO2)cc1OC ZINC000481594594 568061578 /nfs/dbraw/zinc/06/15/78/568061578.db2.gz DUWOOQQYHVXIJT-HOCLYGCPSA-N 1 1 366.458 3.639 20 5 FHBDMO O=[N+]([O-])c1ccc(Cl)c(CNC2CC[NH+](CCC(F)(F)F)CC2)c1 ZINC000291160032 568067221 /nfs/dbraw/zinc/06/72/21/568067221.db2.gz MABCYGFYILMCAT-UHFFFAOYSA-N 1 1 365.783 3.755 20 5 FHBDMO COc1cc(C[N@@H+]2CCC[C@]3(C2)OCc2ccccc23)c([N+](=O)[O-])cc1F ZINC000481703598 568091256 /nfs/dbraw/zinc/09/12/56/568091256.db2.gz RXYLYCZFYUZWCW-HXUWFJFHSA-N 1 1 372.396 3.764 20 5 FHBDMO COc1cc(C[N@H+]2CCC[C@]3(C2)OCc2ccccc23)c([N+](=O)[O-])cc1F ZINC000481703598 568091257 /nfs/dbraw/zinc/09/12/57/568091257.db2.gz RXYLYCZFYUZWCW-HXUWFJFHSA-N 1 1 372.396 3.764 20 5 FHBDMO CS[C@@H](C[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)C(C)(C)C ZINC000568671653 568116933 /nfs/dbraw/zinc/11/69/33/568116933.db2.gz ITDBALRHUQSPBM-HOTGVXAUSA-N 1 1 362.499 3.785 20 5 FHBDMO CCC[N@H+]1CCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1SC(C)C ZINC000568675639 568120027 /nfs/dbraw/zinc/12/00/27/568120027.db2.gz QTJGJGLMIFQWCF-HNNXBMFYSA-N 1 1 365.499 3.700 20 5 FHBDMO C[C@@H]1CCC[N@@H+](Cc2ccccc2CNC(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000481802257 568127339 /nfs/dbraw/zinc/12/73/39/568127339.db2.gz XCCNCXZEXYZGGW-CQSZACIVSA-N 1 1 373.478 3.818 20 5 FHBDMO C[C@@H](C(=O)NCC(C)(C)[N@@H+]1C[C@H](C)C[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000568942304 568256390 /nfs/dbraw/zinc/25/63/90/568256390.db2.gz RHMIUAFFFILDEX-OWCLPIDISA-N 1 1 361.486 3.571 20 5 FHBDMO C[C@H]1[C@H](NC(=O)c2c(Cl)cccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000291770469 568304542 /nfs/dbraw/zinc/30/45/42/568304542.db2.gz MOYCIVSTPBPCLJ-XJKSGUPXSA-N 1 1 373.840 3.641 20 5 FHBDMO CC[N@@H+](Cc1ccc(C(=O)NCc2cccc([N+](=O)[O-])c2)cc1)C1CC1 ZINC000604568571 568314376 /nfs/dbraw/zinc/31/43/76/568314376.db2.gz HZKJWPHXFVBSIH-UHFFFAOYSA-N 1 1 353.422 3.509 20 5 FHBDMO Cc1ccccc1C[N@H+]1CCCN(C(=O)c2cccc(C)c2[N+](=O)[O-])CC1 ZINC000031766889 568337235 /nfs/dbraw/zinc/33/72/35/568337235.db2.gz IAPWZNRDNQIURK-UHFFFAOYSA-N 1 1 367.449 3.560 20 5 FHBDMO COc1ccc(C[NH2+][C@H](C)c2ncc(-c3ccccc3)n2C)cc1[N+](=O)[O-] ZINC000453084761 568506179 /nfs/dbraw/zinc/50/61/79/568506179.db2.gz NRROYIPTLSIEKF-CQSZACIVSA-N 1 1 366.421 3.855 20 5 FHBDMO Cc1c(NC(=O)CC[N@@H+]2Cc3ccccc3OC[C@H]2C)cccc1[N+](=O)[O-] ZINC000542012740 568542164 /nfs/dbraw/zinc/54/21/64/568542164.db2.gz KVEMOZBOVUTRBS-CQSZACIVSA-N 1 1 369.421 3.515 20 5 FHBDMO O=[N+]([O-])c1c(Cl)ccnc1N1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001164618858 719056210 /nfs/dbraw/zinc/05/62/10/719056210.db2.gz BZQUXJUVAZULQO-DOTOQJQBSA-N 1 1 372.856 3.744 20 5 FHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](CCc1ccc3c(c1)OC(F)(F)O3)CC2 ZINC001167648352 936374732 /nfs/dbraw/zinc/37/47/32/936374732.db2.gz TUZMKMFVHJJSPN-UHFFFAOYSA-N 1 1 362.332 3.517 20 5 FHBDMO CCOCCC[N@H+]1CC[C@H](N[C@H](C)c2cccc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000248012195 937174216 /nfs/dbraw/zinc/17/42/16/937174216.db2.gz LIVYFSNAYIQICZ-WDYCEAGBSA-N 1 1 363.502 3.691 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H]1CC(=O)c1cccs1 ZINC000430206808 928063185 /nfs/dbraw/zinc/06/31/85/928063185.db2.gz LFRKGHRKMYIJFQ-AWEZNQCLSA-N 1 1 360.435 3.902 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]1CC(=O)c1cccs1 ZINC000430206808 928063204 /nfs/dbraw/zinc/06/32/04/928063204.db2.gz LFRKGHRKMYIJFQ-AWEZNQCLSA-N 1 1 360.435 3.902 20 5 FHBDMO C[C@@H]1CCCC[N@H+]1CCCCNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000510096425 928221917 /nfs/dbraw/zinc/22/19/17/928221917.db2.gz ZOQXGPQSJDBDRX-CQSZACIVSA-N 1 1 360.458 3.546 20 5 FHBDMO Cn1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c(-c2cccnc2)n1 ZINC000154257452 928646086 /nfs/dbraw/zinc/64/60/86/928646086.db2.gz KEHTYJPGKIYMLB-UHFFFAOYSA-N 1 1 363.421 3.555 20 5 FHBDMO CCCc1ccc([C@H](C)[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CC(N)=O)cc1 ZINC000609120941 928986701 /nfs/dbraw/zinc/98/67/01/928986701.db2.gz BDYIWHSPMMMUBA-INIZCTEOSA-N 1 1 369.465 3.638 20 5 FHBDMO C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)c2cccc(Cl)c2[N+](=O)[O-])C1 ZINC000175771600 929040052 /nfs/dbraw/zinc/04/00/52/929040052.db2.gz QTLAXPOJMLOSJF-BETUJISGSA-N 1 1 367.877 3.735 20 5 FHBDMO CS[C@H]1CCCC[N@@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000134579385 929071021 /nfs/dbraw/zinc/07/10/21/929071021.db2.gz VVIFPAPWOLEHKK-YPMHNXCESA-N 1 1 371.890 3.793 20 5 FHBDMO CS[C@H]1CCCC[N@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000134579385 929071039 /nfs/dbraw/zinc/07/10/39/929071039.db2.gz VVIFPAPWOLEHKK-YPMHNXCESA-N 1 1 371.890 3.793 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1CNC[C@H]1CCC[N@@H+]1Cc1ccccc1 ZINC000609634038 929288399 /nfs/dbraw/zinc/28/83/99/929288399.db2.gz APBBFRIOTSDFEC-HXUWFJFHSA-N 1 1 369.465 3.748 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1CNC[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000609634038 929288412 /nfs/dbraw/zinc/28/84/12/929288412.db2.gz APBBFRIOTSDFEC-HXUWFJFHSA-N 1 1 369.465 3.748 20 5 FHBDMO CN(C(=O)[C@H]1CC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1)c1ccccc1 ZINC000430295858 929387800 /nfs/dbraw/zinc/38/78/00/929387800.db2.gz BQLYBEJJBNZWJA-HNNXBMFYSA-N 1 1 373.840 3.733 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@H](C(=O)N(C)c2ccccc2)C1 ZINC000430301016 929546241 /nfs/dbraw/zinc/54/62/41/929546241.db2.gz PNOPZOWHSMIXRL-IAGOWNOFSA-N 1 1 367.449 3.949 20 5 FHBDMO O=C(NC1CCCCC1)OC[C@@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000796681991 937348935 /nfs/dbraw/zinc/34/89/35/937348935.db2.gz FZGITFWZOLVJKB-SFHVURJKSA-N 1 1 361.442 3.618 20 5 FHBDMO Cc1ccc(C(=O)NCC[C@H](C)[N@@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000471450699 929686955 /nfs/dbraw/zinc/68/69/55/929686955.db2.gz IAAUUKSIYIFLCJ-INIZCTEOSA-N 1 1 355.438 3.544 20 5 FHBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000610296331 929714405 /nfs/dbraw/zinc/71/44/05/929714405.db2.gz AJCIOWRZARMCHN-KRWDZBQOSA-N 1 1 373.840 3.595 20 5 FHBDMO Cc1c(NC(=O)CC[N@H+](C)[C@H]2CCc3ccccc32)cccc1[N+](=O)[O-] ZINC000063492134 929717657 /nfs/dbraw/zinc/71/76/57/929717657.db2.gz KLUCOSDGZWQULB-IBGZPJMESA-N 1 1 353.422 3.851 20 5 FHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCC[C@@H]1C[C@H](O)c1cccs1 ZINC000175831846 929776044 /nfs/dbraw/zinc/77/60/44/929776044.db2.gz ORZPYRAUJGHGIM-WBMJQRKESA-N 1 1 350.415 3.884 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@H]3c3ccc(O)cc3)o2)cc1 ZINC000610390103 930302730 /nfs/dbraw/zinc/30/27/30/930302730.db2.gz HOTPLGYUMCLHDU-KRWDZBQOSA-N 1 1 366.377 3.688 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@H]3c3ccc(O)cc3)o2)cc1 ZINC000610390103 930302733 /nfs/dbraw/zinc/30/27/33/930302733.db2.gz HOTPLGYUMCLHDU-KRWDZBQOSA-N 1 1 366.377 3.688 20 5 FHBDMO CCC[N@@H+](CC)CCNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275813734 930435511 /nfs/dbraw/zinc/43/55/11/930435511.db2.gz RDWFXPCPAJNFEH-UHFFFAOYSA-N 1 1 351.450 3.555 20 5 FHBDMO CCCC[N@@H+](C)C[C@@H](C)NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000583410539 937424297 /nfs/dbraw/zinc/42/42/97/937424297.db2.gz SAPGWRIKHCAQCC-CQSZACIVSA-N 1 1 362.499 3.928 20 5 FHBDMO C[C@H](CCNc1ncnc2sc([N+](=O)[O-])cc21)[N@@H+](C)Cc1ccccc1 ZINC000379667531 930517947 /nfs/dbraw/zinc/51/79/47/930517947.db2.gz BJLZPSHVRURSQL-CYBMUJFWSA-N 1 1 371.466 3.922 20 5 FHBDMO CCn1c(C)nc([N+](=O)[O-])c1N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000379666728 930518002 /nfs/dbraw/zinc/51/80/02/930518002.db2.gz XFMQBKIFRHJLFD-WMLDXEAASA-N 1 1 357.458 3.585 20 5 FHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](c2ccccc2F)C1 ZINC000580577042 930872191 /nfs/dbraw/zinc/87/21/91/930872191.db2.gz DXZPMVJAUGOLPG-UONOGXRCSA-N 1 1 357.385 3.550 20 5 FHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](c2ccccc2F)C1 ZINC000580577042 930872207 /nfs/dbraw/zinc/87/22/07/930872207.db2.gz DXZPMVJAUGOLPG-UONOGXRCSA-N 1 1 357.385 3.550 20 5 FHBDMO COc1ccc(NC(=O)[C@@H](C)[N@H+]2CCC[C@H](C(C)C)CC2)c([N+](=O)[O-])c1 ZINC001167424388 930940554 /nfs/dbraw/zinc/94/05/54/930940554.db2.gz HZOOFHALJXFVFX-CABCVRRESA-N 1 1 363.458 3.689 20 5 FHBDMO CCCC[N@H+](CC(N)=O)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000091950215 931274901 /nfs/dbraw/zinc/27/49/01/931274901.db2.gz XZNOFDNHOTWHHE-UHFFFAOYSA-N 1 1 365.817 3.596 20 5 FHBDMO CCCC[N@@H+](CC(N)=O)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000091950215 931274908 /nfs/dbraw/zinc/27/49/08/931274908.db2.gz XZNOFDNHOTWHHE-UHFFFAOYSA-N 1 1 365.817 3.596 20 5 FHBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)CCN1c1ncc([N+](=O)[O-])cc1Cl ZINC000610468831 931379121 /nfs/dbraw/zinc/37/91/21/931379121.db2.gz IGRCNLOXCRUILQ-AWEZNQCLSA-N 1 1 360.845 3.744 20 5 FHBDMO C[C@@](CO)([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1cccc(C(F)(F)F)c1 ZINC000610476370 931537984 /nfs/dbraw/zinc/53/79/84/931537984.db2.gz AZOUFKAQAHFOBP-INIZCTEOSA-N 1 1 372.318 3.750 20 5 FHBDMO O=[N+]([O-])c1ccc(OCC[N@@H+](Cc2ccc(F)cc2)C2CCOCC2)cc1 ZINC000581361835 931894752 /nfs/dbraw/zinc/89/47/52/931894752.db2.gz UKGZPLSXQLDCMJ-UHFFFAOYSA-N 1 1 374.412 3.794 20 5 FHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(C(=O)c2ccc(O)cc2)CC1 ZINC000610389814 932009809 /nfs/dbraw/zinc/00/98/09/932009809.db2.gz YGWPCVCEIOJFDI-CQSZACIVSA-N 1 1 354.406 3.956 20 5 FHBDMO O=C(Nc1ccccc1)NC1CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000276262860 932136373 /nfs/dbraw/zinc/13/63/73/932136373.db2.gz BLPQXXPYKBMXEQ-UHFFFAOYSA-N 1 1 372.400 3.520 20 5 FHBDMO Cc1c(NC(=O)CC[N@H+](C)[C@H](C)Cc2ccc(O)cc2)cccc1[N+](=O)[O-] ZINC000119396941 932195652 /nfs/dbraw/zinc/19/56/52/932195652.db2.gz WALYTCWCUQEKDM-CQSZACIVSA-N 1 1 371.437 3.500 20 5 FHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](CNC(=O)c2ccccc2)C1 ZINC000178043213 932217406 /nfs/dbraw/zinc/21/74/06/932217406.db2.gz VQJBPLNAMOLDAQ-DLBZAZTESA-N 1 1 367.449 3.798 20 5 FHBDMO Cc1c(C[N@H+]2CCC[C@@H](CNC(=O)c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000178051105 932223295 /nfs/dbraw/zinc/22/32/95/932223295.db2.gz NXLIBKFVYBMKLP-KRWDZBQOSA-N 1 1 367.449 3.545 20 5 FHBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccccc1N1CCCC1 ZINC000051120799 932338643 /nfs/dbraw/zinc/33/86/43/932338643.db2.gz SJJBBBDEVYNDEA-UHFFFAOYSA-N 1 1 355.438 3.706 20 5 FHBDMO Cc1cc(N2CC[C@]3(C2)CCC[N@H+](C)C3)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000581679247 932476265 /nfs/dbraw/zinc/47/62/65/932476265.db2.gz NXNXJPIUIQHFCV-MRXNPFEDSA-N 1 1 357.376 3.844 20 5 FHBDMO CC[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccccc1C ZINC000097254496 932556268 /nfs/dbraw/zinc/55/62/68/932556268.db2.gz GPKXXLLUZNRENI-UHFFFAOYSA-N 1 1 352.394 3.975 20 5 FHBDMO CC[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccccc1C ZINC000097254496 932556273 /nfs/dbraw/zinc/55/62/73/932556273.db2.gz GPKXXLLUZNRENI-UHFFFAOYSA-N 1 1 352.394 3.975 20 5 FHBDMO COc1cc(N[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c([N+](=O)[O-])cc1OC ZINC000302060178 932656685 /nfs/dbraw/zinc/65/66/85/932656685.db2.gz SONFQCFTBAQNBL-UONOGXRCSA-N 1 1 363.458 3.677 20 5 FHBDMO C[C@H]1C[C@@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000430659816 932683735 /nfs/dbraw/zinc/68/37/35/932683735.db2.gz CATYOHAGYVHAFG-KSSFIOAISA-N 1 1 371.412 3.517 20 5 FHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](NC(=O)c2ccccc2)C1 ZINC001167483652 932698678 /nfs/dbraw/zinc/69/86/78/932698678.db2.gz YCDOGCPFUSRFFU-WBVHZDCISA-N 1 1 353.422 3.550 20 5 FHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](NC(=O)c2ccccc2)C1 ZINC001167483652 932698681 /nfs/dbraw/zinc/69/86/81/932698681.db2.gz YCDOGCPFUSRFFU-WBVHZDCISA-N 1 1 353.422 3.550 20 5 FHBDMO Cc1nc(C2([NH2+]CCOc3ccccc3[N+](=O)[O-])CCCCCC2)no1 ZINC000101546053 932865724 /nfs/dbraw/zinc/86/57/24/932865724.db2.gz DTLJPNZDEDMICB-UHFFFAOYSA-N 1 1 360.414 3.504 20 5 FHBDMO CCOc1cccc(N2CC[C@@H](n3c[nH+]c4c3CCCC4)C2)c1[N+](=O)[O-] ZINC000548333997 933009145 /nfs/dbraw/zinc/00/91/45/933009145.db2.gz BGXRCAKAVINKRR-CQSZACIVSA-N 1 1 356.426 3.520 20 5 FHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCCO[C@@H](c4ccccc4)C3)nc2c1 ZINC000610581954 933325146 /nfs/dbraw/zinc/32/51/46/933325146.db2.gz YVQOMZABYQMGRE-GOSISDBHSA-N 1 1 353.378 3.700 20 5 FHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCCO[C@@H](c4ccccc4)C3)nc2c1 ZINC000610581954 933325157 /nfs/dbraw/zinc/32/51/57/933325157.db2.gz YVQOMZABYQMGRE-GOSISDBHSA-N 1 1 353.378 3.700 20 5 FHBDMO O=[N+]([O-])c1ccccc1OCC[NH+]1C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C1 ZINC000610604701 933513182 /nfs/dbraw/zinc/51/31/82/933513182.db2.gz HCKDWJOMUINFPV-UWVGGRQHSA-N 1 1 372.265 3.646 20 5 FHBDMO O=[N+]([O-])c1ccc(OCC[NH+]2C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)cc1 ZINC000610604772 933514596 /nfs/dbraw/zinc/51/45/96/933514596.db2.gz LELSYDIMOQEQOW-RYUDHWBXSA-N 1 1 372.265 3.646 20 5 FHBDMO CN1CCC([N@@H+](CCc2ccc([N+](=O)[O-])cc2)Cc2ccccc2)CC1 ZINC000611191034 933670136 /nfs/dbraw/zinc/67/01/36/933670136.db2.gz SZWDBEIJGKIZHZ-UHFFFAOYSA-N 1 1 353.466 3.734 20 5 FHBDMO CCc1nnc([C@H](C)[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[nH]1 ZINC000535685117 934278679 /nfs/dbraw/zinc/27/86/79/934278679.db2.gz CYLZEYPQEZXWCX-NSHDSACASA-N 1 1 357.439 3.855 20 5 FHBDMO CC(C)[N@H+](CC(=O)N[C@@H](C)c1cccs1)Cc1ccc([N+](=O)[O-])cc1 ZINC000098135173 934293999 /nfs/dbraw/zinc/29/39/99/934293999.db2.gz CGZCIJUOLPNYJN-AWEZNQCLSA-N 1 1 361.467 3.744 20 5 FHBDMO CC(C)[N@@H+](CC(=O)N[C@@H](C)c1cccs1)Cc1ccc([N+](=O)[O-])cc1 ZINC000098135173 934294004 /nfs/dbraw/zinc/29/40/04/934294004.db2.gz CGZCIJUOLPNYJN-AWEZNQCLSA-N 1 1 361.467 3.744 20 5 FHBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC[C@H]1CCC[N@@H+](C)C1 ZINC000458209707 934380438 /nfs/dbraw/zinc/38/04/38/934380438.db2.gz KOUJZUNXKRHTRY-CQSZACIVSA-N 1 1 365.499 3.559 20 5 FHBDMO C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)c1csc([N+](=O)[O-])c1 ZINC000247661541 934553352 /nfs/dbraw/zinc/55/33/52/934553352.db2.gz XOPRFIIBLCYHOX-UOIKSKOESA-N 1 1 373.478 3.543 20 5 FHBDMO Cc1nn(C[N@@H+]2CCC[C@@H]2c2cccc(C)n2)c2cc([N+](=O)[O-])ccc12 ZINC000121264405 934806725 /nfs/dbraw/zinc/80/67/25/934806725.db2.gz HHORTGSHCNBNGW-GOSISDBHSA-N 1 1 351.410 3.751 20 5 FHBDMO Cc1nn(C[N@H+]2CCC[C@@H]2c2cccc(C)n2)c2cc([N+](=O)[O-])ccc12 ZINC000121264405 934806729 /nfs/dbraw/zinc/80/67/29/934806729.db2.gz HHORTGSHCNBNGW-GOSISDBHSA-N 1 1 351.410 3.751 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1CN[C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000380702556 934879777 /nfs/dbraw/zinc/87/97/77/934879777.db2.gz HBHLHMRYSQRFSH-WMZOPIPTSA-N 1 1 369.465 3.604 20 5 FHBDMO Cn1cc(C[N@H+]2CC[C@H]2Cc2ccccc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000538723406 934897671 /nfs/dbraw/zinc/89/76/71/934897671.db2.gz AVZNNUUJITYALR-FQEVSTJZSA-N 1 1 362.433 3.812 20 5 FHBDMO COc1ccc(C[N@@H+]2CCC[C@@H]2CC(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000121719780 934941196 /nfs/dbraw/zinc/94/11/96/934941196.db2.gz SYBZMMQTIRJHJW-CQSZACIVSA-N 1 1 360.435 3.902 20 5 FHBDMO COc1ccc(C[N@H+]2CCC[C@@H]2CC(=O)c2cccs2)cc1[N+](=O)[O-] ZINC000121719780 934941198 /nfs/dbraw/zinc/94/11/98/934941198.db2.gz SYBZMMQTIRJHJW-CQSZACIVSA-N 1 1 360.435 3.902 20 5 FHBDMO CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)[C@@H](C)[C@@H]1C ZINC000538917600 934948587 /nfs/dbraw/zinc/94/85/87/934948587.db2.gz CLQFDYDAFMINAY-KBPBESRZSA-N 1 1 365.499 3.508 20 5 FHBDMO CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)[C@@H](C)[C@@H]1C ZINC000538917600 934948589 /nfs/dbraw/zinc/94/85/89/934948589.db2.gz CLQFDYDAFMINAY-KBPBESRZSA-N 1 1 365.499 3.508 20 5 FHBDMO O=[N+]([O-])c1ccc(OCC[N@H+](Cc2ccccc2)C[C@@H]2CCCO2)cc1 ZINC000065536249 934961989 /nfs/dbraw/zinc/96/19/89/934961989.db2.gz FNZGHBLVANTQCM-FQEVSTJZSA-N 1 1 356.422 3.655 20 5 FHBDMO C[C@@H](c1nc(-c2cccs2)no1)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511093606 935440533 /nfs/dbraw/zinc/44/05/33/935440533.db2.gz DELSKCPQRREPCW-LBPRGKRZSA-N 1 1 358.423 3.942 20 5 FHBDMO C[C@@H](c1nc(-c2cccs2)no1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511093606 935440547 /nfs/dbraw/zinc/44/05/47/935440547.db2.gz DELSKCPQRREPCW-LBPRGKRZSA-N 1 1 358.423 3.942 20 5 FHBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000051560292 935476709 /nfs/dbraw/zinc/47/67/09/935476709.db2.gz KTQDRGZXBAQUGU-MRXNPFEDSA-N 1 1 370.405 3.582 20 5 FHBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000127568989 935627017 /nfs/dbraw/zinc/62/70/17/935627017.db2.gz XZRXWOQFKCVNHP-MRXNPFEDSA-N 1 1 360.458 3.598 20 5 FHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@H]2c2ccc3c(c2)OCCO3)cc1 ZINC000051650055 935636711 /nfs/dbraw/zinc/63/67/11/935636711.db2.gz NSHHVFGCGUJQPZ-SFHVURJKSA-N 1 1 354.406 3.746 20 5 FHBDMO Cc1ccc([C@@H]2CCCCC[N@H+]2Cc2ccc(C(N)=O)cc2[N+](=O)[O-])o1 ZINC000158655850 935887793 /nfs/dbraw/zinc/88/77/93/935887793.db2.gz LYFXTDFANZBTRY-INIZCTEOSA-N 1 1 357.410 3.712 20 5 FHBDMO O=[N+]([O-])c1cnn(CC[N@H+](Cc2c(F)cccc2F)C2CCCC2)c1 ZINC000472241045 935938319 /nfs/dbraw/zinc/93/83/19/935938319.db2.gz LQQMWELDSJRWOZ-UHFFFAOYSA-N 1 1 350.369 3.514 20 5 FHBDMO O=[N+]([O-])c1cnn(CC[N@@H+](Cc2c(F)cccc2F)C2CCCC2)c1 ZINC000472241045 935938323 /nfs/dbraw/zinc/93/83/23/935938323.db2.gz LQQMWELDSJRWOZ-UHFFFAOYSA-N 1 1 350.369 3.514 20 5 FHBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2ncnc3ccc([N+](=O)[O-])cc32)C1 ZINC000611707496 935948921 /nfs/dbraw/zinc/94/89/21/935948921.db2.gz NOZJBGQAKMMFRM-HOTGVXAUSA-N 1 1 369.469 3.629 20 5 FHBDMO C[C@H](CC[N@@H+]1CCOc2ccc([N+](=O)[O-])cc2C1)OCc1ccccc1 ZINC000582694955 935950914 /nfs/dbraw/zinc/95/09/14/935950914.db2.gz QCNPZPSSPCHILW-MRXNPFEDSA-N 1 1 356.422 3.785 20 5 FHBDMO C[C@H](CC[N@H+]1CCOc2ccc([N+](=O)[O-])cc2C1)OCc1ccccc1 ZINC000582694955 935950917 /nfs/dbraw/zinc/95/09/17/935950917.db2.gz QCNPZPSSPCHILW-MRXNPFEDSA-N 1 1 356.422 3.785 20 5 FHBDMO COc1cc(C[NH2+]C2(c3ccccc3)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000077377950 936046237 /nfs/dbraw/zinc/04/62/37/936046237.db2.gz DADMPECCNJIMCZ-UHFFFAOYSA-N 1 1 364.348 3.984 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2nc(C[NH2+][C@@H](c3ccncc3)C3CC3)co2)cc1 ZINC000934695501 936185536 /nfs/dbraw/zinc/18/55/36/936185536.db2.gz ONTOQVPABZHPOC-GOSISDBHSA-N 1 1 350.378 3.886 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1[C@H](C)C[C@H]2CCCC[C@H]21 ZINC000246125284 938340182 /nfs/dbraw/zinc/34/01/82/938340182.db2.gz HXWGOGHTMDVQDL-CKEIUWERSA-N 1 1 361.442 3.585 20 5 FHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])[C@@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000052638622 938458059 /nfs/dbraw/zinc/45/80/59/938458059.db2.gz DIXXVTUYCGMBIX-DLBZAZTESA-N 1 1 367.232 3.992 20 5 FHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000052638622 938458061 /nfs/dbraw/zinc/45/80/61/938458061.db2.gz DIXXVTUYCGMBIX-DLBZAZTESA-N 1 1 367.232 3.992 20 5 FHBDMO CN(CCC[N@@H+](C)Cc1ccco1)c1ccnc2c1cccc2[N+](=O)[O-] ZINC000432138157 945178991 /nfs/dbraw/zinc/17/89/91/945178991.db2.gz KIQSKAHVSSQYCL-UHFFFAOYSA-N 1 1 354.410 3.694 20 5 FHBDMO CC[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@H](C)c1cccc(OC)c1 ZINC000052706032 938504015 /nfs/dbraw/zinc/50/40/15/938504015.db2.gz MKJKKBOCEZINNG-OAHLLOKOSA-N 1 1 371.437 3.649 20 5 FHBDMO CC[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@H](C)c1cccc(OC)c1 ZINC000052706032 938504018 /nfs/dbraw/zinc/50/40/18/938504018.db2.gz MKJKKBOCEZINNG-OAHLLOKOSA-N 1 1 371.437 3.649 20 5 FHBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)[C@@H]1CCC[C@H]1O ZINC000584021377 938553613 /nfs/dbraw/zinc/55/36/13/938553613.db2.gz ROFQHJCYVQUORL-HZPDHXFCSA-N 1 1 350.802 3.853 20 5 FHBDMO O=[N+]([O-])c1ccccc1/C=C\C[NH+]1CCC(Oc2ccc(F)nc2)CC1 ZINC000588587917 938611910 /nfs/dbraw/zinc/61/19/10/938611910.db2.gz HUOZEJVWVDTBTF-HYXAFXHYSA-N 1 1 357.385 3.686 20 5 FHBDMO O=C(NC[C@@H]1CCC[N@H+]1C1CCCCC1)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000437869696 945200847 /nfs/dbraw/zinc/20/08/47/945200847.db2.gz NLKXGOGFQVDKBP-INIZCTEOSA-N 1 1 370.453 3.603 20 5 FHBDMO Cc1c(CNC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000708540182 938815970 /nfs/dbraw/zinc/81/59/70/938815970.db2.gz SWEYEAQMSPPPKI-UZLBHIALSA-N 1 1 353.466 3.761 20 5 FHBDMO Cc1c(CNC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000708540182 938815972 /nfs/dbraw/zinc/81/59/72/938815972.db2.gz SWEYEAQMSPPPKI-UZLBHIALSA-N 1 1 353.466 3.761 20 5 FHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)CCc1ccccc1 ZINC000053048039 938852395 /nfs/dbraw/zinc/85/23/95/938852395.db2.gz WJLZKUIZRZZVKU-AWEZNQCLSA-N 1 1 352.394 3.880 20 5 FHBDMO Cc1c(C(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)cccc1[N+](=O)[O-] ZINC000140194011 938945424 /nfs/dbraw/zinc/94/54/24/938945424.db2.gz GZEYNYUEIGEPPT-HNNXBMFYSA-N 1 1 373.478 3.607 20 5 FHBDMO COc1cc(C[NH2+][C@@H](CN2CCCCC2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000611935388 938993051 /nfs/dbraw/zinc/99/30/51/938993051.db2.gz WSNUEBSUFQDRGH-IBGZPJMESA-N 1 1 369.465 3.920 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@H](Cc2ccccc2)[C@H]1C ZINC000472341972 939001073 /nfs/dbraw/zinc/00/10/73/939001073.db2.gz IBFIPHMORVLIFN-AEFFLSMTSA-N 1 1 367.449 3.795 20 5 FHBDMO C[C@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@H]1c1cccc(F)c1 ZINC000472344991 939006175 /nfs/dbraw/zinc/00/61/75/939006175.db2.gz BNTUFKKTUDHFKZ-VBKZILBWSA-N 1 1 371.412 3.780 20 5 FHBDMO C[C@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@H]1c1cccc(F)c1 ZINC000472344991 939006176 /nfs/dbraw/zinc/00/61/76/939006176.db2.gz BNTUFKKTUDHFKZ-VBKZILBWSA-N 1 1 371.412 3.780 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H](Cc2ccccc2)[C@@H]1C ZINC000472352523 939015931 /nfs/dbraw/zinc/01/59/31/939015931.db2.gz ZPMLZUMIXUQGGH-WMZOPIPTSA-N 1 1 367.449 3.795 20 5 FHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)cn1 ZINC000612101620 939050771 /nfs/dbraw/zinc/05/07/71/939050771.db2.gz BVSGEGREFYXELJ-YTQUADARSA-N 1 1 352.438 3.702 20 5 FHBDMO COc1cc(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000511844851 945261656 /nfs/dbraw/zinc/26/16/56/945261656.db2.gz TVUGWBPCKSFLNP-AAEUAGOBSA-N 1 1 356.369 3.969 20 5 FHBDMO COc1cc(C[N@H+](C)Cc2ccc(Cl)cc2)c([N+](=O)[O-])cc1OC ZINC000506766683 945271574 /nfs/dbraw/zinc/27/15/74/945271574.db2.gz KWUKITJHTMBXPG-UHFFFAOYSA-N 1 1 350.802 3.897 20 5 FHBDMO COc1cc(C[N@@H+](C)Cc2ccc(Cl)cc2)c([N+](=O)[O-])cc1OC ZINC000506766683 945271579 /nfs/dbraw/zinc/27/15/79/945271579.db2.gz KWUKITJHTMBXPG-UHFFFAOYSA-N 1 1 350.802 3.897 20 5 FHBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(c2ncnc3cccc([N+](=O)[O-])c32)C1 ZINC000612444843 940072788 /nfs/dbraw/zinc/07/27/88/940072788.db2.gz WSXNTSGQJGPOAB-JKSUJKDBSA-N 1 1 369.469 3.629 20 5 FHBDMO CCc1ccc(-c2noc(C[N@H+](C)CCc3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000548933306 940093834 /nfs/dbraw/zinc/09/38/34/940093834.db2.gz BLPKIJGRUORKDY-UHFFFAOYSA-N 1 1 366.421 3.882 20 5 FHBDMO CCc1ccc(-c2noc(C[N@@H+](C)CCc3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000548933306 940093838 /nfs/dbraw/zinc/09/38/38/940093838.db2.gz BLPKIJGRUORKDY-UHFFFAOYSA-N 1 1 366.421 3.882 20 5 FHBDMO Cc1ccc(Sc2ccc(C[NH2+]CC(=O)NC(C)C)cc2[N+](=O)[O-])cc1 ZINC000236643250 940114826 /nfs/dbraw/zinc/11/48/26/940114826.db2.gz MUJJJJGHDZQBNZ-UHFFFAOYSA-N 1 1 373.478 3.669 20 5 FHBDMO C[C@H]1C[C@H](C(F)(F)F)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411809093 940123691 /nfs/dbraw/zinc/12/36/91/940123691.db2.gz SYTJKRCVKGCSDO-NWDGAFQWSA-N 1 1 359.348 3.586 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCSC2(CCC2)CC1 ZINC000411872308 940146163 /nfs/dbraw/zinc/14/61/63/940146163.db2.gz VAJOFMJCCDUXTK-UHFFFAOYSA-N 1 1 363.483 3.593 20 5 FHBDMO O=C(CC[N@@H+]1CCc2sc(Cl)cc2C1)Nc1ccccc1[N+](=O)[O-] ZINC000563068203 940168526 /nfs/dbraw/zinc/16/85/26/940168526.db2.gz LJNMNLVOGRNHDX-UHFFFAOYSA-N 1 1 365.842 3.697 20 5 FHBDMO O=C(CC[N@H+]1CCc2sc(Cl)cc2C1)Nc1ccccc1[N+](=O)[O-] ZINC000563068203 940168535 /nfs/dbraw/zinc/16/85/35/940168535.db2.gz LJNMNLVOGRNHDX-UHFFFAOYSA-N 1 1 365.842 3.697 20 5 FHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH+]2CCC(OC[C@H]3CCCCO3)CC2)c1 ZINC000177585507 940299261 /nfs/dbraw/zinc/29/92/61/940299261.db2.gz ALEZOYIJBLMWEO-QGZVFWFLSA-N 1 1 368.861 3.798 20 5 FHBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)no1 ZINC000612955432 940358757 /nfs/dbraw/zinc/35/87/57/940358757.db2.gz ZMEXLEBVZSWZIP-RQIDDLAKSA-N 1 1 354.410 3.879 20 5 FHBDMO CC(C)c1[nH+]ccn1C[C@@H]1CCCN1c1ncnc2sc([N+](=O)[O-])cc21 ZINC000376170617 940410569 /nfs/dbraw/zinc/41/05/69/940410569.db2.gz GFFFDIZYHNQUEV-LBPRGKRZSA-N 1 1 372.454 3.588 20 5 FHBDMO CC(=O)c1cc([N+](=O)[O-])ccc1N1CCC[C@@H](n2cc[nH+]c2C(C)C)C1 ZINC000376189244 940441449 /nfs/dbraw/zinc/44/14/49/940441449.db2.gz UQEZQIIRLUUQKI-MRXNPFEDSA-N 1 1 356.426 3.959 20 5 FHBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000685869018 940507796 /nfs/dbraw/zinc/50/77/96/940507796.db2.gz PWIRTNIPEHBQAL-HNNXBMFYSA-N 1 1 365.477 3.532 20 5 FHBDMO COc1cc(C[N@@H+]2CC[C@@H](Oc3cccc(F)c3)C2)c([N+](=O)[O-])cc1F ZINC000613384129 940659282 /nfs/dbraw/zinc/65/92/82/940659282.db2.gz ZODYGZJHYBOZPY-OAHLLOKOSA-N 1 1 364.348 3.535 20 5 FHBDMO COc1cc(C[N@H+]2CC[C@@H](Oc3cccc(F)c3)C2)c([N+](=O)[O-])cc1F ZINC000613384129 940659283 /nfs/dbraw/zinc/65/92/83/940659283.db2.gz ZODYGZJHYBOZPY-OAHLLOKOSA-N 1 1 364.348 3.535 20 5 FHBDMO CCC[C@@]1(CO)CC[N@@H+](Cc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)C1 ZINC000582328340 940666344 /nfs/dbraw/zinc/66/63/44/940666344.db2.gz UYAAYUZSPXUCNC-HXUWFJFHSA-N 1 1 374.437 3.848 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+](C)CCC1CCCCC1 ZINC000507605610 945352325 /nfs/dbraw/zinc/35/23/25/945352325.db2.gz AYWQQTVJALHTHO-AWEZNQCLSA-N 1 1 363.458 3.833 20 5 FHBDMO C[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C1CCN(CC(F)(F)F)CC1 ZINC000452032523 940870957 /nfs/dbraw/zinc/87/09/57/940870957.db2.gz NZADXFXXKLNTIR-UHFFFAOYSA-N 1 1 365.783 3.707 20 5 FHBDMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC([N@H+]2CCC[C@@H]2C)CC1 ZINC000363798175 941047538 /nfs/dbraw/zinc/04/75/38/941047538.db2.gz PSOVTQZASRHDON-FUHWJXTLSA-N 1 1 373.497 3.639 20 5 FHBDMO CC[N@H+](Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1)C[C@H]1CCCO1 ZINC000511510333 941086017 /nfs/dbraw/zinc/08/60/17/941086017.db2.gz YDEDTDIDZXROQN-OAHLLOKOSA-N 1 1 360.410 3.864 20 5 FHBDMO C[N@@H+](CCCOc1ccc(F)cc1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000177008738 941092894 /nfs/dbraw/zinc/09/28/94/941092894.db2.gz HZNKLINCGDABII-UHFFFAOYSA-N 1 1 359.357 3.776 20 5 FHBDMO COCCO[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000188814418 941095819 /nfs/dbraw/zinc/09/58/19/941095819.db2.gz XAWAHTXJBRUITO-CQSZACIVSA-N 1 1 362.451 3.561 20 5 FHBDMO CN(Cc1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311108633 941105632 /nfs/dbraw/zinc/10/56/32/941105632.db2.gz LZLOSCYIARZODN-KRWDZBQOSA-N 1 1 359.857 3.955 20 5 FHBDMO C[N@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C[C@@H]1CCCC[C@@H]1O ZINC000181099100 941108704 /nfs/dbraw/zinc/10/87/04/941108704.db2.gz ZNJYXJVWLCGWMK-YOEHRIQHSA-N 1 1 361.467 3.701 20 5 FHBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000178678071 941294482 /nfs/dbraw/zinc/29/44/82/941294482.db2.gz OSODXPWGBDTNGC-DYESRHJHSA-N 1 1 359.473 3.944 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCCO[C@H](CF)C3)s2)cc1 ZINC000414479634 941330333 /nfs/dbraw/zinc/33/03/33/941330333.db2.gz SGJSNIHQMJBGKV-OAHLLOKOSA-N 1 1 350.415 3.884 20 5 FHBDMO Cc1ccc(C(=O)C2CC[NH+](C[C@H](O)c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000136981947 941756441 /nfs/dbraw/zinc/75/64/41/941756441.db2.gz HTWOYFOOSYVDMM-FQEVSTJZSA-N 1 1 368.433 3.532 20 5 FHBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1C(F)(F)F)C[C@@H]1CCn2ccnc2C1 ZINC000377657324 941874450 /nfs/dbraw/zinc/87/44/50/941874450.db2.gz XPLYDNHPVVBPOA-GFCCVEGCSA-N 1 1 368.359 3.505 20 5 FHBDMO COc1ccccc1O[C@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000513395838 941890086 /nfs/dbraw/zinc/89/00/86/941890086.db2.gz AIMIUIUSSDPROG-SFHVURJKSA-N 1 1 372.421 3.526 20 5 FHBDMO CC(C)[N@H+](CC(=O)N1CCC[C@@H]2CCCC[C@H]21)Cc1ccc([N+](=O)[O-])cc1 ZINC000513405268 941898982 /nfs/dbraw/zinc/89/89/82/941898982.db2.gz FVVMCOACRVHKQX-AZUAARDMSA-N 1 1 373.497 3.986 20 5 FHBDMO CC(C)[N@@H+](CC(=O)N1CCC[C@@H]2CCCC[C@H]21)Cc1ccc([N+](=O)[O-])cc1 ZINC000513405268 941898984 /nfs/dbraw/zinc/89/89/84/941898984.db2.gz FVVMCOACRVHKQX-AZUAARDMSA-N 1 1 373.497 3.986 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H]1C1CCCCC1 ZINC000513407095 941901322 /nfs/dbraw/zinc/90/13/22/941901322.db2.gz BDWXEXCWBMMSJP-KRWDZBQOSA-N 1 1 361.442 3.587 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)Cc1ccccc1N1CCOCC1 ZINC000182618874 941947997 /nfs/dbraw/zinc/94/79/97/941947997.db2.gz QOHLBEJDFYZGGE-QGZVFWFLSA-N 1 1 369.465 3.933 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@H](CNC(=O)C(C)(C)C)C1 ZINC000182785401 941966789 /nfs/dbraw/zinc/96/67/89/941966789.db2.gz QYKRCNSOVZTPNQ-HZPDHXFCSA-N 1 1 361.486 3.839 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@@H]1Cn1cc[nH+]c1C(C)C ZINC000377797561 941994348 /nfs/dbraw/zinc/99/43/48/941994348.db2.gz XLYWLTWIQKFKBO-MRXNPFEDSA-N 1 1 356.426 3.528 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](Cc3ccccc3)C2)c2c(c1)COCO2 ZINC000513637118 942049260 /nfs/dbraw/zinc/04/92/60/942049260.db2.gz FTWYOBDLKXJPLI-QGZVFWFLSA-N 1 1 368.433 3.916 20 5 FHBDMO CSc1ccccc1C[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000501913775 942120831 /nfs/dbraw/zinc/12/08/31/942120831.db2.gz FJAAXJBLSQCCSX-UHFFFAOYSA-N 1 1 359.451 3.777 20 5 FHBDMO Cc1cccc([C@H]2CC[N@@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])C2)c1 ZINC000501010164 942256615 /nfs/dbraw/zinc/25/66/15/942256615.db2.gz IIOKVKKAEQWRAP-KRWDZBQOSA-N 1 1 353.422 3.721 20 5 FHBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccc(Cl)c(F)c1 ZINC000501031935 942262449 /nfs/dbraw/zinc/26/24/49/942262449.db2.gz ZYXVNVWLLDKNAQ-UHFFFAOYSA-N 1 1 365.792 3.848 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@H](CC(F)(F)F)C3)n2)cc1 ZINC000420952862 942272877 /nfs/dbraw/zinc/27/28/77/942272877.db2.gz SLBJGIZWQUJDGF-LLVKDONJSA-N 1 1 370.331 3.809 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@H](CC(F)(F)F)C3)n2)cc1 ZINC000420952862 942272879 /nfs/dbraw/zinc/27/28/79/942272879.db2.gz SLBJGIZWQUJDGF-LLVKDONJSA-N 1 1 370.331 3.809 20 5 FHBDMO CCC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CCc1cccs1 ZINC000501035307 942278573 /nfs/dbraw/zinc/27/85/73/942278573.db2.gz HMEHTSLRXSPQFZ-UHFFFAOYSA-N 1 1 361.467 3.940 20 5 FHBDMO CC[C@H]1Cc2ccccc2C[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000501054376 942280221 /nfs/dbraw/zinc/28/02/21/942280221.db2.gz NCSQJXCWYIQAHL-KRWDZBQOSA-N 1 1 353.422 3.760 20 5 FHBDMO CSc1cccc(C(=O)N(C)CC[N@@H+](C)C2CCCCC2)c1[N+](=O)[O-] ZINC000188070332 942325215 /nfs/dbraw/zinc/32/52/15/942325215.db2.gz WVIJNQBIYURGFO-UHFFFAOYSA-N 1 1 365.499 3.653 20 5 FHBDMO C[N@H+]1CCC[C@H](CNc2ncc([N+](=O)[O-])cc2F)[C@H]1c1cccs1 ZINC000413157583 942353234 /nfs/dbraw/zinc/35/32/34/942353234.db2.gz IAIATGJJXBPDMH-ABAIWWIYSA-N 1 1 350.419 3.685 20 5 FHBDMO Cc1ccc(N2CCC(Nc3nccc4ccc([N+](=O)[O-])cc43)CC2)[nH+]c1 ZINC000413157516 942353388 /nfs/dbraw/zinc/35/33/88/942353388.db2.gz HULOPKMLMIGNEB-UHFFFAOYSA-N 1 1 363.421 3.927 20 5 FHBDMO C[N@H+]1CCC[C@H](CNc2ncc([N+](=O)[O-])cc2F)[C@@H]1c1cccs1 ZINC000413157585 942353395 /nfs/dbraw/zinc/35/33/95/942353395.db2.gz IAIATGJJXBPDMH-IAQYHMDHSA-N 1 1 350.419 3.685 20 5 FHBDMO COc1ccc(-c2ccc(CN3CCC[N@H+](C(C)C)CC3)o2)c([N+](=O)[O-])c1 ZINC000505268053 942437138 /nfs/dbraw/zinc/43/71/38/942437138.db2.gz YAJQTKXQEYYSQY-UHFFFAOYSA-N 1 1 373.453 3.780 20 5 FHBDMO CC(C)c1ccc(C[NH+]2CCN(c3ccc(O)cc3)CC2)cc1[N+](=O)[O-] ZINC000505317895 942473879 /nfs/dbraw/zinc/47/38/79/942473879.db2.gz ARLVCBXLHFTDPQ-UHFFFAOYSA-N 1 1 355.438 3.746 20 5 FHBDMO COc1cccc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1OC(F)F ZINC000549407723 942488540 /nfs/dbraw/zinc/48/85/40/942488540.db2.gz IOWDKVYIJPFAJS-UHFFFAOYSA-N 1 1 366.364 3.879 20 5 FHBDMO C[C@H]1C[C@H](CO)C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000421362927 942516272 /nfs/dbraw/zinc/51/62/72/942516272.db2.gz OJDUGCIMDHAVNZ-STQMWFEESA-N 1 1 364.829 3.959 20 5 FHBDMO O=C(NC[C@H]1CCCC[N@H+]1C1CC1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000434427049 942654532 /nfs/dbraw/zinc/65/45/32/942654532.db2.gz YADORGGGVQREAO-OAHLLOKOSA-N 1 1 359.451 3.556 20 5 FHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC(CCC[NH+](C)C)CC1 ZINC000501778019 942669150 /nfs/dbraw/zinc/66/91/50/942669150.db2.gz SIKNFMBQMQDVLZ-UHFFFAOYSA-N 1 1 363.502 3.936 20 5 FHBDMO Cc1cc(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cn2cc[nH+]c12 ZINC000502800042 942753360 /nfs/dbraw/zinc/75/33/60/942753360.db2.gz VOQQFSGKUQSROD-LLVKDONJSA-N 1 1 374.784 3.610 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]([N@@H+]2[C@H](C)CC[C@@H]2C)C1 ZINC000421756505 942800320 /nfs/dbraw/zinc/80/03/20/942800320.db2.gz KAXNUQGEHCDQQQ-IXDOHACOSA-N 1 1 359.470 3.689 20 5 FHBDMO CCC[C@H](C)[N@@H+](C)CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000434639134 942830933 /nfs/dbraw/zinc/83/09/33/942830933.db2.gz UWALPEYVZQOFTB-LBPRGKRZSA-N 1 1 362.455 3.777 20 5 FHBDMO CC1(C)C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC[C@H]1C(F)(F)F ZINC000190206197 942857959 /nfs/dbraw/zinc/85/79/59/942857959.db2.gz UMGOVCAZAHMVCZ-CQSZACIVSA-N 1 1 373.375 3.834 20 5 FHBDMO Cc1cccc2c1C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)CC2 ZINC000429592669 942866008 /nfs/dbraw/zinc/86/60/08/942866008.db2.gz UGKKKLXQSKMDHV-UHFFFAOYSA-N 1 1 353.422 3.599 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](Cc1cccc(F)c1)C(C)C ZINC000434715329 942878269 /nfs/dbraw/zinc/87/82/69/942878269.db2.gz XSZFLJNWOYXEGN-UHFFFAOYSA-N 1 1 359.401 3.891 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](Cc1cccc(F)c1)C(C)C ZINC000434715329 942878271 /nfs/dbraw/zinc/87/82/71/942878271.db2.gz XSZFLJNWOYXEGN-UHFFFAOYSA-N 1 1 359.401 3.891 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H](c2ccccc2)[C@H]1C ZINC000434901220 943038104 /nfs/dbraw/zinc/03/81/04/943038104.db2.gz TUVNFSYFENRJME-WBVHZDCISA-N 1 1 353.422 3.720 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H](c2ccccc2)[C@H]1C ZINC000434901220 943038108 /nfs/dbraw/zinc/03/81/08/943038108.db2.gz TUVNFSYFENRJME-WBVHZDCISA-N 1 1 353.422 3.720 20 5 FHBDMO COc1cc(C[N@@H+](C)[C@H](C)C2CCC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000505589323 943111953 /nfs/dbraw/zinc/11/19/53/943111953.db2.gz ZZZJQXASTNLABR-LLVKDONJSA-N 1 1 358.385 3.868 20 5 FHBDMO [NH3+]C[C@@H]1CCN(Cc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)C1 ZINC000414659550 943128935 /nfs/dbraw/zinc/12/89/35/943128935.db2.gz SXQCLGZWQAIJIF-AWEZNQCLSA-N 1 1 361.829 3.821 20 5 FHBDMO CCOc1ccc(C[N@H+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])cc1 ZINC000505637376 943269337 /nfs/dbraw/zinc/26/93/37/943269337.db2.gz RMXJCTFHJPRJNL-UHFFFAOYSA-N 1 1 360.410 3.643 20 5 FHBDMO CCOc1ccc(C[N@@H+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])cc1 ZINC000505637376 943269342 /nfs/dbraw/zinc/26/93/42/943269342.db2.gz RMXJCTFHJPRJNL-UHFFFAOYSA-N 1 1 360.410 3.643 20 5 FHBDMO C[C@H](N[C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000422934572 943336956 /nfs/dbraw/zinc/33/69/56/943336956.db2.gz CPKAYDNBBHSTLQ-BOUXLOLZSA-N 1 1 353.422 3.501 20 5 FHBDMO CCc1ccc([C@H](NCC[C@@H]2CCC[NH2+]C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423258872 943462112 /nfs/dbraw/zinc/46/21/12/943462112.db2.gz MXKCUVMFJKOZAQ-MGPUTAFESA-N 1 1 357.454 3.819 20 5 FHBDMO Cc1cccc(C(=O)NC[C@@]2(C)CCC[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000162376797 943492294 /nfs/dbraw/zinc/49/22/94/943492294.db2.gz FYEGMDDGEBDUIC-OAQYLSRUSA-N 1 1 367.449 3.688 20 5 FHBDMO C[N@H+](Cc1ccc(Br)cc1[N+](=O)[O-])[C@@H](CO)c1ccccc1 ZINC000425394863 943493195 /nfs/dbraw/zinc/49/31/95/943493195.db2.gz LZRCLHBYQHEITE-INIZCTEOSA-N 1 1 365.227 3.523 20 5 FHBDMO C[N@@H+](Cc1ccc(Br)cc1[N+](=O)[O-])[C@@H](CO)c1ccccc1 ZINC000425394863 943493196 /nfs/dbraw/zinc/49/31/96/943493196.db2.gz LZRCLHBYQHEITE-INIZCTEOSA-N 1 1 365.227 3.523 20 5 FHBDMO CCOc1ccc([C@H](C)[NH2+]C[C@@H]2NCCc3ccccc32)cc1[N+](=O)[O-] ZINC000423446944 943513505 /nfs/dbraw/zinc/51/35/05/943513505.db2.gz ZMFAAWHZXQBFDB-KSSFIOAISA-N 1 1 355.438 3.531 20 5 FHBDMO CCc1ccc([C@H](NCCC[C@@H]2CCC[NH2+]2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423490364 943534859 /nfs/dbraw/zinc/53/48/59/943534859.db2.gz XOAXGCOROPBCFH-OXJNMPFZSA-N 1 1 357.454 3.961 20 5 FHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@](O)(C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000515254602 943605262 /nfs/dbraw/zinc/60/52/62/943605262.db2.gz URBGPUMOLIDDLP-MRXNPFEDSA-N 1 1 360.376 3.998 20 5 FHBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2NC[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000584790525 943610981 /nfs/dbraw/zinc/61/09/81/943610981.db2.gz QIFKAYXCBJFSNK-XLIONFOSSA-N 1 1 351.450 3.694 20 5 FHBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000584790525 943610985 /nfs/dbraw/zinc/61/09/85/943610985.db2.gz QIFKAYXCBJFSNK-XLIONFOSSA-N 1 1 351.450 3.694 20 5 FHBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C[C@H]1CCN(Cc2ccccc2)C1 ZINC000584790525 943610989 /nfs/dbraw/zinc/61/09/89/943610989.db2.gz QIFKAYXCBJFSNK-XLIONFOSSA-N 1 1 351.450 3.694 20 5 FHBDMO CC[C@H](C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1 ZINC000516897982 943814651 /nfs/dbraw/zinc/81/46/51/943814651.db2.gz KMQXBXIYIMGSNI-VQIMIIECSA-N 1 1 369.465 3.991 20 5 FHBDMO CCC(O)(CC)C(C)(C)C[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000566501999 943838795 /nfs/dbraw/zinc/83/87/95/943838795.db2.gz WHIAMSPULNDFDN-KRWDZBQOSA-N 1 1 374.485 3.585 20 5 FHBDMO CC[N@H+]1CC[C@H](N(C)Cc2ccc(Br)cc2[N+](=O)[O-])C[C@H]1C ZINC000425422341 943880403 /nfs/dbraw/zinc/88/04/03/943880403.db2.gz NASWEWKOUNNZGK-DOMZBBRYSA-N 1 1 370.291 3.662 20 5 FHBDMO Cc1ccsc1[C@H](CO)[NH2+]Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425432433 943907722 /nfs/dbraw/zinc/90/77/22/943907722.db2.gz KPDCSTAAHCKTDO-LBPRGKRZSA-N 1 1 371.256 3.550 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000504915375 943910786 /nfs/dbraw/zinc/91/07/86/943910786.db2.gz SRPPQRKKTIDXJM-KRWDZBQOSA-N 1 1 368.437 3.689 20 5 FHBDMO CCOc1ccc([C@@H](C)N[C@H]2CC[N@@H+](CC3CCCC3)C2)cc1[N+](=O)[O-] ZINC000504929773 943926690 /nfs/dbraw/zinc/92/66/90/943926690.db2.gz LGUJRZGSXRCMAH-QAPCUYQASA-N 1 1 361.486 3.909 20 5 FHBDMO CCOc1ccc([C@@H](C)[NH2+][C@H]2CCN(CC3CCCC3)C2)cc1[N+](=O)[O-] ZINC000504929773 943926692 /nfs/dbraw/zinc/92/66/92/943926692.db2.gz LGUJRZGSXRCMAH-QAPCUYQASA-N 1 1 361.486 3.909 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C[C@H](C)c1ccccc1)[C@@H](C)CO ZINC000517048566 943951535 /nfs/dbraw/zinc/95/15/35/943951535.db2.gz SKBISJHGFCHDGZ-HOTGVXAUSA-N 1 1 358.438 3.590 20 5 FHBDMO O=[N+]([O-])c1cc(Br)ccc1C[NH+]1CCC([C@H]2CCCO2)CC1 ZINC000425444243 943956193 /nfs/dbraw/zinc/95/61/93/943956193.db2.gz MCOUKBTWZCHIIT-MRXNPFEDSA-N 1 1 369.259 3.748 20 5 FHBDMO C[C@@H](c1ccccc1)[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)C1CCCC1 ZINC000425460830 944005105 /nfs/dbraw/zinc/00/51/05/944005105.db2.gz TZDRJXXMKHXIME-INIZCTEOSA-N 1 1 355.438 3.762 20 5 FHBDMO CC[C@@H]1CCC[N@@H+]1CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000436097787 944029477 /nfs/dbraw/zinc/02/94/77/944029477.db2.gz IMZAZOTVPADXAZ-CYBMUJFWSA-N 1 1 360.439 3.531 20 5 FHBDMO CC[C@@H]1CCC[N@H+]1CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000436097787 944029488 /nfs/dbraw/zinc/02/94/88/944029488.db2.gz IMZAZOTVPADXAZ-CYBMUJFWSA-N 1 1 360.439 3.531 20 5 FHBDMO O=C(CC[N@H+]1CCSC[C@@H]1c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000500115841 944120953 /nfs/dbraw/zinc/12/09/53/944120953.db2.gz MNNHBRDUEMABEX-GOSISDBHSA-N 1 1 371.462 3.714 20 5 FHBDMO O=C(CC[N@H+]1CC[C@@H](Cc2ccc(F)cc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000500113361 944128901 /nfs/dbraw/zinc/12/89/01/944128901.db2.gz GMTPFXNMVRFFIM-INIZCTEOSA-N 1 1 371.412 3.627 20 5 FHBDMO CC(C)c1ccc(C[NH+]2CCN(c3cccc(O)c3)CC2)cc1[N+](=O)[O-] ZINC000506136855 944136404 /nfs/dbraw/zinc/13/64/04/944136404.db2.gz LGQOSIVACSYVDW-UHFFFAOYSA-N 1 1 355.438 3.746 20 5 FHBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](Nc2c3c(ccc2[N+](=O)[O-])NCC3)C1 ZINC000436317064 944196215 /nfs/dbraw/zinc/19/62/15/944196215.db2.gz KFUOOFLZZGCGHT-HOCLYGCPSA-N 1 1 352.438 3.810 20 5 FHBDMO O=[N+]([O-])c1cnc(C(F)(F)F)cc1N[C@@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000436390324 944260556 /nfs/dbraw/zinc/26/05/56/944260556.db2.gz ODMISAKFGBZYRL-GFCCVEGCSA-N 1 1 358.364 3.685 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(CN3CC[NH+](C4CC4)CC3)o2)c(Cl)c1 ZINC000506479456 944310730 /nfs/dbraw/zinc/31/07/30/944310730.db2.gz XLRZGSMPKSFHEJ-UHFFFAOYSA-N 1 1 361.829 3.788 20 5 FHBDMO COc1ccccc1CC[N@@H+](C)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000729464483 944365163 /nfs/dbraw/zinc/36/51/63/944365163.db2.gz WUNDBHGSCVRLJU-UHFFFAOYSA-N 1 1 366.421 3.599 20 5 FHBDMO CC(C)c1ccc(CN[C@H](Cc2ccccc2)C[NH+](C)C)cc1[N+](=O)[O-] ZINC000517536429 944381821 /nfs/dbraw/zinc/38/18/21/944381821.db2.gz HMLYXHJEWDDZDL-LJQANCHMSA-N 1 1 355.482 3.981 20 5 FHBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@H]2/C=C\c2ccccc2)c1 ZINC000505844002 944411623 /nfs/dbraw/zinc/41/16/23/944411623.db2.gz CRPOKQMRXVUZMK-IACUCBDGSA-N 1 1 368.433 3.512 20 5 FHBDMO Cc1cc(NC(=O)N[C@@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000473789233 944468939 /nfs/dbraw/zinc/46/89/39/944468939.db2.gz RTDBPIHMKOOCLY-MAUKXSAKSA-N 1 1 368.437 3.860 20 5 FHBDMO C[C@@H]1C[C@H](c2ccccc2)CC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000439333700 944544335 /nfs/dbraw/zinc/54/43/35/944544335.db2.gz WGCCDSLQFYTIRV-POAQFYNOSA-N 1 1 370.449 3.603 20 5 FHBDMO Cn1c(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])nc2cccc(Cl)c21 ZINC000566688633 944595212 /nfs/dbraw/zinc/59/52/12/944595212.db2.gz GDYMNIXMDBXQGE-AWEZNQCLSA-N 1 1 356.813 3.912 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+](CCO)Cc3cccc(F)c3)o2)cc1 ZINC000426384322 944608642 /nfs/dbraw/zinc/60/86/42/944608642.db2.gz GKXMCSXXFLGZCW-UHFFFAOYSA-N 1 1 370.380 3.988 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@](C)(c2ccccc2)C1 ZINC000438482131 944662593 /nfs/dbraw/zinc/66/25/93/944662593.db2.gz KGKGINGPDNQEDF-OAQYLSRUSA-N 1 1 367.449 3.895 20 5 FHBDMO CN(C(=O)C[N@@H+]1CCC[C@H]1c1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000053718301 944747767 /nfs/dbraw/zinc/74/77/67/944747767.db2.gz SPOQRJWWCMXSGP-SFHVURJKSA-N 1 1 357.385 3.534 20 5 FHBDMO CN(C(=O)C[N@H+]1CCC[C@H]1c1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000053718301 944747771 /nfs/dbraw/zinc/74/77/71/944747771.db2.gz SPOQRJWWCMXSGP-SFHVURJKSA-N 1 1 357.385 3.534 20 5 FHBDMO Cn1ccnc1[C@H]([NH2+][C@@H]1CCCC(F)(F)C1)c1cccc([N+](=O)[O-])c1 ZINC000518805898 944786013 /nfs/dbraw/zinc/78/60/13/944786013.db2.gz BWNVPACGIGYGHO-UKRRQHHQSA-N 1 1 350.369 3.585 20 5 FHBDMO O=C(c1ccccc1)c1ccc(N2CC[NH+](C3CCC3)CC2)c([N+](=O)[O-])c1 ZINC000500409107 944797402 /nfs/dbraw/zinc/79/74/02/944797402.db2.gz LLTGXYZJMMADNE-UHFFFAOYSA-N 1 1 365.433 3.500 20 5 FHBDMO C[C@@H](CNC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)[N@H+]1CCCC[C@H]1C ZINC000437933601 944811765 /nfs/dbraw/zinc/81/17/65/944811765.db2.gz PPHIJZNIOYNVMB-CVEARBPZSA-N 1 1 374.485 3.532 20 5 FHBDMO CC[C@@H](c1cccc(OC)c1)[N@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000518000545 944921693 /nfs/dbraw/zinc/92/16/93/944921693.db2.gz PEFYYICHBPTVOL-KRWDZBQOSA-N 1 1 357.410 3.625 20 5 FHBDMO CC[C@@H](c1cccc(OC)c1)[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000518000545 944921697 /nfs/dbraw/zinc/92/16/97/944921697.db2.gz PEFYYICHBPTVOL-KRWDZBQOSA-N 1 1 357.410 3.625 20 5 FHBDMO Cc1ccccc1[C@H]1CC[N@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000507179747 945010650 /nfs/dbraw/zinc/01/06/50/945010650.db2.gz HTKCHEOATPUHGB-HOTGVXAUSA-N 1 1 353.422 3.720 20 5 FHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@@](O)(C4CC4)C3)o2)c(Cl)c1 ZINC000426524973 945055107 /nfs/dbraw/zinc/05/51/07/945055107.db2.gz QKTQILVVMVCFKS-SFHVURJKSA-N 1 1 362.813 3.855 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCc2ccccc2[C@@H]1C ZINC000106862476 945418840 /nfs/dbraw/zinc/41/88/40/945418840.db2.gz KIAIRRRDHQJKEE-AWEZNQCLSA-N 1 1 369.421 3.551 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCc2ccccc2C1 ZINC000106888507 945424511 /nfs/dbraw/zinc/42/45/11/945424511.db2.gz QUXDLBFKZWQFGQ-UHFFFAOYSA-N 1 1 353.422 3.680 20 5 FHBDMO C[C@H](O)[C@@H]1CC[N@@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000507697628 945461294 /nfs/dbraw/zinc/46/12/94/945461294.db2.gz KMDIKMHVPJBVEZ-DZGCQCFKSA-N 1 1 360.385 3.729 20 5 FHBDMO Cc1nc(C2([NH2+]CCOc3ccc([N+](=O)[O-])cc3)CCCCCC2)no1 ZINC000507710161 945483314 /nfs/dbraw/zinc/48/33/14/945483314.db2.gz SUYZCEOBHZLAKP-UHFFFAOYSA-N 1 1 360.414 3.504 20 5 FHBDMO CC[NH+](CC)CCCC1CCN(Cc2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC000519730276 945676664 /nfs/dbraw/zinc/67/66/64/945676664.db2.gz SNPYYWIALCKALG-UHFFFAOYSA-N 1 1 363.502 3.937 20 5 FHBDMO CC[N@H+](Cc1cccc([N+](=O)[O-])c1C)[C@H]1CCN(c2ccccc2)C1=O ZINC000522711772 945705666 /nfs/dbraw/zinc/70/56/66/945705666.db2.gz PNXWKYFZYLQMLY-IBGZPJMESA-N 1 1 353.422 3.531 20 5 FHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)[C@H]1CCN(c2ccccc2)C1=O ZINC000522711772 945705668 /nfs/dbraw/zinc/70/56/68/945705668.db2.gz PNXWKYFZYLQMLY-IBGZPJMESA-N 1 1 353.422 3.531 20 5 FHBDMO CC(=O)c1ccc(N2CCC[C@H](c3[nH+]cc4n3CCCC4)C2)c([N+](=O)[O-])c1 ZINC000281864018 945892264 /nfs/dbraw/zinc/89/22/64/945892264.db2.gz KJPNNEISBUGHHF-INIZCTEOSA-N 1 1 368.437 3.714 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000487354427 946096422 /nfs/dbraw/zinc/09/64/22/946096422.db2.gz MEHHIFSZBVSROT-AEFFLSMTSA-N 1 1 367.449 3.544 20 5 FHBDMO CC[C@H](Cc1ccc(C)cc1)[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000444243414 946118056 /nfs/dbraw/zinc/11/80/56/946118056.db2.gz PVRAIWVYEYNBFU-QGZVFWFLSA-N 1 1 355.438 3.795 20 5 FHBDMO CC(C)Cc1ccc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC001167779216 946147173 /nfs/dbraw/zinc/14/71/73/946147173.db2.gz QKFJWHGIIGULOC-SFHVURJKSA-N 1 1 354.454 3.875 20 5 FHBDMO CC(C)Cc1ccc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC001167779214 946157793 /nfs/dbraw/zinc/15/77/93/946157793.db2.gz QKFJWHGIIGULOC-GOSISDBHSA-N 1 1 354.454 3.875 20 5 FHBDMO C[C@@H]1C[C@H](c2cccc(F)c2)[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000441344597 946492885 /nfs/dbraw/zinc/49/28/85/946492885.db2.gz IWMLTNZXGFFXHP-HEFCMCLBSA-N 1 1 374.412 3.557 20 5 FHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+](CCO)[C@H]2CCCSC2)o1 ZINC000475510254 946522645 /nfs/dbraw/zinc/52/26/45/946522645.db2.gz NDVCTOAEKWFCCL-AWEZNQCLSA-N 1 1 362.451 3.545 20 5 FHBDMO O=C(C[NH+]1CCC(CCc2ccccc2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000025832398 946537929 /nfs/dbraw/zinc/53/79/29/946537929.db2.gz QDSOAPXGVQCFDV-UHFFFAOYSA-N 1 1 367.449 3.878 20 5 FHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000441395415 946549904 /nfs/dbraw/zinc/54/99/04/946549904.db2.gz MLQQQZSJKVFQJN-OXQOHEQNSA-N 1 1 373.497 3.831 20 5 FHBDMO CCS[C@H]1CCCC[N@@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000441396867 946554164 /nfs/dbraw/zinc/55/41/64/946554164.db2.gz DLBGYARSFPGGHQ-HNNXBMFYSA-N 1 1 354.472 3.590 20 5 FHBDMO COc1ccc(OCC[N@H+]2C[C@H](c3ccccc3)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC000441400617 946556934 /nfs/dbraw/zinc/55/69/34/946556934.db2.gz WWSNLTVYHAGFNT-DOTOQJQBSA-N 1 1 356.422 3.860 20 5 FHBDMO Cc1cc(C(=O)N[C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000487386681 946563972 /nfs/dbraw/zinc/56/39/72/946563972.db2.gz HDOGKKOBVISNMI-QFBILLFUSA-N 1 1 367.449 3.544 20 5 FHBDMO COc1ccc(-c2ccc(C[N@H+]3CCC[C@@](C)(OC)C3)o2)c([N+](=O)[O-])c1 ZINC000475269435 946785028 /nfs/dbraw/zinc/78/50/28/946785028.db2.gz LNNQPDZRQKUZDK-LJQANCHMSA-N 1 1 360.410 3.864 20 5 FHBDMO C[C@@H]1OCC[C@@]12C[N@@H+](Cc1ccc(-c3ccccc3[N+](=O)[O-])s1)CCO2 ZINC000475290045 946829146 /nfs/dbraw/zinc/82/91/46/946829146.db2.gz DZDOLGIFHGLJRA-IFXJQAMLSA-N 1 1 374.462 3.703 20 5 FHBDMO Cc1cc(C(=O)NC[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000129763850 946908006 /nfs/dbraw/zinc/90/80/06/946908006.db2.gz LNBHZBMWFZWFBW-QAPCUYQASA-N 1 1 373.478 3.778 20 5 FHBDMO COCC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H](C)c1ccccc1 ZINC000444620606 947052583 /nfs/dbraw/zinc/05/25/83/947052583.db2.gz OKXNKXNCWUOIFX-AWEZNQCLSA-N 1 1 354.410 3.681 20 5 FHBDMO COCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H](C)c1ccccc1 ZINC000444620606 947052595 /nfs/dbraw/zinc/05/25/95/947052595.db2.gz OKXNKXNCWUOIFX-AWEZNQCLSA-N 1 1 354.410 3.681 20 5 FHBDMO C[C@H]1[C@@H](Cc2ccccc2)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444649437 947070729 /nfs/dbraw/zinc/07/07/29/947070729.db2.gz JLRMIIOHTFVTFX-GOEBONIOSA-N 1 1 350.422 3.924 20 5 FHBDMO C[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])CC1(c2ccccc2)CC1 