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+](Cc1cnnn1[C@@H]1CCC[NH2+]C1)Cc1ccc([N+](=O)[O-])cc1 ZINC000903886253 1016287621 /nfs/dbraw/zinc/28/76/21/1016287621.db2.gz ODFMGNCUTAKSLW-QGZVFWFLSA-N 2 2 358.446 2.521 20 5 FFBDLP CC(C)[N@@H+](Cc1cnnn1[C@@H]1CCC[NH2+]C1)Cc1ccc([N+](=O)[O-])cc1 ZINC000903886253 1016287628 /nfs/dbraw/zinc/28/76/28/1016287628.db2.gz ODFMGNCUTAKSLW-QGZVFWFLSA-N 2 2 358.446 2.521 20 5 FFBDLP C[NH+](C)/C=C/c1cc(NCC[C@@H]2CC[NH2+]CC2(F)F)ncc1[N+](=O)[O-] ZINC001162812551 1028666155 /nfs/dbraw/zinc/66/61/55/1028666155.db2.gz MTYAYRFRKAQUCT-LJLILKBBSA-N 2 2 355.389 2.569 20 5 FFBDLP [NH3+][C@@H](Cc1c2ccccc2cc2ccccc21)C(=O)NCCn1cc[nH+]c1 ZINC001219563586 1033692558 /nfs/dbraw/zinc/69/25/58/1033692558.db2.gz BOGWEPVVVOWTFK-NRFANRHFSA-N 2 2 358.445 2.876 20 5 FFBDLP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](CCCC[NH3+])C(=O)OC(C)(C)C ZINC001246201227 1039276732 /nfs/dbraw/zinc/27/67/32/1039276732.db2.gz HWHISCDSLWJCBJ-YOEHRIQHSA-N 2 2 365.474 2.955 20 5 FFBDLP CC(C)[N@@H+]1CCOC[C@@]2(CCC[NH+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1 ZINC001254592717 1040822485 /nfs/dbraw/zinc/82/24/85/1040822485.db2.gz GAANOPWFXBAFGJ-RTWAWAEBSA-N 2 2 373.497 2.885 20 5 FFBDLP CC(C)[N@H+]1CCOC[C@@]2(CCC[NH+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1 ZINC001254592717 1040822494 /nfs/dbraw/zinc/82/24/94/1040822494.db2.gz GAANOPWFXBAFGJ-RTWAWAEBSA-N 2 2 373.497 2.885 20 5 FFBDLP CC(C)[NH+]1CCOC[C@@]2(CCC[N@@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1 ZINC001254592717 1040822510 /nfs/dbraw/zinc/82/25/10/1040822510.db2.gz GAANOPWFXBAFGJ-RTWAWAEBSA-N 2 2 373.497 2.885 20 5 FFBDLP CC(C)[NH+]1CCOC[C@@]2(CCC[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1 ZINC001254592717 1040822521 /nfs/dbraw/zinc/82/25/21/1040822521.db2.gz GAANOPWFXBAFGJ-RTWAWAEBSA-N 2 2 373.497 2.885 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)C[C@H](N(c1cc[nH+]cc1F)C1CC[NH2+]CC1)C2 ZINC001254612167 1040841745 /nfs/dbraw/zinc/84/17/45/1040841745.db2.gz VOXYWVCSSTYBPF-QGZVFWFLSA-N 2 2 356.401 2.855 20 5 FFBDLP O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[NH+](C[C@H]2CCC[NH2+]C2)CC1 ZINC001328398765 1048286820 /nfs/dbraw/zinc/28/68/20/1048286820.db2.gz MYJFJKPWYKOHAL-ZDUSSCGKSA-N 2 2 372.391 2.735 20 5 FFBDLP CC[NH+]1CCN([C@@H]2CC[N@H+](Cc3ccc(C(C)C)c([N+](=O)[O-])c3)C2)CC1 ZINC000093133040 250017884 /nfs/dbraw/zinc/01/78/84/250017884.db2.gz PZNRGSPIXHETMF-GOSISDBHSA-N 2 2 360.502 2.930 20 5 FFBDLP CC[NH+]1CCN([C@@H]2CC[N@@H+](Cc3ccc(C(C)C)c([N+](=O)[O-])c3)C2)CC1 ZINC000093133040 250017886 /nfs/dbraw/zinc/01/78/86/250017886.db2.gz PZNRGSPIXHETMF-GOSISDBHSA-N 2 2 360.502 2.930 20 5 FFBDLP O=[N+]([O-])c1ccc2[nH]c(C[NH2+]C3CC[NH+](Cc4ccccn4)CC3)nc2c1 ZINC000278698631 256339037 /nfs/dbraw/zinc/33/90/37/256339037.db2.gz NLOWFZQJGOCHRH-UHFFFAOYSA-N 2 2 366.425 2.620 20 5 FFBDLP CC(C)[NH+]1CCC([NH+]2CCN(Cc3ccc([N+](=O)[O-])cc3F)CC2)CC1 ZINC000332400819 258228966 /nfs/dbraw/zinc/22/89/66/258228966.db2.gz VLPNDYAMRZMFNL-UHFFFAOYSA-N 2 2 364.465 2.724 20 5 FFBDLP COc1ccc(OCC[N@@H+]2CCC[C@@H](c3[nH+]ccn3C)C2)c([N+](=O)[O-])c1 ZINC000377261356 512190952 /nfs/dbraw/zinc/19/09/52/512190952.db2.gz INWAVLJILUPPLD-CQSZACIVSA-N 2 2 360.414 2.595 20 5 FFBDLP COc1ccc(OCC[N@H+]2CCC[C@@H](c3[nH+]ccn3C)C2)c([N+](=O)[O-])c1 ZINC000377261356 512190960 /nfs/dbraw/zinc/19/09/60/512190960.db2.gz INWAVLJILUPPLD-CQSZACIVSA-N 2 2 360.414 2.595 20 5 FFBDLP C[C@@H]1C[N@H+](Cc2ccccn2)CC[C@@H]1[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000089580801 507847241 /nfs/dbraw/zinc/84/72/41/507847241.db2.gz HWRNOWAEFQFYFW-UZLBHIALSA-N 2 2 370.453 2.869 20 5 FFBDLP C[C@@H]1C[N@@H+](Cc2ccccn2)CC[C@@H]1[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000089580801 507847243 /nfs/dbraw/zinc/84/72/43/507847243.db2.gz HWRNOWAEFQFYFW-UZLBHIALSA-N 2 2 370.453 2.869 20 5 FFBDLP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC)[C@H](C)C1 ZINC000122414808 508531478 /nfs/dbraw/zinc/53/14/78/508531478.db2.gz QSLYPOMPHPUGCX-CRAIPNDOSA-N 2 2 365.474 2.830 20 5 FFBDLP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC)[C@H](C)C1 ZINC000122414808 508531483 /nfs/dbraw/zinc/53/14/83/508531483.db2.gz QSLYPOMPHPUGCX-CRAIPNDOSA-N 2 2 365.474 2.830 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1C(=O)NCC1([NH+]2CCCCC2)CC[NH+](C)CC1 ZINC000172752129 509213061 /nfs/dbraw/zinc/21/30/61/509213061.db2.gz UEPLVYLCSIRPOJ-UHFFFAOYSA-N 2 2 374.485 2.583 20 5 FFBDLP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)CC[C@H]21 ZINC000248163834 509251541 /nfs/dbraw/zinc/25/15/41/509251541.db2.gz SPPLINHUNNJSBU-GDBMZVCRSA-N 2 2 357.414 2.561 20 5 FFBDLP C[N@H+]1CCC[C@@H]2C[NH+](Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)CC[C@H]21 ZINC000248163834 509251548 /nfs/dbraw/zinc/25/15/48/509251548.db2.gz SPPLINHUNNJSBU-GDBMZVCRSA-N 2 2 357.414 2.561 20 5 FFBDLP C[NH+]1CCC[C@@H]2C[N@H+](Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)CC[C@H]21 ZINC000248163834 509251550 /nfs/dbraw/zinc/25/15/50/509251550.db2.gz SPPLINHUNNJSBU-GDBMZVCRSA-N 2 2 357.414 2.561 20 5 FFBDLP C[NH+]1CCC[C@@H]2C[N@@H+](Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)CC[C@H]21 ZINC000248163834 509251557 /nfs/dbraw/zinc/25/15/57/509251557.db2.gz SPPLINHUNNJSBU-GDBMZVCRSA-N 2 2 357.414 2.561 20 5 FFBDLP CC(C)[NH2+]C1CC[NH+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC1 ZINC000189179728 509451832 /nfs/dbraw/zinc/45/18/32/509451832.db2.gz OROWIEZKZUFQNF-UHFFFAOYSA-N 2 2 352.410 2.525 20 5 FFBDLP COc1cc(C[NH2+]CCn2cc[nH+]c2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000237208675 509594316 /nfs/dbraw/zinc/59/43/16/509594316.db2.gz GKXDQSOCKOEUFI-UHFFFAOYSA-N 2 2 374.319 2.531 20 5 FFBDLP CC[N@H+](C)C[C@H]1CC[NH+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000245445772 509939139 /nfs/dbraw/zinc/93/91/39/509939139.db2.gz KQDCVRBBWVQABV-ZIAGYGMSSA-N 2 2 359.430 2.979 20 5 FFBDLP CC[N@@H+](C)C[C@H]1CC[NH+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000245445772 509939146 /nfs/dbraw/zinc/93/91/46/509939146.db2.gz KQDCVRBBWVQABV-ZIAGYGMSSA-N 2 2 359.430 2.979 20 5 FFBDLP CC[NH+](C)C[C@H]1CC[N@@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000245445772 509939156 /nfs/dbraw/zinc/93/91/56/509939156.db2.gz KQDCVRBBWVQABV-ZIAGYGMSSA-N 2 2 359.430 2.979 20 5 FFBDLP CC[NH+](C)C[C@H]1CC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000245445772 509939164 /nfs/dbraw/zinc/93/91/64/509939164.db2.gz KQDCVRBBWVQABV-ZIAGYGMSSA-N 2 2 359.430 2.979 20 5 FFBDLP COc1cc(C[N@@H+]2CCC[C@H](Cc3[nH+]ccn3C)C2)c([N+](=O)[O-])cc1OC ZINC000184731738 510489001 /nfs/dbraw/zinc/48/90/01/510489001.db2.gz CMSASHSHISKQKJ-CQSZACIVSA-N 2 2 374.441 2.800 20 5 FFBDLP COc1cc(C[N@H+]2CCC[C@H](Cc3[nH+]ccn3C)C2)c([N+](=O)[O-])cc1OC ZINC000184731738 510489007 /nfs/dbraw/zinc/48/90/07/510489007.db2.gz CMSASHSHISKQKJ-CQSZACIVSA-N 2 2 374.441 2.800 20 5 FFBDLP C[N@@H+]1CCC[C@@]2(CC[NH+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)C2)C1 ZINC000292883168 511757467 /nfs/dbraw/zinc/75/74/67/511757467.db2.gz FEGAFLSFWOHIEW-GOSISDBHSA-N 2 2 357.414 2.563 20 5 FFBDLP C[N@H+]1CCC[C@@]2(CC[NH+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)C2)C1 ZINC000292883168 511757473 /nfs/dbraw/zinc/75/74/73/511757473.db2.gz FEGAFLSFWOHIEW-GOSISDBHSA-N 2 2 357.414 2.563 20 5 FFBDLP C[NH+]1CCC[C@@]2(CC[N@H+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)C2)C1 ZINC000292883168 511757478 /nfs/dbraw/zinc/75/74/78/511757478.db2.gz FEGAFLSFWOHIEW-GOSISDBHSA-N 2 2 357.414 2.563 20 5 FFBDLP C[NH+]1CCC[C@@]2(CC[N@@H+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)C2)C1 ZINC000292883168 511757484 /nfs/dbraw/zinc/75/74/84/511757484.db2.gz FEGAFLSFWOHIEW-GOSISDBHSA-N 2 2 357.414 2.563 20 5 FFBDLP C[NH+]1CCC([N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])c(OC(F)F)c3)C2)CC1 ZINC000367518178 512539125 /nfs/dbraw/zinc/53/91/25/512539125.db2.gz MIPNRYWVKZOYNF-ZDUSSCGKSA-N 2 2 370.400 2.777 20 5 FFBDLP C[NH+]1CCC([N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])c(OC(F)F)c3)C2)CC1 ZINC000367518178 512539127 /nfs/dbraw/zinc/53/91/27/512539127.db2.gz MIPNRYWVKZOYNF-ZDUSSCGKSA-N 2 2 370.400 2.777 20 5 FFBDLP C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@@H]1CCCC[N@@H+]1C1CC1 ZINC000446976932 513372797 /nfs/dbraw/zinc/37/27/97/513372797.db2.gz ZEDUSGDRFVWYLG-KDOFPFPSSA-N 2 2 360.458 2.918 20 5 FFBDLP C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@@H]1CCCC[N@H+]1C1CC1 ZINC000446976932 513372803 /nfs/dbraw/zinc/37/28/03/513372803.db2.gz ZEDUSGDRFVWYLG-KDOFPFPSSA-N 2 2 360.458 2.918 20 5 FFBDLP CN(C(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)C(C)(C)C[NH+]1CCCC1 ZINC000416096594 513570573 /nfs/dbraw/zinc/57/05/73/513570573.db2.gz PJCCZPOVYJFCDP-UHFFFAOYSA-N 2 2 371.441 2.727 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CCOCC2)cc1NC[C@@H]1CCCC[N@@H+]1C1CC1 ZINC000447813616 513578463 /nfs/dbraw/zinc/57/84/63/513578463.db2.gz SRJBCVFRMJYBIU-SFHVURJKSA-N 2 2 374.485 2.856 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CCOCC2)cc1NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC000447813616 513578469 /nfs/dbraw/zinc/57/84/69/513578469.db2.gz SRJBCVFRMJYBIU-SFHVURJKSA-N 2 2 374.485 2.856 20 5 FFBDLP C[NH+](C)[C@@H]1CCC[C@@H](Nc2cc(C[NH+]3CCOCC3)ccc2[N+](=O)[O-])C1 ZINC000447817335 513581999 /nfs/dbraw/zinc/58/19/99/513581999.db2.gz NNCPNWMIHCKYEQ-IAGOWNOFSA-N 2 2 362.474 2.712 20 5 FFBDLP Cn1cc[nH+]c1CN(Cc1c(F)cccc1[N+](=O)[O-])[C@H]1CC12CC[NH2+]CC2 ZINC000435697222 513660435 /nfs/dbraw/zinc/66/04/35/513660435.db2.gz XNRFJXONEHOLTP-KRWDZBQOSA-N 2 2 373.432 2.612 20 5 FFBDLP COc1ccc([C@H]2CC[NH2+]C[C@H]2[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000414884968 514340803 /nfs/dbraw/zinc/34/08/03/514340803.db2.gz OTHCGPRAXODBEB-QZTJIDSGSA-N 2 2 371.437 2.847 20 5 FFBDLP COc1ccc(NC(=O)[C@H](C)[NH+]2CCC(c3[nH]cc[nH+]3)CC2)c([N+](=O)[O-])c1 ZINC000467132029 514910213 /nfs/dbraw/zinc/91/02/13/514910213.db2.gz PWPOICJJIAUYER-LBPRGKRZSA-N 2 2 373.413 2.533 20 5 FFBDLP CC[C@@H]1CCCC[N@@H+]1CCNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000499724389 515428423 /nfs/dbraw/zinc/42/84/23/515428423.db2.gz RLDXMNBQZNKADM-MRXNPFEDSA-N 2 2 371.441 2.775 20 5 FFBDLP CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000499724389 515428429 /nfs/dbraw/zinc/42/84/29/515428429.db2.gz RLDXMNBQZNKADM-MRXNPFEDSA-N 2 2 371.441 2.775 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@@H+]2Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000491890194 515480738 /nfs/dbraw/zinc/48/07/38/515480738.db2.gz KGMNWBWRNGPQBP-DQYPLSBCSA-N 2 2 353.850 2.932 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@H+]2Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000491890194 515480749 /nfs/dbraw/zinc/48/07/49/515480749.db2.gz KGMNWBWRNGPQBP-DQYPLSBCSA-N 2 2 353.850 2.932 20 5 FFBDLP C[C@H]([NH2+]C[C@@]1(O)CC[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000484135243 516302498 /nfs/dbraw/zinc/30/24/98/516302498.db2.gz QXUMMAZSEFIAAK-JXFKEZNVSA-N 2 2 355.438 2.882 20 5 FFBDLP C[C@H]([NH2+]C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000484135243 516302502 /nfs/dbraw/zinc/30/25/02/516302502.db2.gz QXUMMAZSEFIAAK-JXFKEZNVSA-N 2 2 355.438 2.882 20 5 FFBDLP CC(C)C[C@@H](CN[C@@H](c1[nH+]ccn1C)c1cccc([N+](=O)[O-])c1)[NH+](C)C ZINC000557393529 517988146 /nfs/dbraw/zinc/98/81/46/517988146.db2.gz SQFNXLGTFHMHHP-ZWKOTPCHSA-N 2 2 359.474 2.984 20 5 FFBDLP O=[N+]([O-])c1cccc2c1CC[N@H+](Cc1cccc(C[NH+]3CCOCC3)c1)C2 ZINC000566908229 518259385 /nfs/dbraw/zinc/25/93/85/518259385.db2.gz KAFYOGKGPVPRLV-UHFFFAOYSA-N 2 2 367.449 2.985 20 5 FFBDLP O=[N+]([O-])c1cccc2c1CC[N@@H+](Cc1cccc(C[NH+]3CCOCC3)c1)C2 ZINC000566908229 518259392 /nfs/dbraw/zinc/25/93/92/518259392.db2.gz KAFYOGKGPVPRLV-UHFFFAOYSA-N 2 2 367.449 2.985 20 5 FFBDLP C[N@H+](CC[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000573817590 518851271 /nfs/dbraw/zinc/85/12/71/518851271.db2.gz PVSVATVRVHJXPO-UHFFFAOYSA-N 2 2 356.426 2.645 20 5 FFBDLP C[N@@H+](CC[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000573817590 518851276 /nfs/dbraw/zinc/85/12/76/518851276.db2.gz PVSVATVRVHJXPO-UHFFFAOYSA-N 2 2 356.426 2.645 20 5 FFBDLP Cn1cc[nH+]c1[C@H](N[C@@H]1CC[NH2+]C2(CCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000591582259 519959016 /nfs/dbraw/zinc/95/90/16/519959016.db2.gz BXHWZJMIMWXRDK-NVXWUHKLSA-N 2 2 355.442 2.682 20 5 FFBDLP O=[N+]([O-])c1ccn(CC[NH+]2CCC(Cc3[nH]c4ccccc4[nH+]3)CC2)n1 ZINC000595550553 520547894 /nfs/dbraw/zinc/54/78/94/520547894.db2.gz BYRRVOPZZRPCGM-UHFFFAOYSA-N 2 2 354.414 2.622 20 5 FFBDLP C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C[C@H]1CC[N@@H+]1C1CCCC1 ZINC000599072933 521016823 /nfs/dbraw/zinc/01/68/23/521016823.db2.gz COPJPJUHKBHUCF-KBXCAEBGSA-N 2 2 360.458 2.918 20 5 FFBDLP C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C[C@H]1CC[N@H+]1C1CCCC1 ZINC000599072933 521016832 /nfs/dbraw/zinc/01/68/32/521016832.db2.gz COPJPJUHKBHUCF-KBXCAEBGSA-N 2 2 360.458 2.918 20 5 FFBDLP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC000611274781 521075273 /nfs/dbraw/zinc/07/52/73/521075273.db2.gz HXWFVFIULSOGOG-HNNXBMFYSA-N 2 2 361.442 2.530 20 5 FFBDLP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC000611274781 521075279 /nfs/dbraw/zinc/07/52/79/521075279.db2.gz HXWFVFIULSOGOG-HNNXBMFYSA-N 2 2 361.442 2.530 20 5 FFBDLP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC000611274781 521075284 /nfs/dbraw/zinc/07/52/84/521075284.db2.gz HXWFVFIULSOGOG-HNNXBMFYSA-N 2 2 361.442 2.530 20 5 FFBDLP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC000611274781 521075291 /nfs/dbraw/zinc/07/52/91/521075291.db2.gz HXWFVFIULSOGOG-HNNXBMFYSA-N 2 2 361.442 2.530 20 5 FFBDLP CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)cc1OC ZINC000611661341 521270388 /nfs/dbraw/zinc/27/03/88/521270388.db2.gz WCKKWBMOTQXFGW-BMFZPTHFSA-N 2 2 363.458 2.680 20 5 FFBDLP CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2C[C@H]3C[NH2+]C[C@H]3C2)cc1OC ZINC000611661341 521270394 /nfs/dbraw/zinc/27/03/94/521270394.db2.gz WCKKWBMOTQXFGW-BMFZPTHFSA-N 2 2 363.458 2.680 20 5 FFBDLP CN(c1ccc([N+](=O)[O-])cc1Cl)[C@H]1CC[N@@H+](C2CC[NH+](C)CC2)C1 ZINC000733894196 734856811 /nfs/dbraw/zinc/85/68/11/734856811.db2.gz ZDJSKSQSCYCQRZ-HNNXBMFYSA-N 2 2 352.866 2.853 20 5 FFBDLP CN(c1ccc([N+](=O)[O-])cc1Cl)[C@H]1CC[N@H+](C2CC[NH+](C)CC2)C1 ZINC000733894196 734856813 /nfs/dbraw/zinc/85/68/13/734856813.db2.gz ZDJSKSQSCYCQRZ-HNNXBMFYSA-N 2 2 352.866 2.853 20 5 FFBDLP C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H]1CC2(CO1)CC[NH2+]CC2 ZINC000903719105 736159644 /nfs/dbraw/zinc/15/96/44/736159644.db2.gz VYFKJEWGPNMGBC-HNNXBMFYSA-N 2 2 353.850 