smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC(C)[N@H+]1CCc2c(sc3c2C(=O)N[C@H](c2cccc([N+](=O)[O-])c2)N3)C1 ZINC000006616567 204257057 /nfs/dbraw/zinc/25/70/57/204257057.db2.gz QKBLQTGQUQSFQN-INIZCTEOSA-N 1 1 372.450 3.852 50 5 FHBAMO Cc1cc(N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)ccc1[NH+]1CCCC1 ZINC000032853727 570821768 /nfs/dbraw/zinc/82/17/68/570821768.db2.gz LBIZIWAYYUTQMG-OAHLLOKOSA-N 1 1 368.437 3.943 50 5 FHBAMO CSc1ccc(C[NH+]2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000000865190 571094018 /nfs/dbraw/zinc/09/40/18/571094018.db2.gz MMPSNKSYGCQWBD-UHFFFAOYSA-N 1 1 357.479 3.635 50 5 FHBAMO COc1ccc(NC(=O)C[N@@H+](C)[C@H]2CCCc3ccccc32)c([N+](=O)[O-])c1 ZINC000008126850 206213679 /nfs/dbraw/zinc/21/36/79/206213679.db2.gz WGFVAOMOJZYMPY-SFHVURJKSA-N 1 1 369.421 3.551 50 5 FHBAMO O=[N+]([O-])c1cccc(C[NH+]2CCN(c3cccc(C(F)(F)F)c3)CC2)c1 ZINC000055543186 136127027 /nfs/dbraw/zinc/12/70/27/136127027.db2.gz RBPKQXBWFFOHPT-UHFFFAOYSA-N 1 1 365.355 3.936 50 5 FHBAMO C[C@@H]1CCC[N@@H+](CC(=O)Nc2cc(N3CCC[C@H](C)C3)ccc2[N+](=O)[O-])C1 ZINC000008345444 571041755 /nfs/dbraw/zinc/04/17/55/571041755.db2.gz DYSGQIOYIKUBCQ-CVEARBPZSA-N 1 1 374.485 3.502 50 5 FHBAMO C[C@@H]1CCC[N@H+](CC(=O)Nc2cc(N3CCC[C@H](C)C3)ccc2[N+](=O)[O-])C1 ZINC000008345444 571041756 /nfs/dbraw/zinc/04/17/56/571041756.db2.gz DYSGQIOYIKUBCQ-CVEARBPZSA-N 1 1 374.485 3.502 50 5 FHBAMO O=[N+]([O-])c1cc2c(cc1C[NH2+][C@@H]1CCSc3c(F)cccc31)OCO2 ZINC000071867254 571127476 /nfs/dbraw/zinc/12/74/76/571127476.db2.gz JUQMSEKTPPWGLI-CYBMUJFWSA-N 1 1 362.382 3.789 50 5 FHBAMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3ccsc3)CC2)c2ccncc21 ZINC000012557959 571181349 /nfs/dbraw/zinc/18/13/49/571181349.db2.gz OLEWBXFWSZTFRG-UHFFFAOYSA-N 1 1 354.435 3.527 50 5 FHBAMO Cc1ccc([N+](=O)[O-])c(NC(=O)C[N@@H+](C)[C@H]2CCc3ccccc32)c1C ZINC000029487021 571342487 /nfs/dbraw/zinc/34/24/87/571342487.db2.gz UQIIEACPZJVXQS-KRWDZBQOSA-N 1 1 353.422 3.769 50 5 FHBAMO Cc1ccc([N+](=O)[O-])c(NC(=O)C[N@H+](C)[C@H]2CCc3ccccc32)c1C ZINC000029487021 571342488 /nfs/dbraw/zinc/34/24/88/571342488.db2.gz UQIIEACPZJVXQS-KRWDZBQOSA-N 1 1 353.422 3.769 50 5 FHBAMO O=[N+]([O-])c1cccc(/C=C/C2=CC[N@@H+](C[C@H](O)c3ccccc3)CC2)c1 ZINC000004007020 571353915 /nfs/dbraw/zinc/35/39/15/571353915.db2.gz YRHJMYLPJDJXMF-GLCJEOIMSA-N 1 1 350.418 3.974 50 5 FHBAMO COc1cc(C(=O)CC[N@H+]2CC[C@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000004122127 204122289 /nfs/dbraw/zinc/12/22/89/204122289.db2.gz VDDIPDGXPRLPQT-KRWDZBQOSA-N 1 1 354.406 3.666 50 5 FHBAMO CCOC(=O)[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000004986150 204182709 /nfs/dbraw/zinc/18/27/09/204182709.db2.gz CVVYRZATVIOPIP-CQSZACIVSA-N 1 1 358.394 3.630 50 5 FHBAMO CCCN1CCC([NH2+][C@H]2CCCc3c4cc([N+](=O)[O-])ccc4[nH]c32)CC1 ZINC000005032136 204186601 /nfs/dbraw/zinc/18/66/01/204186601.db2.gz FTQNXGWSSXOUKZ-IBGZPJMESA-N 1 1 356.470 3.918 50 5 FHBAMO CCC[NH+]1CCC(N[C@H]2CCCc3c4cc([N+](=O)[O-])ccc4[nH]c32)CC1 ZINC000005032136 204186603 /nfs/dbraw/zinc/18/66/03/204186603.db2.gz FTQNXGWSSXOUKZ-IBGZPJMESA-N 1 1 356.470 3.918 50 5 FHBAMO O=C(C[NH2+]C(c1ccccc1)c1ccccc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000054531226 205201847 /nfs/dbraw/zinc/20/18/47/205201847.db2.gz OBWRVMNBCOWABC-UHFFFAOYSA-N 1 1 361.401 3.913 50 5 FHBAMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)c1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000241644469 524563785 /nfs/dbraw/zinc/56/37/85/524563785.db2.gz PRAVEMPIGJILRJ-MAUKXSAKSA-N 1 1 367.449 3.602 50 5 FHBAMO Cc1cc(OC[C@H](O)C[N@@H+](Cc2ccccc2)C(C)(C)C)ccc1[N+](=O)[O-] ZINC000000771875 568197053 /nfs/dbraw/zinc/19/70/53/568197053.db2.gz OYHKGTQGXDOFIT-GOSISDBHSA-N 1 1 372.465 3.944 50 5 FHBAMO Cc1cc(OC[C@@H](O)C[N@@H+](Cc2ccccc2)C(C)(C)C)ccc1[N+](=O)[O-] ZINC000000771876 568197065 /nfs/dbraw/zinc/19/70/65/568197065.db2.gz OYHKGTQGXDOFIT-SFHVURJKSA-N 1 1 372.465 3.944 50 5 FHBAMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)c1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000075105835 571154981 /nfs/dbraw/zinc/15/49/81/571154981.db2.gz PRAVEMPIGJILRJ-YJBOKZPZSA-N 1 1 367.449 3.602 50 5 FHBAMO Cc1ccc([N+](=O)[O-])c(NC(=O)C[N@@H+]2CCC[C@@H]2c2ccccc2)c1C ZINC000010340390 204394231 /nfs/dbraw/zinc/39/42/31/204394231.db2.gz FWSNNQMMDMOJMZ-QGZVFWFLSA-N 1 1 353.422 3.987 50 5 FHBAMO Cc1ccc([N+](=O)[O-])c(NC(=O)C[N@H+]2CCC[C@@H]2c2ccccc2)c1C ZINC000010340390 204394235 /nfs/dbraw/zinc/39/42/35/204394235.db2.gz FWSNNQMMDMOJMZ-QGZVFWFLSA-N 1 1 353.422 3.987 50 5 FHBAMO Cc1cccc(C(=O)NC[C@@H](c2ccccc2Cl)[NH+](C)C)c1[N+](=O)[O-] ZINC000012765428 571084054 /nfs/dbraw/zinc/08/40/54/571084054.db2.gz RONWZBOBJDRCGN-INIZCTEOSA-N 1 1 361.829 3.589 50 5 FHBAMO O=[N+]([O-])c1cccnc1N1CCN(c2cc[nH+]c3cc(Cl)ccc32)CC1 ZINC000004753715 571231840 /nfs/dbraw/zinc/23/18/40/571231840.db2.gz UNWXLMJUOBFOMT-UHFFFAOYSA-N 1 1 369.812 3.518 50 5 FHBAMO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000095958280 571332927 /nfs/dbraw/zinc/33/29/27/571332927.db2.gz JXEKTVPVXASZFY-OAHLLOKOSA-N 1 1 362.474 3.925 50 5 FHBAMO Cc1ccc([N+](=O)[O-])c(NC(=O)C[N@@H+](C)[C@@H]2CCc3ccccc32)c1C ZINC000029487018 571342479 /nfs/dbraw/zinc/34/24/79/571342479.db2.gz UQIIEACPZJVXQS-QGZVFWFLSA-N 1 1 353.422 3.769 50 5 FHBAMO Cc1ccc([N+](=O)[O-])c(NC(=O)C[N@H+](C)[C@@H]2CCc3ccccc32)c1C ZINC000029487018 571342480 /nfs/dbraw/zinc/34/24/80/571342480.db2.gz UQIIEACPZJVXQS-QGZVFWFLSA-N 1 1 353.422 3.769 50 5 FHBAMO CCOc1ccc(C[N@H+](C)CC(=O)Nc2cc(C)c(C)cc2[N+](=O)[O-])cc1 ZINC000006649354 204258276 /nfs/dbraw/zinc/25/82/76/204258276.db2.gz KUIIFEUPUGLJQH-UHFFFAOYSA-N 1 1 371.437 3.681 50 5 FHBAMO CCOc1ccc(C[N@@H+](C)CC(=O)Nc2cc(C)c(C)cc2[N+](=O)[O-])cc1 ZINC000006649354 204258279 /nfs/dbraw/zinc/25/82/79/204258279.db2.gz KUIIFEUPUGLJQH-UHFFFAOYSA-N 1 1 371.437 3.681 50 5 FHBAMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)CCOc1ccccc1 ZINC000007647724 204301934 /nfs/dbraw/zinc/30/19/34/204301934.db2.gz CRMJQRUYDAIFFG-AWEZNQCLSA-N 1 1 368.393 3.717 50 5 FHBAMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)CCOc1ccccc1 ZINC000007647724 204301938 /nfs/dbraw/zinc/30/19/38/204301938.db2.gz CRMJQRUYDAIFFG-AWEZNQCLSA-N 1 1 368.393 3.717 50 5 FHBAMO COc1ccc([C@H]2CCC[N@H+]2CCOc2cccc([N+](=O)[O-])c2)cc1OC ZINC000036396723 204377082 /nfs/dbraw/zinc/37/70/82/204377082.db2.gz NYPTXIXDIJWQID-GOSISDBHSA-N 1 1 372.421 3.828 50 5 FHBAMO Cc1[nH+]ccn1-c1ccc(NC(=O)c2cccc([N+](=O)[O-])c2C)cc1F ZINC000056102798 205228070 /nfs/dbraw/zinc/22/80/70/205228070.db2.gz GYMMAPPYMKMDEJ-UHFFFAOYSA-N 1 1 354.341 3.789 50 5 FHBAMO O=C(CC[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1ccc(Cl)cc1 ZINC000052537675 136124455 /nfs/dbraw/zinc/12/44/55/136124455.db2.gz GAEASSKGAXIANV-UHFFFAOYSA-N 1 1 373.840 3.643 50 5 FHBAMO O=[N+]([O-])c1cccc(/C=C/C2=CC[N@@H+](C[C@@H](O)c3ccccc3)CC2)c1 ZINC000000755519 568145845 /nfs/dbraw/zinc/14/58/45/568145845.db2.gz YRHJMYLPJDJXMF-LCCNJJIFSA-N 1 1 350.418 3.974 50 5 FHBAMO C[N@@H+](CCCc1ccccc1)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000052802434 206221797 /nfs/dbraw/zinc/22/17/97/206221797.db2.gz FDSQPFCCQDIZFT-UHFFFAOYSA-N 1 1 361.829 3.751 50 5 FHBAMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1N(C)Cc1ccc([N+](=O)[O-])cc1 ZINC000106922252 206313447 /nfs/dbraw/zinc/31/34/47/206313447.db2.gz HNXXWYBHOKWZDK-LAUBAEHRSA-N 1 1 353.466 3.937 50 5 FHBAMO C[C@H]1CN(Cc2ccccc2)CC[C@H]1[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000106922252 206313452 /nfs/dbraw/zinc/31/34/52/206313452.db2.gz HNXXWYBHOKWZDK-LAUBAEHRSA-N 1 1 353.466 3.937 50 5 FHBAMO C[C@H]1CN(Cc2ccccc2)CC[C@H]1[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000106922252 206313454 /nfs/dbraw/zinc/31/34/54/206313454.db2.gz HNXXWYBHOKWZDK-LAUBAEHRSA-N 1 1 353.466 3.937 50 5 FHBAMO O=C(NC1CC1)c1ccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000023040192 206397566 /nfs/dbraw/zinc/39/75/66/206397566.db2.gz IJDSHJQAQREOLH-UHFFFAOYSA-N 1 1 365.433 3.652 50 5 FHBAMO O=C(NC1CC1)c1ccc(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000023040192 206397571 /nfs/dbraw/zinc/39/75/71/206397571.db2.gz IJDSHJQAQREOLH-UHFFFAOYSA-N 1 1 365.433 3.652 50 5 FHBAMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000106528092 570891969 /nfs/dbraw/zinc/89/19/69/570891969.db2.gz DVCHAWWMSQWLCS-SJORKVTESA-N 1 1 367.232 3.992 50 5 FHBAMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000106528092 570891973 /nfs/dbraw/zinc/89/19/73/570891973.db2.gz DVCHAWWMSQWLCS-SJORKVTESA-N 1 1 367.232 3.992 50 5 FHBAMO CC(=O)N(c1ccc(F)cc1)C1CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000034675627 571106523 /nfs/dbraw/zinc/10/65/23/571106523.db2.gz RCFYRQCXFQNDDP-UHFFFAOYSA-N 1 1 371.412 3.751 50 5 FHBAMO Cc1[nH+]ccn1-c1ccc([C@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000075106432 571155293 /nfs/dbraw/zinc/15/52/93/571155293.db2.gz GOFKXNXZJQRUAJ-ZDUSSCGKSA-N 1 1 350.378 3.580 50 5 FHBAMO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000095958281 571332905 /nfs/dbraw/zinc/33/29/05/571332905.db2.gz JXEKTVPVXASZFY-HNNXBMFYSA-N 1 1 362.474 3.925 50 5 FHBAMO CC[N@H+]1CCC[C@@H](CNc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C1 ZINC000058050982 205248721 /nfs/dbraw/zinc/24/87/21/205248721.db2.gz SMNAQQYTIWKMEQ-INIZCTEOSA-N 1 1 367.449 3.970 50 5 FHBAMO O=[N+]([O-])c1cc2c(cc1C[NH2+][C@H]1CCSc3c(F)cccc31)OCO2 ZINC000071867253 571127565 /nfs/dbraw/zinc/12/75/65/571127565.db2.gz JUQMSEKTPPWGLI-ZDUSSCGKSA-N 1 1 362.382 3.789 50 5 FHBAMO Cc1[nH+]ccn1-c1ccc([C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000075106430 571155305 /nfs/dbraw/zinc/15/53/05/571155305.db2.gz GOFKXNXZJQRUAJ-CYBMUJFWSA-N 1 1 350.378 3.580 50 5 FHBAMO CC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)CC[N@@H+]1Cc1ccccc1 ZINC000170595192 571266353 /nfs/dbraw/zinc/26/63/53/571266353.db2.gz YERMGKVYHXJQIL-LJQANCHMSA-N 1 1 367.449 3.640 50 5 FHBAMO CC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)CC[N@H+]1Cc1ccccc1 ZINC000170595192 571266355 /nfs/dbraw/zinc/26/63/55/571266355.db2.gz YERMGKVYHXJQIL-LJQANCHMSA-N 1 1 367.449 3.640 50 5 FHBAMO CC(C)[N@H+]1CCc2c(sc3c2C(=O)N[C@H](c2ccccc2[N+](=O)[O-])N3)C1 ZINC000006159806 207132296 /nfs/dbraw/zinc/13/22/96/207132296.db2.gz VBDADRGKRIQZHH-INIZCTEOSA-N 1 1 372.450 3.852 50 5 FHBAMO O=[N+]([O-])c1c2cccnc2ccc1N1CCC[N@@H+](Cc2cccs2)CC1 ZINC000040153614 208237171 /nfs/dbraw/zinc/23/71/71/208237171.db2.gz PBVLXDNQYJTDAE-UHFFFAOYSA-N 1 1 368.462 3.917 50 5 FHBAMO C[C@@H]1CCCN(c2ccc([N+](=O)[O-])c(NC(=O)C[N@@H+]3CCC[C@@H](C)C3)c2)C1 ZINC000012691616 571049628 /nfs/dbraw/zinc/04/96/28/571049628.db2.gz DYSGQIOYIKUBCQ-HZPDHXFCSA-N 1 1 374.485 3.502 50 5 FHBAMO C[C@@H]1CCCN(c2ccc([N+](=O)[O-])c(NC(=O)C[N@H+]3CCC[C@@H](C)C3)c2)C1 ZINC000012691616 571049629 /nfs/dbraw/zinc/04/96/29/571049629.db2.gz DYSGQIOYIKUBCQ-HZPDHXFCSA-N 1 1 374.485 3.502 50 5 FHBAMO CC(C)c1ccc(C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C2CC2)cc1 ZINC000084625112 571093354 /nfs/dbraw/zinc/09/33/54/571093354.db2.gz PFIJDWJRNSYWRD-UHFFFAOYSA-N 1 1 355.438 3.545 50 5 FHBAMO Cc1c(C(=O)NC[C@@H](c2ccccc2Cl)[NH+](C)C)cccc1[N+](=O)[O-] ZINC000012780476 571098779 /nfs/dbraw/zinc/09/87/79/571098779.db2.gz JEKJSAMQHWIORV-KRWDZBQOSA-N 1 1 361.829 3.589 50 5 FHBAMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3ccccc3F)CC2)c2ccncc21 ZINC000012557485 571181277 /nfs/dbraw/zinc/18/12/77/571181277.db2.gz QDSXYVSCRYYQIW-UHFFFAOYSA-N 1 1 366.396 3.604 50 5 FHBAMO C[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCc2ccccc21 ZINC000029483525 571342467 /nfs/dbraw/zinc/34/24/67/571342467.db2.gz FDXUUHOVEBXYSL-QGZVFWFLSA-N 1 1 359.813 3.806 50 5 FHBAMO C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCc2ccccc21 ZINC000029483525 571342468 /nfs/dbraw/zinc/34/24/68/571342468.db2.gz FDXUUHOVEBXYSL-QGZVFWFLSA-N 1 1 359.813 3.806 50 5 FHBAMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000058343819 571350705 /nfs/dbraw/zinc/35/07/05/571350705.db2.gz DVCHAWWMSQWLCS-DLBZAZTESA-N 1 1 367.232 3.992 50 5 FHBAMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000058343819 571350706 /nfs/dbraw/zinc/35/07/06/571350706.db2.gz DVCHAWWMSQWLCS-DLBZAZTESA-N 1 1 367.232 3.992 50 5 FHBAMO O=[N+]([O-])c1ccccc1/C=C/CN1CC[NH+](C/C=C/c2ccccc2)CC1 ZINC000004987215 207069525 /nfs/dbraw/zinc/06/95/25/207069525.db2.gz NRGYNZQRBTVEKK-QXZILWSFSA-N 1 1 363.461 3.939 50 5 FHBAMO COc1ccc([C@@H]2CCC[N@H+]2CCOc2cccc([N+](=O)[O-])c2)cc1OC ZINC000036396722 207281192 /nfs/dbraw/zinc/28/11/92/207281192.db2.gz NYPTXIXDIJWQID-SFHVURJKSA-N 1 1 372.421 3.828 50 5 FHBAMO CSc1ccc(C[NH+]2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000000865271 571094278 /nfs/dbraw/zinc/09/42/78/571094278.db2.gz CKPUPLKCQZOBHK-UHFFFAOYSA-N 1 1 357.479 3.635 50 5 FHBAMO COc1ccc2[nH]c3c(c2c1)CC[NH2+][C@H]3c1cc([N+](=O)[O-])ccc1Cl ZINC000019932552 571327783 /nfs/dbraw/zinc/32/77/83/571327783.db2.gz RELZHFFZZUGYBJ-KRWDZBQOSA-N 1 1 357.797 3.973 50 5 FHBAMO C[N@@H+](CCCc1ccccc1)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000048374771 209332469 /nfs/dbraw/zinc/33/24/69/209332469.db2.gz JMIGBPPTYONIBE-UHFFFAOYSA-N 1 1 352.394 3.709 50 5 FHBAMO Clc1ccc2c(c1)c1nc3ccccc3nc1n2CC[NH+]1CCOCC1 ZINC000020624402 207748863 /nfs/dbraw/zinc/74/88/63/207748863.db2.gz UEWGGUPJEQOIFX-UHFFFAOYSA-N 1 1 366.852 3.723 50 5 FHBAMO Cc1cc(N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)ccc1[NH+]1CCCC1 ZINC000032853718 208049573 /nfs/dbraw/zinc/04/95/73/208049573.db2.gz CQLDQUDDZDTVSB-HNNXBMFYSA-N 1 1 368.437 3.943 50 5 FHBAMO Cc1cccc([C@H]2CCC[N@@H+]2CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000048362157 570951367 /nfs/dbraw/zinc/95/13/67/570951367.db2.gz NAFWMYVXYNWRNX-LJQANCHMSA-N 1 1 353.422 3.703 50 5 FHBAMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)CCOc1ccccc1 ZINC000007647725 207200537 /nfs/dbraw/zinc/20/05/37/207200537.db2.gz CRMJQRUYDAIFFG-CQSZACIVSA-N 1 1 368.393 3.717 50 5 FHBAMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)CCOc1ccccc1 ZINC000007647725 207200541 /nfs/dbraw/zinc/20/05/41/207200541.db2.gz CRMJQRUYDAIFFG-CQSZACIVSA-N 1 1 368.393 3.717 50 5 FHBAMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC=C(c3ccc(F)cc3)CC1)OCO2 ZINC000004986954 571072953 /nfs/dbraw/zinc/07/29/53/571072953.db2.gz DBDIRBJGUQJDQF-UHFFFAOYSA-N 1 1 356.353 3.752 50 5 FHBAMO O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CC=C(c3ccc(F)cc3)CC1)OCO2 ZINC000004986954 571072955 /nfs/dbraw/zinc/07/29/55/571072955.db2.gz DBDIRBJGUQJDQF-UHFFFAOYSA-N 1 1 356.353 3.752 50 5 FHBAMO O=C(NC[C@@H](c1ccccc1Cl)[NH+]1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000015787756 571127102 /nfs/dbraw/zinc/12/71/02/571127102.db2.gz NHUNBDLBLYMAHA-SFHVURJKSA-N 1 1 373.840 3.815 50 5 FHBAMO CC[N@@H+](Cc1ccccc1)CC(C)(C)CNC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000038536747 208203136 /nfs/dbraw/zinc/20/31/36/208203136.db2.gz QVSIMXOXVSYOPP-UHFFFAOYSA-N 1 1 369.465 3.873 50 5 FHBAMO CSc1ccc(C[N@H+](C)[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000006651449 571239338 /nfs/dbraw/zinc/23/93/38/571239338.db2.gz HPGGLWGVXHGRIH-CYBMUJFWSA-N 1 1 359.451 3.776 50 5 FHBAMO CSc1ccc(C[N@@H+](C)[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000006651449 571239339 /nfs/dbraw/zinc/23/93/39/571239339.db2.gz HPGGLWGVXHGRIH-CYBMUJFWSA-N 1 1 359.451 3.776 50 5 FHBAMO CC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)CC[N@@H+]1Cc1ccccc1 ZINC000170595193 571266388 /nfs/dbraw/zinc/26/63/88/571266388.db2.gz YERMGKVYHXJQIL-IBGZPJMESA-N 1 1 367.449 3.640 50 5 FHBAMO CC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)CC[N@H+]1Cc1ccccc1 