ZINC000444675614 947100123 /nfs/dbraw/zinc/10/01/23/947100123.db2.gz OELBATLXUUUIOZ-UHFFFAOYSA-N 1 1 373.840 3.850 20 5 FHBDMO C[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])CC1(c2ccccc2)CC1 ZINC000444675614 947100130 /nfs/dbraw/zinc/10/01/30/947100130.db2.gz OELBATLXUUUIOZ-UHFFFAOYSA-N 1 1 373.840 3.850 20 5 FHBDMO CC[N@@H+](CCCn1c2cc([N+](=O)[O-])ccc2oc1=O)[C@H]1CCCC[C@@H]1C ZINC000444675379 947100460 /nfs/dbraw/zinc/10/04/60/947100460.db2.gz LXEPIGKOAFYVTH-HOCLYGCPSA-N 1 1 361.442 3.793 20 5 FHBDMO C[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(OC(F)F)cc1 ZINC000444682497 947107275 /nfs/dbraw/zinc/10/72/75/947107275.db2.gz ACDORVYTUDJCMV-JTQLQIEISA-N 1 1 362.336 3.923 20 5 FHBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+](C)Cc2cc(C)cc(C)c2)c([N+](=O)[O-])c1 ZINC000444694969 947119832 /nfs/dbraw/zinc/11/98/32/947119832.db2.gz KWTCZJKVYOZRAC-HNNXBMFYSA-N 1 1 371.437 3.679 20 5 FHBDMO COc1ccc(NC(=O)[C@H](C)[N@H+](C)Cc2cc(C)cc(C)c2)c([N+](=O)[O-])c1 ZINC000444694969 947119826 /nfs/dbraw/zinc/11/98/26/947119826.db2.gz KWTCZJKVYOZRAC-HNNXBMFYSA-N 1 1 371.437 3.679 20 5 FHBDMO Cc1cc(C)cc(C[N@H+](C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000444696649 947121386 /nfs/dbraw/zinc/12/13/86/947121386.db2.gz WEFBKVNULVPZLY-MRXNPFEDSA-N 1 1 355.438 3.979 20 5 FHBDMO CC(C)O[C@H](C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000428387521 947440849 /nfs/dbraw/zinc/44/08/49/947440849.db2.gz YLJQXMYMCMJZTK-IEBWSBKVSA-N 1 1 370.453 3.642 20 5 FHBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000072837718 947569952 /nfs/dbraw/zinc/56/99/52/947569952.db2.gz FUGNIRBMROGDQI-LSDHHAIUSA-N 1 1 365.499 3.838 20 5 FHBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000072837722 947570574 /nfs/dbraw/zinc/57/05/74/947570574.db2.gz FUGNIRBMROGDQI-HUUCEWRRSA-N 1 1 365.499 3.838 20 5 FHBDMO O=[N+]([O-])c1ccc2cnn(C[NH+]3CCC(OCc4ccccc4)CC3)c2c1 ZINC000105324966 948004538 /nfs/dbraw/zinc/00/45/38/948004538.db2.gz HCIMTBFEAKZCRC-UHFFFAOYSA-N 1 1 366.421 3.583 20 5 FHBDMO CCN(CC)C(=O)[C@@H]1CCC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000512082677 948380972 /nfs/dbraw/zinc/38/09/72/948380972.db2.gz KNQCKRJBQWRQEF-SFHVURJKSA-N 1 1 371.437 3.688 20 5 FHBDMO CCN(CC)C(=O)[C@H]1CCC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000512082676 948381515 /nfs/dbraw/zinc/38/15/15/948381515.db2.gz KNQCKRJBQWRQEF-GOSISDBHSA-N 1 1 371.437 3.688 20 5 FHBDMO CCOc1ccc(C[N@H+](C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)cc1 ZINC000728895715 948545167 /nfs/dbraw/zinc/54/51/67/948545167.db2.gz FPTOVGKDHYKKKQ-UHFFFAOYSA-N 1 1 366.421 3.947 20 5 FHBDMO CCOc1ccc(C[N@@H+](C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)cc1 ZINC000728895715 948545172 /nfs/dbraw/zinc/54/51/72/948545172.db2.gz FPTOVGKDHYKKKQ-UHFFFAOYSA-N 1 1 366.421 3.947 20 5 FHBDMO CC(C)CCOC1CC[NH+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000728897371 948617195 /nfs/dbraw/zinc/61/71/95/948617195.db2.gz PWQKLDHXWODCRF-UHFFFAOYSA-N 1 1 372.469 3.943 20 5 FHBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccc(N2CCCNC2=O)cc1 ZINC000291020978 567965389 /nfs/dbraw/zinc/96/53/89/567965389.db2.gz CPTJLHAHBDTAPY-ZDUSSCGKSA-N 1 1 372.400 3.504 20 5 FHBDMO O=c1c(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cccn1C(F)F ZINC000602686473 568011380 /nfs/dbraw/zinc/01/13/80/568011380.db2.gz VMOSNNUVPQFMPE-AWEZNQCLSA-N 1 1 363.364 3.531 20 5 FHBDMO CC(C)([NH2+]Cc1ccc(Br)cn1)c1ccccc1[N+](=O)[O-] ZINC000291669155 568252523 /nfs/dbraw/zinc/25/25/23/568252523.db2.gz GBBLHTSSRWUTKF-UHFFFAOYSA-N 1 1 350.216 3.777 20 5 FHBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC3(CCC3)[C@@H]2c2ccccc2)c1 ZINC000453023918 568254617 /nfs/dbraw/zinc/25/46/17/568254617.db2.gz SBTLSFZKNYHGDU-QUCCMNQESA-N 1 1 368.433 3.562 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000604484471 568300966 /nfs/dbraw/zinc/30/09/66/568300966.db2.gz RFWMLRFVLYXINA-LJQANCHMSA-N 1 1 369.421 3.775 20 5 FHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](c2ccccc2F)C1 ZINC000569345245 568395730 /nfs/dbraw/zinc/39/57/30/568395730.db2.gz LHPANDPUTYHYHS-ZIAGYGMSSA-N 1 1 357.385 3.550 20 5 FHBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](c2ccccc2F)C1 ZINC000569345245 568395731 /nfs/dbraw/zinc/39/57/31/568395731.db2.gz LHPANDPUTYHYHS-ZIAGYGMSSA-N 1 1 357.385 3.550 20 5 FHBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](c2ccccc2F)C1 ZINC000569345242 568395763 /nfs/dbraw/zinc/39/57/63/568395763.db2.gz LHPANDPUTYHYHS-KBPBESRZSA-N 1 1 357.385 3.550 20 5 FHBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](c2ccccc2F)C1 ZINC000569345242 568395764 /nfs/dbraw/zinc/39/57/64/568395764.db2.gz LHPANDPUTYHYHS-KBPBESRZSA-N 1 1 357.385 3.550 20 5 FHBDMO Cc1c(C)c(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)ncc1[N+](=O)[O-] ZINC001164621039 719083146 /nfs/dbraw/zinc/08/31/46/719083146.db2.gz GLTZIUXGEJYSQZ-QUCCMNQESA-N 1 1 366.465 3.707 20 5 FHBDMO Cc1cc([N+](=O)[O-])cnc1N1CCC[C@]2(CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001164994854 722192147 /nfs/dbraw/zinc/19/21/47/722192147.db2.gz QHAUADWYKPRFAP-FQEVSTJZSA-N 1 1 370.428 3.682 20 5 FHBDMO Cc1cnc(N2CCC[C@@]3(CC[N@H+]3Cc3cccc(F)c3)C2)c([N+](=O)[O-])c1 ZINC001164992848 722192453 /nfs/dbraw/zinc/19/24/53/722192453.db2.gz BFLSODHNXDDRAT-HXUWFJFHSA-N 1 1 370.428 3.682 20 5 FHBDMO O=[N+]([O-])c1cc(F)cnc1N1CCC[C@]2(CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001164995346 722195937 /nfs/dbraw/zinc/19/59/37/722195937.db2.gz UWIKRXLHSPEMNL-IBGZPJMESA-N 1 1 374.391 3.513 20 5 FHBDMO CC(=O)NCC[C@@H]1CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000582992558 936349563 /nfs/dbraw/zinc/34/95/63/936349563.db2.gz GSANUKFMCFIHPQ-INIZCTEOSA-N 1 1 371.437 3.593 20 5 FHBDMO CC(C)[N@@H+](C)CC1CCN(c2cc(C(F)(F)F)ncc2[N+](=O)[O-])CC1 ZINC000564701392 936355561 /nfs/dbraw/zinc/35/55/61/936355561.db2.gz XYFDZTOMDUYINI-UHFFFAOYSA-N 1 1 360.380 3.565 20 5 FHBDMO CCOc1c(OC)cc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1OC ZINC000582991806 936350719 /nfs/dbraw/zinc/35/07/19/936350719.db2.gz GVDXSJSRLYDNHY-UHFFFAOYSA-N 1 1 374.437 3.685 20 5 FHBDMO CC(C)C[N@H+]1Cc2cccc(NC(=O)c3ccc(F)cc3[N+](=O)[O-])c2C1 ZINC000162182898 936353403 /nfs/dbraw/zinc/35/34/03/936353403.db2.gz GPZQIETYMBIFDI-UHFFFAOYSA-N 1 1 357.385 3.958 20 5 FHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H](O)Cc1ccc(C(F)(F)F)cc1 ZINC000178746640 936379991 /nfs/dbraw/zinc/37/99/91/936379991.db2.gz GXCHBLSZLXCREV-INIZCTEOSA-N 1 1 368.355 3.649 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000079557410 937133725 /nfs/dbraw/zinc/13/37/25/937133725.db2.gz UJWGOGGQRDSHBE-AEFFLSMTSA-N 1 1 367.449 3.686 20 5 FHBDMO Cc1ccc([C@@H](C)NC(=O)C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1C ZINC000558740133 927564107 /nfs/dbraw/zinc/56/41/07/927564107.db2.gz VZYURCCLNPFCME-QGZVFWFLSA-N 1 1 369.465 3.563 20 5 FHBDMO Cc1ccc([C@@H](C)NC(=O)C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1C ZINC000558740133 927564112 /nfs/dbraw/zinc/56/41/12/927564112.db2.gz VZYURCCLNPFCME-QGZVFWFLSA-N 1 1 369.465 3.563 20 5 FHBDMO C[C@@H]1C[C@@H](CCNC(=O)c2ccccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000510083415 927939400 /nfs/dbraw/zinc/93/94/00/927939400.db2.gz HRBWTPGIMDQVAC-SJLPKXTDSA-N 1 1 367.449 3.625 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H](OCCCc2ccccc2)C1 ZINC000430210043 928110243 /nfs/dbraw/zinc/11/02/43/928110243.db2.gz ZZUILQBXSKZLJW-HXUWFJFHSA-N 1 1 370.449 3.827 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](OCCCc2ccccc2)C1 ZINC000430210043 928110254 /nfs/dbraw/zinc/11/02/54/928110254.db2.gz ZZUILQBXSKZLJW-HXUWFJFHSA-N 1 1 370.449 3.827 20 5 FHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(Oc2ccccn2)CC1 ZINC000471153761 928121311 /nfs/dbraw/zinc/12/13/11/928121311.db2.gz YPVHQTBKYSTPEE-UHFFFAOYSA-N 1 1 371.437 3.820 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1CNC(C)(C)C[N@@H+](C)Cc1ccccc1 ZINC000430210720 928137517 /nfs/dbraw/zinc/13/75/17/928137517.db2.gz VKORHRVLDKKJCJ-UHFFFAOYSA-N 1 1 357.454 3.604 20 5 FHBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+]C(C)(C)CN(C)Cc1ccccc1 ZINC000430210720 928137523 /nfs/dbraw/zinc/13/75/23/928137523.db2.gz VKORHRVLDKKJCJ-UHFFFAOYSA-N 1 1 357.454 3.604 20 5 FHBDMO COc1cc(C[NH2+][C@@H]2CCc3sc(Cl)cc32)c([N+](=O)[O-])cc1O ZINC000583232862 937262649 /nfs/dbraw/zinc/26/26/49/937262649.db2.gz HCKJIQUSHILJFI-SNVBAGLBSA-N 1 1 354.815 3.801 20 5 FHBDMO CN(C)c1cccnc1C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000583233073 937264255 /nfs/dbraw/zinc/26/42/55/937264255.db2.gz RHUXAZXBYPLFMV-UHFFFAOYSA-N 1 1 352.394 3.606 20 5 FHBDMO Cn1cc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c(-c2ccncc2)n1 ZINC000154295036 928697381 /nfs/dbraw/zinc/69/73/81/928697381.db2.gz IWOMJOFNAJRJFJ-UHFFFAOYSA-N 1 1 363.421 3.555 20 5 FHBDMO COc1ccc(CN(C)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000509548448 928929609 /nfs/dbraw/zinc/92/96/09/928929609.db2.gz HNJUWKGLLQIVMR-IBGZPJMESA-N 1 1 369.465 3.700 20 5 FHBDMO COc1ccc(C[N@H+](C)[C@H]2CCCN(Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000509548448 928929612 /nfs/dbraw/zinc/92/96/12/928929612.db2.gz HNJUWKGLLQIVMR-IBGZPJMESA-N 1 1 369.465 3.700 20 5 FHBDMO COc1ccc(C[N@@H+](C)[C@H]2CCCN(Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000509548448 928929619 /nfs/dbraw/zinc/92/96/19/928929619.db2.gz HNJUWKGLLQIVMR-IBGZPJMESA-N 1 1 369.465 3.700 20 5 FHBDMO CS[C@H]1CCCC[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000134576826 929069579 /nfs/dbraw/zinc/06/95/79/929069579.db2.gz ZKWGSLHECFMAJR-WFASDCNBSA-N 1 1 362.455 3.923 20 5 FHBDMO Cc1c(C[NH+]2CCN(c3ccc4ccccc4n3)CC2)cccc1[N+](=O)[O-] ZINC000471212790 929117996 /nfs/dbraw/zinc/11/79/96/929117996.db2.gz WSRULJFSPRMTAX-UHFFFAOYSA-N 1 1 362.433 3.774 20 5 FHBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCCC[C@@H]1CCCc1ccccc1 ZINC000535628475 929310559 /nfs/dbraw/zinc/31/05/59/929310559.db2.gz WBSXMXFDXSQESX-LJQANCHMSA-N 1 1 369.465 3.634 20 5 FHBDMO C[C@@H](c1ccc(NC(=O)Nc2cccc([N+](=O)[O-])c2)cc1)[NH+]1CCOCC1 ZINC000109846622 929706763 /nfs/dbraw/zinc/70/67/63/929706763.db2.gz QFHAJFOIBSRYCZ-AWEZNQCLSA-N 1 1 370.409 3.632 20 5 FHBDMO C[C@H](c1nnc(-c2ccccc2)o1)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000375626782 929717269 /nfs/dbraw/zinc/71/72/69/929717269.db2.gz ZAMHPTNJAKOJCW-CQSZACIVSA-N 1 1 352.394 3.880 20 5 FHBDMO C[C@H](c1nnc(-c2ccccc2)o1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000375626782 929717274 /nfs/dbraw/zinc/71/72/74/929717274.db2.gz ZAMHPTNJAKOJCW-CQSZACIVSA-N 1 1 352.394 3.880 20 5 FHBDMO O=C(C[N@H+]1CCC[C@H]1C1CC1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000610390812 930304852 /nfs/dbraw/zinc/30/48/52/930304852.db2.gz FRPAXEIHTCCEFE-INIZCTEOSA-N 1 1 372.450 3.531 20 5 FHBDMO C[C@H]([C@H]1Cc2ccccc2O1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000134245216 930767609 /nfs/dbraw/zinc/76/76/09/930767609.db2.gz QRQBNUALGGTREC-KZULUSFZSA-N 1 1 353.378 3.560 20 5 FHBDMO Cc1ccc([C@H](C)NC(=O)[C@H](C)[N@@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000177875755 931430686 /nfs/dbraw/zinc/43/06/86/931430686.db2.gz GKGJUHOISQKZEI-HOTGVXAUSA-N 1 1 367.449 3.527 20 5 FHBDMO Cc1ccc([C@H](C)NC(=O)[C@H](C)[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000177875755 931430691 /nfs/dbraw/zinc/43/06/91/931430691.db2.gz GKGJUHOISQKZEI-HOTGVXAUSA-N 1 1 367.449 3.527 20 5 FHBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000477045902 931741961 /nfs/dbraw/zinc/74/19/61/931741961.db2.gz FZCARQMPEVTKBD-IFXJQAMLSA-N 1 1 372.425 3.598 20 5 FHBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@H](c3nccs3)C2)cccc1[N+](=O)[O-] ZINC000157014290 931774444 /nfs/dbraw/zinc/77/44/44/931774444.db2.gz CTSMVEIZGORGIU-AWEZNQCLSA-N 1 1 374.466 3.568 20 5 FHBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H]1c1cccc(F)c1 ZINC000610505499 932026674 /nfs/dbraw/zinc/02/66/74/932026674.db2.gz MRBMEFNETYRKEY-QGZVFWFLSA-N 1 1 373.384 3.518 20 5 FHBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCCO[C@H](c4ccccc4)C3)nc2c1 ZINC000610581955 932071716 /nfs/dbraw/zinc/07/17/16/932071716.db2.gz YVQOMZABYQMGRE-SFHVURJKSA-N 1 1 353.378 3.700 20 5 FHBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCCO[C@H](c4ccccc4)C3)nc2c1 ZINC000610581955 