2.839 20 5 FFBDLP C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H]1CC2(CO1)CC[NH2+]CC2 ZINC000903719105 736159648 /nfs/dbraw/zinc/15/96/48/736159648.db2.gz VYFKJEWGPNMGBC-HNNXBMFYSA-N 2 2 353.850 2.839 20 5 FFBDLP CN(Cc1cc(Cl)ccc1[N+](=O)[O-])[C@H]1CC[N@@H+](C2CC[NH+](C)CC2)C1 ZINC000774739900 738020497 /nfs/dbraw/zinc/02/04/97/738020497.db2.gz QHKPJAUJXFQWBB-KRWDZBQOSA-N 2 2 366.893 2.849 20 5 FFBDLP CN(Cc1cc(Cl)ccc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CC[NH+](C)CC2)C1 ZINC000774739900 738020500 /nfs/dbraw/zinc/02/05/00/738020500.db2.gz QHKPJAUJXFQWBB-KRWDZBQOSA-N 2 2 366.893 2.849 20 5 FFBDLP Cc1[nH+]ccn1-c1cc[nH+]cc1NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC001116065595 1032101958 /nfs/dbraw/zinc/10/19/58/1032101958.db2.gz AMJCRTVRUBOPQU-UHFFFAOYSA-N 2 2 366.381 2.925 20 5 FFBDLP CNc1ccc(C(=O)Nc2c[nH+]ccc2-n2cc[nH+]c2C)cc1[N+](=O)[O-] ZINC001116071136 1032108180 /nfs/dbraw/zinc/10/81/80/1032108180.db2.gz RDUFXDOUXFQVRN-UHFFFAOYSA-N 2 2 352.354 2.778 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@H]2CC[N@H+](CC3CC3)C2)c1F ZINC001173177805 1012319281 /nfs/dbraw/zinc/31/92/81/1012319281.db2.gz DQPGCPGBGLDPJG-OCCSQVGLSA-N 2 2 351.422 2.747 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@H]2CC[N@@H+](CC3CC3)C2)c1F ZINC001173177805 1012319302 /nfs/dbraw/zinc/31/93/02/1012319302.db2.gz DQPGCPGBGLDPJG-OCCSQVGLSA-N 2 2 351.422 2.747 20 5 FFBDLP C[C@H]1CC[N@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H]1n1cc[nH+]c1 ZINC000246635784 1026304055 /nfs/dbraw/zinc/30/40/55/1026304055.db2.gz OOZXQPLWAAWOJO-WMLDXEAASA-N 2 2 367.413 2.590 20 5 FFBDLP C[C@H]1CC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H]1n1cc[nH+]c1 ZINC000246635784 1026304068 /nfs/dbraw/zinc/30/40/68/1026304068.db2.gz OOZXQPLWAAWOJO-WMLDXEAASA-N 2 2 367.413 2.590 20 5 FFBDLP CN(Cc1c2ccccc2cc2ccccc21)C(=O)[C@@]12C[NH2+]C[C@@H]1CC[NH2+]2 ZINC001160740203 1027847353 /nfs/dbraw/zinc/84/73/53/1027847353.db2.gz YWODZRBRPBCFET-FDDCHVKYSA-N 2 2 359.473 2.903 20 5 FFBDLP O=C(O[C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000835396340 1035744757 /nfs/dbraw/zinc/74/47/57/1035744757.db2.gz MFGJSKNLEAEVKH-CABCVRRESA-N 2 2 356.382 2.564 20 5 FFBDLP O=C(O[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000835396340 1035744773 /nfs/dbraw/zinc/74/47/73/1035744773.db2.gz MFGJSKNLEAEVKH-CABCVRRESA-N 2 2 356.382 2.564 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CC[C@@]3(C2)CCC[NH2+]C3)c1F ZINC001246600011 1039411025 /nfs/dbraw/zinc/41/10/25/1039411025.db2.gz CNTAXULRMWHZGN-UGSOOPFHSA-N 2 2 351.422 2.749 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CC[C@@]3(C2)CCC[NH2+]C3)c1F ZINC001246600011 1039411032 /nfs/dbraw/zinc/41/10/32/1039411032.db2.gz CNTAXULRMWHZGN-UGSOOPFHSA-N 2 2 351.422 2.749 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CC[C@H]3[NH2+]CCC[C@H]3C2)c1F ZINC001247006829 1039575743 /nfs/dbraw/zinc/57/57/43/1039575743.db2.gz AZBBGNLDDHBLJE-KCQAQPDRSA-N 2 2 351.422 2.747 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CC[C@H]3[NH2+]CCC[C@H]3C2)c1F ZINC001247006829 1039575756 /nfs/dbraw/zinc/57/57/56/1039575756.db2.gz AZBBGNLDDHBLJE-KCQAQPDRSA-N 2 2 351.422 2.747 20 5 FFBDLP [NH3+]C[C@@H]1Cc2ccccc2C[N@@H+]1C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001254472509 1040739626 /nfs/dbraw/zinc/73/96/26/1040739626.db2.gz ARYLZTSZDXIZNS-NRFANRHFSA-N 2 2 366.465 2.949 20 5 FFBDLP [NH3+]C[C@@H]1Cc2ccccc2C[N@H+]1C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001254472509 1040739639 /nfs/dbraw/zinc/73/96/39/1040739639.db2.gz ARYLZTSZDXIZNS-NRFANRHFSA-N 2 2 366.465 2.949 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH+]1C[C@H]2C[NH+](Cc3ccccn3)C[C@@H]2C1 ZINC001254560955 1040797581 /nfs/dbraw/zinc/79/75/81/1040797581.db2.gz IOPSDROTWBMVTC-BHIYHBOVSA-N 2 2 366.465 2.985 20 5 FFBDLP COc1cc(N([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C2CC[NH2+]CC2)cc[nH+]1 ZINC001254610658 1040838842 /nfs/dbraw/zinc/83/88/42/1040838842.db2.gz MJEOQRIEAPEVSD-LJQANCHMSA-N 2 2 368.437 2.724 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CCC(O)(C[NH+]3CCCCC3)CC2)cc1F ZINC001560217131 1076248336 /nfs/dbraw/zinc/24/83/36/1076248336.db2.gz GFLNKWISQWDRKR-UHFFFAOYSA-N 2 2 351.422 2.547 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)cccc1[N+](=O)[O-] ZINC000267398028 251346108 /nfs/dbraw/zinc/34/61/08/251346108.db2.gz FHHSJYSHPAQTLG-KBPBESRZSA-N 2 2 357.414 2.833 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)cccc1[N+](=O)[O-] ZINC000267398028 251346111 /nfs/dbraw/zinc/34/61/11/251346111.db2.gz FHHSJYSHPAQTLG-KBPBESRZSA-N 2 2 357.414 2.833 20 5 FFBDLP Cc1ccc(C[NH+]2CCN(CC[NH+]3[C@@H](C)CC[C@@H]3C)CC2)cc1[N+](=O)[O-] ZINC000092665002 508091901 /nfs/dbraw/zinc/09/19/01/508091901.db2.gz UHXZMDPRMYOJGV-ROUUACIJSA-N 2 2 360.502 2.894 20 5 FFBDLP C[C@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000158515803 508715902 /nfs/dbraw/zinc/71/59/02/508715902.db2.gz YEPGEUYQRXCUSN-HNNXBMFYSA-N 2 2 355.442 2.592 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)cccc1[N+](=O)[O-] ZINC000139914363 508797177 /nfs/dbraw/zinc/79/71/77/508797177.db2.gz FFFILKRZSWGHFJ-HDMKZQKVSA-N 2 2 360.458 2.646 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)cccc1[N+](=O)[O-] ZINC000139914363 508797180 /nfs/dbraw/zinc/79/71/80/508797180.db2.gz FFFILKRZSWGHFJ-HDMKZQKVSA-N 2 2 360.458 2.646 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)cccc1[N+](=O)[O-] ZINC000139914363 508797184 /nfs/dbraw/zinc/79/71/84/508797184.db2.gz FFFILKRZSWGHFJ-HDMKZQKVSA-N 2 2 360.458 2.646 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)cccc1[N+](=O)[O-] ZINC000139914363 508797186 /nfs/dbraw/zinc/79/71/86/508797186.db2.gz FFFILKRZSWGHFJ-HDMKZQKVSA-N 2 2 360.458 2.646 20 5 FFBDLP C[C@@H]1C[C@@H]([NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[N@@H+]1C1CC1 ZINC000151102524 508956735 /nfs/dbraw/zinc/95/67/35/508956735.db2.gz XPMHSOLAZYVRFZ-CZUORRHYSA-N 2 2 355.442 2.710 20 5 FFBDLP C[C@@H]1C[C@@H]([NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[N@H+]1C1CC1 ZINC000151102524 508956739 /nfs/dbraw/zinc/95/67/39/508956739.db2.gz XPMHSOLAZYVRFZ-CZUORRHYSA-N 2 2 355.442 2.710 20 5 FFBDLP COc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH+]1CCC(c2[nH]cc[nH+]2)CC1 ZINC000265481394 510079392 /nfs/dbraw/zinc/07/93/92/510079392.db2.gz KXGXLWQTEMOSAR-UHFFFAOYSA-N 2 2 373.413 2.535 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246487524 510515865 /nfs/dbraw/zinc/51/58/65/510515865.db2.gz GYGPZIODBMOILR-VCBZYWHSSA-N 2 2 372.469 2.871 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246487524 510515869 /nfs/dbraw/zinc/51/58/69/510515869.db2.gz GYGPZIODBMOILR-VCBZYWHSSA-N 2 2 372.469 2.871 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246487524 510515871 /nfs/dbraw/zinc/51/58/71/510515871.db2.gz GYGPZIODBMOILR-VCBZYWHSSA-N 2 2 372.469 2.871 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246487524 510515872 /nfs/dbraw/zinc/51/58/72/510515872.db2.gz GYGPZIODBMOILR-VCBZYWHSSA-N 2 2 372.469 2.871 20 5 FFBDLP Cc1c(C[N@@H+](C)C[C@@]2(O)CC[NH+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000188294266 510694495 /nfs/dbraw/zinc/69/44/95/510694495.db2.gz FBRXSKNKJVNYTK-NRFANRHFSA-N 2 2 369.465 2.972 20 5 FFBDLP Cc1c(C[N@H+](C)C[C@@]2(O)CC[NH+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000188294266 510694501 /nfs/dbraw/zinc/69/45/01/510694501.db2.gz FBRXSKNKJVNYTK-NRFANRHFSA-N 2 2 369.465 2.972 20 5 FFBDLP Cc1c(C[NH+](C)C[C@@]2(O)CC[N@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000188294266 510694508 /nfs/dbraw/zinc/69/45/08/510694508.db2.gz FBRXSKNKJVNYTK-NRFANRHFSA-N 2 2 369.465 2.972 20 5 FFBDLP Cc1c(C[NH+](C)C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000188294266 510694515 /nfs/dbraw/zinc/69/45/15/510694515.db2.gz FBRXSKNKJVNYTK-NRFANRHFSA-N 2 2 369.465 2.972 20 5 FFBDLP CC(C)[NH+]1CCN(C2CC[NH+](Cc3ccc([N+](=O)[O-])cc3F)CC2)CC1 ZINC000270965431 511039863 /nfs/dbraw/zinc/03/98/63/511039863.db2.gz VMMLJEFNFCVYMQ-UHFFFAOYSA-N 2 2 364.465 2.724 20 5 FFBDLP C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CC[C@H]1N1CC[NH+](C)CC1 ZINC000364725634 511044893 /nfs/dbraw/zinc/04/48/93/511044893.db2.gz ZXXYXNBCELMKJM-RDTXWAMCSA-N 2 2 366.893 2.706 20 5 FFBDLP C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CC[C@H]1N1CC[NH+](C)CC1 ZINC000364725634 511044896 /nfs/dbraw/zinc/04/48/96/511044896.db2.gz ZXXYXNBCELMKJM-RDTXWAMCSA-N 2 2 366.893 2.706 20 5 FFBDLP C[NH+](C)CC1CC[NH+](c2ccc(Nc3ncc([N+](=O)[O-])cn3)cc2)CC1 ZINC000273569925 511538416 /nfs/dbraw/zinc/53/84/16/511538416.db2.gz CZOMIYZTOSNVHA-UHFFFAOYSA-N 2 2 356.430 2.906 20 5 FFBDLP C[C@H](CCNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)[NH+]1CCCCC1 ZINC000450558238 513250310 /nfs/dbraw/zinc/25/03/10/513250310.db2.gz FHTCZDJKLSABLX-OAHLLOKOSA-N 2 2 371.441 2.775 20 5 FFBDLP [NH3+]C[C@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CCCCC1 ZINC000420354717 514106954 /nfs/dbraw/zinc/10/69/54/514106954.db2.gz BJKYCWITQCTICR-HNNXBMFYSA-N 2 2 354.838 2.684 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCC[N@H+](C)[C@H]1c1ccnn1C ZINC000449319473 514164246 /nfs/dbraw/zinc/16/42/46/514164246.db2.gz YWOFFMFZOIKXRL-OXFYSEKESA-N 2 2 371.485 2.932 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCC[N@@H+](C)[C@H]1c1ccnn1C ZINC000449319473 514164251 /nfs/dbraw/zinc/16/42/51/514164251.db2.gz YWOFFMFZOIKXRL-OXFYSEKESA-N 2 2 371.485 2.932 20 5 FFBDLP CC[NH+]1CCC([N@@H+]2CCCN(c3ccc(F)cc3[N+](=O)[O-])CC2)CC1 ZINC000420632041 514208225 /nfs/dbraw/zinc/20/82/25/514208225.db2.gz WELGOAHPLQMDFA-UHFFFAOYSA-N 2 2 350.438 2.730 20 5 FFBDLP CC[NH+]1CCC([N@H+]2CCCN(c3ccc(F)cc3[N+](=O)[O-])CC2)CC1 ZINC000420632041 514208229 /nfs/dbraw/zinc/20/82/29/514208229.db2.gz WELGOAHPLQMDFA-UHFFFAOYSA-N 2 2 350.438 2.730 20 5 FFBDLP C[NH+](C)C1CCC(Nc2cc(C[NH+]3CCOCC3)ccc2[N+](=O)[O-])CC1 ZINC000420631569 514208458 /nfs/dbraw/zinc/20/84/58/514208458.db2.gz VJVCGDXXFBQHDX-UHFFFAOYSA-N 2 2 362.474 2.712 20 5 FFBDLP Cc1ccc(Sc2ccc(C[N@H+](C)C[C@@H](O)C[NH3+])cc2[N+](=O)[O-])cc1 ZINC000415063596 514423868 /nfs/dbraw/zinc/42/38/68/514423868.db2.gz ANTCSCWKLPYNOT-HNNXBMFYSA-N 2 2 361.467 2.806 20 5 FFBDLP Cc1ccc(Sc2ccc(C[N@@H+](C)C[C@@H](O)C[NH3+])cc2[N+](=O)[O-])cc1 ZINC000415063596 514423871 /nfs/dbraw/zinc/42/38/71/514423871.db2.gz ANTCSCWKLPYNOT-HNNXBMFYSA-N 2 2 361.467 2.806 20 5 FFBDLP COc1cc(C[N@@H+]2CC[C@@H](C)[C@H](C[NH3+])C2)c([N+](=O)[O-])cc1OC(F)F ZINC000415103290 514445449 /nfs/dbraw/zinc/44/54/49/514445449.db2.gz DAZFSFZHEJADGZ-ZYHUDNBSSA-N 2 2 359.373 2.622 20 5 FFBDLP COc1cc(C[N@H+]2CC[C@@H](C)[C@H](C[NH3+])C2)c([N+](=O)[O-])cc1OC(F)F ZINC000415103290 514445452 /nfs/dbraw/zinc/44/54/52/514445452.db2.gz DAZFSFZHEJADGZ-ZYHUDNBSSA-N 2 2 359.373 2.622 20 5 FFBDLP CC[NH+](CC)CCO[C@H]1CC[N@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000509671732 515284304 /nfs/dbraw/zinc/28/43/04/515284304.db2.gz GOMQMXMATQVBCP-AWEZNQCLSA-N 2 2 357.401 2.806 20 5 FFBDLP CC[NH+](CC)CCO[C@H]1CC[N@@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000509671732 515284311 /nfs/dbraw/zinc/28/43/11/515284311.db2.gz GOMQMXMATQVBCP-AWEZNQCLSA-N 2 2 357.401 2.806 20 5 FFBDLP CCN(C[C@@H]1CCC[N@@H+]1CC)C(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000547799410 516570509 /nfs/dbraw/zinc/57/05/09/516570509.db2.gz ZDQRYPLGPMFSEF-INIZCTEOSA-N 2 2 371.441 2.727 20 5 FFBDLP CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000547799410 516570517 /nfs/dbraw/zinc/57/05/17/516570517.db2.gz ZDQRYPLGPMFSEF-INIZCTEOSA-N 2 2 371.441 2.727 20 5 FFBDLP C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@@H](c2[nH+]ccn2C)C1 ZINC000536068647 516617051 /nfs/dbraw/zinc/61/70/51/516617051.db2.gz JUBXDXLFSWZBIR-GXTWGEPZSA-N 2 2 368.397 2.929 20 5 FFBDLP C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](c2[nH+]ccn2C)C1 ZINC000536068647 516617059 /nfs/dbraw/zinc/61/70/59/516617059.db2.gz JUBXDXLFSWZBIR-GXTWGEPZSA-N 2 2 368.397 2.929 20 5 FFBDLP O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](Cc3cc(-n4cc[nH+]c4)cs3)C2)nc1 ZINC000542466686 517581999 /nfs/dbraw/zinc/58/19/99/517581999.db2.gz QIBUAGYWNZXSDF-ZDUSSCGKSA-N 2 2 370.438 2.923 20 5 FFBDLP O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3cc(-n4cc[nH+]c4)cs3)C2)nc1 ZINC000542466686 517582006 /nfs/dbraw/zinc/58/20/06/517582006.db2.gz QIBUAGYWNZXSDF-ZDUSSCGKSA-N 2 2 370.438 2.923 20 5 FFBDLP Cn1ccnc1[C@H]([NH2+]CCCCn1cc[nH+]c1)c1ccc([N+](=O)[O-])cc1 ZINC000560514373 517864353 /nfs/dbraw/zinc/86/43/53/517864353.db2.gz KLFRRYRJTKYNHZ-QGZVFWFLSA-N 2 2 354.414 2.684 20 5 FFBDLP CCN(C[C@H]1CCC[N@@H+]1CC)C(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000577578152 519146898 /nfs/dbraw/zinc/14/68/98/519146898.db2.gz XIPZSBRWXGJKGQ-MRXNPFEDSA-N 2 2 371.441 2.727 20 5 FFBDLP CCN(C[C@H]1CCC[N@H+]1CC)C(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000577578152 519146904 /nfs/dbraw/zinc/14/69/04/519146904.db2.gz XIPZSBRWXGJKGQ-MRXNPFEDSA-N 2 2 371.441 2.727 20 5 FFBDLP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(F)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000595439689 520471615 /nfs/dbraw/zinc/47/16/15/520471615.db2.gz KCMCNHWRIFMGTP-RHSMWYFYSA-N 2 2 353.438 2.961 20 5 FFBDLP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(F)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000595439689 520471617 /nfs/dbraw/zinc/47/16/17/520471617.db2.gz KCMCNHWRIFMGTP-RHSMWYFYSA-N 2 2 353.438 2.961 20 5 FFBDLP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(F)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000595439688 520472038 /nfs/dbraw/zinc/47/20/38/520472038.db2.gz KCMCNHWRIFMGTP-PBHICJAKSA-N 2 2 353.438 2.961 20 5 FFBDLP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2ccc(F)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000595439688 520472043 /nfs/dbraw/zinc/47/20/43/520472043.db2.gz KCMCNHWRIFMGTP-PBHICJAKSA-N 2 2 353.438 2.961 20 5 FFBDLP C[C@H](CNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)[NH+]1CCC(C)CC1 ZINC000604472090 520569576 /nfs/dbraw/zinc/56/95/76/520569576.db2.gz AGQHAOIZLWVDBQ-OAHLLOKOSA-N 2 2 371.441 2.631 20 5 FFBDLP C[C@H]([NH2+]C[C@]1(O)CC[N@H+](Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000610422074 520675630 /nfs/dbraw/zinc/67/56/30/520675630.db2.gz UQBGJHKCKVKUQR-OXJNMPFZSA-N 2 2 355.438 2.882 20 5 FFBDLP C[C@H]([NH2+]C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000610422074 520675640 /nfs/dbraw/zinc/67/56/40/520675640.db2.gz UQBGJHKCKVKUQR-OXJNMPFZSA-N 2 2 355.438 2.882 20 5 FFBDLP CCOc1cc(C[N@@H+]2CCO[C@@H](CCC[NH+](C)C)C2)ccc1[N+](=O)[O-] ZINC000595905262 520810778 /nfs/dbraw/zinc/81/07/78/520810778.db2.gz AVDSCNLDNUUNMI-INIZCTEOSA-N 2 2 351.447 