ZINC000170595193 571266390 /nfs/dbraw/zinc/26/63/90/571266390.db2.gz YERMGKVYHXJQIL-IBGZPJMESA-N 1 1 367.449 3.640 50 5 FHBAMO COc1ccc2[nH]c3c(c2c1)CC[NH2+][C@@H]3c1cc([N+](=O)[O-])ccc1Cl ZINC000019932549 571327765 /nfs/dbraw/zinc/32/77/65/571327765.db2.gz RELZHFFZZUGYBJ-QGZVFWFLSA-N 1 1 357.797 3.973 50 5 FHBAMO O=[N+]([O-])c1ccc(NCC2([NH+]3CCOCC3)CCCCC2)c(Cl)c1 ZINC000022344165 571336634 /nfs/dbraw/zinc/33/66/34/571336634.db2.gz HVJVMPITPFWTNL-UHFFFAOYSA-N 1 1 353.850 3.695 50 5 FHBAMO O=[N+]([O-])c1cccc(OCCCCN2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000004833023 207053020 /nfs/dbraw/zinc/05/30/20/207053020.db2.gz YNAYTMKNGKUXGB-UHFFFAOYSA-N 1 1 369.465 3.572 50 5 FHBAMO C[C@H]1CCCC[N@H+]1CCCNC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000040098661 208227547 /nfs/dbraw/zinc/22/75/47/208227547.db2.gz IJRZALBOJWGIOL-LBPRGKRZSA-N 1 1 354.838 3.634 50 5 FHBAMO COc1ccccc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CCCO1 ZINC000040105837 208227853 /nfs/dbraw/zinc/22/78/53/208227853.db2.gz KGUGUOFMJOKHTE-LJQANCHMSA-N 1 1 356.422 3.785 50 5 FHBAMO COc1ccccc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CCCO1 ZINC000040105837 208227858 /nfs/dbraw/zinc/22/78/58/208227858.db2.gz KGUGUOFMJOKHTE-LJQANCHMSA-N 1 1 356.422 3.785 50 5 FHBAMO Cc1cc2nc3c4ccccc4n(CC[NH+]4CCOCC4)c3nc2cc1C ZINC000020648256 570922592 /nfs/dbraw/zinc/92/25/92/570922592.db2.gz AXHQPERUDFSOIB-UHFFFAOYSA-N 1 1 360.461 3.687 50 5 FHBAMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1N(C)Cc1ccc([N+](=O)[O-])cc1 ZINC000072308338 571065908 /nfs/dbraw/zinc/06/59/08/571065908.db2.gz HNXXWYBHOKWZDK-UWJYYQICSA-N 1 1 353.466 3.937 50 5 FHBAMO C[C@H]1CN(Cc2ccccc2)CC[C@@H]1[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000072308338 571065909 /nfs/dbraw/zinc/06/59/09/571065909.db2.gz HNXXWYBHOKWZDK-UWJYYQICSA-N 1 1 353.466 3.937 50 5 FHBAMO C[C@H]1CN(Cc2ccccc2)CC[C@@H]1[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000072308338 571065911 /nfs/dbraw/zinc/06/59/11/571065911.db2.gz HNXXWYBHOKWZDK-UWJYYQICSA-N 1 1 353.466 3.937 50 5 FHBAMO C[C@H]1C[C@H](C)C[NH+](Cc2csc(NC(=O)c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000012905097 571143168 /nfs/dbraw/zinc/14/31/68/571143168.db2.gz GVKCMNNNFBKQRP-STQMWFEESA-N 1 1 374.466 3.782 50 5 FHBAMO O=[N+]([O-])c1ccc(Nc2cccc(C[NH+]3CCOCC3)c2)c2ccncc21 ZINC000058162549 571348960 /nfs/dbraw/zinc/34/89/60/571348960.db2.gz DYSDIJFJTRGCHY-UHFFFAOYSA-N 1 1 364.405 3.719 50 5 FHBAMO CC[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](C)c1cccc(OC)c1 ZINC000045806120 209325959 /nfs/dbraw/zinc/32/59/59/209325959.db2.gz AQJRQFRQSYRDQP-CQSZACIVSA-N 1 1 357.410 3.625 50 5 FHBAMO CC[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](C)c1cccc(OC)c1 ZINC000045806120 209325964 /nfs/dbraw/zinc/32/59/64/209325964.db2.gz AQJRQFRQSYRDQP-CQSZACIVSA-N 1 1 357.410 3.625 50 5 FHBAMO CC(C)[N@H+]1CCc2c(sc3c2C(=O)N[C@@H](c2ccccc2[N+](=O)[O-])N3)C1 ZINC000006159807 207131648 /nfs/dbraw/zinc/13/16/48/207131648.db2.gz VBDADRGKRIQZHH-MRXNPFEDSA-N 1 1 372.450 3.852 50 5 FHBAMO C[C@@H]1CCCN(c2ccc([N+](=O)[O-])c(NC(=O)C[N@@H+]3CCC[C@H](C)C3)c2)C1 ZINC000012691621 571049641 /nfs/dbraw/zinc/04/96/41/571049641.db2.gz DYSGQIOYIKUBCQ-JKSUJKDBSA-N 1 1 374.485 3.502 50 5 FHBAMO C[C@@H]1CCCN(c2ccc([N+](=O)[O-])c(NC(=O)C[N@H+]3CCC[C@H](C)C3)c2)C1 ZINC000012691621 571049643 /nfs/dbraw/zinc/04/96/43/571049643.db2.gz DYSGQIOYIKUBCQ-JKSUJKDBSA-N 1 1 374.485 3.502 50 5 FHBAMO C[N@H+]1CCCN(c2nc(C(F)(F)F)nc3ccc4ccccc4c32)CC1 ZINC000241371238 571109985 /nfs/dbraw/zinc/10/99/85/571109985.db2.gz MLMDUSBZYXNXPW-UHFFFAOYSA-N 1 1 360.383 3.944 50 5 FHBAMO Cc1c(NC(=O)C[N@H+](Cc2ccc(F)cc2)C2CC2)cccc1[N+](=O)[O-] ZINC000012901980 571143191 /nfs/dbraw/zinc/14/31/91/571143191.db2.gz RNLXZPLBPCOCCS-UHFFFAOYSA-N 1 1 357.385 3.645 50 5 FHBAMO Cc1c(NC(=O)C[N@@H+](Cc2ccc(F)cc2)C2CC2)cccc1[N+](=O)[O-] ZINC000012901980 571143195 /nfs/dbraw/zinc/14/31/95/571143195.db2.gz RNLXZPLBPCOCCS-UHFFFAOYSA-N 1 1 357.385 3.645 50 5 FHBAMO COc1ccc(NC(=O)[C@@H]2CCC[N@@H+]2Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000048364412 209332227 /nfs/dbraw/zinc/33/22/27/209332227.db2.gz ZMIFHMJIKKYLOZ-IBGZPJMESA-N 1 1 369.421 3.515 50 5 FHBAMO COc1ccc(NC(=O)[C@@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000048364412 209332231 /nfs/dbraw/zinc/33/22/31/209332231.db2.gz ZMIFHMJIKKYLOZ-IBGZPJMESA-N 1 1 369.421 3.515 50 5 FHBAMO CCCC[N@@H+](CC)CC(=O)Nc1cc(C)c2c(=O)oc3ccccc3c2n1 ZINC000009608905 207279019 /nfs/dbraw/zinc/27/90/19/207279019.db2.gz RNIJDEMKKUITHG-UHFFFAOYSA-N 1 1 367.449 3.710 50 5 FHBAMO Cc1cc(N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)ccc1[NH+]1CCCC1 ZINC000032853716 208048548 /nfs/dbraw/zinc/04/85/48/208048548.db2.gz CQLDQUDDZDTVSB-OAHLLOKOSA-N 1 1 368.437 3.943 50 5 FHBAMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3ccc(OCCCF)cc3)CC2)cc1 ZINC000058980999 136131908 /nfs/dbraw/zinc/13/19/08/136131908.db2.gz IKKMVNBKHOKYQH-UHFFFAOYSA-N 1 1 373.428 3.655 50 5 FHBAMO COc1ccc(NC(=O)C[N@H+](Cc2ccco2)C2CCCC2)c([N+](=O)[O-])c1 ZINC000053139563 571076077 /nfs/dbraw/zinc/07/60/77/571076077.db2.gz FACHZVPNGWGNLF-UHFFFAOYSA-N 1 1 373.409 3.580 50 5 