932071724 /nfs/dbraw/zinc/07/17/24/932071724.db2.gz YVQOMZABYQMGRE-SFHVURJKSA-N 1 1 353.378 3.700 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H](C1CC1)[N@@H+](C)Cc1ccccc1 ZINC000477282039 932445216 /nfs/dbraw/zinc/44/52/16/932445216.db2.gz WIXQQJYBPVVIAP-FQEVSTJZSA-N 1 1 367.449 3.544 20 5 FHBDMO CCc1oc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1C(=O)OC ZINC000559069587 932622603 /nfs/dbraw/zinc/62/26/03/932622603.db2.gz QHQLTJLTIALDNZ-UHFFFAOYSA-N 1 1 360.410 3.947 20 5 FHBDMO CCc1oc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1C(=O)OC ZINC000559069587 932622606 /nfs/dbraw/zinc/62/26/06/932622606.db2.gz QHQLTJLTIALDNZ-UHFFFAOYSA-N 1 1 360.410 3.947 20 5 FHBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCC(C)(C)[N@H+]1CCC[C@H](C)C1 ZINC000477619368 932734877 /nfs/dbraw/zinc/73/48/77/932734877.db2.gz BSUBQTNRGBYVCM-LBPRGKRZSA-N 1 1 367.877 3.797 20 5 FHBDMO C[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)CC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000134661789 932836032 /nfs/dbraw/zinc/83/60/32/932836032.db2.gz HOIXBUXLJMBWCL-ZBFHGGJFSA-N 1 1 363.458 3.515 20 5 FHBDMO CCc1ccc(C(=O)NCc2cccc(C[N@H+](C)CC)c2)cc1[N+](=O)[O-] ZINC000471791227 932933963 /nfs/dbraw/zinc/93/39/63/932933963.db2.gz IGLBKBRMUFSSHE-UHFFFAOYSA-N 1 1 355.438 3.539 20 5 FHBDMO C[C@H]([NH2+][C@@H](C)c1ncnn1C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000276709302 933009763 /nfs/dbraw/zinc/00/97/63/933009763.db2.gz WMILFGDCMQDGFB-RYUDHWBXSA-N 1 1 357.439 3.864 20 5 FHBDMO COC(=O)COc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000544006684 933187231 /nfs/dbraw/zinc/18/72/31/933187231.db2.gz PDWPREKWGNQILM-UHFFFAOYSA-N 1 1 372.421 3.557 20 5 FHBDMO O=[N+]([O-])c1ccc(OCC[NH+]2C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C2)cc1 ZINC000610604774 933514279 /nfs/dbraw/zinc/51/42/79/933514279.db2.gz LELSYDIMOQEQOW-VXGBXAGGSA-N 1 1 372.265 3.646 20 5 FHBDMO O=[N+]([O-])c1cc(F)c(C[NH2+][C@H]2CCO[C@H]2c2ccc(F)c(F)c2)c(F)c1 ZINC000510793445 933731243 /nfs/dbraw/zinc/73/12/43/933731243.db2.gz AFILTMRZAAMPKZ-IRXDYDNUSA-N 1 1 370.302 3.771 20 5 FHBDMO CCCC[N@@H+](CC)Cc1cccc(CNC(=O)c2ccc([N+](=O)[O-])o2)c1 ZINC000471924741 933798222 /nfs/dbraw/zinc/79/82/22/933798222.db2.gz WNQHAAPRIZKPEX-UHFFFAOYSA-N 1 1 359.426 3.740 20 5 FHBDMO COc1ccc(C[NH2+]Cc2cc(Br)ccc2F)cc1[N+](=O)[O-] ZINC000132680572 934081268 /nfs/dbraw/zinc/08/12/68/934081268.db2.gz TVMNLKKNWGMROB-UHFFFAOYSA-N 1 1 369.190 3.795 20 5 FHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H]2C[C@@H](O)c2ccc(F)cc2)c(F)c1 ZINC000134812824 934338326 /nfs/dbraw/zinc/33/83/26/934338326.db2.gz JCYFSBAJHLSNBO-QFBILLFUSA-N 1 1 362.376 3.961 20 5 FHBDMO COC(=O)[C@@H](C)[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccccc1 ZINC000176225438 934533501 /nfs/dbraw/zinc/53/35/01/934533501.db2.gz MBMNHNKDVJRYEF-YVEFUNNKSA-N 1 1 362.813 3.888 20 5 FHBDMO Cc1nn(C[N@@H+]2CCC[C@H]2c2cccc(C)n2)c2cc([N+](=O)[O-])ccc12 ZINC000121264235 934806897 /nfs/dbraw/zinc/80/68/97/934806897.db2.gz HHORTGSHCNBNGW-SFHVURJKSA-N 1 1 351.410 3.751 20 5 FHBDMO Cc1nn(C[N@H+]2CCC[C@H]2c2cccc(C)n2)c2cc([N+](=O)[O-])ccc12 ZINC000121264235 934806903 /nfs/dbraw/zinc/80/69/03/934806903.db2.gz HHORTGSHCNBNGW-SFHVURJKSA-N 1 1 351.410 3.751 20 5 FHBDMO Cn1ccnc1[C@@H]([NH2+]CC(C)(C)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000611560352 934822607 /nfs/dbraw/zinc/82/26/07/934822607.db2.gz WJNMIPRSXDQMOV-IBGZPJMESA-N 1 1 364.449 3.985 20 5 FHBDMO COc1cc(C[N@H+]2CC[C@@H](C)[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000538792720 934904672 /nfs/dbraw/zinc/90/46/72/934904672.db2.gz FNWVOUBDELRHCA-MNOVXSKESA-N 1 1 362.348 3.775 20 5 FHBDMO CC(=O)c1cc(N2CCC[N@H+](Cc3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000383089975 945074001 /nfs/dbraw/zinc/07/40/01/945074001.db2.gz QTNQCEBWRVTNRN-MRXNPFEDSA-N 1 1 367.449 3.898 20 5 FHBDMO C[C@H](c1ccncc1)[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000091989727 935204125 /nfs/dbraw/zinc/20/41/25/935204125.db2.gz RZIQDPJSSATBFN-CQSZACIVSA-N 1 1 352.394 3.880 20 5 FHBDMO C[NH+](C)Cc1ccc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)cc1Cl ZINC000478034956 935215963 /nfs/dbraw/zinc/21/59/63/935215963.db2.gz KWRAUUJTZQHCJY-UHFFFAOYSA-N 1 1 351.765 3.701 20 5 FHBDMO Cc1ccc(C)n1C1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000434847829 935248282 /nfs/dbraw/zinc/24/82/82/935248282.db2.gz YWNIJHURTMHQGC-UHFFFAOYSA-N 1 1 354.410 3.991 20 5 FHBDMO CC(C)c1ccccc1OC[C@H](O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511073658 935250426 /nfs/dbraw/zinc/25/04/26/935250426.db2.gz PZDQPECXKXNTFV-GOSISDBHSA-N 1 1 372.465 3.632 20 5 FHBDMO Cc1ccccc1[C@@H](C)NC(=O)[C@H](C)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511074610 935266586 /nfs/dbraw/zinc/26/65/86/935266586.db2.gz VRDXLHVVONXUPK-SJORKVTESA-N 1 1 369.465 3.643 20 5 FHBDMO Cc1ccccc1[C@@H](C)NC(=O)[C@H](C)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511074610 935266591 /nfs/dbraw/zinc/26/65/91/935266591.db2.gz VRDXLHVVONXUPK-SJORKVTESA-N 1 1 369.465 3.643 20 5 FHBDMO CCN(CC)C(=O)[C@H](c1ccccc1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511074537 935267236 /nfs/dbraw/zinc/26/72/36/935267236.db2.gz VHAHWHOQIQMTPZ-FQEVSTJZSA-N 1 1 369.465 3.679 20 5 FHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1 ZINC000439921231 945091584 /nfs/dbraw/zinc/09/15/84/945091584.db2.gz YOYYMXRKEANQNL-CJNGLKHVSA-N 1 1 372.400 3.691 20 5 FHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1 ZINC000439921231 945091593 /nfs/dbraw/zinc/09/15/93/945091593.db2.gz YOYYMXRKEANQNL-CJNGLKHVSA-N 1 1 372.400 3.691 20 5 FHBDMO Cc1cc(-c2noc(C[N@H+](C)CCc3ccccc3[N+](=O)[O-])n2)ccc1F ZINC000511093925 935431497 /nfs/dbraw/zinc/43/14/97/935431497.db2.gz RNLAJNJIMSSVMH-UHFFFAOYSA-N 1 1 370.384 3.767 20 5 FHBDMO Cc1cc(-c2noc(C[N@@H+](C)CCc3ccccc3[N+](=O)[O-])n2)ccc1F ZINC000511093925 935431499 /nfs/dbraw/zinc/43/14/99/935431499.db2.gz RNLAJNJIMSSVMH-UHFFFAOYSA-N 1 1 370.384 3.767 20 5 FHBDMO COc1ccc(OC)c([C@@H]2CCC[N@@H+]2Cc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000051589227 935513820 /nfs/dbraw/zinc/51/38/20/935513820.db2.gz MMPGAALQLAZPPP-KRWDZBQOSA-N 1 1 372.421 3.958 20 5 FHBDMO COc1ccc(OC)c([C@@H]2CCC[N@H+]2Cc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000051589227 935513822 /nfs/dbraw/zinc/51/38/22/935513822.db2.gz MMPGAALQLAZPPP-KRWDZBQOSA-N 1 1 372.421 3.958 20 5 FHBDMO C[C@H](NCc1ccc([N+](=O)[O-])cc1F)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000381711592 935544439 /nfs/dbraw/zinc/54/44/39/935544439.db2.gz JIBHNNDYKMFFCG-MAUKXSAKSA-N 1 1 357.429 3.734 20 5 FHBDMO C[N@@H+](CCC(=O)Nc1ccc(Cl)cc1)CCc1ccccc1[N+](=O)[O-] ZINC000511121922 935681052 /nfs/dbraw/zinc/68/10/52/935681052.db2.gz GAZWPMBRAYJRGP-UHFFFAOYSA-N 1 1 361.829 3.751 20 5 FHBDMO C[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[S@](=O)C1 ZINC000277599704 935704071 /nfs/dbraw/zinc/70/40/71/935704071.db2.gz VNUNYYQFMIYSFM-RZFZLAGVSA-N 1 1 364.492 3.524 20 5 FHBDMO C[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[S@](=O)C1 ZINC000277599704 935704080 /nfs/dbraw/zinc/70/40/80/935704080.db2.gz VNUNYYQFMIYSFM-RZFZLAGVSA-N 1 1 364.492 3.524 20 5 FHBDMO Cc1ccc(NC(=O)[C@@H](C)[N@H+](C)CCc2ccccc2[N+](=O)[O-])cc1C ZINC000511142463 935784190 /nfs/dbraw/zinc/78/41/90/935784190.db2.gz OSUZCISJMPMWMZ-MRXNPFEDSA-N 1 1 355.438 3.713 20 5 FHBDMO Cc1ccc(NC(=O)[C@@H](C)[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1C ZINC000511142463 935784193 /nfs/dbraw/zinc/78/41/93/935784193.db2.gz OSUZCISJMPMWMZ-MRXNPFEDSA-N 1 1 355.438 3.713 20 5 FHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCc2sccc2[C@@H]1c1cccs1 ZINC000611658567 935879913 /nfs/dbraw/zinc/87/99/13/935879913.db2.gz LSJXBYMSJOBEFY-QGZVFWFLSA-N 1 1 374.491 3.870 20 5 FHBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCc2sccc2[C@@H]1c1cccs1 ZINC000611658567 935879916 /nfs/dbraw/zinc/87/99/16/935879916.db2.gz LSJXBYMSJOBEFY-QGZVFWFLSA-N 1 1 374.491 3.870 20 5 FHBDMO CCn1nc(C)c([N+](=O)[O-])c1NCC[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000480078835 935959194 /nfs/dbraw/zinc/95/91/94/935959194.db2.gz BEUMPFUQLRYTOQ-CRAIPNDOSA-N 1 1 371.485 3.832 20 5 FHBDMO Cc1cc(NC2CC[NH+](Cc3ccc(F)c(F)c3)CC2)ncc1[N+](=O)[O-] ZINC000074742030 935987630 /nfs/dbraw/zinc/98/76/30/935987630.db2.gz HGZIDZKYGNJXGC-UHFFFAOYSA-N 1 1 362.380 3.653 20 5 FHBDMO Cc1[nH+]ccn1CCCNc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000078333225 936110378 /nfs/dbraw/zinc/11/03/78/936110378.db2.gz WHUYJLSZNHHHAI-UHFFFAOYSA-N 1 1 364.405 3.833 20 5 FHBDMO Cc1cnc(N2CCC(C[N@H+](C)Cc3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000078658391 936227364 /nfs/dbraw/zinc/22/73/64/936227364.db2.gz RMXJXQNIPLKYHF-UHFFFAOYSA-N 1 1 354.454 3.647 20 5 FHBDMO C[N@H+](CCCNC(=O)OC(C)(C)C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000782475624 938602283 /nfs/dbraw/zinc/60/22/83/938602283.db2.gz JIBODHQBLDOZKP-UHFFFAOYSA-N 1 1 357.838 3.595 20 5 FHBDMO C[N@@H+](CCCNC(=O)OC(C)(C)C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000782475624 938602284 /nfs/dbraw/zinc/60/22/84/938602284.db2.gz JIBODHQBLDOZKP-UHFFFAOYSA-N 1 1 357.838 3.595 20 5 FHBDMO O=C(NC[C@H]1CCC[N@H+]1C1CCCCC1)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000437864169 945197648 /nfs/dbraw/zinc/19/76/48/945197648.db2.gz AAFRNRUMWJMGHV-OAHLLOKOSA-N 1 1 370.453 3.603 20 5 FHBDMO C[C@H]1CCCC[N@H+]1CCCNc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000077523896 938801930 /nfs/dbraw/zinc/80/19/30/938801930.db2.gz YUFKHPKIFDKTSQ-INIZCTEOSA-N 1 1 374.485 3.507 20 5 FHBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)CCc1ccccc1 ZINC000053048041 938852204 /nfs/dbraw/zinc/85/22/04/938852204.db2.gz WJLZKUIZRZZVKU-CQSZACIVSA-N 1 1 352.394 3.880 20 5 FHBDMO COc1ccc(-c2ccc(C[N@@H+](C)CCc3nccs3)o2)c([N+](=O)[O-])c1 ZINC000093843937 938930733 /nfs/dbraw/zinc/93/07/33/938930733.db2.gz FBGONIXMWVVWMW-UHFFFAOYSA-N 1 1 373.434 3.994 20 5 FHBDMO CC[N@@H+](Cc1ccc(C(=O)NCc2ccc([N+](=O)[O-])cc2)cc1)C1CC1 ZINC000511824658 945218164 /nfs/dbraw/zinc/21/81/64/945218164.db2.gz SESHVJKXNJEOIM-UHFFFAOYSA-N 1 1 353.422 3.509 20 5 FHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000136085660 938991287 /nfs/dbraw/zinc/99/12/87/938991287.db2.gz BMWYYCJBXWVZOF-QAPCUYQASA-N 1 1 358.442 3.662 20 5 FHBDMO O=[N+]([O-])c1ccc(N2C[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)c2ccncc21 ZINC000480578698 938996045 /nfs/dbraw/zinc/99/60/45/938996045.db2.gz KLOPTHAIKLAPMC-HDICACEKSA-N 1 1 374.444 3.711 20 5 FHBDMO COc1ccc(-c2ccc(C[N@@H+]3CCC[C@@H](OC)CC3)o2)c([N+](=O)[O-])c1 ZINC000611984182 939013652 /nfs/dbraw/zinc/01/36/52/939013652.db2.gz PUQIKBNDNFLMFU-CQSZACIVSA-N 1 1 360.410 3.864 20 5 FHBDMO COc1ccc(-c2ccc(C[N@@H+]3CCC[C@H](OC)CC3)o2)c([N+](=O)[O-])c1 ZINC000611984180 939013672 /nfs/dbraw/zinc/01/36/72/939013672.db2.gz PUQIKBNDNFLMFU-AWEZNQCLSA-N 1 1 360.410 3.864 20 5 FHBDMO CN(C)Cc1cc(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)ccc1F ZINC000120833738 945221343 /nfs/dbraw/zinc/22/13/43/945221343.db2.gz CNTDORXHEXCDQS-HXUWFJFHSA-N 1 1 371.456 3.906 20 5 FHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@@H](C3OCCO3)C2)s1 ZINC000179370177 939105302 /nfs/dbraw/zinc/10/53/02/939105302.db2.gz DRYWOZRCRORVBH-CQSZACIVSA-N 1 1 374.462 3.908 20 5 FHBDMO Cc1cccc([C@H]2CC[N@@H+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)C2)c1 ZINC000612172530 939188463 /nfs/dbraw/zinc/18/84/63/939188463.db2.gz ZDGBJWCLTJSYGM-INIZCTEOSA-N 1 1 354.406 3.759 20 5 FHBDMO CC(=O)c1cc(N2CC[C@@H](C)[N@H+](Cc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000383102675 945245830 /nfs/dbraw/zinc/24/58/30/945245830.db2.gz CARDLVGZNILVID-MRXNPFEDSA-N 1 1 367.449 3.898 20 5 FHBDMO O=[N+]([O-])c1cccc(F)c1C[NH2+][C@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000179737720 939928417 /nfs/dbraw/zinc/92/84/17/939928417.db2.gz CVGZPIULAASNBO-IBGZPJMESA-N 1 1 358.369 3.746 20 5 FHBDMO O=[N+]([O-])c1ccnn1C[NH+]1CCC(c2ccc(C(F)(F)F)cc2)CC1 ZINC000179789017 939935737 /nfs/dbraw/zinc/93/57/37/939935737.db2.gz BORJMWMXCMXVAK-UHFFFAOYSA-N 1 1 354.332 3.647 20 5 FHBDMO COc1ccc(NC(=O)CC[N@@H+]([C@@H](C)c2ccco2)C2CC2)c([N+](=O)[O-])c1 ZINC000411394514 940037384 /nfs/dbraw/zinc/03/73/84/940037384.db2.gz UGWIKPCTGUPOIT-ZDUSSCGKSA-N 1 1 373.409 3.751 20 5 FHBDMO