2.536 20 5 FFBDLP CCOc1cc(C[N@H+]2CCO[C@@H](CCC[NH+](C)C)C2)ccc1[N+](=O)[O-] ZINC000595905262 520810783 /nfs/dbraw/zinc/81/07/83/520810783.db2.gz AVDSCNLDNUUNMI-INIZCTEOSA-N 2 2 351.447 2.536 20 5 FFBDLP CCC1([NH+]2CCOCC2)CC[NH+](CCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000599668511 521381820 /nfs/dbraw/zinc/38/18/20/521381820.db2.gz GPMIEKQWFLUZBP-UHFFFAOYSA-N 2 2 363.458 2.550 20 5 FFBDLP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCN([C@@H]2CCC[N@@H+](C)C2)CC1 ZINC000615835650 521552575 /nfs/dbraw/zinc/55/25/75/521552575.db2.gz XVAUGACNKLJICN-MBGNVJMVSA-N 2 2 358.486 2.710 20 5 FFBDLP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCN([C@@H]2CCC[N@H+](C)C2)CC1 ZINC000615835650 521552584 /nfs/dbraw/zinc/55/25/84/521552584.db2.gz XVAUGACNKLJICN-MBGNVJMVSA-N 2 2 358.486 2.710 20 5 FFBDLP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCN([C@@H]2CCC[N@@H+](C)C2)CC1 ZINC000615835653 521552622 /nfs/dbraw/zinc/55/26/22/521552622.db2.gz XVAUGACNKLJICN-XMJIKXADSA-N 2 2 358.486 2.710 20 5 FFBDLP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCN([C@@H]2CCC[N@H+](C)C2)CC1 ZINC000615835653 521552632 /nfs/dbraw/zinc/55/26/32/521552632.db2.gz XVAUGACNKLJICN-XMJIKXADSA-N 2 2 358.486 2.710 20 5 FFBDLP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccc(Br)c([N+](=O)[O-])c3)C[C@@H]21 ZINC000230132219 729550465 /nfs/dbraw/zinc/55/04/65/729550465.db2.gz AGLMCCXMLDUSEV-MBNYWOFBSA-N 2 2 354.248 2.917 20 5 FFBDLP [NH3+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccc(Br)c([N+](=O)[O-])c3)C[C@@H]21 ZINC000230132219 729550469 /nfs/dbraw/zinc/55/04/69/729550469.db2.gz AGLMCCXMLDUSEV-MBNYWOFBSA-N 2 2 354.248 2.917 20 5 FFBDLP [NH3+]C[C@@H]([NH2+]CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C1CCCCC1 ZINC000842476968 747612755 /nfs/dbraw/zinc/61/27/55/747612755.db2.gz YKJRLDRVCSHHOP-CQSZACIVSA-N 2 2 354.838 2.684 20 5 FFBDLP CC[NH2+]CC1CC[NH+]([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000843352088 747815262 /nfs/dbraw/zinc/81/52/62/747815262.db2.gz DHJKWMGZFKQBNG-LBPRGKRZSA-N 2 2 368.865 2.897 20 5 FFBDLP CC(C)[C@H]([NH3+])CC[N@H+](C)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000843354750 747816045 /nfs/dbraw/zinc/81/60/45/747816045.db2.gz LRHARLGTCZZHLT-SMDDNHRTSA-N 2 2 356.854 2.880 20 5 FFBDLP CC(C)[C@H]([NH3+])CC[N@@H+](C)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000843354750 747816054 /nfs/dbraw/zinc/81/60/54/747816054.db2.gz LRHARLGTCZZHLT-SMDDNHRTSA-N 2 2 356.854 2.880 20 5 FFBDLP O=[N+]([O-])c1cn(C[NH+]2CCC(C[NH+]3CCCC3)CC2)nc1-c1ccncc1 ZINC000172908974 985711630 /nfs/dbraw/zinc/71/16/30/985711630.db2.gz LUEXAQRGCUBFOX-UHFFFAOYSA-N 2 2 370.457 2.619 20 5 FFBDLP CC(C)[N@H+](Cc1cnnn1[C@H]1CCC[NH2+]C1)Cc1ccc([N+](=O)[O-])cc1 ZINC000903886251 1016287809 /nfs/dbraw/zinc/28/78/09/1016287809.db2.gz ODFMGNCUTAKSLW-KRWDZBQOSA-N 2 2 358.446 2.521 20 5 FFBDLP CC(C)[N@@H+](Cc1cnnn1[C@H]1CCC[NH2+]C1)Cc1ccc([N+](=O)[O-])cc1 ZINC000903886251 1016287816 /nfs/dbraw/zinc/28/78/16/1016287816.db2.gz ODFMGNCUTAKSLW-KRWDZBQOSA-N 2 2 358.446 2.521 20 5 FFBDLP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H]2C[NH+](Cc3ccccn3)C[C@H]2C1 ZINC001173228529 1012365137 /nfs/dbraw/zinc/36/51/37/1012365137.db2.gz YVFYSBMWCUNEOL-QRQLOZEOSA-N 2 2 366.465 2.985 20 5 FFBDLP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H]2C[NH+](Cc3ccccn3)C[C@H]2C1 ZINC001173228529 1012365154 /nfs/dbraw/zinc/36/51/54/1012365154.db2.gz YVFYSBMWCUNEOL-QRQLOZEOSA-N 2 2 366.465 2.985 20 5 FFBDLP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1C[C@H]2C[N@@H+](Cc3ccccn3)C[C@H]2C1 ZINC001173228529 1012365167 /nfs/dbraw/zinc/36/51/67/1012365167.db2.gz YVFYSBMWCUNEOL-QRQLOZEOSA-N 2 2 366.465 2.985 20 5 FFBDLP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1C[C@H]2C[N@H+](Cc3ccccn3)C[C@H]2C1 ZINC001173228529 1012365177 /nfs/dbraw/zinc/36/51/77/1012365177.db2.gz YVFYSBMWCUNEOL-QRQLOZEOSA-N 2 2 366.465 2.985 20 5 FFBDLP COc1cc([C@H](C)[NH2+]C2CC[NH+](C[C@H]3CCCO3)CC2)cc([N+](=O)[O-])c1 ZINC000903096357 1020674598 /nfs/dbraw/zinc/67/45/98/1020674598.db2.gz BSSKFJZWTWLEJT-KBXCAEBGSA-N 2 2 363.458 2.897 20 5 FFBDLP O=[N+]([O-])c1cnn(CC[NH+]2CCC(c3ccccc3)([NH+]3CCCC3)CC2)c1 ZINC000933548411 1021030111 /nfs/dbraw/zinc/03/01/11/1021030111.db2.gz UJBAPFNLGROGHB-UHFFFAOYSA-N 2 2 369.469 2.878 20 5 FFBDLP C[C@@H]1CC[N@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H]1n1cc[nH+]c1 ZINC000246444088 1026144738 /nfs/dbraw/zinc/14/47/38/1026144738.db2.gz DWCHIVFCZPOTDP-RHSMWYFYSA-N 2 2 367.413 2.590 20 5 FFBDLP C[C@@H]1CC[N@@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H]1n1cc[nH+]c1 ZINC000246444088 1026144745 /nfs/dbraw/zinc/14/47/45/1026144745.db2.gz DWCHIVFCZPOTDP-RHSMWYFYSA-N 2 2 367.413 2.590 20 5 FFBDLP [NH3+]C[C@H]1Cc2ccccc2C[N@@H+]1C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001254472510 1040739024 /nfs/dbraw/zinc/73/90/24/1040739024.db2.gz ARYLZTSZDXIZNS-OAQYLSRUSA-N 2 2 366.465 2.949 20 5 FFBDLP [NH3+]C[C@H]1Cc2ccccc2C[N@H+]1C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001254472510 1040739041 /nfs/dbraw/zinc/73/90/41/1040739041.db2.gz ARYLZTSZDXIZNS-OAQYLSRUSA-N 2 2 366.465 2.949 20 5 FFBDLP C[NH+]1CCN(c2ccc3[nH]c(Cc4ccc([N+](=O)[O-])cc4)[nH+]c3c2)CC1 ZINC001250606204 1041263939 /nfs/dbraw/zinc/26/39/39/1041263939.db2.gz CSDOAKIZASNQCT-UHFFFAOYSA-N 2 2 351.410 2.814 20 5 FFBDLP O=[N+]([O-])c1cccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2CO)c1 ZINC001308283580 1052441637 /nfs/dbraw/zinc/44/16/37/1052441637.db2.gz ZIFKFDVGXSQFAR-ICSRJNTNSA-N 2 2 355.438 2.567 20 5 FFBDLP O=[N+]([O-])c1cccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2CO)c1 ZINC001308283580 1052441643 /nfs/dbraw/zinc/44/16/43/1052441643.db2.gz ZIFKFDVGXSQFAR-ICSRJNTNSA-N 2 2 355.438 2.567 20 5 FFBDLP O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@@H](Cn2cc[nH+]c2)c2ccccc2)cc1 ZINC001473748187 1065345068 /nfs/dbraw/zinc/34/50/68/1065345068.db2.gz WLJZDVREEMSSNX-RBUKOAKNSA-N 2 2 352.394 2.856 20 5 FFBDLP Cc1[nH+]ccn1CCC[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272521739 252057955 /nfs/dbraw/zinc/05/79/55/252057955.db2.gz LHCRVJCBEAWQQA-QGZVFWFLSA-N 2 2 354.414 2.603 20 5 FFBDLP C[C@H]1C[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000371305411 512318089 /nfs/dbraw/zinc/31/80/89/512318089.db2.gz YRCVWEZLELBQDW-KSSFIOAISA-N 2 2 366.893 2.706 20 5 FFBDLP C[C@H]1C[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000371305411 512318095 /nfs/dbraw/zinc/31/80/95/512318095.db2.gz YRCVWEZLELBQDW-KSSFIOAISA-N 2 2 366.893 2.706 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@H](c4[nH]cc[nH+]4)C3)n2)cc1 ZINC000080961723 508117784 /nfs/dbraw/zinc/11/77/84/508117784.db2.gz MQSDZVDUQVIURO-ZDUSSCGKSA-N 2 2 354.370 2.748 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@H](c4[nH]cc[nH+]4)C3)n2)cc1 ZINC000080961723 508117786 /nfs/dbraw/zinc/11/77/86/508117786.db2.gz MQSDZVDUQVIURO-ZDUSSCGKSA-N 2 2 354.370 2.748 20 5 FFBDLP O=C1[C@@H]([N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000157436478 508565958 /nfs/dbraw/zinc/56/59/58/508565958.db2.gz VCFASGCALNDLNG-LPHOPBHVSA-N 2 2 372.469 2.650 20 5 FFBDLP O=C1[C@@H]([N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000157436478 508565960 /nfs/dbraw/zinc/56/59/60/508565960.db2.gz VCFASGCALNDLNG-LPHOPBHVSA-N 2 2 372.469 2.650 20 5 FFBDLP C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000123651587 508720678 /nfs/dbraw/zinc/72/06/78/508720678.db2.gz VSMYRLNAXWWUJV-HUUCEWRRSA-N 2 2 371.441 2.610 20 5 FFBDLP C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000123651587 508720681 /nfs/dbraw/zinc/72/06/81/508720681.db2.gz VSMYRLNAXWWUJV-HUUCEWRRSA-N 2 2 371.441 2.610 20 5 FFBDLP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)CC[C@@H]21 ZINC000158593604 508725964 /nfs/dbraw/zinc/72/59/64/508725964.db2.gz SPPLINHUNNJSBU-ZBFHGGJFSA-N 2 2 357.414 2.561 20 5 FFBDLP C[N@H+]1CCC[C@@H]2C[NH+](Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)CC[C@@H]21 ZINC000158593604 508725966 /nfs/dbraw/zinc/72/59/66/508725966.db2.gz SPPLINHUNNJSBU-ZBFHGGJFSA-N 2 2 357.414 2.561 20 5 FFBDLP C[NH+]1CCC[C@@H]2C[N@H+](Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)CC[C@@H]21 ZINC000158593604 508725970 /nfs/dbraw/zinc/72/59/70/508725970.db2.gz SPPLINHUNNJSBU-ZBFHGGJFSA-N 2 2 357.414 2.561 20 5 FFBDLP C[NH+]1CCC[C@@H]2C[N@@H+](Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)CC[C@@H]21 ZINC000158593604 508725971 /nfs/dbraw/zinc/72/59/71/508725971.db2.gz SPPLINHUNNJSBU-ZBFHGGJFSA-N 2 2 357.414 2.561 20 5 FFBDLP CC[NH+]1CCC(CCNC(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)CC1 ZINC000174107373 509951086 /nfs/dbraw/zinc/95/10/86/509951086.db2.gz MQORIRPIQPRIMF-UHFFFAOYSA-N 2 2 371.441 2.632 20 5 FFBDLP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H](C)C1 ZINC000174773131 510304907 /nfs/dbraw/zinc/30/49/07/510304907.db2.gz RRAUKAZGKSQIFP-CZUORRHYSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[N@H+]1CC[C@@H]([NH+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H](C)C1 ZINC000174773131 510304914 /nfs/dbraw/zinc/30/49/14/510304914.db2.gz RRAUKAZGKSQIFP-CZUORRHYSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[NH+]1CC[C@@H]([N@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H](C)C1 ZINC000174773131 510304924 /nfs/dbraw/zinc/30/49/24/510304924.db2.gz RRAUKAZGKSQIFP-CZUORRHYSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H](C)C1 ZINC000174773131 510304937 /nfs/dbraw/zinc/30/49/37/510304937.db2.gz RRAUKAZGKSQIFP-CZUORRHYSA-N 2 2 359.430 2.807 20 5 FFBDLP C[C@H](CCNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)[NH+]1CCCCC1 ZINC000182237749 510828283 /nfs/dbraw/zinc/82/82/83/510828283.db2.gz UVXUYVQZDPKFSO-OAHLLOKOSA-N 2 2 371.441 2.775 20 5 FFBDLP C[C@H](C1CC[NH+](C)CC1)N(C)C(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000270978095 511044672 /nfs/dbraw/zinc/04/46/72/511044672.db2.gz UYURQLMMENNALZ-CQSZACIVSA-N 2 2 371.441 2.583 20 5 FFBDLP COc1ccc(NC(=O)[C@H](C)[N@@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)c([N+](=O)[O-])c1 ZINC000377917710 512511273 /nfs/dbraw/zinc/51/12/73/512511273.db2.gz RXYCEAYCDONAJL-STQMWFEESA-N 2 2 373.413 2.533 20 5 FFBDLP COc1ccc(NC(=O)[C@H](C)[N@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)c([N+](=O)[O-])c1 ZINC000377917710 512511277 /nfs/dbraw/zinc/51/12/77/512511277.db2.gz RXYCEAYCDONAJL-STQMWFEESA-N 2 2 373.413 2.533 20 5 FFBDLP CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCO[C@@H]2C[C@@H]([NH+](C)C)CC[C@H]21 ZINC000374429931 512829297 /nfs/dbraw/zinc/82/92/97/512829297.db2.gz QOUBTSVFGHACGJ-KVSKMBFKSA-N 2 2 363.458 2.677 20 5 FFBDLP CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCO[C@@H]2C[C@@H]([NH+](C)C)CC[C@H]21 ZINC000374429931 512829299 /nfs/dbraw/zinc/82/92/99/512829299.db2.gz QOUBTSVFGHACGJ-KVSKMBFKSA-N 2 2 363.458 2.677 20 5 FFBDLP CC(C)[N@@H+]1CCC[C@H](CNC(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)C1 ZINC000448825086 513916557 /nfs/dbraw/zinc/91/65/57/513916557.db2.gz UWGSMTDHKHMHDD-OAHLLOKOSA-N 2 2 371.441 2.631 20 5 FFBDLP CC(C)[N@H+]1CCC[C@H](CNC(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)C1 ZINC000448825086 513916562 /nfs/dbraw/zinc/91/65/62/513916562.db2.gz UWGSMTDHKHMHDD-OAHLLOKOSA-N 2 2 371.441 2.631 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCCC[C@H]3[C@H]3CC[NH2+]C3)n2)cc1 ZINC000420390999 514127002 /nfs/dbraw/zinc/12/70/02/514127002.db2.gz IFMFNOSGOWPUJT-HOCLYGCPSA-N 2 2 357.414 2.609 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCCC[C@H]3[C@H]3CC[NH2+]C3)n2)cc1 ZINC000420390999 514127007 /nfs/dbraw/zinc/12/70/07/514127007.db2.gz IFMFNOSGOWPUJT-HOCLYGCPSA-N 2 2 357.414 2.609 20 5 FFBDLP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCC[N@H+](C)[C@H]1c1ccnn1C ZINC000449319475 514164194 /nfs/dbraw/zinc/16/41/94/514164194.db2.gz YWOFFMFZOIKXRL-RIFZZMRRSA-N 2 2 371.485 2.932 20 5 FFBDLP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCC[N@@H+](C)[C@H]1c1ccnn1C ZINC000449319475 514164199 /nfs/dbraw/zinc/16/41/99/514164199.db2.gz YWOFFMFZOIKXRL-RIFZZMRRSA-N 2 2 371.485 2.932 20 5 FFBDLP C[N@@H+](Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)C[C@H](O)C[NH3+] ZINC000415070956 514429661 /nfs/dbraw/zinc/42/96/61/514429661.db2.gz RUYBDEHTFITUPM-CYBMUJFWSA-N 2 2 365.817 2.792 20 5 FFBDLP C[N@H+](Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)C[C@H](O)C[NH3+] ZINC000415070956 514429662 /nfs/dbraw/zinc/42/96/62/514429662.db2.gz RUYBDEHTFITUPM-CYBMUJFWSA-N 2 2 365.817 2.792 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](CCC[NH3+])Cc1ccccc1 ZINC000479759531 514714124 /nfs/dbraw/zinc/71/41/24/514714124.db2.gz ZFEUXLWXCQVDOL-UHFFFAOYSA-N 2 2 356.426 2.693 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](CCC[NH3+])Cc1ccccc1 ZINC000479759531 514714131 /nfs/dbraw/zinc/71/41/31/514714131.db2.gz ZFEUXLWXCQVDOL-UHFFFAOYSA-N 2 2 356.426 2.693 20 5 FFBDLP COCC[NH+]1CCC([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1 ZINC000494528739 515872726 /nfs/dbraw/zinc/87/27/26/515872726.db2.gz SWGBQJHXPUDVBA-UHFFFAOYSA-N 2 2 361.364 2.814 20 5 FFBDLP C[C@@H]1C[N@@H+](C2CC2)C[C@@H]1[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000540625405 516645892 /nfs/dbraw/zinc/64/58/92/516645892.db2.gz FDZXUHYMWHJCHS-ACJLOTCBSA-N 2 2 355.442 2.568 20 5 FFBDLP C[C@@H]1C[N@H+](C2CC2)C[C@@H]1[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000540625405 516645899 /nfs/dbraw/zinc/64/58/99/516645899.db2.gz FDZXUHYMWHJCHS-ACJLOTCBSA-N 2 2 355.442 2.568 20 5 FFBDLP O=C(CC[NH+]1CCC(Nc2cccc[nH+]2)CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000534862888 518063322 /nfs/dbraw/zinc/06/33/22/518063322.db2.gz QKFYDFGEZLKQRK-UHFFFAOYSA-N 2 2 369.425 2.895 20 5 FFBDLP CCCC[N@H+](C)C[C@@H](C)Nc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000570014869 518399063 /nfs/dbraw/zinc/39/90/63/518399063.db2.gz MDCZMRYOZOWBSC-MRXNPFEDSA-N 2 2 364.490 2.959 20 5 FFBDLP CCCC[N@@H+](C)C[C@@H](C)Nc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000570014869 518399070 /nfs/dbraw/zinc/39/90/70/518399070.db2.gz MDCZMRYOZOWBSC-MRXNPFEDSA-N 2 2 364.490 2.959 20 5 FFBDLP CC(C)C[C@@H](CN[C@@H](c1[nH+]ccn1C)c1ccc([N+](=O)[O-])cc1)[NH+](C)C ZINC000582137957 518605796 /nfs/dbraw/zinc/60/57/96/518605796.db2.gz NDABLOJDKGMBLD-ZWKOTPCHSA-N 2 2 359.474 2.984 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@@H](n4cc[nH+]c4)C3)n2)cc1 ZINC000609157409 520213280 /nfs/dbraw/zinc/21/32/80/520213280.db2.gz KJYWXYPRTMNBHZ-OAHLLOKOSA-N 2 2 354.370 2.678 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@@H](n4cc[nH+]c4)C3)n2)cc1 ZINC000609157409 520213286 /nfs/dbraw/zinc/21/32/86/520213286.db2.gz KJYWXYPRTMNBHZ-OAHLLOKOSA-N 2 2 354.370 2.678 