FHBAMO COc1ccc(NC(=O)C[N@@H+](Cc2ccco2)C2CCCC2)c([N+](=O)[O-])c1 ZINC000053139563 571076078 /nfs/dbraw/zinc/07/60/78/571076078.db2.gz FACHZVPNGWGNLF-UHFFFAOYSA-N 1 1 373.409 3.580 50 5 FHBAMO CSc1ccc(C[N@H+](C)[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000006651445 571239334 /nfs/dbraw/zinc/23/93/34/571239334.db2.gz HPGGLWGVXHGRIH-ZDUSSCGKSA-N 1 1 359.451 3.776 50 5 FHBAMO CSc1ccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000006651445 571239335 /nfs/dbraw/zinc/23/93/35/571239335.db2.gz HPGGLWGVXHGRIH-ZDUSSCGKSA-N 1 1 359.451 3.776 50 5 FHBAMO CSc1ccc(C[N@H+](C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000003347611 571348026 /nfs/dbraw/zinc/34/80/26/571348026.db2.gz CKHVBIFTZAJXEL-ZDUSSCGKSA-N 1 1 359.451 3.776 50 5 FHBAMO CSc1ccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000003347611 571348027 /nfs/dbraw/zinc/34/80/27/571348027.db2.gz CKHVBIFTZAJXEL-ZDUSSCGKSA-N 1 1 359.451 3.776 50 5 FHBAMO C[N@H+]1CCCC12CCN(c1c(F)cc([N+](=O)[O-])cc1Br)CC2 ZINC000095460531 132211356 /nfs/dbraw/zinc/21/13/56/132211356.db2.gz VXRZYZFKWKCTMQ-UHFFFAOYSA-N 1 1 372.238 3.561 50 5 FHBAMO NC(=O)c1ccc(C[NH2+]C(c2ccccc2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000024573966 570859741 /nfs/dbraw/zinc/85/97/41/570859741.db2.gz YWNXCYDLKGAITA-UHFFFAOYSA-N 1 1 361.401 3.573 50 5 FHBAMO Cc1ccc2c(c1)[C@H]1C[N@@H+](C)CC[C@@H]1N2C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000036389751 571252440 /nfs/dbraw/zinc/25/24/40/571252440.db2.gz VYYBAEJENLPVFA-MJGOQNOKSA-N 1 1 366.421 3.743 50 5 FHBAMO O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000017076714 211179695 /nfs/dbraw/zinc/17/96/95/211179695.db2.gz JGMJYDOJTGOJMG-UHFFFAOYSA-N 1 1 374.828 3.598 50 5 FHBAMO CSc1ccc(C[N@H+](C)Cc2cc([N+](=O)[O-])cc3c2OCOC3)cc1 ZINC000015302381 211126990 /nfs/dbraw/zinc/12/69/90/211126990.db2.gz TWIIDZGIOPBYOK-UHFFFAOYSA-N 1 1 360.435 3.815 50 5 FHBAMO CSc1ccc(C[N@@H+](C)Cc2cc([N+](=O)[O-])cc3c2OCOC3)cc1 ZINC000015302381 211126994 /nfs/dbraw/zinc/12/69/94/211126994.db2.gz TWIIDZGIOPBYOK-UHFFFAOYSA-N 1 1 360.435 3.815 50 5 FHBAMO C[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H]1CCc2ccccc21 ZINC000040153875 571086820 /nfs/dbraw/zinc/08/68/20/571086820.db2.gz HQPJFADXRVUIKV-QGZVFWFLSA-N 1 1 350.378 3.764 50 5 FHBAMO C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H]1CCc2ccccc21 ZINC000040153875 571086823 /nfs/dbraw/zinc/08/68/23/571086823.db2.gz HQPJFADXRVUIKV-QGZVFWFLSA-N 1 1 350.378 3.764 50 5 FHBAMO CC[N@H+]1CCC[C@H](CNc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C1 ZINC000058050978 571347404 /nfs/dbraw/zinc/34/74/04/571347404.db2.gz SMNAQQYTIWKMEQ-MRXNPFEDSA-N 1 1 367.449 3.970 50 5 FHBAMO CC(C)[N@H+](Cc1cccc(Cl)c1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000052906991 221040755 /nfs/dbraw/zinc/04/07/55/221040755.db2.gz RCVFMXROXDAGRU-UHFFFAOYSA-N 1 1 361.829 3.758 50 5 FHBAMO CC(C)[N@@H+](Cc1cccc(Cl)c1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000052906991 221040758 /nfs/dbraw/zinc/04/07/58/221040758.db2.gz RCVFMXROXDAGRU-UHFFFAOYSA-N 1 1 361.829 3.758 50 5 FHBAMO C[C@H]1CCCN(c2ccc([N+](=O)[O-])c(NC(=O)C[N@@H+]3CCC[C@H](C)C3)c2)C1 ZINC000008345449 571041913 /nfs/dbraw/zinc/04/19/13/571041913.db2.gz DYSGQIOYIKUBCQ-HOTGVXAUSA-N 1 1 374.485 3.502 50 5 FHBAMO C[C@H]1CCCN(c2ccc([N+](=O)[O-])c(NC(=O)C[N@H+]3CCC[C@H](C)C3)c2)C1 ZINC000008345449 571041915 /nfs/dbraw/zinc/04/19/15/571041915.db2.gz DYSGQIOYIKUBCQ-HOTGVXAUSA-N 1 1 374.485 3.502 50 5 FHBAMO Cc1c(C(=O)NC[C@H](c2ccccc2Cl)[NH+](C)C)cccc1[N+](=O)[O-] ZINC000012780480 571098768 /nfs/dbraw/zinc/09/87/68/571098768.db2.gz JEKJSAMQHWIORV-QGZVFWFLSA-N 1 1 361.829 3.589 50 5 FHBAMO O=[N+]([O-])c1cc2c(cc1C[NH2+][C@@H]1CCSc3ccc(F)cc31)OCO2 ZINC000071008967 571118939 /nfs/dbraw/zinc/11/89/39/571118939.db2.gz DKEOIWIVRPNDRC-CYBMUJFWSA-N 1 1 362.382 3.789 50 5 FHBAMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3cc(-c4ccccc4)no3)CC2)cc1 ZINC000012597154 132861043 /nfs/dbraw/zinc/86/10/43/132861043.db2.gz FTJDKSSJDOPQGD-UHFFFAOYSA-N 1 1 364.405 3.572 50 5 FHBAMO O=c1cc(C[NH+]2CCN(c3ccccn3)CC2)c2c(ccc3ccccc32)o1 ZINC000084598179 570518758 /nfs/dbraw/zinc/51/87/58/570518758.db2.gz CBNPOVCYEJFYOC-UHFFFAOYSA-N 1 1 371.440 3.663 50 5 FHBAMO CC[N@H+]1CCC[C@@H](Nc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C1 ZINC000040157796 571088016 /nfs/dbraw/zinc/08/80/16/571088016.db2.gz HHANRPGNKNSKBD-QGZVFWFLSA-N 1 1 353.422 3.722 50 5 FHBAMO CC(C)(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H](O)COc1ccccc1 ZINC000000753780 219318134 /nfs/dbraw/zinc/31/81/34/219318134.db2.gz FMEUATDWKJMGPJ-SFHVURJKSA-N 1 1 358.438 3.635 50 5 FHBAMO Cc1c(C(=O)N2CCC[N@@H+](CC3CCCCC3)CC2)cccc1[N+](=O)[O-] ZINC000059887178 212018963 /nfs/dbraw/zinc/01/89/63/212018963.db2.gz QWIFUSHWUAYZNV-UHFFFAOYSA-N 1 1 359.470 3.631 50 5 FHBAMO CCOC(=O)[C@H]1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000004986156 570571429 /nfs/dbraw/zinc/57/14/29/570571429.db2.gz CVVYRZATVIOPIP-AWEZNQCLSA-N 1 1 358.394 3.630 50 5 FHBAMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000106528089 570891952 /nfs/dbraw/zinc/89/19/52/570891952.db2.gz DVCHAWWMSQWLCS-IAGOWNOFSA-N 1 1 367.232 3.992 50 5 FHBAMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000106528089 570891955 /nfs/dbraw/zinc/89/19/55/570891955.db2.gz DVCHAWWMSQWLCS-IAGOWNOFSA-N 1 1 367.232 3.992 50 5 FHBAMO Cc1cccc(N2CC[NH+](CCNc3ccc([N+](=O)[O-])cc3Cl)CC2)c1 ZINC000031577120 571171159 /nfs/dbraw/zinc/17/11/59/571171159.db2.gz SJNBTOOGFPVQGR-UHFFFAOYSA-N 1 1 374.872 3.791 50 5 FHBAMO COc1cc(C(=O)CC[N@H+]2CC[C@@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000004122128 571355821 /nfs/dbraw/zinc/35/58/21/571355821.db2.gz VDDIPDGXPRLPQT-QGZVFWFLSA-N 1 1 354.406 3.666 50 5 FHBAMO Cc1ccccc1C[N@H+]1CCCN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000032912706 570852530 /nfs/dbraw/zinc/85/25/30/570852530.db2.gz AVJULIHUGJERBS-UHFFFAOYSA-N 1 1 368.437 3.643 50 5 FHBAMO O=[N+]([O-])c1cc2c(cc1C[NH2+][C@H]1CCSc3ccc(F)cc31)OCO2 ZINC000071008970 571118952 /nfs/dbraw/zinc/11/89/52/571118952.db2.gz DKEOIWIVRPNDRC-ZDUSSCGKSA-N 1 1 362.382 3.789 50 5 FHBAMO Cc1ccccc1C[N@H+]1CCCN(C(=O)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000027387094 571289316 /nfs/dbraw/zinc/28/93/16/571289316.db2.gz PKGSXSOSOVNWMM-UHFFFAOYSA-N 1 1 367.449 3.560 50 5 FHBAMO CCc1cc(NC[C@@H]2CCC[N@H+](CC)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000060333552 212020268 /nfs/dbraw/zinc/02/02/68/212020268.db2.gz XQPKNPAINHDUMJ-HNNXBMFYSA-N 1 1 369.469 3.758 50 5 FHBAMO Cc1ccc2c(c1)[C@H]1C[N@@H+](C)CC[C@H]1N2C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000252444225 526213089 /nfs/dbraw/zinc/21/30/89/526213089.db2.gz VYYBAEJENLPVFA-IEBWSBKVSA-N 1 1 366.421 3.743 50 5 FHBAMO CC(C)c1[nH+]ccn1Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])o2)c1 ZINC000058224184 571349633 /nfs/dbraw/zinc/34/96/33/571349633.db2.gz JIGFSSXYPCZMHE-UHFFFAOYSA-N 1 1 354.366 3.808 50 5 FHBAMO O=C(NC[C@H](c1ccccc1Cl)[NH+]1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000015787755 220165202 /nfs/dbraw/zinc/16/52/02/220165202.db2.gz NHUNBDLBLYMAHA-GOSISDBHSA-N 1 1 373.840 3.815 50 5 FHBAMO C[C@@H]1CCCC[N@H+]1CCCNC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000040098659 211722783 /nfs/dbraw/zinc/72/27/83/211722783.db2.gz IJRZALBOJWGIOL-GFCCVEGCSA-N 1 1 354.838 3.634 50 5 FHBAMO Cc1ccc2c(c1)[C@@H]1C[N@@H+](C)CC[C@H]1N2C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000014094557 211073294 /nfs/dbraw/zinc/07/32/94/211073294.db2.gz VYYBAEJENLPVFA-PKOBYXMFSA-N 1 1 366.421 3.743 50 5 FHBAMO C[C@@H]1C[C@H](C)C[N@@H+](Cc2csc(NC(=O)c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000012905093 211004935 /nfs/dbraw/zinc/00/49/35/211004935.db2.gz GVKCMNNNFBKQRP-BETUJISGSA-N 1 1 374.466 3.782 50 5 FHBAMO C[C@@H]1C[C@H](C)C[N@H+](Cc2csc(NC(=O)c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000012905093 211004942 /nfs/dbraw/zinc/00/49/42/211004942.db2.gz GVKCMNNNFBKQRP-BETUJISGSA-N 1 1 374.466 3.782 50 5 FHBAMO COc1ccc(CC[N@@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])cc1OC ZINC000001226408 210337363 /nfs/dbraw/zinc/33/73/63/210337363.db2.gz NGGVSRYVZQZRCT-SOFGYWHQSA-N 1 1 356.422 3.800 50 5 FHBAMO COc1ccc(NC(=O)[C@H]2CCC[N@@H+]2Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000048364409 221011627 /nfs/dbraw/zinc/01/16/27/221011627.db2.gz ZMIFHMJIKKYLOZ-LJQANCHMSA-N 1 1 369.421 3.515 50 5 FHBAMO COc1ccc(NC(=O)[C@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000048364409 221011629 /nfs/dbraw/zinc/01/16/29/221011629.db2.gz ZMIFHMJIKKYLOZ-LJQANCHMSA-N 1 1 369.421 3.515 50 5 FHBAMO CCCN1CCC([NH2+][C@@H]2CCCc3c4cc([N+](=O)[O-])ccc4[nH]c32)CC1 ZINC000005032132 570576654 /nfs/dbraw/zinc/57/66/54/570576654.db2.gz FTQNXGWSSXOUKZ-LJQANCHMSA-N 1 1 356.470 3.918 50 5 FHBAMO CCC[NH+]1CCC(N[C@@H]2CCCc3c4cc([N+](=O)[O-])ccc4[nH]c32)CC1 ZINC000005032132 570576656 /nfs/dbraw/zinc/57/66/56/570576656.db2.gz FTQNXGWSSXOUKZ-LJQANCHMSA-N 1 1 356.470 3.918 50 5 FHBAMO CC[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)c1cccc(OC)c1 ZINC000045806116 570912110 /nfs/dbraw/zinc/91/21/10/570912110.db2.gz AQJRQFRQSYRDQP-AWEZNQCLSA-N 1 1 357.410 3.625 50 5 FHBAMO CC[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)c1cccc(OC)c1 ZINC000045806116 570912114 /nfs/dbraw/zinc/91/21/14/570912114.db2.gz AQJRQFRQSYRDQP-AWEZNQCLSA-N 1 1 357.410 3.625 50 5 FHBAMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H]1c1ccc(OC)c(OC)c1 ZINC000040067035 571070947 /nfs/dbraw/zinc/07/09/47/571070947.db2.gz QXLWLGCSVHYYFE-QGZVFWFLSA-N 1 1 372.421 3.958 50 5 FHBAMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1c1ccc(OC)c(OC)c1 ZINC000040067035 571070948 /nfs/dbraw/zinc/07/09/48/571070948.db2.gz QXLWLGCSVHYYFE-QGZVFWFLSA-N 1 1 372.421 3.958 50 5 FHBAMO CC(C)[N@H+]1CCc2c(sc3c2C(=O)N[C@@H](c2cccc([N+](=O)[O-])c2)N3)C1 ZINC000006616580 571237172 /nfs/dbraw/zinc/23/71/72/571237172.db2.gz QKBLQTGQUQSFQN-MRXNPFEDSA-N 1 1 372.450 3.852 50 5 FHBAMO CSc1ccc(C[N@H+](C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000003347613 571348047 /nfs/dbraw/zinc/34/80/47/571348047.db2.gz CKHVBIFTZAJXEL-CYBMUJFWSA-N 1 1 359.451 3.776 50 5 FHBAMO CSc1ccc(C[N@@H+](C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000003347613 571348048 /nfs/dbraw/zinc/34/80/48/571348048.db2.gz CKHVBIFTZAJXEL-CYBMUJFWSA-N 1 1 359.451 3.776 50 5 FHBAMO