CCc1ccc([C@@H](N[C@@H]2CC[N@@H+](CC3CC3)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612410060 940054150 /nfs/dbraw/zinc/05/41/50/940054150.db2.gz YCVUASLUDRINSX-UTKZUKDTSA-N 1 1 369.465 3.914 20 5 FHBDMO CCc1ccc([C@H](N[C@H]2CC[N@@H+](CC3CC3)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612410058 940054174 /nfs/dbraw/zinc/05/41/74/940054174.db2.gz YCVUASLUDRINSX-LAUBAEHRSA-N 1 1 369.465 3.914 20 5 FHBDMO CC(=O)c1cc(N2CCC[C@H](n3cc[nH+]c3C(C)C)C2)ccc1[N+](=O)[O-] ZINC000376172087 940412913 /nfs/dbraw/zinc/41/29/13/940412913.db2.gz KCEQQNORRZNRTI-INIZCTEOSA-N 1 1 356.426 3.959 20 5 FHBDMO CC(C)c1[nH+]ccn1[C@H]1CCCN(c2ncnc3sc([N+](=O)[O-])cc32)C1 ZINC000376188064 940439004 /nfs/dbraw/zinc/43/90/04/940439004.db2.gz NPZYDNBWFRPYLB-LBPRGKRZSA-N 1 1 372.454 3.761 20 5 FHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@H](CC2CC2)C1 ZINC000580336090 940473293 /nfs/dbraw/zinc/47/32/93/940473293.db2.gz XPBFGMJTPFNYLR-WCQYABFASA-N 1 1 351.834 3.697 20 5 FHBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@H](CC2CC2)C1 ZINC000580336090 940473294 /nfs/dbraw/zinc/47/32/94/940473294.db2.gz XPBFGMJTPFNYLR-WCQYABFASA-N 1 1 351.834 3.697 20 5 FHBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2NCc1cccc(C[NH+]2CCCC2)c1 ZINC000581081802 940493137 /nfs/dbraw/zinc/49/31/37/940493137.db2.gz FYYTUBUHSWSKAH-FQEVSTJZSA-N 1 1 351.450 3.968 20 5 FHBDMO CCn1c(C)nc([N+](=O)[O-])c1NCc1ccccc1C[N@H+]1CCC[C@@H](C)C1 ZINC000582143522 940650546 /nfs/dbraw/zinc/65/05/46/940650546.db2.gz WITSEHQMIKCIHH-OAHLLOKOSA-N 1 1 371.485 3.964 20 5 FHBDMO CCn1c(C)nc([N+](=O)[O-])c1NCc1ccccc1C[N@H+]1CCC[C@H](C)C1 ZINC000582143521 940650573 /nfs/dbraw/zinc/65/05/73/940650573.db2.gz WITSEHQMIKCIHH-HNNXBMFYSA-N 1 1 371.485 3.964 20 5 FHBDMO Cc1[nH+]ccn1-c1ccc([C@H](C)NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000175799836 940931714 /nfs/dbraw/zinc/93/17/14/940931714.db2.gz ATRKTORAZKGBLA-ZDUSSCGKSA-N 1 1 350.378 3.580 20 5 FHBDMO CCN(C(=O)c1cc([N+](=O)[O-])ccc1C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000186302200 940971943 /nfs/dbraw/zinc/97/19/43/940971943.db2.gz XDBIGIYKYNIBPQ-LJQANCHMSA-N 1 1 367.449 3.640 20 5 FHBDMO CC(C)n1cnnc1[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000180618527 941055728 /nfs/dbraw/zinc/05/57/28/941055728.db2.gz WDNKHSRTHUZGRQ-ZDUSSCGKSA-N 1 1 363.849 3.800 20 5 FHBDMO CC(C)n1cnnc1[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000180618527 941055729 /nfs/dbraw/zinc/05/57/29/941055729.db2.gz WDNKHSRTHUZGRQ-ZDUSSCGKSA-N 1 1 363.849 3.800 20 5 FHBDMO C[C@@H]1C[C@@H](NC(=O)c2cc(F)ccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000176721189 941073731 /nfs/dbraw/zinc/07/37/31/941073731.db2.gz ZTPMHTJAFDLQCT-PBHICJAKSA-N 1 1 371.412 3.517 20 5 FHBDMO CCOCCC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])c3cnccc23)[C@H](C)C1 ZINC000115521331 941114822 /nfs/dbraw/zinc/11/48/22/941114822.db2.gz PWOAROJLHYNZJJ-QAPCUYQASA-N 1 1 372.469 3.692 20 5 FHBDMO Cn1ncc2c1CCC[N@@H+](Cc1ccc(-c3cccc([N+](=O)[O-])c3)o1)C2 ZINC000414470257 941288573 /nfs/dbraw/zinc/28/85/73/941288573.db2.gz IFNPSIQXJBISEW-UHFFFAOYSA-N 1 1 352.394 3.537 20 5 FHBDMO CC[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H](O)C(F)(F)F ZINC000189876788 941292820 /nfs/dbraw/zinc/29/28/20/941292820.db2.gz XRVRGIOKRUAMPS-OAHLLOKOSA-N 1 1 358.316 3.600 20 5 FHBDMO CC[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H](O)C(F)(F)F ZINC000189876788 941292823 /nfs/dbraw/zinc/29/28/23/941292823.db2.gz XRVRGIOKRUAMPS-OAHLLOKOSA-N 1 1 358.316 3.600 20 5 FHBDMO Cc1ccc([C@@H]2C[C@@H](C)[N@H+](Cn3c4cc([N+](=O)[O-])ccc4oc3=O)C2)cc1 ZINC000782954248 941331268 /nfs/dbraw/zinc/33/12/68/941331268.db2.gz LVJWEARFQWBSSY-GDBMZVCRSA-N 1 1 367.405 3.647 20 5 FHBDMO Cc1ccc([C@H]2C[C@@H](C)[N@H+](Cn3c4cc([N+](=O)[O-])ccc4oc3=O)C2)cc1 ZINC000782954251 941331834 /nfs/dbraw/zinc/33/18/34/941331834.db2.gz LVJWEARFQWBSSY-ZBFHGGJFSA-N 1 1 367.405 3.647 20 5 FHBDMO COc1cc(C[NH2+]Cc2cnccc2C(C)(C)C)c([N+](=O)[O-])cc1OC ZINC000414498184 941367620 /nfs/dbraw/zinc/36/76/20/941367620.db2.gz MJENQCAPBJOJLL-UHFFFAOYSA-N 1 1 359.426 3.594 20 5 FHBDMO C[C@@H]1C[C@H](O)C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000414522282 941371885 /nfs/dbraw/zinc/37/18/85/941371885.db2.gz GMZNAFHSJUKHIO-YPMHNXCESA-N 1 1 350.802 3.711 20 5 FHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@H](N3CCCC3=O)CC2)cc1[N+](=O)[O-] ZINC000414552499 941378041 /nfs/dbraw/zinc/37/80/41/941378041.db2.gz QICGTHPDWDGWRR-QGZVFWFLSA-N 1 1 359.470 3.695 20 5 FHBDMO CC(C)[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@H]1CCC(=O)N1 ZINC000414557788 941378652 /nfs/dbraw/zinc/37/86/52/941378652.db2.gz MCCUOBXWEAKRHT-OAHLLOKOSA-N 1 1 373.478 3.812 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC000377185970 941542321 /nfs/dbraw/zinc/54/23/21/941542321.db2.gz UWGQXEHJZIMHDZ-FUHWJXTLSA-N 1 1 367.449 3.544 20 5 FHBDMO Cc1ccc(NC(=O)[C@H](C)[N@H+](C)CCc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000549156392 941549495 /nfs/dbraw/zinc/54/94/95/941549495.db2.gz CTUYAUKYIASHBM-INIZCTEOSA-N 1 1 355.438 3.713 20 5 FHBDMO Cc1ccc(NC(=O)[C@H](C)[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000549156392 941549498 /nfs/dbraw/zinc/54/94/98/941549498.db2.gz CTUYAUKYIASHBM-INIZCTEOSA-N 1 1 355.438 3.713 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@H](C)C[C@@H]1c1ccccc1 ZINC000513233530 941790414 /nfs/dbraw/zinc/79/04/14/941790414.db2.gz YPHSHKNPZDKDCX-RDTXWAMCSA-N 1 1 353.422 3.925 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@H](C)C[C@@H]1c1ccccc1 ZINC000513233530 941790419 /nfs/dbraw/zinc/79/04/19/941790419.db2.gz YPHSHKNPZDKDCX-RDTXWAMCSA-N 1 1 353.422 3.925 20 5 FHBDMO CCCC[N@@H+](C)CC1CCN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CC1 ZINC000412124795 941808513 /nfs/dbraw/zinc/80/85/13/941808513.db2.gz PEBLLYNEIPIZFQ-VQTJNVASSA-N 1 1 373.497 3.669 20 5 FHBDMO COC(=O)[C@H](C)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000182348141 941813000 /nfs/dbraw/zinc/81/30/00/941813000.db2.gz WTRCOSTVWJYSQT-PXAZEXFGSA-N 1 1 362.813 3.888 20 5 FHBDMO C[C@H]1C[C@H](c2ccccc2)[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000513272577 941825059 /nfs/dbraw/zinc/82/50/59/941825059.db2.gz RKIDHVOLXQOYOJ-HNAYVOBHSA-N 1 1 365.433 3.567 20 5 FHBDMO C[C@@H]([NH2+]Cc1c(Cl)cccc1[N+](=O)[O-])c1ccc(-n2cncn2)cc1 ZINC000119636157 941892034 /nfs/dbraw/zinc/89/20/34/941892034.db2.gz SUOGYBNLQXIVFT-GFCCVEGCSA-N 1 1 357.801 3.680 20 5 FHBDMO CCc1ccc([C@H]2CCC[N@@H+](Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C2)cc1 ZINC000513400103 941895753 /nfs/dbraw/zinc/89/57/53/941895753.db2.gz AWCUHOFTASWZEH-SFHVURJKSA-N 1 1 367.449 3.636 20 5 FHBDMO Cc1ccc(NC(=O)C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(F)c1 ZINC000513412154 941909532 /nfs/dbraw/zinc/90/95/32/941909532.db2.gz VTJUXKPPPDUUGY-UHFFFAOYSA-N 1 1 359.401 3.891 20 5 FHBDMO Cc1ccc(NC(=O)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(F)c1 ZINC000513412154 941909536 /nfs/dbraw/zinc/90/95/36/941909536.db2.gz VTJUXKPPPDUUGY-UHFFFAOYSA-N 1 1 359.401 3.891 20 5 FHBDMO Cc1cccc(OC[C@@H](O)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000513483484 941950336 /nfs/dbraw/zinc/95/03/36/941950336.db2.gz DJTFBWJPUANMLX-IBGZPJMESA-N 1 1 358.438 3.554 20 5 FHBDMO Cc1cnn([C@@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3C(F)(F)F)C2)c1 ZINC000377759667 941966454 /nfs/dbraw/zinc/96/64/54/941966454.db2.gz IAMOVFKVIKVZDF-CQSZACIVSA-N 1 1 354.332 3.566 20 5 FHBDMO Cc1cnn([C@@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3C(F)(F)F)C2)c1 ZINC000377759667 941966456 /nfs/dbraw/zinc/96/64/56/941966456.db2.gz IAMOVFKVIKVZDF-CQSZACIVSA-N 1 1 354.332 3.566 20 5 FHBDMO C[C@H](C(=O)NC[C@H]1CCC[N@H+]1CC1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000574216179 942011084 /nfs/dbraw/zinc/01/10/84/942011084.db2.gz SHMPAITURWIAOG-OXJNMPFZSA-N 1 1 373.497 3.859 20 5 FHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@H](O)COc1ccc(C(C)(C)C)cc1 ZINC000501876645 942099141 /nfs/dbraw/zinc/09/91/41/942099141.db2.gz VEKQQQFFWBSMGA-SFHVURJKSA-N 1 1 372.465 3.764 20 5 FHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@H](O)COc1ccc(C(C)(C)C)cc1 ZINC000501876645 942099144 /nfs/dbraw/zinc/09/91/44/942099144.db2.gz VEKQQQFFWBSMGA-SFHVURJKSA-N 1 1 372.465 3.764 20 5 FHBDMO CC(C)OC(=O)C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000541190970 942231247 /nfs/dbraw/zinc/23/12/47/942231247.db2.gz XGRSPHVDLMISNJ-GOSISDBHSA-N 1 1 360.385 3.907 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](CC(F)(F)F)C2)c2c(c1)COCO2 ZINC000420941510 942279361 /nfs/dbraw/zinc/27/93/61/942279361.db2.gz FSSISQUOFOYXHJ-LLVKDONJSA-N 1 1 360.332 3.626 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](CC(F)(F)F)C2)c2c(c1)COCO2 ZINC000420941510 942279365 /nfs/dbraw/zinc/27/93/65/942279365.db2.gz FSSISQUOFOYXHJ-LLVKDONJSA-N 1 1 360.332 3.626 20 5 FHBDMO Cn1ccnc1[C@H]([NH2+]CCc1cccc(F)c1F)c1ccc([N+](=O)[O-])cc1 ZINC000513708739 942348201 /nfs/dbraw/zinc/34/82/01/942348201.db2.gz WQJQKFWFSYBAQL-GOSISDBHSA-N 1 1 372.375 3.528 20 5 FHBDMO COc1cc(C[N@H+]2CCC[C@H](C)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000505318940 942475086 /nfs/dbraw/zinc/47/50/86/942475086.db2.gz DRSGPRQMYKMBJW-NSHDSACASA-N 1 1 362.348 3.776 20 5 FHBDMO O=C(c1cc(F)ccc1F)C1CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000047797621 942545808 /nfs/dbraw/zinc/54/58/08/942545808.db2.gz MMLAFDQPGITRAH-UHFFFAOYSA-N 1 1 360.360 3.968 20 5 FHBDMO COc1ccccc1C[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000104661970 942566678 /nfs/dbraw/zinc/56/66/78/942566678.db2.gz NWQLQSMZICIBSQ-UHFFFAOYSA-N 1 1 367.405 3.933 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000421491116 942605729 /nfs/dbraw/zinc/60/57/29/942605729.db2.gz NKFYXTXHWDWJBP-SFHVURJKSA-N 1 1 367.449 3.558 20 5 FHBDMO CN(CCC[N@@H+](C)Cc1ccco1)c1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC000413293549 942613954 /nfs/dbraw/zinc/61/39/54/942613954.db2.gz NKAALTCDIBAAKD-UHFFFAOYSA-N 1 1 372.347 3.560 20 5 FHBDMO Cc1ccc([C@H]2CC[N@@H+](CC(=O)Nc3ccc([N+](=O)[O-])cc3C)C2)cc1 ZINC000541393248 942671460 /nfs/dbraw/zinc/67/14/60/942671460.db2.gz MJPNIJQCJBFJAC-KRWDZBQOSA-N 1 1 353.422 3.640 20 5 FHBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC[C@H]([N@@H+]2[C@H](C)CC[C@@H]2C)C1 ZINC000421756504 942800040 /nfs/dbraw/zinc/80/00/40/942800040.db2.gz KAXNUQGEHCDQQQ-BBWFWOEESA-N 1 1 359.470 3.689 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCc2cc(F)cc(C)c2C1 ZINC000502876159 942807384 /nfs/dbraw/zinc/80/73/84/942807384.db2.gz HDQZVSQFTRXPJC-UHFFFAOYSA-N 1 1 371.412 3.738 20 5 FHBDMO Cc1cc(C)c2c(c1)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])CCO2 ZINC000365804335 942917282 /nfs/dbraw/zinc/91/72/82/942917282.db2.gz DQPADXKIODSOIP-MRXNPFEDSA-N 1 1 357.366 3.733 20 5 FHBDMO Cc1cc(Nc2ccc(C(N)=O)cc2[N+](=O)[O-])c[nH+]c1N1CCCC[C@@H]1C ZINC000503279140 943096906 /nfs/dbraw/zinc/09/69/06/943096906.db2.gz HKCXSJKSONMZHR-ZDUSSCGKSA-N 1 1 369.425 3.520 20 5 FHBDMO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000274305138 943220846 /nfs/dbraw/zinc/22/08/46/943220846.db2.gz PBEGOISWCPXXTR-LBPRGKRZSA-N 1 1 374.441 3.572 20 5 FHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@H](n3ccnn3)C2)s1 ZINC000425355113 943361340 /nfs/dbraw/zinc/36/13/40/943361340.db2.gz UGYFXBCZEVQPTQ-AWEZNQCLSA-N 1 1 369.450 3.752 20 5 FHBDMO CC[C@H]1C[C@H](C)C[N@H+]1CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000467208879 943480447 /nfs/dbraw/zinc/48/04/47/943480447.db2.gz VGAUTCRMPMPBDD-JSGCOSHPSA-N 1 1 374.466 3.777 20 5 FHBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1nncn1-c1ccccc1)CCCC2 ZINC000417326100 943518105 /nfs/dbraw/zinc/51/81/05/943518105.db2.gz QZEIFXOOUWEMEF-IBGZPJMESA-N 1 1 363.421 3.733 20 5 FHBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@H]1CC[N@H+](C)[C@@H]1c1cccs1 ZINC000364119881 943606063 /nfs/dbraw/zinc/60/60/63/943606063.db2.gz HTHSLHOBJZXBIL-DYVFJYSZSA-N 1 1 374.466 3.779 20 5 FHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccccc1C(=O)N(C)C ZINC000417709611 943844833 /nfs/dbraw/zinc/84/48/33/943844833.db2.gz CMALVHMYCMHXSJ-UHFFFAOYSA-N 1 1 355.438 3.707 20 5 FHBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000425416286 943857753 /nfs/dbraw/zinc/85/77/53/943857753.db2.gz GBWAEGAYXHIQSH-OCCSQVGLSA-N 1 1 369.259 3.606 20 5 FHBDMO