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1 ZINC000595007806 520254282 /nfs/dbraw/zinc/25/42/82/520254282.db2.gz KVZIWTZFRXWODD-LSDHHAIUSA-N 2 2 363.458 2.755 20 5 FFBDLP CC(C)(C)[N@@H+]1CC[C@@H](CNC(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)C1 ZINC000597854306 520284009 /nfs/dbraw/zinc/28/40/09/520284009.db2.gz FXPFOVSXLHHFSK-AWEZNQCLSA-N 2 2 371.441 2.631 20 5 FFBDLP CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)C1 ZINC000597854306 520284012 /nfs/dbraw/zinc/28/40/12/520284012.db2.gz FXPFOVSXLHHFSK-AWEZNQCLSA-N 2 2 371.441 2.631 20 5 FFBDLP C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C[C@H]1CC[N@@H+]1C1CCCC1 ZINC000599072936 521016620 /nfs/dbraw/zinc/01/66/20/521016620.db2.gz COPJPJUHKBHUCF-RDTXWAMCSA-N 2 2 360.458 2.918 20 5 FFBDLP C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C[C@H]1CC[N@H+]1C1CCCC1 ZINC000599072936 521016625 /nfs/dbraw/zinc/01/66/25/521016625.db2.gz COPJPJUHKBHUCF-RDTXWAMCSA-N 2 2 360.458 2.918 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CCC([NH2+]CCO)CC3)s2)cc1 ZINC000602018444 521080795 /nfs/dbraw/zinc/08/07/95/521080795.db2.gz CATWDSKAKPJAPR-UHFFFAOYSA-N 2 2 361.467 2.870 20 5 FFBDLP C[C@@H]1CC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@@H]1n1cc[nH+]c1 ZINC000611286001 521081470 /nfs/dbraw/zinc/08/14/70/521081470.db2.gz QJANZDUEWRHXPM-CJNGLKHVSA-N 2 2 358.398 2.646 20 5 FFBDLP C[C@@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@@H]1n1cc[nH+]c1 ZINC000611286001 521081477 /nfs/dbraw/zinc/08/14/77/521081477.db2.gz QJANZDUEWRHXPM-CJNGLKHVSA-N 2 2 358.398 2.646 20 5 FFBDLP O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CC[C@H]3[C@H](CCC[NH+]3C3CC3)C1)OCCO2 ZINC000611287364 521081515 /nfs/dbraw/zinc/08/15/15/521081515.db2.gz ZUDJVJXEWWGKGD-PBHICJAKSA-N 2 2 373.453 2.815 20 5 FFBDLP O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@H]3[C@H](CCC[NH+]3C3CC3)C1)OCCO2 ZINC000611287364 521081521 /nfs/dbraw/zinc/08/15/21/521081521.db2.gz ZUDJVJXEWWGKGD-PBHICJAKSA-N 2 2 373.453 2.815 20 5 FFBDLP O=[N+]([O-])c1cc2c(cc1C[NH+]1CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C1)OCCO2 ZINC000611287364 521081525 /nfs/dbraw/zinc/08/15/25/521081525.db2.gz ZUDJVJXEWWGKGD-PBHICJAKSA-N 2 2 373.453 2.815 20 5 FFBDLP O=[N+]([O-])c1cc2c(cc1C[NH+]1CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C1)OCCO2 ZINC000611287364 521081532 /nfs/dbraw/zinc/08/15/32/521081532.db2.gz ZUDJVJXEWWGKGD-PBHICJAKSA-N 2 2 373.453 2.815 20 5 FFBDLP C[C@@H](C[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)[N@@H+]1CCC[C@H](C)C1 ZINC000602514453 521387420 /nfs/dbraw/zinc/38/74/20/521387420.db2.gz JOFTZWNYYFOLOD-HOTGVXAUSA-N 2 2 361.490 2.669 20 5 FFBDLP C[C@@H](C[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)[N@H+]1CCC[C@H](C)C1 ZINC000602514453 521387426 /nfs/dbraw/zinc/38/74/26/521387426.db2.gz JOFTZWNYYFOLOD-HOTGVXAUSA-N 2 2 361.490 2.669 20 5 FFBDLP C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[NH+]1CCC(C[NH+](C)C)CC1 ZINC000729266276 734568529 /nfs/dbraw/zinc/56/85/29/734568529.db2.gz VBIUEUHLWJSEAP-GFCCVEGCSA-N 2 2 368.865 2.849 20 5 FFBDLP COC(=O)CCC[NH+]1CCC([NH2+]C[C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000897466127 981132763 /nfs/dbraw/zinc/13/27/63/981132763.db2.gz OQLAMSBFKJFAQM-HNNXBMFYSA-N 2 2 363.458 2.706 20 5 FFBDLP CC(C)(C)[N@@H+]1CC[C@@H]1COC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000845727351 998639725 /nfs/dbraw/zinc/63/97/25/998639725.db2.gz BJMWGHRZLSVBPG-CQSZACIVSA-N 2 2 358.398 2.810 20 5 FFBDLP CC(C)(C)[N@H+]1CC[C@@H]1COC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000845727351 998639732 /nfs/dbraw/zinc/63/97/32/998639732.db2.gz BJMWGHRZLSVBPG-CQSZACIVSA-N 2 2 358.398 2.810 20 5 FFBDLP Cc1cc(NCC[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)nc(C(C)C)[nH+]1 ZINC000863575824 1010260449 /nfs/dbraw/zinc/26/04/49/1010260449.db2.gz KBZUICZTMKBZEX-MRXNPFEDSA-N 2 2 359.430 2.552 20 5 FFBDLP CC(C)[N@@H+]1CC[C@H]([NH2+]C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173009539 1012179671 /nfs/dbraw/zinc/17/96/71/1012179671.db2.gz WTCNOSXNJUFINS-AWEZNQCLSA-N 2 2 368.428 2.914 20 5 FFBDLP CC(C)[N@H+]1CC[C@H]([NH2+]C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173009539 1012179676 /nfs/dbraw/zinc/17/96/76/1012179676.db2.gz WTCNOSXNJUFINS-AWEZNQCLSA-N 2 2 368.428 2.914 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2cnn(C[NH+]3CCC(n4cc[nH+]c4)CC3)c2)c1 ZINC000777955298 1020318987 /nfs/dbraw/zinc/31/89/87/1020318987.db2.gz KGLLPXWEPLPLDK-UHFFFAOYSA-N 2 2 352.398 2.949 20 5 FFBDLP O=[N+]([O-])c1ccc(N2CC[NH+](C[C@@H]3CCC[NH2+]C3)CC2)c(C(F)(F)F)c1 ZINC001118557037 1022288528 /nfs/dbraw/zinc/28/85/28/1022288528.db2.gz AUUWMUZSIDVWLK-CYBMUJFWSA-N 2 2 372.391 2.735 20 5 FFBDLP C[C@H]1CC[N@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H]1n1cc[nH+]c1 ZINC000246444093 1026143666 /nfs/dbraw/zinc/14/36/66/1026143666.db2.gz DWCHIVFCZPOTDP-WMLDXEAASA-N 2 2 367.413 2.590 20 5 FFBDLP C[C@H]1CC[N@@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H]1n1cc[nH+]c1 ZINC000246444093 1026143677 /nfs/dbraw/zinc/14/36/77/1026143677.db2.gz DWCHIVFCZPOTDP-WMLDXEAASA-N 2 2 367.413 2.590 20 5 FFBDLP C[NH+](C)C1(CNc2nc(Cl)c(Cl)cc2[N+](=O)[O-])CC[NH+](C)CC1 ZINC001156182153 1029078483 /nfs/dbraw/zinc/07/84/83/1029078483.db2.gz PITOANLAJYGRKI-UHFFFAOYSA-N 2 2 362.261 2.735 20 5 FFBDLP O=[N+]([O-])c1cccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2CO)c1 ZINC001308283582 1052441766 /nfs/dbraw/zinc/44/17/66/1052441766.db2.gz ZIFKFDVGXSQFAR-UYAOXDASSA-N 2 2 355.438 2.567 20 5 FFBDLP O=[N+]([O-])c1cccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2CO)c1 ZINC001308283582 1052441771 /nfs/dbraw/zinc/44/17/71/1052441771.db2.gz ZIFKFDVGXSQFAR-UYAOXDASSA-N 2 2 355.438 2.567 20 5 FFBDLP Cn1cc[nH+]c1C[C@@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC001356532125 1055559082 /nfs/dbraw/zinc/55/90/82/1055559082.db2.gz IJTREQVZQIACIX-MOPGFXCFSA-N 2 2 366.421 2.935 20 5 FFBDLP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C[C@@H](O)C[N@@H+]1CCc2ccccc2C1 ZINC001474155094 1056576121 /nfs/dbraw/zinc/57/61/21/1056576121.db2.gz CZLSHUGIGNOKKF-LJQANCHMSA-N 2 2 369.465 2.720 20 5 FFBDLP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC001474155094 1056576132 /nfs/dbraw/zinc/57/61/32/1056576132.db2.gz CZLSHUGIGNOKKF-LJQANCHMSA-N 2 2 369.465 2.720 20 5 FFBDLP C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848483143 1060121296 /nfs/dbraw/zinc/12/12/96/1060121296.db2.gz YUPQNXYUUYPKQJ-MAUKXSAKSA-N 2 2 355.442 2.832 20 5 FFBDLP C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848483143 1060121304 /nfs/dbraw/zinc/12/13/04/1060121304.db2.gz YUPQNXYUUYPKQJ-MAUKXSAKSA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848483143 1060121309 /nfs/dbraw/zinc/12/13/09/1060121309.db2.gz YUPQNXYUUYPKQJ-MAUKXSAKSA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848483143 1060121319 /nfs/dbraw/zinc/12/13/19/1060121319.db2.gz YUPQNXYUUYPKQJ-MAUKXSAKSA-N 2 2 355.442 2.832 20 5 FFBDLP Cc1cc(NCC[NH+]2CCC([NH+](C)C)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000302019713 258082478 /nfs/dbraw/zinc/08/24/78/258082478.db2.gz NFVWOUUDVMIEOX-UHFFFAOYSA-N 2 2 357.458 2.889 20 5 FFBDLP C[C@H]1C[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)CC[C@H]1N1CC[NH+](C)CC1 ZINC000371305409 512318494 /nfs/dbraw/zinc/31/84/94/512318494.db2.gz YRCVWEZLELBQDW-KBXCAEBGSA-N 2 2 366.893 2.706 20 5 FFBDLP C[C@H]1C[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)CC[C@H]1N1CC[NH+](C)CC1 ZINC000371305409 512318497 /nfs/dbraw/zinc/31/84/97/512318497.db2.gz YRCVWEZLELBQDW-KBXCAEBGSA-N 2 2 366.893 2.706 20 5 FFBDLP C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000156413565 508417558 /nfs/dbraw/zinc/41/75/58/508417558.db2.gz XTBUISOICGAPIQ-ZQIUZPCESA-N 2 2 357.414 2.701 20 5 FFBDLP C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000156413565 508417563 /nfs/dbraw/zinc/41/75/63/508417563.db2.gz XTBUISOICGAPIQ-ZQIUZPCESA-N 2 2 357.414 2.701 20 5 FFBDLP C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000156442129 508421615 /nfs/dbraw/zinc/42/16/15/508421615.db2.gz CBMLPFOHMIGJCE-KEYYUXOJSA-N 2 2 357.414 2.701 20 5 FFBDLP C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000156442129 508421618 /nfs/dbraw/zinc/42/16/18/508421618.db2.gz CBMLPFOHMIGJCE-KEYYUXOJSA-N 2 2 357.414 2.701 20 5 FFBDLP C[C@H]1CC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1n1cc[nH+]c1 ZINC000156477457 508426458 /nfs/dbraw/zinc/42/64/58/508426458.db2.gz OQFHSYQTYHQBBW-YOEHRIQHSA-N 2 2 357.414 2.703 20 5 FFBDLP C[C@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1n1cc[nH+]c1 ZINC000156477457 508426461 /nfs/dbraw/zinc/42/64/61/508426461.db2.gz OQFHSYQTYHQBBW-YOEHRIQHSA-N 2 2 357.414 2.703 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000129365925 508718623 /nfs/dbraw/zinc/71/86/23/508718623.db2.gz YTWTYGHLHOKVEF-RHSMWYFYSA-N 2 2 357.414 2.621 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000129365925 508718626 /nfs/dbraw/zinc/71/86/26/508718626.db2.gz YTWTYGHLHOKVEF-RHSMWYFYSA-N 2 2 357.414 2.621 20 5 FFBDLP C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000123651316 508720797 /nfs/dbraw/zinc/72/07/97/508720797.db2.gz VSMYRLNAXWWUJV-LSDHHAIUSA-N 2 2 371.441 2.610 20 5 FFBDLP C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000123651316 508720799 /nfs/dbraw/zinc/72/07/99/508720799.db2.gz VSMYRLNAXWWUJV-LSDHHAIUSA-N 2 2 371.441 2.610 20 5 FFBDLP C[C@@H]([NH2+]C[C@@H](O)C[N@@H+]1CCc2ccccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000151801351 509085970 /nfs/dbraw/zinc/08/59/70/509085970.db2.gz BQPQZHQVFITUOO-FOIQADDNSA-N 2 2 355.438 2.665 20 5 FFBDLP C[C@@H]([NH2+]C[C@@H](O)C[N@H+]1CCc2ccccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000151801351 509085973 /nfs/dbraw/zinc/08/59/73/509085973.db2.gz BQPQZHQVFITUOO-FOIQADDNSA-N 2 2 355.438 2.665 20 5 FFBDLP Cc1cccc(C(=O)NCC2([NH+]3CCCCC3)CC[NH+](C)CC2)c1[N+](=O)[O-] ZINC000172750287 509211033 /nfs/dbraw/zinc/21/10/33/509211033.db2.gz VOACJUVRRFFUNF-UHFFFAOYSA-N 2 2 374.485 2.583 20 5 FFBDLP C[N@@H+]1CCC[C@H]2C[NH+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)CC[C@H]21 ZINC000248161116 509251582 /nfs/dbraw/zinc/25/15/82/509251582.db2.gz SDFZJKDHEZVBTR-GOEBONIOSA-N 2 2 357.414 2.561 20 5 FFBDLP C[N@H+]1CCC[C@H]2C[NH+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)CC[C@H]21 ZINC000248161116 509251586 /nfs/dbraw/zinc/25/15/86/509251586.db2.gz SDFZJKDHEZVBTR-GOEBONIOSA-N 2 2 357.414 2.561 20 5 FFBDLP C[NH+]1CCC[C@H]2C[N@H+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)CC[C@H]21 ZINC000248161116 509251589 /nfs/dbraw/zinc/25/15/89/509251589.db2.gz SDFZJKDHEZVBTR-GOEBONIOSA-N 2 2 357.414 2.561 20 5 FFBDLP C[NH+]1CCC[C@H]2C[N@@H+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)CC[C@H]21 ZINC000248161116 509251594 /nfs/dbraw/zinc/25/15/94/509251594.db2.gz SDFZJKDHEZVBTR-GOEBONIOSA-N 2 2 357.414 2.561 20 5 FFBDLP CN(CC[C@H]1CCCC[N@@H+]1C)C(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000172833089 509261632 /nfs/dbraw/zinc/26/16/32/509261632.db2.gz MLDYEBXHHOBWGB-MRXNPFEDSA-N 2 2 371.441 2.727 20 5 FFBDLP CN(CC[C@H]1CCCC[N@H+]1C)C(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000172833089 509261640 /nfs/dbraw/zinc/26/16/40/509261640.db2.gz MLDYEBXHHOBWGB-MRXNPFEDSA-N 2 2 371.441 2.727 20 5 FFBDLP CN(CC[C@@H]1CCCC[N@@H+]1C)C(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000172833094 509262645 /nfs/dbraw/zinc/26/26/45/509262645.db2.gz MLDYEBXHHOBWGB-INIZCTEOSA-N 2 2 371.441 2.727 20 5 FFBDLP CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000172833094 509262649 /nfs/dbraw/zinc/26/26/49/509262649.db2.gz MLDYEBXHHOBWGB-INIZCTEOSA-N 2 2 371.441 2.727 20 5 FFBDLP CN1CC[N@H+](C)C[C@@H]1C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000264738023 509674765 /nfs/dbraw/zinc/67/47/65/509674765.db2.gz JMWPLJDMFLKONU-AWEZNQCLSA-N 2 2 360.483 2.659 20 5 FFBDLP CN1CC[N@@H+](C)C[C@@H]1C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000264738023 509674771 /nfs/dbraw/zinc/67/47/71/509674771.db2.gz JMWPLJDMFLKONU-AWEZNQCLSA-N 2 2 360.483 2.659 20 5 FFBDLP O=C1[C@@H]([N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000247186775 510850063 /nfs/dbraw/zinc/85/00/63/510850063.db2.gz VCFASGCALNDLNG-APWZRJJASA-N 2 2 372.469 2.650 20 5 FFBDLP O=C1[C@@H]([N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000247186775 510850064 /nfs/dbraw/zinc/85/00/64/510850064.db2.gz VCFASGCALNDLNG-APWZRJJASA-N 2 2 372.469 2.650 20 5 FFBDLP C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000247376559 510859024 /nfs/dbraw/zinc/85/90/24/510859024.db2.gz HWBXALBKSWUOEL-CPUCHLNUSA-N 2 2 357.414 2.701 20 5 FFBDLP C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000247376559 510859025 /nfs/dbraw/zinc/85/90/25/510859025.db2.gz HWBXALBKSWUOEL-CPUCHLNUSA-N 2 2 357.414 2.701 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CCOCC2)cc1NC[C@H]1CCCC[N@@H+]1C1CC1 ZINC000447813615 513578200 /nfs/dbraw/zinc/57/82/00/513578200.db2.gz SRJBCVFRMJYBIU-GOSISDBHSA-N 2 2 374.485 2.856 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CCOCC2)cc1NC[C@H]1CCCC[N@H+]1C1CC1 ZINC000447813615 513578209 /nfs/dbraw/zinc/57/82/09/513578209.db2.gz SRJBCVFRMJYBIU-GOSISDBHSA-N 2 2 374.485 2.856 20 5 FFBDLP CC[NH+]1CCN(CC(C)(C)[NH2+]Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000451993661 514117496 /nfs/dbraw/zinc/11/74/96/514117496.db2.gz UWIINOPJDCYCFN-UHFFFAOYSA-N 2 2 354.882 2.754 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@H]3C[NH2+]CCCO3)o2)c(Cl)c1 ZINC000415047720 514415358 /nfs/dbraw/zinc/41/53/58/514415358.db2.gz WFDWBUMHHCUXQG-CQSZACIVSA-N 2 2 365.817 2.976 20 5 FFBDLP COc1cc(C[N@@H+]2CC[C@@H](C)[C@@H](C[NH3+])C2)c([N+](=O)[O-])cc1OC(F)F ZINC000415103288 514445827 /nfs/dbraw/zinc/44/58/27/514445827.db2.gz DAZFSFZHEJADGZ-PWSUYJOCSA-N 2 2 359.373 2.622 20 5 FFBDLP COc1cc(C[N@H+]2CC[C@@H](C)[C@@H](C[NH3+])C2)c([N+](=O)[O-])cc1OC(F)F ZINC000415103288 514445833 /nfs/dbraw/zinc/44/58/33/514445833.db2.gz DAZFSFZHEJADGZ-PWSUYJOCSA-N 2 2 359.373 2.622 20 5 FFBDLP CC[NH+](CC)C[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)C1 ZINC000449990900 514456706 /nfs/dbraw/zinc/45/67/06/514456706.db2.gz KNBLULBSTJSHGI-HNNXBMFYSA-N 2 2 371.441 2.584 20 5 FFBDLP Cc1cc(N2CC[N@H+](C3CC[NH+](C)CC3)[C@H](C)C2)c(F)cc1[N+](=O)[O-] ZINC000461937931 514796833 /nfs/dbraw/zinc/79/68/33/514796833.db2.gz WFKPXBHKUOHDFM-CQSZACIVSA-N 2 2 350.438 2.647 20 5 FFBDLP Cc1cc(N2CC[N@@H+](C3CC[NH+](C)CC3)[C@H](C)C2)c(F)cc1[N+](=O)[O-] ZINC000461937931 514796845 /nfs/dbraw/zinc/79/68/45/514796845.db2.gz WFKPXBHKUOHDFM-CQSZACIVSA-N 2 2 350.438 2.647 20 5 FFBDLP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCN(c2cc[nH+]c(C)n2)CC1 