COc1ccc(NC(=O)C[N@@H+](C)[C@@H]2CCCc3ccccc32)c([N+](=O)[O-])c1 ZINC000008126846 571359230 /nfs/dbraw/zinc/35/92/30/571359230.db2.gz WGFVAOMOJZYMPY-GOSISDBHSA-N 1 1 369.421 3.551 50 5 FHBAMO COc1cc2c(cc1OC)C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])CC2 ZINC000001226207 219391390 /nfs/dbraw/zinc/39/13/90/219391390.db2.gz CCWIMBIGBIRCFQ-FNORWQNLSA-N 1 1 354.406 3.684 50 5 FHBAMO COc1cc2c(cc1OC)C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])CC2 ZINC000001226207 219391393 /nfs/dbraw/zinc/39/13/93/219391393.db2.gz CCWIMBIGBIRCFQ-FNORWQNLSA-N 1 1 354.406 3.684 50 5 FHBAMO O=[N+]([O-])c1ccc(C[NH+]2CCN(c3cccc(C(F)(F)F)c3)CC2)cc1 ZINC000055543200 136127066 /nfs/dbraw/zinc/12/70/66/136127066.db2.gz VPUAKYMPELBFHE-UHFFFAOYSA-N 1 1 365.355 3.936 50 5 FHBAMO C[N@H+]1CCC[C@@H]1Cc1c[nH]c2ccc(Nc3ncccc3[N+](=O)[O-])cc12 ZINC000003793347 219525386 /nfs/dbraw/zinc/52/53/86/219525386.db2.gz YPFIYPNOWVPAPR-OAHLLOKOSA-N 1 1 351.410 3.851 50 5 in-vitro FHBAMO CC(C)[N@H+]1CCc2c(sc3c2C(=O)N[C@@H](c2ccc([N+](=O)[O-])cc2)N3)C1 ZINC000004553984 570833775 /nfs/dbraw/zinc/83/37/75/570833775.db2.gz VZIVTXWHRMLXJB-MRXNPFEDSA-N 1 1 372.450 3.852 50 5 FHBAMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1N(C)Cc1ccc([N+](=O)[O-])cc1 ZINC000072308337 571066040 /nfs/dbraw/zinc/06/60/40/571066040.db2.gz HNXXWYBHOKWZDK-UTKZUKDTSA-N 1 1 353.466 3.937 50 5 FHBAMO C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000072308337 571066045 /nfs/dbraw/zinc/06/60/45/571066045.db2.gz HNXXWYBHOKWZDK-UTKZUKDTSA-N 1 1 353.466 3.937 50 5 FHBAMO C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000072308337 571066048 /nfs/dbraw/zinc/06/60/48/571066048.db2.gz HNXXWYBHOKWZDK-UTKZUKDTSA-N 1 1 353.466 3.937 50 5 FHBAMO O=[N+]([O-])c1ccccc1CN1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC000004744589 571230258 /nfs/dbraw/zinc/23/02/58/571230258.db2.gz CEASBSABHOIRQB-UHFFFAOYSA-N 1 1 351.450 3.618 50 5 FHBAMO C[C@@H]1C[C@@H](C)C[NH+](Cc2csc(NC(=O)c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000012905083 220041242 /nfs/dbraw/zinc/04/12/42/220041242.db2.gz GVKCMNNNFBKQRP-CHWSQXEVSA-N 1 1 374.466 3.782 50 5 FHBAMO COc1cccc(C[NH2+]Cc2ccc([N+](=O)[O-])c(OC)c2OC(F)F)c1 ZINC000048355327 221009797 /nfs/dbraw/zinc/00/97/97/221009797.db2.gz IPDDILDORDFMIU-UHFFFAOYSA-N 1 1 368.336 3.503 50 5 FHBAMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000058343820 221114791 /nfs/dbraw/zinc/11/47/91/221114791.db2.gz DVCHAWWMSQWLCS-IRXDYDNUSA-N 1 1 367.232 3.992 50 5 FHBAMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000058343820 221114794 /nfs/dbraw/zinc/11/47/94/221114794.db2.gz DVCHAWWMSQWLCS-IRXDYDNUSA-N 1 1 367.232 3.992 50 5 FHBAMO O=[N+]([O-])c1ccccc1C[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1 ZINC000055543853 136126948 /nfs/dbraw/zinc/12/69/48/136126948.db2.gz PSNARNPRDKPSJX-UHFFFAOYSA-N 1 1 365.355 3.936 50 5 FHBAMO CC[NH+]1CCN(c2ccc([N+](=O)[O-])cc2C(=O)c2ccc(Cl)cc2)CC1 ZINC000004499257 570799446 /nfs/dbraw/zinc/79/94/46/570799446.db2.gz WTPMCLVFWZNZLZ-UHFFFAOYSA-N 1 1 373.840 3.621 50 5 FHBAMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H]1c1ccc(OC)c(OC)c1 ZINC000040067038 571070893 /nfs/dbraw/zinc/07/08/93/571070893.db2.gz QXLWLGCSVHYYFE-KRWDZBQOSA-N 1 1 372.421 3.958 50 5 FHBAMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1c1ccc(OC)c(OC)c1 ZINC000040067038 571070896 /nfs/dbraw/zinc/07/08/96/571070896.db2.gz QXLWLGCSVHYYFE-KRWDZBQOSA-N 1 1 372.421 3.958 50 5 FHBAMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)c1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000075105834 571154993 /nfs/dbraw/zinc/15/49/93/571154993.db2.gz PRAVEMPIGJILRJ-QAPCUYQASA-N 1 1 367.449 3.602 50 5 FHBAMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1NCCc1cn2c([nH+]1)CCCC2 ZINC000012520681 220002054 /nfs/dbraw/zinc/00/20/54/220002054.db2.gz ZNINYKSCLMJOII-UHFFFAOYSA-N 1 1 354.332 3.801 50 5 FHBAMO Cc1cccc(C(=O)NC[C@H](c2ccccc2Cl)[NH+](C)C)c1[N+](=O)[O-] ZINC000012765431 220027622 /nfs/dbraw/zinc/02/76/22/220027622.db2.gz RONWZBOBJDRCGN-MRXNPFEDSA-N 1 1 361.829 3.589 50 5 FHBAMO CN(C(=O)C[N@H+](C)Cc1ccc2ccccc2c1)c1ccc([N+](=O)[O-])cc1 ZINC000012889125 220038456 /nfs/dbraw/zinc/03/84/56/220038456.db2.gz JUNXIFXWOGKTEF-UHFFFAOYSA-N 1 1 363.417 3.843 50 5 FHBAMO CN(C(=O)C[N@@H+](C)Cc1ccc2ccccc2c1)c1ccc([N+](=O)[O-])cc1 ZINC000012889125 220038458 /nfs/dbraw/zinc/03/84/58/220038458.db2.gz JUNXIFXWOGKTEF-UHFFFAOYSA-N 1 1 363.417 3.843 50 5 FHBAMO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)c1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000107072096 222390958 /nfs/dbraw/zinc/39/09/58/222390958.db2.gz PRAVEMPIGJILRJ-CRAIPNDOSA-N 1 1 367.449 3.602 50 5 FHBAMO COc1ccccc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1CCCO1 ZINC000040105836 571077400 /nfs/dbraw/zinc/07/74/00/571077400.db2.gz KGUGUOFMJOKHTE-IBGZPJMESA-N 1 1 356.422 3.785 50 5 FHBAMO COc1ccccc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1CCCO1 ZINC000040105836 571077402 /nfs/dbraw/zinc/07/74/02/571077402.db2.gz KGUGUOFMJOKHTE-IBGZPJMESA-N 1 1 356.422 3.785 50 5 FHBAMO CC(=O)N(c1ccc(F)cc1)C1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000037559901 571287936 /nfs/dbraw/zinc/28/79/36/571287936.db2.gz QCXCHCKAVMTSRZ-UHFFFAOYSA-N 1 1 371.412 3.751 50 5 FHBAMO Cc1cccc([C@@H]2CCC[N@@H+]2CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000048362154 221010506 /nfs/dbraw/zinc/01/05/06/221010506.db2.gz NAFWMYVXYNWRNX-IBGZPJMESA-N 1 1 353.422 3.703 50 5 FHBAMO CC[N@H+]1CCC[C@H](Nc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C1 ZINC000040157795 571088052 /nfs/dbraw/zinc/08/80/52/571088052.db2.gz HHANRPGNKNSKBD-KRWDZBQOSA-N 1 1 353.422 3.722 50 5 FHBAMO Cc1ccsc1C[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000007980798 571111984 /nfs/dbraw/zinc/11/19/84/571111984.db2.gz WXRPZRRCMKHQOS-UHFFFAOYSA-N 1 1 353.831 3.689 50 5 FHBAMO Cc1ccsc1C[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000007980798 571111986 /nfs/dbraw/zinc/11/19/86/571111986.db2.gz WXRPZRRCMKHQOS-UHFFFAOYSA-N 1 1 353.831 3.689 50 5 FHBAMO C[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCc2ccccc21 ZINC000029483528 571342520 /nfs/dbraw/zinc/34/25/20/571342520.db2.gz FDXUUHOVEBXYSL-KRWDZBQOSA-N 1 1 359.813 3.806 50 5 FHBAMO C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCc2ccccc21 ZINC000029483528 571342521 /nfs/dbraw/zinc/34/25/21/571342521.db2.gz FDXUUHOVEBXYSL-KRWDZBQOSA-N 1 1 359.813 3.806 50 5 FHBAMO C[N@H+](CCOc1ccc(Cl)cc1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000022341085 220384359 /nfs/dbraw/zinc/38/43/59/220384359.db2.gz ZGMQRGSHTOWHST-UHFFFAOYSA-N 1 1 360.801 3.566 50 5 FHBAMO C[N@@H+](CCOc1ccc(Cl)cc1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000022341085 220384362 /nfs/dbraw/zinc/38/43/62/220384362.db2.gz ZGMQRGSHTOWHST-UHFFFAOYSA-N 1 1 360.801 3.566 50 5 FHBAMO O=[N+]([O-])c1ccc(NCc2ccccc2C[NH+]2CCOCC2)c(Cl)c1 ZINC000038444118 536301293 /nfs/dbraw/zinc/30/12/93/536301293.db2.gz TUIKVHIGRHUXGV-UHFFFAOYSA-N 1 1 361.829 3.693 50 5 FHBAMO Cc1cc(N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)ccc1[NH+]1CCCC1 ZINC000032853729 570821781 /nfs/dbraw/zinc/82/17/81/570821781.db2.gz LBIZIWAYYUTQMG-HNNXBMFYSA-N 1 1 368.437 3.943 50 5 FHBAMO Cc1ccc([N+](=O)[O-])c(NC(=O)C[N@@H+]2CCC[C@H]2c2ccccc2)c1C ZINC000010340391 571125317 /nfs/dbraw/zinc/12/53/17/571125317.db2.gz FWSNNQMMDMOJMZ-KRWDZBQOSA-N 1 1 353.422 3.987 50 5 FHBAMO Cc1ccc([N+](=O)[O-])c(NC(=O)C[N@H+]2CCC[C@H]2c2ccccc2)c1C ZINC000010340391 571125318 /nfs/dbraw/zinc/12/53/18/571125318.db2.gz FWSNNQMMDMOJMZ-KRWDZBQOSA-N 1 1 353.422 3.987 50 5 FHBAMO CC(C)(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H](O)COc1ccccc1 ZINC000000753782 219318412 /nfs/dbraw/zinc/31/84/12/219318412.db2.gz FMEUATDWKJMGPJ-GOSISDBHSA-N 1 1 358.438 3.635 50 5 FHBAMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1N(C)Cc1ccc([N+](=O)[O-])cc1 ZINC000252669443 525008356 /nfs/dbraw/zinc/00/83/56/525008356.db2.gz HNXXWYBHOKWZDK-DYESRHJHSA-N 1 1 353.466 3.937 50 5 FHBAMO C[C@@H]1CN(Cc2ccccc2)CC[C@H]1[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000252669443 525008368 /nfs/dbraw/zinc/00/83/68/525008368.db2.gz HNXXWYBHOKWZDK-DYESRHJHSA-N 1 1 353.466 3.937 50 5 FHBAMO C[C@@H]1CN(Cc2ccccc2)CC[C@H]1[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000252669443 525008377 /nfs/dbraw/zinc/00/83/77/525008377.db2.gz HNXXWYBHOKWZDK-DYESRHJHSA-N 1 1 353.466 3.937 50 5 FHBAMO CC(C)[N@H+]1CCc2c(sc3c2C(=O)N[C@H](c2ccc([N+](=O)[O-])cc2)N3)C1 ZINC000004553982 570833504 /nfs/dbraw/zinc/83/35/04/570833504.db2.gz VZIVTXWHRMLXJB-INIZCTEOSA-N 1 1 372.450 3.852 50 5 FHBAMO COC(=O)c1cccc([N+](=O)[O-])c1C[NH+]1CCC(Cc2ccccc2)CC1 ZINC000001402321 571061731 /nfs/dbraw/zinc/06/17/31/571061731.db2.gz PSCZOVXXFWQCJC-UHFFFAOYSA-N 1 1 368.433 3.836 50 5 FHBAMO C[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@H]1CCc2ccccc21 ZINC000040153876 571086797 /nfs/dbraw/zinc/08/67/97/571086797.db2.gz HQPJFADXRVUIKV-KRWDZBQOSA-N 1 1 350.378 3.764 50 5 FHBAMO C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@H]1CCc2ccccc21 ZINC000040153876 571086798 /nfs/dbraw/zinc/08/67/98/571086798.db2.gz HQPJFADXRVUIKV-KRWDZBQOSA-N 1 1 350.378 3.764 50 5 FHBAMO Cc1ccc2c(c1)[C@@H]1C[N@@H+](C)CC[C@@H]1N2C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000014094558 220106625 /nfs/dbraw/zinc/10/66/25/220106625.db2.gz VYYBAEJENLPVFA-HKUYNNGSSA-N 1 1 366.421 3.743 50 5 FHBAMO CCc1cc(NC[C@H]2CCC[N@H+](CC)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000060333553 221129409 /nfs/dbraw/zinc/12/94/09/221129409.db2.gz XQPKNPAINHDUMJ-OAHLLOKOSA-N 1 1 369.469 3.758 50 5 FHBAMO O=[N+]([O-])c1ccc(N2CCC[N@@H+](CC3CCCCC3)CC2)c([N+](=O)[O-])c1 ZINC000071816926 221379216 /nfs/dbraw/zinc/37/92/16/221379216.db2.gz MDMFNFYRMCPRIU-UHFFFAOYSA-N 1 1 362.430 3.595 50 5 FHBAMO COc1cc(C[N@H+]2CC=C(c3ccc(F)cc3)CC2)cc([N+](=O)[O-])c1[O-] ZINC000004986759 570571314 /nfs/dbraw/zinc/57/13/14/570571314.db2.gz NNXLXPRDPFNKSS-UHFFFAOYSA-N 1 1 358.369 3.737 50 5 FHBAMO COc1cc(C[N@@H+]2CC=C(c3ccc(F)cc3)CC2)cc([N+](=O)[O-])c1[O-] ZINC000004986759 570571316 /nfs/dbraw/zinc/57/13/16/570571316.db2.gz NNXLXPRDPFNKSS-UHFFFAOYSA-N 1 1 358.369 3.737 50 5 FHBAMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3cc(F)cc4cccnc43)CC2)cc1 ZINC000032825168 570816631 /nfs/dbraw/zinc/81/66/31/570816631.db2.gz PYXVEBCPBZKEQF-UHFFFAOYSA-N 1 1 366.396 3.604 50 5 FHBAMO