CO[C@]1(C)CCC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000425466504 944022964 /nfs/dbraw/zinc/02/29/64/944022964.db2.gz AYDULJHGQBICJO-OAHLLOKOSA-N 1 1 357.248 3.748 20 5 FHBDMO CO[C@]1(C)CCC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000425466504 944022972 /nfs/dbraw/zinc/02/29/72/944022972.db2.gz AYDULJHGQBICJO-OAHLLOKOSA-N 1 1 357.248 3.748 20 5 FHBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000500116440 944124570 /nfs/dbraw/zinc/12/45/70/944124570.db2.gz OCYKLPUKLDXYNB-ZIAGYGMSSA-N 1 1 351.472 3.529 20 5 FHBDMO CC[C@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])c1nnc2n1CCCCC2 ZINC000517245746 944138884 /nfs/dbraw/zinc/13/88/84/944138884.db2.gz AJHVUWNNHZYEBY-JKSUJKDBSA-N 1 1 355.442 3.641 20 5 FHBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccc(F)cc1Cl ZINC000500154684 944178181 /nfs/dbraw/zinc/17/81/81/944178181.db2.gz LZUBJGOIENPURS-UHFFFAOYSA-N 1 1 365.792 3.848 20 5 FHBDMO O=[N+]([O-])c1cnc(N2CC[C@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)c(F)c1 ZINC000518336045 944282893 /nfs/dbraw/zinc/28/28/93/944282893.db2.gz OZHKIBZPKFHQFI-LPHOPBHVSA-N 1 1 370.428 3.620 20 5 FHBDMO COc1cc(C[N@H+]2CC[C@@H](COCc3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC000184224007 944286700 /nfs/dbraw/zinc/28/67/00/944286700.db2.gz RCDDXJTXRRACLY-MRXNPFEDSA-N 1 1 374.412 3.781 20 5 FHBDMO CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](C)[N@@H+](C)Cc2ccccc2)c1 ZINC000110355451 944455825 /nfs/dbraw/zinc/45/58/25/944455825.db2.gz DSVZQHUKULCLRS-CQSZACIVSA-N 1 1 373.478 3.567 20 5 FHBDMO O=C(NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000110386007 944475263 /nfs/dbraw/zinc/47/52/63/944475263.db2.gz PTYVVQJKRZYPMS-YQQQUEKLSA-N 1 1 365.433 3.520 20 5 FHBDMO Cc1cc(NC(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000473787768 944485062 /nfs/dbraw/zinc/48/50/62/944485062.db2.gz POFWPCWZSJMEJY-GOSISDBHSA-N 1 1 368.437 3.641 20 5 FHBDMO C[C@@H]1C[C@@H](c2ccccc2)CC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000439333698 944544687 /nfs/dbraw/zinc/54/46/87/944544687.db2.gz WGCCDSLQFYTIRV-IMFGXOCKSA-N 1 1 370.449 3.603 20 5 FHBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@](C)(c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000438502354 944699529 /nfs/dbraw/zinc/69/95/29/944699529.db2.gz VZRGSXSQYBQZNK-IERDGZPVSA-N 1 1 367.449 3.894 20 5 FHBDMO CC(=O)c1cc(N2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)ccc1[N+](=O)[O-] ZINC000383074065 944707864 /nfs/dbraw/zinc/70/78/64/944707864.db2.gz RYGSGQJSPNNAGV-UHFFFAOYSA-N 1 1 367.449 3.898 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC=C(c2ccc(O)cc2)CC1 ZINC000506260919 944712362 /nfs/dbraw/zinc/71/23/62/944712362.db2.gz AWMDWRBGIMTNTC-UHFFFAOYSA-N 1 1 354.406 3.988 20 5 FHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC=C(c2ccc(O)cc2)CC1 ZINC000506260919 944712368 /nfs/dbraw/zinc/71/23/68/944712368.db2.gz AWMDWRBGIMTNTC-UHFFFAOYSA-N 1 1 354.406 3.988 20 5 FHBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC000053749272 944853086 /nfs/dbraw/zinc/85/30/86/944853086.db2.gz OGFFDDHMQVIXOR-PBHICJAKSA-N 1 1 354.410 3.552 20 5 FHBDMO CC(C)c1ccc(C(=O)N[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000439742337 944938304 /nfs/dbraw/zinc/93/83/04/944938304.db2.gz UBXNBYOCJRHXHP-RBUKOAKNSA-N 1 1 367.449 3.546 20 5 FHBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC000516593747 945055604 /nfs/dbraw/zinc/05/56/04/945055604.db2.gz OGFFDDHMQVIXOR-WMLDXEAASA-N 1 1 354.410 3.552 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)cnc1N1CCC[C@H](c2[nH+]cc3n2CCCC3)C1 ZINC000281764817 945840949 /nfs/dbraw/zinc/84/09/49/945840949.db2.gz CWMIQWYQCHATHP-LBPRGKRZSA-N 1 1 361.833 3.560 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CC[N@@H+](C)[C@H]1c1ccc(Cl)cc1 ZINC000248741938 946096726 /nfs/dbraw/zinc/09/67/26/946096726.db2.gz DNFHHLMQYQQKHP-QAPCUYQASA-N 1 1 373.840 3.732 20 5 FHBDMO Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CC[N@H+](C)[C@H]1c1ccc(Cl)cc1 ZINC000248741938 946096732 /nfs/dbraw/zinc/09/67/32/946096732.db2.gz DNFHHLMQYQQKHP-QAPCUYQASA-N 1 1 373.840 3.732 20 5 FHBDMO CC[N@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@@H](C)c1cccc(OC)c1 ZINC000045806109 946160455 /nfs/dbraw/zinc/16/04/55/946160455.db2.gz HNJJLWANGAHRME-HNNXBMFYSA-N 1 1 371.437 3.933 20 5 FHBDMO CC[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@@H](C)c1cccc(OC)c1 ZINC000045806109 946160461 /nfs/dbraw/zinc/16/04/61/946160461.db2.gz HNJJLWANGAHRME-HNNXBMFYSA-N 1 1 371.437 3.933 20 5 FHBDMO C[C@H]1C[C@@H](N(C)Cc2cc(O)ccc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000093318021 946262148 /nfs/dbraw/zinc/26/21/48/946262148.db2.gz XELLHNLKQYUGMT-LPHOPBHVSA-N 1 1 369.465 3.785 20 5 FHBDMO C[C@H]1C[C@@H](N(C)Cc2cc(O)ccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000093318021 946262156 /nfs/dbraw/zinc/26/21/56/946262156.db2.gz XELLHNLKQYUGMT-LPHOPBHVSA-N 1 1 369.465 3.785 20 5 FHBDMO Cc1ccc(C(C)(C)C[N@@H+](C)C[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC000441346567 946498211 /nfs/dbraw/zinc/49/82/11/946498211.db2.gz NMQJQBDUSSCPCK-LJQANCHMSA-N 1 1 372.465 3.553 20 5 FHBDMO COc1cc(F)ccc1N1CC[NH+]([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000441382179 946505146 /nfs/dbraw/zinc/50/51/46/946505146.db2.gz NMFIPEWWMHEIBN-CQSZACIVSA-N 1 1 359.401 3.626 20 5 FHBDMO COc1ccc(OCC[N@H+]2CC[C@H](Cc3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000441383423 946506458 /nfs/dbraw/zinc/50/64/58/946506458.db2.gz LOCBRUWFVYPIGM-MRXNPFEDSA-N 1 1 374.412 3.686 20 5 FHBDMO Cc1cc(C(=O)N[C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000487386679 946564121 /nfs/dbraw/zinc/56/41/21/946564121.db2.gz HDOGKKOBVISNMI-APWZRJJASA-N 1 1 367.449 3.544 20 5 FHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2NCc2ccccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000475174158 946564945 /nfs/dbraw/zinc/56/49/45/946564945.db2.gz MYDXGTMIFFTKEK-IYBDPMFKSA-N 1 1 355.438 3.816 20 5 FHBDMO C[C@@H]1C[N@H+](Cc2ccccc2NCc2ccccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000475174158 946564957 /nfs/dbraw/zinc/56/49/57/946564957.db2.gz MYDXGTMIFFTKEK-IYBDPMFKSA-N 1 1 355.438 3.816 20 5 FHBDMO COc1ccc(OCC[N@H+]2CCSC[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000441410237 946565460 /nfs/dbraw/zinc/56/54/60/946565460.db2.gz KYMWPYVHVRCDJR-SFHVURJKSA-N 1 1 374.462 3.772 20 5 FHBDMO C[N@@H+]1CCc2c(N[C@@H]3C[C@H]3c3ccc(F)c(F)c3)ccc([N+](=O)[O-])c2C1 ZINC001168069788 946573747 /nfs/dbraw/zinc/57/37/47/946573747.db2.gz IXYQWBPIKOMZFM-SCLBCKFNSA-N 1 1 359.376 3.829 20 5 FHBDMO C[N@H+]1CCc2c(N[C@@H]3C[C@H]3c3ccc(F)c(F)c3)ccc([N+](=O)[O-])c2C1 ZINC001168069788 946573752 /nfs/dbraw/zinc/57/37/52/946573752.db2.gz IXYQWBPIKOMZFM-SCLBCKFNSA-N 1 1 359.376 3.829 20 5 FHBDMO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+]C1CC(N2CCCCC2)C1 ZINC000475560098 946641521 /nfs/dbraw/zinc/64/15/21/946641521.db2.gz RZYIZNPLESXDAU-WQUXRXDGSA-N 1 1 357.498 3.913 20 5 FHBDMO O=C(NC1CC1)[C@H]1CCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000121450076 946744945 /nfs/dbraw/zinc/74/49/45/946744945.db2.gz LWSHVICCDJNXKG-QGZVFWFLSA-N 1 1 371.462 3.566 20 5 FHBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@@H]3Cc3ccccc3)n2)c1 ZINC000025938032 946905363 /nfs/dbraw/zinc/90/53/63/946905363.db2.gz CKFGGDKKEMXXHD-QGZVFWFLSA-N 1 1 364.405 3.852 20 5 FHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3ccc(C(F)(F)F)cc3)C2)nc1 ZINC000112629327 946911370 /nfs/dbraw/zinc/91/13/70/946911370.db2.gz XZBSHSWVDJYMLC-CQSZACIVSA-N 1 1 366.343 3.695 20 5 FHBDMO Cn1nc(C2CC2)cc1C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000897224165 946954122 /nfs/dbraw/zinc/95/41/22/946954122.db2.gz JBHRAZPZPJBKDF-UHFFFAOYSA-N 1 1 354.332 3.514 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCCN(C(=O)c2ccccc2)CC1 ZINC000182624665 946959015 /nfs/dbraw/zinc/95/90/15/946959015.db2.gz DMRMUHFJHNSKRD-KRWDZBQOSA-N 1 1 367.449 3.812 20 5 FHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCCN(C(=O)c2ccccc2)CC1 ZINC000182624665 946959022 /nfs/dbraw/zinc/95/90/22/946959022.db2.gz DMRMUHFJHNSKRD-KRWDZBQOSA-N 1 1 367.449 3.812 20 5 FHBDMO O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(C[N@@H+]2C[C@@H](O)C3(CC3)C2)cc1 ZINC000428370902 947044307 /nfs/dbraw/zinc/04/43/07/947044307.db2.gz CEYZROSQPLWZML-GOSISDBHSA-N 1 1 374.824 3.997 20 5 FHBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CCCc3ccc(Cl)cc3)C2)nc1 ZINC000440495516 947049321 /nfs/dbraw/zinc/04/93/21/947049321.db2.gz CAONQPGBWROHQH-MRXNPFEDSA-N 1 1 360.845 3.762 20 5 FHBDMO CC(C)COc1ccccc1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000440494813 947065278 /nfs/dbraw/zinc/06/52/78/947065278.db2.gz NNDMRZJBPZTKLP-QGZVFWFLSA-N 1 1 370.453 3.711 20 5 FHBDMO Cc1ccc(C(=O)N(C)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000074445748 947068043 /nfs/dbraw/zinc/06/80/43/947068043.db2.gz HUJHRCNQSSTSPJ-IBGZPJMESA-N 1 1 367.449 3.640 20 5 FHBDMO Cc1ccccc1C[C@@H]1CCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444642154 947085059 /nfs/dbraw/zinc/08/50/59/947085059.db2.gz RADZKOOVUCNFID-INIZCTEOSA-N 1 1 350.422 3.987 20 5 FHBDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000523343650 947163398 /nfs/dbraw/zinc/16/33/98/947163398.db2.gz UGBDOZQSKYJMLW-CQSZACIVSA-N 1 1 365.499 3.701 20 5 FHBDMO CCCCC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)Cc1ccc(F)cc1 ZINC000536378960 947850393 /nfs/dbraw/zinc/85/03/93/947850393.db2.gz QTMLRJUUKLLVAZ-UHFFFAOYSA-N 1 1 361.417 3.588 20 5 FHBDMO COc1ccc(OCC[N@@H+](C)Cc2cc(C)c(OC)c(C)c2)c([N+](=O)[O-])c1 ZINC000441545527 948242122 /nfs/dbraw/zinc/24/21/22/948242122.db2.gz LHHGNDGWIHEQQB-UHFFFAOYSA-N 1 1 374.437 3.740 20 5 FHBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@@]4(C3)CCCOC4)o2)c([N+](=O)[O-])c1 ZINC000585767913 948278900 /nfs/dbraw/zinc/27/89/00/948278900.db2.gz FGUTZPABFHLIPH-HXUWFJFHSA-N 1 1 372.421 3.866 20 5 FHBDMO CCN(CC)C(=O)[C@@H]1CCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000512081862 948375990 /nfs/dbraw/zinc/37/59/90/948375990.db2.gz FIWMXPYLJIAYPF-SFHVURJKSA-N 1 1 371.437 3.688 20 5 FHBDMO C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCC[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000574735025 948420100 /nfs/dbraw/zinc/42/01/00/948420100.db2.gz LCQDRPPFQANUEC-LRHNDGHRSA-N 1 1 372.469 3.623 20 5 FHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C1 ZINC000536481628 948726247 /nfs/dbraw/zinc/72/62/47/948726247.db2.gz LMTJOKHROZDTSD-ZNMIVQPWSA-N 1 1 370.453 3.554 20 5 FHBDMO CCC[N@H+](CC(=O)Nc1ccccc1C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000051452262 221036150 /nfs/dbraw/zinc/03/61/50/221036150.db2.gz WXFXRORALUYIGF-UHFFFAOYSA-N 1 1 371.437 3.763 20 5 FHBDMO CCC[N@@H+](CC(=O)Nc1ccccc1C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000051452262 221036152 /nfs/dbraw/zinc/03/61/52/221036152.db2.gz WXFXRORALUYIGF-UHFFFAOYSA-N 1 1 371.437 3.763 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@H+](Cc2ccco2)C2CCCC2)c2c(c1)COCO2 ZINC000052077145 221037581 /nfs/dbraw/zinc/03/75/81/221037581.db2.gz UYEVAWHFQCIEBJ-UHFFFAOYSA-N 1 1 358.394 3.999 20 5 FHBDMO O=[N+]([O-])c1cc(C[N@@H+](Cc2ccco2)C2CCCC2)c2c(c1)COCO2 ZINC000052077145 221037583 /nfs/dbraw/zinc/03/75/83/221037583.db2.gz UYEVAWHFQCIEBJ-UHFFFAOYSA-N 1 1 358.394 3.999 20 5 FHBDMO C[C@@H]1C[N@H+](Cc2ccccc2NCCc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000541798912 567852437 /nfs/dbraw/zinc/85/24/37/567852437.db2.gz AWBBALITSUUEPH-CALCHBBNSA-N 1 1 369.465 3.859 20 5 FHBDMO C[C@H](c1cccc(NCCc2ccc([N+](=O)[O-])cc2)c1)[NH+]1CCOCC1 ZINC000541799393 567857274 /nfs/dbraw/zinc/85/72/74/567857274.db2.gz GKJYYVVUPFMHGL-MRXNPFEDSA-N 1 1 355.438 3.643 20 5 FHBDMO CC[C@H]1[C@H](C)CC[N@H+]1Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000481414154 567915707 /nfs/dbraw/zinc/91/57/07/567915707.db2.gz OEVMLQBTLVJKSX-YPMHNXCESA-N 1 1 358.385 3.868 20 5 FHBDMO C[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@@H](c1ccccc1)N(C)C ZINC000602619503 567998390 /nfs/dbraw/zinc/99/83/90/567998390.db2.gz OGTIPRKKZQLXAX-DJJJIMSYSA-N 1 1 354.410 3.517 20 5 FHBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@@H](c3nc4ccccc4o3)C2)cc1 ZINC000604473328 568298796 /nfs/dbraw/zinc/29/87/96/568298796.db2.gz QBZIKHOPBQIPSR-OAHLLOKOSA-N 1 1 367.405 3.994 20 5 FHBDMO