ZINC000470208595 516172962 /nfs/dbraw/zinc/17/29/62/516172962.db2.gz ZSXHOYRJELQYAE-QINSGFPZSA-N 2 2 353.426 2.919 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CCN(Cc4[nH]cc[nH+]4)CC3)o2)cc1 ZINC000537624014 517266154 /nfs/dbraw/zinc/26/61/54/517266154.db2.gz GDZPYDMYTUSSGT-UHFFFAOYSA-N 2 2 367.409 2.896 20 5 FFBDLP Cc1ccc([C@H](C[NH2+]C[C@H](O)COc2ccccc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000579111162 518527566 /nfs/dbraw/zinc/52/75/66/518527566.db2.gz VGLGRIOTDIYSBP-HKUYNNGSSA-N 2 2 373.453 2.535 20 5 FFBDLP O=[N+]([O-])c1cc(C[NH2+]C2CC[NH+]([C@@H]3CCOC3)CC2)cc(C(F)(F)F)c1 ZINC000594501404 520004081 /nfs/dbraw/zinc/00/40/81/520004081.db2.gz UTKLGQSAUARXII-OAHLLOKOSA-N 2 2 373.375 2.957 20 5 FFBDLP O=C(c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)N1CC[NH2+]C2(CCCCC2)C1 ZINC000594629017 520061425 /nfs/dbraw/zinc/06/14/25/520061425.db2.gz VYNAYKZQEDKLKD-UHFFFAOYSA-N 2 2 369.425 2.529 20 5 FFBDLP O=[N+]([O-])c1ccc(CC[NH2+][C@]2(CO)CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000609620442 520383430 /nfs/dbraw/zinc/38/34/30/520383430.db2.gz YXESOCGEVBUHAD-OAQYLSRUSA-N 2 2 369.465 2.754 20 5 FFBDLP O=[N+]([O-])c1ccc(CC[NH2+][C@]2(CO)CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000609620442 520383440 /nfs/dbraw/zinc/38/34/40/520383440.db2.gz YXESOCGEVBUHAD-OAQYLSRUSA-N 2 2 369.465 2.754 20 5 FFBDLP CCOc1cc(C[N@@H+]2CCC[C@@H]([NH+]3CCOCC3)CC2)ccc1[N+](=O)[O-] ZINC000595473004 520493159 /nfs/dbraw/zinc/49/31/59/520493159.db2.gz RZUDLFWBRNIKPW-QGZVFWFLSA-N 2 2 363.458 2.680 20 5 FFBDLP CCOc1cc(C[N@H+]2CCC[C@@H]([NH+]3CCOCC3)CC2)ccc1[N+](=O)[O-] ZINC000595473004 520493165 /nfs/dbraw/zinc/49/31/65/520493165.db2.gz RZUDLFWBRNIKPW-QGZVFWFLSA-N 2 2 363.458 2.680 20 5 FFBDLP COc1cc(C[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)c([N+](=O)[O-])cc1OC ZINC000596058390 520885339 /nfs/dbraw/zinc/88/53/39/520885339.db2.gz GPVVDZBDDLLWGF-OAHLLOKOSA-N 2 2 363.458 2.824 20 5 FFBDLP COc1cc(C[NH2+]C[C@H]2CCC[N@@H+](CC3CC3)C2)c([N+](=O)[O-])cc1OC ZINC000596058390 520885343 /nfs/dbraw/zinc/88/53/43/520885343.db2.gz GPVVDZBDDLLWGF-OAHLLOKOSA-N 2 2 363.458 2.824 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@@H](n3cc[nH+]c3)C2)cccc1[N+](=O)[O-] ZINC000610945211 520912917 /nfs/dbraw/zinc/91/29/17/520912917.db2.gz SQLPIECGDSEDIQ-LSDHHAIUSA-N 2 2 357.414 2.764 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@@H](n3cc[nH+]c3)C2)cccc1[N+](=O)[O-] ZINC000610945211 520912923 /nfs/dbraw/zinc/91/29/23/520912923.db2.gz SQLPIECGDSEDIQ-LSDHHAIUSA-N 2 2 357.414 2.764 20 5 FFBDLP O=[N+]([O-])c1c2cc[nH+]cc2ccc1N1CCC(C[NH+]2CCOCC2)CC1 ZINC000599026319 520987674 /nfs/dbraw/zinc/98/76/74/520987674.db2.gz UJLCUBLHHIHBPZ-UHFFFAOYSA-N 2 2 356.426 2.692 20 5 FFBDLP CC(C)[NH+]1CCN(C2CC[NH+](Cc3csc([N+](=O)[O-])c3)CC2)CC1 ZINC000611181200 521027093 /nfs/dbraw/zinc/02/70/93/521027093.db2.gz TWEJKDQTNVLXQB-UHFFFAOYSA-N 2 2 352.504 2.647 20 5 FFBDLP Cn1cc(C[N@@H+]2CC[C@@]3(C2)CCC[NH+](Cc2ccccc2)C3)c([N+](=O)[O-])n1 ZINC000602473065 521366018 /nfs/dbraw/zinc/36/60/18/521366018.db2.gz IMGUYQHWTYVNBS-FQEVSTJZSA-N 2 2 369.469 2.816 20 5 FFBDLP Cn1cc(C[N@H+]2CC[C@@]3(C2)CCC[NH+](Cc2ccccc2)C3)c([N+](=O)[O-])n1 ZINC000602473065 521366022 /nfs/dbraw/zinc/36/60/22/521366022.db2.gz IMGUYQHWTYVNBS-FQEVSTJZSA-N 2 2 369.469 2.816 20 5 FFBDLP Cn1cc(C[NH+]2CC[C@@]3(C2)CCC[N@H+](Cc2ccccc2)C3)c([N+](=O)[O-])n1 ZINC000602473065 521366029 /nfs/dbraw/zinc/36/60/29/521366029.db2.gz IMGUYQHWTYVNBS-FQEVSTJZSA-N 2 2 369.469 2.816 20 5 FFBDLP Cn1cc(C[NH+]2CC[C@@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)c([N+](=O)[O-])n1 ZINC000602473065 521366035 /nfs/dbraw/zinc/36/60/35/521366035.db2.gz IMGUYQHWTYVNBS-FQEVSTJZSA-N 2 2 369.469 2.816 20 5 FFBDLP CCC1([NH+]2CCOCC2)CC[NH+](CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000599670461 521386153 /nfs/dbraw/zinc/38/61/53/521386153.db2.gz WHYXHLUKNLQCPL-UHFFFAOYSA-N 2 2 363.458 2.550 20 5 FFBDLP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]CCc2cn3c([nH+]2)CCCC3)n1 ZINC000616008182 521601522 /nfs/dbraw/zinc/60/15/22/521601522.db2.gz WNOZOCCQKYAXEO-HZPDHXFCSA-N 2 2 358.446 2.640 20 5 FFBDLP C[NH+](Cc1ccccc1)C[C@@H](O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000619785175 521872370 /nfs/dbraw/zinc/87/23/70/521872370.db2.gz KINPGUSMGVLRKO-FQEVSTJZSA-N 2 2 357.454 2.562 20 5 FFBDLP C[NH+](Cc1ccccc1)C[C@@H](O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000619785175 521872372 /nfs/dbraw/zinc/87/23/72/521872372.db2.gz KINPGUSMGVLRKO-FQEVSTJZSA-N 2 2 357.454 2.562 20 5 FFBDLP C[NH+](CCc1cccc([N+](=O)[O-])c1)C[C@H](O)C[N@H+](C)Cc1ccccc1 ZINC000619785175 521872374 /nfs/dbraw/zinc/87/23/74/521872374.db2.gz KINPGUSMGVLRKO-FQEVSTJZSA-N 2 2 357.454 2.562 20 5 FFBDLP C[NH+](CCc1cccc([N+](=O)[O-])c1)C[C@H](O)C[N@@H+](C)Cc1ccccc1 ZINC000619785175 521872375 /nfs/dbraw/zinc/87/23/75/521872375.db2.gz KINPGUSMGVLRKO-FQEVSTJZSA-N 2 2 357.454 2.562 20 5 FFBDLP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3c(Br)cccc3[N+](=O)[O-])C[C@@H]21 ZINC000843059946 747758401 /nfs/dbraw/zinc/75/84/01/747758401.db2.gz VRLGGQCEAAFMFE-UHIISALHSA-N 2 2 354.248 2.917 20 5 FFBDLP [NH3+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3c(Br)cccc3[N+](=O)[O-])C[C@@H]21 ZINC000843059946 747758408 /nfs/dbraw/zinc/75/84/08/747758408.db2.gz VRLGGQCEAAFMFE-UHIISALHSA-N 2 2 354.248 2.917 20 5 FFBDLP CC[C@@H](C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)[NH+](CC)CC ZINC000813173990 995633426 /nfs/dbraw/zinc/63/34/26/995633426.db2.gz NMUGXMFXFOPYDU-ROUUACIJSA-N 2 2 363.458 2.833 20 5 FFBDLP CC[C@@H](C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)[NH+](CC)CC ZINC000813173990 995633434 /nfs/dbraw/zinc/63/34/34/995633434.db2.gz NMUGXMFXFOPYDU-ROUUACIJSA-N 2 2 363.458 2.833 20 5 FFBDLP CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)[C@H](C)[NH+](C)C ZINC001180862925 1009879527 /nfs/dbraw/zinc/87/95/27/1009879527.db2.gz WPRLYCAWIKXTDQ-LBPRGKRZSA-N 2 2 352.438 2.845 20 5 FFBDLP Cn1cc[nH+]c1[C@H]1CC[N@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777958148 1020331863 /nfs/dbraw/zinc/33/18/63/1020331863.db2.gz MGUPOTMDQUUMFV-HNNXBMFYSA-N 2 2 352.398 2.639 20 5 FFBDLP Cn1cc[nH+]c1[C@H]1CC[N@@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777958148 1020331870 /nfs/dbraw/zinc/33/18/70/1020331870.db2.gz MGUPOTMDQUUMFV-HNNXBMFYSA-N 2 2 352.398 2.639 20 5 FFBDLP C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777963458 1020332860 /nfs/dbraw/zinc/33/28/60/1020332860.db2.gz LRKRULMXVJTOFP-QFBILLFUSA-N 2 2 355.442 2.832 20 5 FFBDLP C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777963458 1020332868 /nfs/dbraw/zinc/33/28/68/1020332868.db2.gz LRKRULMXVJTOFP-QFBILLFUSA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777963458 1020332880 /nfs/dbraw/zinc/33/28/80/1020332880.db2.gz LRKRULMXVJTOFP-QFBILLFUSA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777963458 1020332887 /nfs/dbraw/zinc/33/28/87/1020332887.db2.gz LRKRULMXVJTOFP-QFBILLFUSA-N 2 2 355.442 2.832 20 5 FFBDLP COc1cc([C@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCCO3)CC2)cc([N+](=O)[O-])c1 ZINC000903096360 1020674313 /nfs/dbraw/zinc/67/43/13/1020674313.db2.gz BSSKFJZWTWLEJT-KSSFIOAISA-N 2 2 363.458 2.897 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH+]1C[C@H]3C[NH+](Cc4ccccn4)C[C@@H]3C1)C2 ZINC001254596679 1040824948 /nfs/dbraw/zinc/82/49/48/1040824948.db2.gz QETVJCVPVMIFKN-DBXWQHBBSA-N 2 2 364.449 2.521 20 5 FFBDLP C[C@H](C[NH2+]Cc1c(Br)cccc1[N+](=O)[O-])Cn1cc[nH+]c1 ZINC001461157718 1061228215 /nfs/dbraw/zinc/22/82/15/1061228215.db2.gz SDOVFJYEALGOSD-LLVKDONJSA-N 2 2 353.220 2.980 20 5 FFBDLP Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001473896408 1065411619 /nfs/dbraw/zinc/41/16/19/1065411619.db2.gz CLRUBLVNMLXSDX-OAHLLOKOSA-N 2 2 360.462 2.931 20 5 FFBDLP Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001473896408 1065411624 /nfs/dbraw/zinc/41/16/24/1065411624.db2.gz CLRUBLVNMLXSDX-OAHLLOKOSA-N 2 2 360.462 2.931 20 5 FFBDLP CCOc1cc(N2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4C)CC2)ccc1[N+](=O)[O-] ZINC000301845289 258070136 /nfs/dbraw/zinc/07/01/36/258070136.db2.gz MAPIHZHTKPYQBX-BYICEURKSA-N 2 2 374.485 2.741 20 5 FFBDLP CCOc1cc(N2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)ccc1[N+](=O)[O-] ZINC000301845289 258070137 /nfs/dbraw/zinc/07/01/37/258070137.db2.gz MAPIHZHTKPYQBX-BYICEURKSA-N 2 2 374.485 2.741 20 5 FFBDLP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC)[C@H](C)C1 ZINC000122414590 508531128 /nfs/dbraw/zinc/53/11/28/508531128.db2.gz QSLYPOMPHPUGCX-QAPCUYQASA-N 2 2 365.474 2.830 20 5 FFBDLP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC)[C@H](C)C1 ZINC000122414590 508531130 /nfs/dbraw/zinc/53/11/30/508531130.db2.gz QSLYPOMPHPUGCX-QAPCUYQASA-N 2 2 365.474 2.830 20 5 FFBDLP Cc1c(C[NH+]2CCN(C3C[C@H]4CC[C@@H](C3)[N@H+]4C)CC2)cccc1[N+](=O)[O-] ZINC000119526904 508813140 /nfs/dbraw/zinc/81/31/40/508813140.db2.gz QKVCKIKEKGPTNK-DFNIBXOVSA-N 2 2 358.486 2.646 20 5 FFBDLP Cc1c(C[NH+]2CCN(C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)cccc1[N+](=O)[O-] ZINC000119526904 508813144 /nfs/dbraw/zinc/81/31/44/508813144.db2.gz QKVCKIKEKGPTNK-DFNIBXOVSA-N 2 2 358.486 2.646 20 5 FFBDLP Cc1c(CN2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4C)CC2)cccc1[N+](=O)[O-] ZINC000119526904 508813145 /nfs/dbraw/zinc/81/31/45/508813145.db2.gz QKVCKIKEKGPTNK-DFNIBXOVSA-N 2 2 358.486 2.646 20 5 FFBDLP Cc1c(CN2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)cccc1[N+](=O)[O-] ZINC000119526904 508813149 /nfs/dbraw/zinc/81/31/49/508813149.db2.gz QKVCKIKEKGPTNK-DFNIBXOVSA-N 2 2 358.486 2.646 20 5 FFBDLP C[C@@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000173357042 509551781 /nfs/dbraw/zinc/55/17/81/509551781.db2.gz CTOVANGBKOUNHM-OAHLLOKOSA-N 2 2 355.442 2.592 20 5 FFBDLP C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000265443704 510057378 /nfs/dbraw/zinc/05/73/78/510057378.db2.gz AGUFLYAOXWNGMB-OLZOCXBDSA-N 2 2 368.865 2.849 20 5 FFBDLP C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000265443704 510057385 /nfs/dbraw/zinc/05/73/85/510057385.db2.gz AGUFLYAOXWNGMB-OLZOCXBDSA-N 2 2 368.865 2.849 20 5 FFBDLP C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[NH+](C)C[C@H]1CCC[N@H+](C)C1 ZINC000265443704 510057390 /nfs/dbraw/zinc/05/73/90/510057390.db2.gz AGUFLYAOXWNGMB-OLZOCXBDSA-N 2 2 368.865 2.849 20 5 FFBDLP C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[NH+](C)C[C@H]1CCC[N@@H+](C)C1 ZINC000265443704 510057394 /nfs/dbraw/zinc/05/73/94/510057394.db2.gz AGUFLYAOXWNGMB-OLZOCXBDSA-N 2 2 368.865 2.849 20 5 FFBDLP C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261884672 510100786 /nfs/dbraw/zinc/10/07/86/510100786.db2.gz YXNNTHLWLVRLCL-UAGQMJEPSA-N 2 2 368.437 2.596 20 5 FFBDLP C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261884672 510100794 /nfs/dbraw/zinc/10/07/94/510100794.db2.gz YXNNTHLWLVRLCL-UAGQMJEPSA-N 2 2 368.437 2.596 20 5 FFBDLP CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCN(c2cc(OC)cc[nH+]2)CC1 ZINC000175182515 510521491 /nfs/dbraw/zinc/52/14/91/510521491.db2.gz YBGKCDJRCFYEBC-UHFFFAOYSA-N 2 2 372.425 2.719 20 5 FFBDLP C[C@H](C[NH+]1CCCCCC1)NC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000185435691 510844765 /nfs/dbraw/zinc/84/47/65/510844765.db2.gz COPVJRIGKPMULL-OAHLLOKOSA-N 2 2 371.441 2.775 20 5 FFBDLP C[C@H]1C[NH+](CCCCNc2[nH+]ccc3ccc([N+](=O)[O-])cc32)C[C@H](C)O1 ZINC000413179976 513502512 /nfs/dbraw/zinc/50/25/12/513502512.db2.gz DCFCCUFNSSXUCN-GJZGRUSLSA-N 2 2 358.442 2.866 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1C[N@@H+](Cc1nccn1C)[C@H]1CC12CC[NH2+]CC2 ZINC000435434290 513586046 /nfs/dbraw/zinc/58/60/46/513586046.db2.gz XFKAATDBMYWFOC-SFHVURJKSA-N 2 2 369.469 2.781 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1C[N@H+](Cc1nccn1C)[C@H]1CC12CC[NH2+]CC2 ZINC000435434290 513586054 /nfs/dbraw/zinc/58/60/54/513586054.db2.gz XFKAATDBMYWFOC-SFHVURJKSA-N 2 2 369.469 2.781 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1CN(Cc1[nH+]ccn1C)[C@H]1CC12CC[NH2+]CC2 ZINC000435434290 513586059 /nfs/dbraw/zinc/58/60/59/513586059.db2.gz XFKAATDBMYWFOC-SFHVURJKSA-N 2 2 369.469 2.781 20 5 FFBDLP C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)[NH+]1CCC(C)CC1 ZINC000448815073 513912649 /nfs/dbraw/zinc/91/26/49/513912649.db2.gz ZMYBGKPCHQFKFR-HNNXBMFYSA-N 2 2 371.441 2.631 20 5 FFBDLP COc1cc(C[NH2+]CC2([NH3+])CCC2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000414871629 514332678 /nfs/dbraw/zinc/33/26/78/514332678.db2.gz DQQGCOHXWFSSKM-UHFFFAOYSA-N 2 2 363.336 2.516 20 5 FFBDLP CC(C)[C@@H](C[N@H+](C)Cc1ccccc1)[NH2+]CCn1cc([N+](=O)[O-])ccc1=O ZINC000472553978 515310879 /nfs/dbraw/zinc/31/08/79/515310879.db2.gz IUMNMFFLMZQHEM-LJQANCHMSA-N 2 2 372.469 2.503 20 5 FFBDLP CC(C)[C@@H](C[N@@H+](C)Cc1ccccc1)[NH2+]CCn1cc([N+](=O)[O-])ccc1=O ZINC000472553978 515310894 /nfs/dbraw/zinc/31/08/94/515310894.db2.gz IUMNMFFLMZQHEM-LJQANCHMSA-N 2 2 372.469 2.503 20 5 FFBDLP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]CCc2cn3ccccc3[nH+]2)n1 ZINC000472604621 515334167 /nfs/dbraw/zinc/33/41/67/515334167.db2.gz WEQGFHYQUJTJLB-JKSUJKDBSA-N 2 2 354.414 2.755 20 5 FFBDLP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]C2CCN(c3cccc[nH+]3)CC2)n1 ZINC000585794121 518601598 /nfs/dbraw/zinc/60/15/98/518601598.db2.gz FTMDPYXHQXSCMY-IAGOWNOFSA-N 2 2 370.457 2.929 20 5 FFBDLP Cn1cc[nH+]c1[C@@H](N[C@@H]1CC[NH2+]C2(CCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000591582261 519958957 /nfs/dbraw/zinc/95/89/57/519958957.db2.gz BXHWZJMIMWXRDK-WBVHZDCISA-N 2 2 355.442 2.682 20 5 FFBDLP COc1cc(C[NH2+]CCc2cn3c(cccc3C)[nH+]2)c([N+](=O)[O-])cc1OC ZINC000592379382 520359532 /nfs/dbraw/zinc/35/95/32/520359532.db2.gz NADCYEPFRQTLSJ-UHFFFAOYSA-N 2 2 370.409 2.900 20 5 FFBDLP CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](C(F)(F)F)[C@@H](C[NH3+])C1 ZINC000600729385 520428731 /nfs/dbraw/zinc/42/87/31/520428731.db2.gz YLLWWWFHWFOAGT-JSGCOSHPSA-N 2 2 361.364 2.953 20 5 FFBDLP CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](C(F)(F)F)[C@@H](C[NH3+])C1 ZINC000600729385 520428738 /nfs/dbraw/zinc/42/87/38/520428738.db2.gz YLLWWWFHWFOAGT-JSGCOSHPSA-N 2 2 361.364 2.953 20 5 FFBDLP C[C@@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@H]1CC[NH3+] ZINC000593735707 521182173 /nfs/dbraw/zinc/18/21/73/521182173.db2.gz ZHELPGDCRUUCHJ-RISCZKNCSA-N 2 2 354.838 2.636 20 5 FFBDLP C[C@@H]1CCC[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@H]1CC[NH3+] ZINC000593735707 521182181 /nfs/dbraw/zinc/18/21/81/521182181.db2.gz ZHELPGDCRUUCHJ-RISCZKNCSA-N 2 2 354.838 2.636 20 5 FFBDLP C[NH+](C)CC[C@@H]([NH3+])C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000593910388 521284886 /nfs/dbraw/zinc/28/48/86/521284886.db2.gz VLALDMFYCIZFHX-QGZVFWFLSA-N 2 2 358.398 2.605 20 5 FFBDLP O=[N+]([O-])c1cccc([C@@H](O)C[NH2+][C@H](Cn2cc[nH+]c2)c2ccccc2)c1 ZINC001197265471 1004147697 /nfs/dbraw/zinc/14/76/97/1004147697.db2.gz SJEKDHVXCOSTDL-MOPGFXCFSA-N 2 2 352.394 2.856 20 5 FFBDLP C[NH+](C)CCCC1CC[NH+](Cn2c(=O)oc3cccc([N+](=O)[O-])c32)CC1 ZINC000794638740 1010437439 /nfs/dbraw/zinc/43/74/39/1010437439.db2.gz GKUSAEAUIRSQNF-UHFFFAOYSA-N 2 2 362.430 2.514 20 5 FFBDLP Cc1[nH+]cn(C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)c1CC[NH3+] ZINC001173011365 1012181692 /nfs/dbraw/zinc/18/16/92/1012181692.db2.gz BWOOVKNASTUYNR-UHFFFAOYSA-N 2 2 365.384 2.721 20 5 FFBDLP C[N@@H+]1CCCC[C@@H]1CCOC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000838101766 1026208895 /nfs/dbraw/zinc/20/88/95/1026208895.db2.gz LPAVEIJJGHNDBM-OAHLLOKOSA-N 2 2 358.398 2.812 20 5 FFBDLP C[N@H+]1CCCC[C@@H]1CCOC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000838101766 1026208909 /nfs/dbraw/zinc/20/89/09/1026208909.db2.gz LPAVEIJJGHNDBM-OAHLLOKOSA-N 2 2 358.398 2.812 20 5 FFBDLP CC[NH+](CC)CC[NH2+]C1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC001256081720 1038366681 /nfs/dbraw/zinc/36/66/81/1038366681.db2.gz CYNIBPOJHKJGMI-UHFFFAOYSA-N 2 2 350.463 2.504 20 5 FFBDLP Cc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2CO)cc1[N+](=O)[O-] ZINC001200704261 1059154564 /nfs/dbraw/zinc/15/45/64/1059154564.db2.gz SCUNSGSORUPPDI-WOJBJXKFSA-N 2 2 369.465 2.876 20 5 FFBDLP Cc1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2CO)cc1[N+](=O)[O-] ZINC001200704261 1059154587 /nfs/dbraw/zinc/15/45/87/1059154587.db2.gz SCUNSGSORUPPDI-WOJBJXKFSA-N 2 2 369.465 2.876 20 5 FFBDLP COc1cc[nH+]c(N2CC[NH+](C/C=C/c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000093078917 508119342 /nfs/dbraw/zinc/11/93/42/508119342.db2.gz MEZGZCQXSBCJCK-GQCTYLIASA-N 2 2 354.410 2.834 20 5 FFBDLP C[C@@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000116396987 508507253 /nfs/dbraw/zinc/50/72/53/508507253.db2.gz CEYMVSGNBIKPLM-CJNGLKHVSA-N 2 2 350.463 2.878 20 5 FFBDLP CCOc1ccc([C@H](C)[NH2+]C[C@H](C)C[NH+]2CCOCC2)cc1[N+](=O)[O-] ZINC000153902267 508673531 /nfs/dbraw/zinc/67/35/31/508673531.db2.gz FLSQBSSYHZZVNM-GJZGRUSLSA-N 2 2 351.447 2.612 20 5 FFBDLP C[NH+](C)CC1CCC(NC(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)CC1 ZINC000129561025 508740450 /nfs/dbraw/zinc/74/04/50/508740450.db2.gz NYRWJVVDNGCUBO-UHFFFAOYSA-N 2 2 371.441 2.631 20 5 FFBDLP CN(c1ccccc1)c1ccc(C[NH2+]C[C@](C)(O)C[NH+](C)C)cc1[N+](=O)[O-] ZINC000131456807 508934307 /nfs/dbraw/zinc/93/43/07/508934307.db2.gz QSXCCDAUCIDPIV-FQEVSTJZSA-N 2 2 372.469 2.765 20 5 FFBDLP C[C@@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1n1cc[nH+]c1 ZINC000120208447 508950747 /nfs/dbraw/zinc/95/07/47/508950747.db2.gz CUWYJEIZQZVJPM-CJNGLKHVSA-N 2 2 368.397 2.924 20 5 FFBDLP C[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1n1cc[nH+]c1 ZINC000120208447 508950748 /nfs/dbraw/zinc/95/07/48/508950748.db2.gz CUWYJEIZQZVJPM-CJNGLKHVSA-N 2 2 368.397 2.924 20 5 FFBDLP O=[N+]([O-])c1cc(C[NH+]2CCC(CCC[NH+]3CCOCC3)CC2)cs1 ZINC000182979556 509528421 /nfs/dbraw/zinc/52/84/21/509528421.db2.gz PQMJPMJOALFWMH-UHFFFAOYSA-N 2 2 353.488 2.981 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@@H](c2ccccc2)[C@H]([NH3+])C1 ZINC000261686475 510027003 /nfs/dbraw/zinc/02/70/03/510027003.db2.gz ISXVCQPHFXHQBC-ZWKOTPCHSA-N 2 2 368.437 2.659 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@@H](c2ccccc2)[C@H]([NH3+])C1 ZINC000261686475 510027008 /nfs/dbraw/zinc/02/70/08/510027008.db2.gz ISXVCQPHFXHQBC-ZWKOTPCHSA-N 2 2 368.437 2.659 20 5 FFBDLP COc1cc(C[N@@H+]2CCC[C@@H](Cc3[nH+]ccn3C)C2)c([N+](=O)[O-])cc1OC ZINC000184731717 510489863 /nfs/dbraw/zinc/48/98/63/510489863.db2.gz CMSASHSHISKQKJ-AWEZNQCLSA-N 2 2 374.441 2.800 20 5 FFBDLP COc1cc(C[N@H+]2CCC[C@@H](Cc3[nH+]ccn3C)C2)c([N+](=O)[O-])cc1OC ZINC000184731717 510489869 /nfs/dbraw/zinc/48/98/69/510489869.db2.gz CMSASHSHISKQKJ-AWEZNQCLSA-N 2 2 374.441 2.800 20 5 FFBDLP COc1cc(C[N@@H+]2CC[C@H](C[NH3+])C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000435392171 513574005 /nfs/dbraw/zinc/57/40/05/513574005.db2.gz VNKQAEWIDRPDTN-MRXNPFEDSA-N 2 2 371.437 2.963 20 5 FFBDLP COc1cc(C[N@H+]2CC[C@H](C[NH3+])C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000435392171 513574011 /nfs/dbraw/zinc/57/40/11/513574011.db2.gz VNKQAEWIDRPDTN-MRXNPFEDSA-N 2 2 371.437 2.963 20 5 FFBDLP CN(C(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)C(C)(C)C[NH+]1CCCC1 ZINC000416112511 513576576 /nfs/dbraw/zinc/57/65/76/513576576.db2.gz XJFRSVQKHCNUPG-UHFFFAOYSA-N 2 2 371.441 2.727 20 5 FFBDLP Cn1cnc([N+](=O)[O-])c1C[N@H+](Cc1ccsc1)[C@H]1CC12CC[NH2+]CC2 ZINC000435698809 513661996 /nfs/dbraw/zinc/66/19/96/513661996.db2.gz XWVLGQVAYFEQOV-HNNXBMFYSA-N 2 2 361.471 2.534 20 5 FFBDLP Cn1cnc([N+](=O)[O-])c1C[N@@H+](Cc1ccsc1)[C@H]1CC12CC[NH2+]CC2 ZINC000435698809 513662000 /nfs/dbraw/zinc/66/20/00/513662000.db2.gz XWVLGQVAYFEQOV-HNNXBMFYSA-N 2 2 361.471 2.534 20 5 FFBDLP COc1ccc([C@@H]2CC[NH2+]C[C@@H]2[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000414884969 514340322 /nfs/dbraw/zinc/34/03/22/514340322.db2.gz OTHCGPRAXODBEB-ROUUACIJSA-N 2 2 371.437 2.847 20 5 FFBDLP CCC[N@H+](C)C[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)C1 ZINC000449986021 514453546 /nfs/dbraw/zinc/45/35/46/514453546.db2.gz FVZPVMXTMZJLGW-HNNXBMFYSA-N 2 2 371.441 2.584 20 5 FFBDLP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)C1 ZINC000449986021 514453552 /nfs/dbraw/zinc/45/35/52/514453552.db2.gz FVZPVMXTMZJLGW-HNNXBMFYSA-N 2 2 371.441 2.584 20 5 FFBDLP CC[N@@H+]1CC[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)[C@H](C)C1 ZINC000449990726 514456562 /nfs/dbraw/zinc/45/65/62/514456562.db2.gz XCZKLNOJLSTKLW-GDBMZVCRSA-N 2 2 371.441 2.583 20 5 FFBDLP CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)[C@H](C)C1 ZINC000449990726 514456567 /nfs/dbraw/zinc/45/65/67/514456567.db2.gz XCZKLNOJLSTKLW-GDBMZVCRSA-N 2 2 371.441 2.583 20 5 FFBDLP Cc1cc(NC[C@]2([NH+](C)C)CCSC2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000479459331 514592008 /nfs/dbraw/zinc/59/20/08/514592008.db2.gz XOYPHIACAXOCOD-GOSISDBHSA-N 2 2 373.482 2.631 20 5 FFBDLP COc1ccc(NC(=O)[C@@H](C)[NH+]2CCC(c3[nH]cc[nH+]3)CC2)c([N+](=O)[O-])c1 ZINC000467132028 514910286 /nfs/dbraw/zinc/91/02/86/514910286.db2.gz PWPOICJJIAUYER-GFCCVEGCSA-N 2 2 373.413 2.533 20 5 FFBDLP Cc1[nH+]ccn1CCCNc1cc(C)[nH+]c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000509450685 515185002 /nfs/dbraw/zinc/18/50/02/515185002.db2.gz HBFSOMXQFKBQNX-UHFFFAOYSA-N 2 2 352.398 2.789 20 5 FFBDLP C[NH+]1CCC([N@@H+]2CC[C@H](Nc3nccc4ccc([N+](=O)[O-])cc43)C2)CC1 ZINC000591147590 519529954 /nfs/dbraw/zinc/52/99/54/519529954.db2.gz RKWWOEAEBORHFX-HNNXBMFYSA-N 2 2 355.442 2.723 20 5 FFBDLP C[NH+]1CCC([N@H+]2CC[C@H](Nc3nccc4ccc([N+](=O)[O-])cc43)C2)CC1 ZINC000591147590 519529962 /nfs/dbraw/zinc/52/99/62/519529962.db2.gz RKWWOEAEBORHFX-HNNXBMFYSA-N 2 2 355.442 2.723 20 5 FFBDLP COc1ccc(C[NH2+][C@@H]2C[NH2+]CC[C@@H]2c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000594739306 520125281 /nfs/dbraw/zinc/12/52/81/520125281.db2.gz UKNIDHOUDUWCGK-IAGOWNOFSA-N 2 2 359.401 2.978 20 5 FFBDLP CC[C@H]1C[N@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])CC[C@@H]1[NH3+] ZINC000592427652 520388219 /nfs/dbraw/zinc/38/82/19/520388219.db2.gz NJUMTADJDFZLPM-JQWIXIFHSA-N 2 2 359.373 2.764 20 5 FFBDLP CC[C@H]1C[N@@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])CC[C@@H]1[NH3+] ZINC000592427652 520388224 /nfs/dbraw/zinc/38/82/24/520388224.db2.gz NJUMTADJDFZLPM-JQWIXIFHSA-N 2 2 359.373 2.764 20 5 FFBDLP CC(C)C[N@H+](C)CCCNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000593479349 521020885 /nfs/dbraw/zinc/02/08/85/521020885.db2.gz BGSQTHKUDSVKHU-UHFFFAOYSA-N 2 2 364.490 2.817 20 5 FFBDLP CC(C)C[N@@H+](C)CCCNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000593479349 521020893 /nfs/dbraw/zinc/02/08/93/521020893.db2.gz BGSQTHKUDSVKHU-UHFFFAOYSA-N 2 2 364.490 2.817 20 5 FFBDLP CC(C)[N@@H+]1CC[C@@H]([NH2+]C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173012710 1012183814 /nfs/dbraw/zinc/18/38/14/1012183814.db2.gz WTCNOSXNJUFINS-CQSZACIVSA-N 2 2 368.428 2.914 20 5 FFBDLP CC(C)[N@H+]1CC[C@@H]([NH2+]C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173012710 1012183826 /nfs/dbraw/zinc/18/38/26/1012183826.db2.gz WTCNOSXNJUFINS-CQSZACIVSA-N 2 2 368.428 2.914 20 5 FFBDLP C[N@@H+]1CCC[C@@H]2C[NH+](Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)CC[C@@H]21 ZINC000777963008 1020355922 /nfs/dbraw/zinc/35/59/22/1020355922.db2.gz FORBQYITJLOWBY-APWZRJJASA-N 2 2 355.442 2.832 20 5 FFBDLP C[N@H+]1CCC[C@@H]2C[NH+](Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)CC[C@@H]21 ZINC000777963008 1020355931 /nfs/dbraw/zinc/35/59/31/1020355931.db2.gz FORBQYITJLOWBY-APWZRJJASA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CCC[C@@H]2C[N@H+](Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)CC[C@@H]21 ZINC000777963008 1020355935 /nfs/dbraw/zinc/35/59/35/1020355935.db2.gz FORBQYITJLOWBY-APWZRJJASA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CCC[C@@H]2C[N@@H+](Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)CC[C@@H]21 ZINC000777963008 1020355946 /nfs/dbraw/zinc/35/59/46/1020355946.db2.gz FORBQYITJLOWBY-APWZRJJASA-N 2 2 355.442 2.832 20 5 FFBDLP COc1cc(N2CCC([N@H+]3C[C@H]4[C@H](C3)CCC[NH+]4C)CC2)ccc1[N+](=O)[O-] ZINC001256101346 1038387941 /nfs/dbraw/zinc/38/79/41/1038387941.db2.gz FMPGJPWTXYBQDE-KXBFYZLASA-N 2 2 374.485 2.598 20 5 FFBDLP COc1cc(N2CCC([N@@H+]3C[C@H]4[C@H](C3)CCC[NH+]4C)CC2)ccc1[N+](=O)[O-] ZINC001256101346 1038387949 /nfs/dbraw/zinc/38/79/49/1038387949.db2.gz FMPGJPWTXYBQDE-KXBFYZLASA-N 2 2 374.485 2.598 20 5 FFBDLP COc1cc(N2CCC([NH+]3C[C@H]4[C@H](C3)CCC[N@@H+]4C)CC2)ccc1[N+](=O)[O-] ZINC001256101346 1038387957 /nfs/dbraw/zinc/38/79/57/1038387957.db2.gz FMPGJPWTXYBQDE-KXBFYZLASA-N 2 2 374.485 2.598 20 5 FFBDLP COc1cc(N2CCC([NH+]3C[C@H]4[C@H](C3)CCC[N@H+]4C)CC2)ccc1[N+](=O)[O-] ZINC001256101346 1038387964 /nfs/dbraw/zinc/38/79/64/1038387964.db2.gz FMPGJPWTXYBQDE-KXBFYZLASA-N 2 2 374.485 2.598 20 5 FFBDLP C[N@@H+]1CC[C@](O)(C[NH2+]Cc2ccc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC001321128751 1045556125 /nfs/dbraw/zinc/55/61/25/1045556125.db2.gz AUIZIHPIZFBSOC-KRWDZBQOSA-N 2 2 365.817 2.664 20 5 FFBDLP C[N@H+]1CC[C@](O)(C[NH2+]Cc2ccc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC001321128751 1045556135 /nfs/dbraw/zinc/55/61/35/1045556135.db2.gz AUIZIHPIZFBSOC-KRWDZBQOSA-N 2 2 365.817 2.664 20 5 FFBDLP C[C@](CO)([NH2+]Cc1ccc(-n2cc[nH+]c2)cc1)c1cccc([N+](=O)[O-])c1 ZINC001473714118 1065328524 /nfs/dbraw/zinc/32/85/24/1065328524.db2.gz LKYXGNHEPAUSQL-LJQANCHMSA-N 2 2 352.394 2.778 20 5 FFBDLP Cc1cc(NCC[NH+]2CCC([NH+](C)C)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000272836865 252143499 /nfs/dbraw/zinc/14/34/99/252143499.db2.gz MDUMYVSLRCXFFZ-UHFFFAOYSA-N 3 2 357.458 2.889 20 5 FFBDLP C[C@H]1C[NH+](CC2CC[NH+](Cc3csc([N+](=O)[O-])c3)CC2)C[C@H](C)O1 ZINC000330427431 258163788 /nfs/dbraw/zinc/16/37/88/258163788.db2.gz KLCXZVCISANDLQ-KBPBESRZSA-N 2 2 353.488 2.978 20 5 FFBDLP CC[N@@H+]1CC[C@@H]([NH+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000081096033 508136847 /nfs/dbraw/zinc/13/68/47/508136847.db2.gz UAPKAZZVTKUAJJ-IUODEOHRSA-N 2 2 368.865 2.849 20 5 FFBDLP CC[N@H+]1CC[C@@H]([NH+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000081096033 508136850 /nfs/dbraw/zinc/13/68/50/508136850.db2.gz UAPKAZZVTKUAJJ-IUODEOHRSA-N 2 2 368.865 2.849 20 5 FFBDLP CC[NH+]1CC[C@@H]([N@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000081096033 508136853 /nfs/dbraw/zinc/13/68/53/508136853.db2.gz UAPKAZZVTKUAJJ-IUODEOHRSA-N 2 2 368.865 2.849 20 5 FFBDLP CC[NH+]1CC[C@@H]([N@@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000081096033 508136856 /nfs/dbraw/zinc/13/68/56/508136856.db2.gz UAPKAZZVTKUAJJ-IUODEOHRSA-N 2 2 368.865 2.849 20 5 FFBDLP C[C@@H]1CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H]1n1cc[nH+]c1 ZINC000156454813 508423352 /nfs/dbraw/zinc/42/33/52/508423352.db2.gz BLEBKEBRXYASDH-CJNGLKHVSA-N 2 2 368.397 2.924 20 5 FFBDLP C[C@@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H]1n1cc[nH+]c1 ZINC000156454813 508423355 /nfs/dbraw/zinc/42/33/55/508423355.db2.gz BLEBKEBRXYASDH-CJNGLKHVSA-N 2 2 368.397 2.924 20 5 FFBDLP C[C@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000116396634 508506364 /nfs/dbraw/zinc/50/63/64/508506364.db2.gz GNYSRCXXHFZIAQ-BBRMVZONSA-N 2 2 350.463 2.878 20 5 FFBDLP C[C@@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000116396994 508507221 /nfs/dbraw/zinc/50/72/21/508507221.db2.gz CEYMVSGNBIKPLM-CZUORRHYSA-N 2 2 350.463 2.878 20 5 FFBDLP Cc1c(C[NH+]2CCN(CC[N@H+]3[C@H](C)CC[C@@H]3C)CC2)cccc1[N+](=O)[O-] ZINC000153920211 508676988 /nfs/dbraw/zinc/67/69/88/508676988.db2.gz XXDQTAZVUJBSKR-CALCHBBNSA-N 2 2 360.502 2.894 20 5 FFBDLP Cc1c(C[NH+]2CCN(CC[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)cccc1[N+](=O)[O-] ZINC000153920211 508676993 /nfs/dbraw/zinc/67/69/93/508676993.db2.gz XXDQTAZVUJBSKR-CALCHBBNSA-N 2 2 360.502 2.894 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@@H](c4[nH]cc[nH+]4)C3)o2)cc1 ZINC000266920024 509258553 /nfs/dbraw/zinc/25/85/53/509258553.db2.gz LPYZYWOJMDGIRM-CYBMUJFWSA-N 2 2 354.370 2.748 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@@H](c4[nH]cc[nH+]4)C3)o2)cc1 ZINC000266920024 509258559 /nfs/dbraw/zinc/25/85/59/509258559.db2.gz LPYZYWOJMDGIRM-CYBMUJFWSA-N 2 2 354.370 2.748 20 5 FFBDLP C[C@H]([NH2+]C[C@@H](O)C[N@@H+]1CCc2ccccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000173315878 509527002 /nfs/dbraw/zinc/52/70/02/509527002.db2.gz ONUBAVLLWQOWCN-MGPUTAFESA-N 2 2 355.438 2.665 20 5 FFBDLP C[C@H]([NH2+]C[C@@H](O)C[N@H+]1CCc2ccccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000173315878 509527007 /nfs/dbraw/zinc/52/70/07/509527007.db2.gz ONUBAVLLWQOWCN-MGPUTAFESA-N 2 2 355.438 2.665 20 5 FFBDLP Cc1c(NC(=O)CC[N@H+](CC[NH3+])CCc2ccccc2)cccc1[N+](=O)[O-] ZINC000261660407 510016643 /nfs/dbraw/zinc/01/66/43/510016643.db2.gz AXSRAWKOLUZMEQ-UHFFFAOYSA-N 2 2 370.453 2.735 20 5 FFBDLP Cc1c(NC(=O)CC[N@@H+](CC[NH3+])CCc2ccccc2)cccc1[N+](=O)[O-] ZINC000261660407 510016652 /nfs/dbraw/zinc/01/66/52/510016652.db2.gz AXSRAWKOLUZMEQ-UHFFFAOYSA-N 2 2 370.453 2.735 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](CC[NH3+])CCc1ccccc1 ZINC000261702077 510032790 /nfs/dbraw/zinc/03/27/90/510032790.db2.gz GIIZGNVHEUQNAE-UHFFFAOYSA-N 2 2 370.453 2.735 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](CC[NH3+])CCc1ccccc1 ZINC000261702077 510032795 /nfs/dbraw/zinc/03/27/95/510032795.db2.gz GIIZGNVHEUQNAE-UHFFFAOYSA-N 2 2 370.453 2.735 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000245743939 510122461 /nfs/dbraw/zinc/12/24/61/510122461.db2.gz XSOBULNJHPURNJ-GUYCJALGSA-N 2 2 357.414 2.621 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000245743939 510122469 /nfs/dbraw/zinc/12/24/69/510122469.db2.gz XSOBULNJHPURNJ-GUYCJALGSA-N 2 2 357.414 2.621 20 5 FFBDLP C[NH+](C)CC[C@H](NC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)C(C)(C)C ZINC000172267195 510640077 /nfs/dbraw/zinc/64/00/77/510640077.db2.gz DNYACJVPUAWAFJ-KRWDZBQOSA-N 2 2 373.457 2.877 20 5 FFBDLP O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c2c(c1)COCO2 ZINC000246909293 510739866 /nfs/dbraw/zinc/73/98/66/510739866.db2.gz RWUUKLLOYOKVMT-IFXJQAMLSA-N 2 2 373.453 2.910 20 5 FFBDLP O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c2c(c1)COCO2 ZINC000246909293 510739869 /nfs/dbraw/zinc/73/98/69/510739869.db2.gz RWUUKLLOYOKVMT-IFXJQAMLSA-N 2 2 373.453 2.910 20 5 FFBDLP O=[N+]([O-])c1cc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c2c(c1)COCO2 ZINC000246909293 510739875 /nfs/dbraw/zinc/73/98/75/510739875.db2.gz RWUUKLLOYOKVMT-IFXJQAMLSA-N 2 2 373.453 2.910 20 5 FFBDLP O=[N+]([O-])c1cc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c2c(c1)COCO2 ZINC000246909293 510739881 /nfs/dbraw/zinc/73/98/81/510739881.db2.gz RWUUKLLOYOKVMT-IFXJQAMLSA-N 2 2 373.453 2.910 20 5 FFBDLP C[C@@H](Nc1ccc(N2CC[C@@H]([NH+](C)C)C2)c[nH+]1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000284985862 511957647 /nfs/dbraw/zinc/95/76/47/511957647.db2.gz GHDVTXUSDOLILN-CZUORRHYSA-N 2 2 370.457 2.885 20 5 FFBDLP COc1ccc(NC(=O)[C@@H](C)[N@@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)c([N+](=O)[O-])c1 ZINC000377917707 512511349 /nfs/dbraw/zinc/51/13/49/512511349.db2.gz RXYCEAYCDONAJL-CHWSQXEVSA-N 2 2 373.413 2.533 20 5 FFBDLP COc1ccc(NC(=O)[C@@H](C)[N@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)c([N+](=O)[O-])c1 ZINC000377917707 512511352 /nfs/dbraw/zinc/51/13/52/512511352.db2.gz RXYCEAYCDONAJL-CHWSQXEVSA-N 2 2 373.413 2.533 20 5 FFBDLP CCn1ccnc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H]1CC12CC[NH2+]CC2 ZINC000435422888 513577820 /nfs/dbraw/zinc/57/78/20/513577820.db2.gz QITVOUJSJXRDTD-SFHVURJKSA-N 2 2 369.469 2.956 20 5 FFBDLP CCn1ccnc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H]1CC12CC[NH2+]CC2 ZINC000435422888 513577824 /nfs/dbraw/zinc/57/78/24/513577824.db2.gz QITVOUJSJXRDTD-SFHVURJKSA-N 2 2 369.469 2.956 20 5 FFBDLP CCn1cc[nH+]c1CN(Cc1ccc([N+](=O)[O-])cc1)[C@H]1CC12CC[NH2+]CC2 ZINC000435422888 513577830 /nfs/dbraw/zinc/57/78/30/513577830.db2.gz QITVOUJSJXRDTD-SFHVURJKSA-N 2 2 369.469 2.956 20 5 FFBDLP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2OC)[C@@H](C)C1 ZINC000430201043 513587395 /nfs/dbraw/zinc/58/73/95/513587395.db2.gz BWBCISSAYLLLNN-MAUKXSAKSA-N 2 2 365.474 2.830 20 5 FFBDLP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2OC)[C@@H](C)C1 ZINC000430201043 513587397 /nfs/dbraw/zinc/58/73/97/513587397.db2.gz BWBCISSAYLLLNN-MAUKXSAKSA-N 2 2 365.474 2.830 20 5 FFBDLP Cn1cc[nH+]c1CN(Cc1c(F)cccc1[N+](=O)[O-])[C@@H]1CC12CC[NH2+]CC2 ZINC000435697223 513661136 /nfs/dbraw/zinc/66/11/36/513661136.db2.gz XNRFJXONEHOLTP-QGZVFWFLSA-N 2 2 373.432 2.612 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC(c2nnc3n2CC[NH2+]C3)CC1 ZINC000420360477 514110961 /nfs/dbraw/zinc/11/09/61/514110961.db2.gz WSZSKMDNGOVESR-AWEZNQCLSA-N 2 2 370.457 2.539 20 5 FFBDLP C[C@H]([NH2+]C[C@H]1C[NH2+]CCN1C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423481865 514149414 /nfs/dbraw/zinc/14/94/14/514149414.db2.gz QYFDOSCQDUNVHX-UONOGXRCSA-N 2 2 360.483 2.878 20 5 FFBDLP CCC[N@@H+]1CC[C@H](CNc2cc(C[NH+]3CCOCC3)ccc2[N+](=O)[O-])C1 ZINC000472345134 515236055 /nfs/dbraw/zinc/23/60/55/515236055.db2.gz VJIMWFQAASOZAI-QGZVFWFLSA-N 2 2 362.474 2.571 20 5 FFBDLP CCC[N@H+]1CC[C@H](CNc2cc(C[NH+]3CCOCC3)ccc2[N+](=O)[O-])C1 ZINC000472345134 515236068 /nfs/dbraw/zinc/23/60/68/515236068.db2.gz VJIMWFQAASOZAI-QGZVFWFLSA-N 2 2 362.474 2.571 20 5 FFBDLP CC[NH+](CC)C[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000482152915 515590590 /nfs/dbraw/zinc/59/05/90/515590590.db2.gz SSGPXTGZKCQYEG-IAGOWNOFSA-N 2 2 362.474 2.684 20 5 FFBDLP CN(C(=O)C[NH+]1CCC(Nc2cccc[nH+]2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000535575821 516407187 /nfs/dbraw/zinc/40/71/87/516407187.db2.gz SEVFUWMIEQLGJR-UHFFFAOYSA-N 2 2 369.425 2.529 20 5 FFBDLP C[N@H+](CCN1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1)Cc1ccccc1 ZINC000513451072 516628773 /nfs/dbraw/zinc/62/87/73/516628773.db2.gz NRUKJZBGERESHS-UHFFFAOYSA-N 2 2 368.481 2.844 20 5 FFBDLP C[N@@H+](CCN1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1)Cc1ccccc1 ZINC000513451072 516628780 /nfs/dbraw/zinc/62/87/80/516628780.db2.gz NRUKJZBGERESHS-UHFFFAOYSA-N 2 2 368.481 2.844 20 5 FFBDLP CC(C)[NH+]1CCN([C@H]2CC[N@H+](Cc3c(Cl)cccc3[N+](=O)[O-])C2)CC1 ZINC000547968079 516664696 /nfs/dbraw/zinc/66/46/96/516664696.db2.gz BZUUDBIOGIWUCK-HNNXBMFYSA-N 2 2 366.893 2.849 20 5 FFBDLP CC(C)[NH+]1CCN([C@H]2CC[N@@H+](Cc3c(Cl)cccc3[N+](=O)[O-])C2)CC1 ZINC000547968079 516664703 /nfs/dbraw/zinc/66/47/03/516664703.db2.gz BZUUDBIOGIWUCK-HNNXBMFYSA-N 2 2 366.893 2.849 20 5 FFBDLP Cn1ccnc1[C@@H]([NH2+]CCCCn1cc[nH+]c1)c1cccc([N+](=O)[O-])c1 ZINC000560516478 517866570 /nfs/dbraw/zinc/86/65/70/517866570.db2.gz KBVNVQFAAKKGRV-KRWDZBQOSA-N 2 2 354.414 2.684 20 5 FFBDLP C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(Nc2cccc[nH+]2)CC1 ZINC000534861855 518059672 /nfs/dbraw/zinc/05/96/72/518059672.db2.gz BYNNNZVBQRPEST-AWEZNQCLSA-N 2 2 369.425 2.893 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c1 ZINC000589503019 519020496 /nfs/dbraw/zinc/02/04/96/519020496.db2.gz KBQXXXDKKISPMK-OAHLLOKOSA-N 2 2 361.442 2.689 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c1 ZINC000589503019 519020504 /nfs/dbraw/zinc/02/05/04/519020504.db2.gz KBQXXXDKKISPMK-OAHLLOKOSA-N 2 2 361.442 2.689 20 5 FFBDLP O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C[C@@H](O)C[N@@H+]1CCc2ccccc2C1 ZINC000568663993 519154965 /nfs/dbraw/zinc/15/49/65/519154965.db2.gz JPVSIIUWPWZNPC-XLIONFOSSA-N 2 2 367.449 2.591 20 5 FFBDLP O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000568663993 519154973 /nfs/dbraw/zinc/15/49/73/519154973.db2.gz JPVSIIUWPWZNPC-XLIONFOSSA-N 2 2 367.449 2.591 20 5 FFBDLP CC(C)(C)[N@@H+]1CC[C@H](CNC(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)C1 ZINC000597854307 520283808 /nfs/dbraw/zinc/28/38/08/520283808.db2.gz FXPFOVSXLHHFSK-CQSZACIVSA-N 2 2 371.441 2.631 20 5 FFBDLP CC(C)(C)[N@H+]1CC[C@H](CNC(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)C1 ZINC000597854307 520283814 /nfs/dbraw/zinc/28/38/14/520283814.db2.gz FXPFOVSXLHHFSK-CQSZACIVSA-N 2 2 371.441 2.631 20 5 FFBDLP O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C1)OCCO2 ZINC000611287366 521081568 /nfs/dbraw/zinc/08/15/68/521081568.db2.gz ZUDJVJXEWWGKGD-WMLDXEAASA-N 2 2 373.453 2.815 20 5 FFBDLP O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C1)OCCO2 ZINC000611287366 521081576 /nfs/dbraw/zinc/08/15/76/521081576.db2.gz ZUDJVJXEWWGKGD-WMLDXEAASA-N 2 2 373.453 2.815 20 5 FFBDLP O=[N+]([O-])c1cc2c(cc1C[NH+]1CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C1)OCCO2 ZINC000611287366 521081583 /nfs/dbraw/zinc/08/15/83/521081583.db2.gz ZUDJVJXEWWGKGD-WMLDXEAASA-N 2 2 373.453 2.815 20 5 FFBDLP O=[N+]([O-])c1cc2c(cc1C[NH+]1CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C1)OCCO2 ZINC000611287366 521081591 /nfs/dbraw/zinc/08/15/91/521081591.db2.gz ZUDJVJXEWWGKGD-WMLDXEAASA-N 2 2 373.453 2.815 20 5 FFBDLP Cn1cc[nH+]c1[C@H](N[C@H]1CC[NH2+]CC(C)(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000602023513 521084871 /nfs/dbraw/zinc/08/48/71/521084871.db2.gz YVCWCIGIOUADBV-DOTOQJQBSA-N 2 2 357.458 2.786 20 5 FFBDLP C[NH+](C)C1CCN(c2ccc(NCc3ccc([N+](=O)[O-])cc3F)[nH+]c2)CC1 ZINC000611491429 521185381 /nfs/dbraw/zinc/18/53/81/521185381.db2.gz CMCUOWDYWTUQOR-UHFFFAOYSA-N 2 2 373.432 2.693 20 5 FFBDLP O=[N+]([O-])c1ccc(N2CCC([NH2+]C[C@@H]3CCCC[N@@H+]3C3CC3)CC2)cn1 ZINC000602634643 521450111 /nfs/dbraw/zinc/45/01/11/521450111.db2.gz UGIBCYCARPPSGP-SFHVURJKSA-N 2 2 359.474 2.565 20 5 FFBDLP O=[N+]([O-])c1ccc(N2CCC([NH2+]C[C@@H]3CCCC[N@H+]3C3CC3)CC2)cn1 ZINC000602634643 521450118 /nfs/dbraw/zinc/45/01/18/521450118.db2.gz UGIBCYCARPPSGP-SFHVURJKSA-N 2 2 359.474 2.565 20 5 FFBDLP O=[N+]([O-])c1cnn(C2CC([NH2+]Cc3ccc(-n4cc[nH+]c4)c(F)c3)C2)c1 ZINC000876970164 1014436521 /nfs/dbraw/zinc/43/65/21/1014436521.db2.gz KJNQIOXITNKCNI-UHFFFAOYSA-N 2 2 356.361 2.609 20 5 FFBDLP CC[C@H](C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)[NH+](CC)CC ZINC000813173991 995633401 /nfs/dbraw/zinc/63/34/01/995633401.db2.gz NMUGXMFXFOPYDU-ZWKOTPCHSA-N 2 2 363.458 2.833 20 5 FFBDLP CC[C@H](C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)[NH+](CC)CC ZINC000813173991 995633406 /nfs/dbraw/zinc/63/34/06/995633406.db2.gz NMUGXMFXFOPYDU-ZWKOTPCHSA-N 2 2 363.458 2.833 20 5 FFBDLP C[C@H](c1ccncc1)[NH+]1CCC([NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000819183521 1008060342 /nfs/dbraw/zinc/06/03/42/1008060342.db2.gz PQODVHIDTWTWCD-QRWLVFNGSA-N 2 2 370.453 2.838 20 5 FFBDLP CC(C)[N@H+](C)CC1CC[NH+](Cn2c(=O)oc3cccc([N+](=O)[O-])c32)CC1 ZINC000794632864 1010448251 /nfs/dbraw/zinc/44/82/51/1010448251.db2.gz RRNVULNKMKDVNF-UHFFFAOYSA-N 2 2 362.430 2.512 20 5 FFBDLP CC(C)[N@@H+](C)CC1CC[NH+](Cn2c(=O)oc3cccc([N+](=O)[O-])c32)CC1 ZINC000794632864 1010448257 /nfs/dbraw/zinc/44/82/57/1010448257.db2.gz RRNVULNKMKDVNF-UHFFFAOYSA-N 2 2 362.430 2.512 20 5 FFBDLP Cc1cc(N2CC[NH+]([C@@H](C)Cc3ccc([N+](=O)[O-])cc3)CC2)nc(C)[nH+]1 ZINC001173226581 1012361718 /nfs/dbraw/zinc/36/17/18/1012361718.db2.gz KNIKJEVYXSCEJK-HNNXBMFYSA-N 2 2 355.442 2.755 20 5 FFBDLP Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)[C@@H]([NH3+])CCC[NH3+] ZINC001219207927 1033555592 /nfs/dbraw/zinc/55/55/92/1033555592.db2.gz OKLUJVDCYUWXMG-KRWDZBQOSA-N 3 2 365.481 2.767 20 5 FFBDLP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272566828 252069155 /nfs/dbraw/zinc/06/91/55/252069155.db2.gz VARMKELQEGTKLC-RDTXWAMCSA-N 2 2 368.441 2.849 20 5 FFBDLP Cc1c(C[NH+]2CCN(C3CC[NH+](C(C)C)CC3)CC2)cccc1[N+](=O)[O-] ZINC000332386128 258228341 /nfs/dbraw/zinc/22/83/41/258228341.db2.gz JEVUBLTUSURTNU-UHFFFAOYSA-N 2 2 360.502 2.894 20 5 FFBDLP C[N@H+](CCNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)C1CCCCC1 ZINC000068902007 507355226 /nfs/dbraw/zinc/35/52/26/507355226.db2.gz YBYPOUBPCXZEPL-UHFFFAOYSA-N 2 2 371.441 2.775 20 5 FFBDLP C[N@@H+](CCNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)C1CCCCC1 ZINC000068902007 507355235 /nfs/dbraw/zinc/35/52/35/507355235.db2.gz YBYPOUBPCXZEPL-UHFFFAOYSA-N 2 2 371.441 2.775 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000090003642 507900467 /nfs/dbraw/zinc/90/04/67/507900467.db2.gz IZNZOSVYVQTKMC-HNNXBMFYSA-N 2 2 371.441 2.530 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000090003642 507900470 /nfs/dbraw/zinc/90/04/70/507900470.db2.gz IZNZOSVYVQTKMC-HNNXBMFYSA-N 2 2 371.441 2.530 20 5 FFBDLP C[C@@H]1C[N@@H+](CC2CC[NH+](Cc3cc(O)ccc3[N+](=O)[O-])CC2)C[C@H](C)O1 ZINC000092586996 508084194 /nfs/dbraw/zinc/08/41/94/508084194.db2.gz KNKSHHSNXHKHEO-GASCZTMLSA-N 2 2 363.458 2.622 20 5 FFBDLP C[C@@H]1C[N@H+](CC2CC[NH+](Cc3cc(O)ccc3[N+](=O)[O-])CC2)C[C@H](C)O1 ZINC000092586996 508084197 /nfs/dbraw/zinc/08/41/97/508084197.db2.gz KNKSHHSNXHKHEO-GASCZTMLSA-N 2 2 363.458 2.622 20 5 FFBDLP COc1cc[nH+]c(N2CC[NH+](CCCOc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000104720162 508343419 /nfs/dbraw/zinc/34/34/19/508343419.db2.gz SXWAEXCJRCDFSZ-UHFFFAOYSA-N 2 2 372.425 2.590 20 5 FFBDLP C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000118841698 508682490 /nfs/dbraw/zinc/68/24/90/508682490.db2.gz UIOHIAQFRDTFHP-QWHCGFSZSA-N 2 2 368.865 2.849 20 5 FFBDLP C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000118841698 508682494 /nfs/dbraw/zinc/68/24/94/508682494.db2.gz UIOHIAQFRDTFHP-QWHCGFSZSA-N 2 2 368.865 2.849 20 5 FFBDLP C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[NH+](C)C[C@@H]1CCC[N@H+](C)C1 ZINC000118841698 508682499 /nfs/dbraw/zinc/68/24/99/508682499.db2.gz UIOHIAQFRDTFHP-QWHCGFSZSA-N 2 2 368.865 2.849 20 5 FFBDLP C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[NH+](C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000118841698 508682503 /nfs/dbraw/zinc/68/25/03/508682503.db2.gz UIOHIAQFRDTFHP-QWHCGFSZSA-N 2 2 368.865 2.849 20 5 FFBDLP C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000123848901 508747409 /nfs/dbraw/zinc/74/74/09/508747409.db2.gz BQPBFFUWVFHFRU-LSDHHAIUSA-N 2 2 371.441 2.610 20 5 FFBDLP C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000123848901 508747413 /nfs/dbraw/zinc/74/74/13/508747413.db2.gz BQPBFFUWVFHFRU-LSDHHAIUSA-N 2 2 371.441 2.610 20 5 FFBDLP C[NH+](C)CC1(CNC(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)CCCC1 ZINC000186185048 509565173 /nfs/dbraw/zinc/56/51/73/509565173.db2.gz WLAGNVRCJHJTSM-UHFFFAOYSA-N 2 2 371.441 2.632 20 5 FFBDLP CC[N@@H+]1CC[C@H]2CC[C@@H](C1)[NH+]2CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000177312283 509991230 /nfs/dbraw/zinc/99/12/30/509991230.db2.gz JBILXFYYBLMAHK-CVEARBPZSA-N 2 2 360.458 2.790 20 5 FFBDLP CC[N@H+]1CC[C@H]2CC[C@@H](C1)[NH+]2CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000177312283 509991236 /nfs/dbraw/zinc/99/12/36/509991236.db2.gz JBILXFYYBLMAHK-CVEARBPZSA-N 2 2 360.458 2.790 20 5 FFBDLP CC[NH+]1CC[C@H]2CC[C@@H](C1)[N@@H+]2CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000177312283 509991244 /nfs/dbraw/zinc/99/12/44/509991244.db2.gz JBILXFYYBLMAHK-CVEARBPZSA-N 2 2 360.458 2.790 20 5 FFBDLP CC[NH+]1CC[C@H]2CC[C@@H](C1)[N@H+]2CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000177312283 509991248 /nfs/dbraw/zinc/99/12/48/509991248.db2.gz JBILXFYYBLMAHK-CVEARBPZSA-N 2 2 360.458 2.790 20 5 FFBDLP O=C(C[NH+]1CCC(c2[nH]cc[nH+]2)CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000265522624 510098072 /nfs/dbraw/zinc/09/80/72/510098072.db2.gz TXPPBLOIZIDSEY-UHFFFAOYSA-N 2 2 363.805 2.789 20 5 FFBDLP C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000171389061 510125912 /nfs/dbraw/zinc/12/59/12/510125912.db2.gz PNSVACSIZSHWFX-OAHLLOKOSA-N 2 2 360.458 2.730 20 5 FFBDLP C[C@@H]1CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H]1n1cc[nH+]c1 ZINC000247014315 510798316 /nfs/dbraw/zinc/79/83/16/510798316.db2.gz DFRWGSJKLRESGA-CZUORRHYSA-N 2 2 368.397 2.924 20 5 FFBDLP C[C@@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H]1n1cc[nH+]c1 ZINC000247014315 510798323 /nfs/dbraw/zinc/79/83/23/510798323.db2.gz DFRWGSJKLRESGA-CZUORRHYSA-N 2 2 368.397 2.924 20 5 FFBDLP C[NH2+]C[C@@H]1CCC[N@H+](Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])C1 ZINC000435396261 513573407 /nfs/dbraw/zinc/57/34/07/513573407.db2.gz VRMBCLNMSYPHOW-LBPRGKRZSA-N 2 2 373.400 2.679 20 5 FFBDLP C[NH2+]C[C@@H]1CCC[N@@H+](Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])C1 ZINC000435396261 513573409 /nfs/dbraw/zinc/57/34/09/513573409.db2.gz VRMBCLNMSYPHOW-LBPRGKRZSA-N 2 2 373.400 2.679 20 5 FFBDLP C[C@H](Nc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-])C(C)(C)C[NH+](C)C ZINC000447813298 513578642 /nfs/dbraw/zinc/57/86/42/513578642.db2.gz VGHQLWNZZOHFTI-HNNXBMFYSA-N 2 2 364.490 2.815 20 5 FFBDLP C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1C[NH2+]C[C@H]1c1ccccc1 ZINC000423529182 514162177 /nfs/dbraw/zinc/16/21/77/514162177.db2.gz OCLYDKZJZPRYRQ-ZOCIIQOWSA-N 2 2 368.437 2.657 20 5 FFBDLP CC1(C)CCC[N@H+](CCNC(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)C1 ZINC000444616214 514274364 /nfs/dbraw/zinc/27/43/64/514274364.db2.gz CDVDPERGTFXJLC-UHFFFAOYSA-N 2 2 371.441 2.632 20 5 FFBDLP CC1(C)CCC[N@@H+](CCNC(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)C1 ZINC000444616214 514274368 /nfs/dbraw/zinc/27/43/68/514274368.db2.gz CDVDPERGTFXJLC-UHFFFAOYSA-N 2 2 371.441 2.632 20 5 FFBDLP COc1cc(C[NH2+][C@H]2CC[NH2+]C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414894003 514345013 /nfs/dbraw/zinc/34/50/13/514345013.db2.gz ZTRMVYQFAIJDAE-INIZCTEOSA-N 2 2 357.410 2.634 20 5 FFBDLP CCc1ccccc1[C@@H]([NH3+])C[NH2+]Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000415063436 514423773 /nfs/dbraw/zinc/42/37/73/514423773.db2.gz IALDYGYZRGTPOJ-INIZCTEOSA-N 2 2 359.426 2.964 20 5 FFBDLP C[NH+](C)[C@@H](CNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-])c1ccco1 ZINC000472041390 515094180 /nfs/dbraw/zinc/09/41/80/515094180.db2.gz FDWULKXGQRWXFT-SFHVURJKSA-N 2 2 374.441 2.735 20 5 FFBDLP COc1cc(C[NH2+]CC(C)(C)C[NH+]2CCCC2)c([N+](=O)[O-])cc1OC ZINC000480935016 515141499 /nfs/dbraw/zinc/14/14/99/515141499.db2.gz PDHVZSWVINIFNS-UHFFFAOYSA-N 2 2 351.447 2.824 20 5 FFBDLP O=C(NC1CC([NH+]2CCCCC2)C1)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000477951661 515650034 /nfs/dbraw/zinc/65/00/34/515650034.db2.gz TUPHGTGQWPVTBX-UHFFFAOYSA-N 2 2 369.425 2.527 20 5 FFBDLP CC[NH+](CC)CCOC1CC[NH+](Cc2cc(O)ccc2[N+](=O)[O-])CC1 ZINC000555377744 516906222 /nfs/dbraw/zinc/90/62/22/516906222.db2.gz UMKKKZACELEODY-UHFFFAOYSA-N 2 2 351.447 2.623 20 5 FFBDLP CC1=CC[N@H+](CC[NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000547285871 518058403 /nfs/dbraw/zinc/05/84/03/518058403.db2.gz JOZGASXTDMJVSH-UHFFFAOYSA-N 2 2 355.442 2.737 20 5 FFBDLP CC1=CC[N@@H+](CC[NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000547285871 518058407 /nfs/dbraw/zinc/05/84/07/518058407.db2.gz JOZGASXTDMJVSH-UHFFFAOYSA-N 2 2 355.442 2.737 20 5 FFBDLP C[NH2+]Cc1ccccc1C[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000593321287 520907966 /nfs/dbraw/zinc/90/79/66/520907966.db2.gz HQJFXRFWABAFGL-LJQANCHMSA-N 2 2 365.437 2.927 20 5 FFBDLP COCC[NH+]1CCC([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602533403 521398829 /nfs/dbraw/zinc/39/88/29/521398829.db2.gz XVMIMBSAUIUZKA-UHFFFAOYSA-N 2 2 361.364 2.814 20 5 FFBDLP O=C(N[C@@H]1CCC[N@@H+]2CCCC[C@H]12)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000594198701 521465122 /nfs/dbraw/zinc/46/51/22/521465122.db2.gz VCPGVBPGRAHVAS-HZPDHXFCSA-N 2 2 369.425 2.527 20 5 FFBDLP O=C(N[C@@H]1CCC[N@H+]2CCCC[C@H]12)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000594198701 521465126 /nfs/dbraw/zinc/46/51/26/521465126.db2.gz VCPGVBPGRAHVAS-HZPDHXFCSA-N 2 2 369.425 2.527 20 5 FFBDLP C[C@@H](C[NH+]1CCC(C)CC1)[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602717564 521493388 /nfs/dbraw/zinc/49/33/88/521493388.db2.gz LUHJNMYTBXDJSB-INIZCTEOSA-N 2 2 361.490 2.669 20 5 FFBDLP Cc1c(NC(=O)CC[NH+]2C[C@@]3(C)C[NH+](C)C[C@]3(C)C2)cccc1[N+](=O)[O-] ZINC000823755631 999074715 /nfs/dbraw/zinc/07/47/15/999074715.db2.gz UZBUEFWPCLERTO-RTBURBONSA-N 2 2 360.458 2.505 20 5 FFBDLP O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@@H](Cn2cc[nH+]c2)c2ccccc2)c1 ZINC001197265474 1004146938 /nfs/dbraw/zinc/14/69/38/1004146938.db2.gz SJEKDHVXCOSTDL-RBUKOAKNSA-N 2 2 352.394 2.856 20 5 FFBDLP C[C@@H](c1ccncc1)[NH+]1CCC([NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000819183523 1008060230 /nfs/dbraw/zinc/06/02/30/1008060230.db2.gz PQODVHIDTWTWCD-YWZLYKJASA-N 2 2 370.453 2.838 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CC[C@@]3(CC[NH+](C)C3)C2)c1F ZINC001173192457 1012336395 /nfs/dbraw/zinc/33/63/95/1012336395.db2.gz LDFMQNNHLZSCTN-SCLBCKFNSA-N 2 2 351.422 2.701 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CC[C@@]3(CC[NH+](C)C3)C2)c1F ZINC001173192457 1012336404 /nfs/dbraw/zinc/33/64/04/1012336404.db2.gz LDFMQNNHLZSCTN-SCLBCKFNSA-N 2 2 351.422 2.701 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH+]2CC[C@@]3(CC[N@H+](C)C3)C2)c1F ZINC001173192457 1012336412 /nfs/dbraw/zinc/33/64/12/1012336412.db2.gz LDFMQNNHLZSCTN-SCLBCKFNSA-N 2 2 351.422 2.701 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH+]2CC[C@@]3(CC[N@@H+](C)C3)C2)c1F ZINC001173192457 1012336417 /nfs/dbraw/zinc/33/64/17/1012336417.db2.gz LDFMQNNHLZSCTN-SCLBCKFNSA-N 2 2 351.422 2.701 20 5 FFBDLP Cc1cccc(NC[C@@H]2CCC[N@@H+]2C[C@H](O)c2cccc([N+](=O)[O-])c2)[nH+]1 ZINC001116351696 1021176048 /nfs/dbraw/zinc/17/60/48/1021176048.db2.gz ISHFVUOFCWVLBW-ROUUACIJSA-N 2 2 356.426 2.908 20 5 FFBDLP Cc1cccc(NC[C@@H]2CCC[N@H+]2C[C@H](O)c2cccc([N+](=O)[O-])c2)[nH+]1 ZINC001116351696 1021176052 /nfs/dbraw/zinc/17/60/52/1021176052.db2.gz ISHFVUOFCWVLBW-ROUUACIJSA-N 2 2 356.426 2.908 20 5 FFBDLP Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)C[NH2+]CCC[NH3+] ZINC001219211117 1033556101 /nfs/dbraw/zinc/55/61/01/1033556101.db2.gz WFKSWCOMZDQJRI-UHFFFAOYSA-N 3 2 365.481 2.639 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CCCC[NH3+])C(=O)OC(C)(C)C ZINC001246201659 1039276837 /nfs/dbraw/zinc/27/68/37/1039276837.db2.gz INGBUIZUAQWDIO-ZBFHGGJFSA-N 2 2 365.474 2.955 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1C[C@H]3C[NH+](Cc4cccnc4)C[C@H]3C1)C2 ZINC001254599385 1040830305 /nfs/dbraw/zinc/83/03/05/1040830305.db2.gz YNFPGGMGPPABAK-SVFBPWRDSA-N 2 2 364.449 2.521 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@@H+]1C[C@H]3C[NH+](Cc4cccnc4)C[C@H]3C1)C2 ZINC001254599385 1040830316 /nfs/dbraw/zinc/83/03/16/1040830316.db2.gz YNFPGGMGPPABAK-SVFBPWRDSA-N 2 2 364.449 2.521 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH+]1C[C@H]3C[N@@H+](Cc4cccnc4)C[C@H]3C1)C2 ZINC001254599385 1040830329 /nfs/dbraw/zinc/83/03/29/1040830329.db2.gz YNFPGGMGPPABAK-SVFBPWRDSA-N 2 2 364.449 2.521 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH+]1C[C@H]3C[N@H+](Cc4cccnc4)C[C@H]3C1)C2 ZINC001254599385 1040830335 /nfs/dbraw/zinc/83/03/35/1040830335.db2.gz YNFPGGMGPPABAK-SVFBPWRDSA-N 2 2 364.449 2.521 20 5 FFBDLP Cn1cc[nH+]c1C[C@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC001356532127 1055559812 /nfs/dbraw/zinc/55/98/12/1055559812.db2.gz IJTREQVZQIACIX-RBUKOAKNSA-N 2 2 366.421 2.935 20 5 FFBDLP O=[N+]([O-])c1ccccc1-c1cnn(C[N@@H+]2CCC[C@@H](n3cc[nH+]c3)C2)c1 ZINC000848478556 1060110399 /nfs/dbraw/zinc/11/03/99/1060110399.db2.gz JZSTZRNCYRESQA-MRXNPFEDSA-N 2 2 352.398 2.949 20 5 FFBDLP O=[N+]([O-])c1ccccc1-c1cnn(C[N@H+]2CCC[C@@H](n3cc[nH+]c3)C2)c1 ZINC000848478556 1060110407 /nfs/dbraw/zinc/11/04/07/1060110407.db2.gz JZSTZRNCYRESQA-MRXNPFEDSA-N 2 2 352.398 2.949 20 5 FFBDLP COc1cc(C[NH2+][C@H]2C[C@@H]([NH3+])C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC001579153773 1078576922 /nfs/dbraw/zinc/57/69/22/1078576922.db2.gz LMYUAWULGHXEJY-IYBDPMFKSA-N 2 2 357.410 2.762 20 5 FFBDLP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000093639091 250040201 /nfs/dbraw/zinc/04/02/01/250040201.db2.gz YBZOQNDGQFZZMT-UKRRQHHQSA-N 2 2 351.447 2.774 20 5 FFBDLP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000093639091 250040204 /nfs/dbraw/zinc/04/02/04/250040204.db2.gz YBZOQNDGQFZZMT-UKRRQHHQSA-N 2 2 351.447 2.774 20 5 FFBDLP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000093639091 250040206 /nfs/dbraw/zinc/04/02/06/250040206.db2.gz YBZOQNDGQFZZMT-UKRRQHHQSA-N 2 2 351.447 2.774 20 5 FFBDLP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000093639091 250040209 /nfs/dbraw/zinc/04/02/09/250040209.db2.gz YBZOQNDGQFZZMT-UKRRQHHQSA-N 2 2 351.447 2.774 20 5 FFBDLP Cc1cc(N2CCN(c3cc[nH+]c(C)n3)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302137805 258090400 /nfs/dbraw/zinc/09/04/00/258090400.db2.gz CATUXYZYDYZCRQ-UHFFFAOYSA-N 2 2 364.409 2.876 20 5 FFBDLP CCOc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+]2CCOC)cc1[N+](=O)[O-] ZINC000153553780 508596543 /nfs/dbraw/zinc/59/65/43/508596543.db2.gz YVEAPJWMEWWIOJ-HOCLYGCPSA-N 2 2 351.447 2.755 20 5 FFBDLP CCOc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+]2CCOC)cc1[N+](=O)[O-] ZINC000153553780 508596547 /nfs/dbraw/zinc/59/65/47/508596547.db2.gz YVEAPJWMEWWIOJ-HOCLYGCPSA-N 2 2 351.447 2.755 20 5 FFBDLP COc1ccc(C[NH2+]C2CC[NH+](Cc3ccccn3)CC2)cc1[N+](=O)[O-] ZINC000237355876 509632089 /nfs/dbraw/zinc/63/20/89/509632089.db2.gz BVYBUPVSRRQJEG-UHFFFAOYSA-N 2 2 356.426 2.753 20 5 FFBDLP Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261683726 510026648 /nfs/dbraw/zinc/02/66/48/510026648.db2.gz IOXQQDOCTIDSKO-SJORKVTESA-N 2 2 368.437 2.516 20 5 FFBDLP Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261683726 510026658 /nfs/dbraw/zinc/02/66/58/510026658.db2.gz IOXQQDOCTIDSKO-SJORKVTESA-N 2 2 368.437 2.516 20 5 FFBDLP CC[N@@H+]1CC[C@H]([NH+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H](C)C1 ZINC000174782394 510307416 /nfs/dbraw/zinc/30/74/16/510307416.db2.gz RYRGAODWMDIWLJ-CJNGLKHVSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[N@H+]1CC[C@H]([NH+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H](C)C1 ZINC000174782394 510307421 /nfs/dbraw/zinc/30/74/21/510307421.db2.gz RYRGAODWMDIWLJ-CJNGLKHVSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[NH+]1CC[C@H]([N@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H](C)C1 ZINC000174782394 510307428 /nfs/dbraw/zinc/30/74/28/510307428.db2.gz RYRGAODWMDIWLJ-CJNGLKHVSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[NH+]1CC[C@H]([N@@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H](C)C1 ZINC000174782394 510307435 /nfs/dbraw/zinc/30/74/35/510307435.db2.gz RYRGAODWMDIWLJ-CJNGLKHVSA-N 2 2 359.430 2.807 20 5 FFBDLP C[N@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000285608394 510976667 /nfs/dbraw/zinc/97/66/67/510976667.db2.gz VQDKBRFGTFTBGI-PBWFPOADSA-N 2 2 366.849 2.744 20 5 FFBDLP C[N@@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000285608394 510976673 /nfs/dbraw/zinc/97/66/73/510976673.db2.gz VQDKBRFGTFTBGI-PBWFPOADSA-N 2 2 366.849 2.744 20 5 FFBDLP C[NH+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000285608394 510976677 /nfs/dbraw/zinc/97/66/77/510976677.db2.gz VQDKBRFGTFTBGI-PBWFPOADSA-N 2 2 366.849 2.744 20 5 FFBDLP C[NH+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000285608394 510976680 /nfs/dbraw/zinc/97/66/80/510976680.db2.gz VQDKBRFGTFTBGI-PBWFPOADSA-N 2 2 366.849 2.744 20 5 FFBDLP Cc1[nH+]c2ccccc2n1C1CC[NH+](CCn2cc([N+](=O)[O-])cn2)CC1 ZINC000280217717 511379104 /nfs/dbraw/zinc/37/91/04/511379104.db2.gz KWINVMRDORFOAL-UHFFFAOYSA-N 2 2 354.414 2.787 20 5 FFBDLP CCCC[N@H+](C)CCNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000447815206 513579559 /nfs/dbraw/zinc/57/95/59/513579559.db2.gz DVNHHBUIGJNLLZ-UHFFFAOYSA-N 2 2 350.463 2.571 20 5 FFBDLP CCCC[N@@H+](C)CCNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000447815206 513579568 /nfs/dbraw/zinc/57/95/68/513579568.db2.gz DVNHHBUIGJNLLZ-UHFFFAOYSA-N 2 2 350.463 2.571 20 5 FFBDLP Cn1cc[nH+]c1CN(Cc1csc([N+](=O)[O-])c1)[C@@H]1CC12CC[NH2+]CC2 ZINC000435430977 513583400 /nfs/dbraw/zinc/58/34/00/513583400.db2.gz GIXBPUYJEITJOC-CQSZACIVSA-N 2 2 361.471 2.534 20 5 FFBDLP O=C(N[C@H]1CC[N@@H+](C2CCCC2)C1)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000448925122 513972334 /nfs/dbraw/zinc/97/23/34/513972334.db2.gz MCMSKMNNXXINOF-HNNXBMFYSA-N 2 2 369.425 2.527 20 5 FFBDLP O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000448925122 513972342 /nfs/dbraw/zinc/97/23/42/513972342.db2.gz MCMSKMNNXXINOF-HNNXBMFYSA-N 2 2 369.425 2.527 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[C@@H](Nc1ccc(N2CC[NH2+]CC2)c[nH+]1)C1CC1 ZINC000423237988 514088042 /nfs/dbraw/zinc/08/80/42/514088042.db2.gz UOXCXXUXGUZBMY-GOSISDBHSA-N 2 2 367.453 2.833 20 5 FFBDLP C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@@H]1C[NH2+]C[C@H]1c1ccccc1 ZINC000423535295 514163962 /nfs/dbraw/zinc/16/39/62/514163962.db2.gz XJDDEZLMNUPSIC-MDASCCDHSA-N 2 2 368.437 2.657 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+][C@H]1CCC[N@@H+](CCCO)C1 ZINC000449399200 514197176 /nfs/dbraw/zinc/19/71/76/514197176.db2.gz YKOWIARNXXZMSR-YTQUADARSA-N 2 2 361.486 2.742 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+][C@H]1CCC[N@H+](CCCO)C1 ZINC000449399200 514197183 /nfs/dbraw/zinc/19/71/83/514197183.db2.gz YKOWIARNXXZMSR-YTQUADARSA-N 2 2 361.486 2.742 20 5 FFBDLP CCC[N@H+](CC)C[C@@H](C)NC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000461607836 514663851 /nfs/dbraw/zinc/66/38/51/514663851.db2.gz JZRFADMXTJXWJJ-CQSZACIVSA-N 2 2 359.430 2.631 20 5 FFBDLP CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000461607836 514663855 /nfs/dbraw/zinc/66/38/55/514663855.db2.gz JZRFADMXTJXWJJ-CQSZACIVSA-N 2 2 359.430 2.631 20 5 FFBDLP COc1cc(C[N@@H+]2CCCC[C@@H]2CC[NH3+])c([N+](=O)[O-])cc1OC(F)F ZINC000489797582 514978541 /nfs/dbraw/zinc/97/85/41/514978541.db2.gz SKWGZSWOCHOGAJ-GFCCVEGCSA-N 2 2 359.373 2.908 20 5 FFBDLP COc1cc(C[N@H+]2CCCC[C@@H]2CC[NH3+])c([N+](=O)[O-])cc1OC(F)F ZINC000489797582 514978548 /nfs/dbraw/zinc/97/85/48/514978548.db2.gz SKWGZSWOCHOGAJ-GFCCVEGCSA-N 2 2 359.373 2.908 20 5 FFBDLP CC[NH+](CC)C[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000482152917 515590346 /nfs/dbraw/zinc/59/03/46/515590346.db2.gz SSGPXTGZKCQYEG-SJORKVTESA-N 2 2 362.474 2.684 20 5 FFBDLP C[NH+](C)[C@H](C[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000557875510 516483706 /nfs/dbraw/zinc/48/37/06/516483706.db2.gz FFJCQKUCOQZNSN-KRWDZBQOSA-N 2 2 370.453 2.686 20 5 FFBDLP C[C@@H](C[N@@H+]1CCC[C@H](C)C1)NC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000518462266 516670458 /nfs/dbraw/zinc/67/04/58/516670458.db2.gz XWTVORWYCAUNKQ-GJZGRUSLSA-N 2 2 371.441 2.631 20 5 FFBDLP C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000518462266 516670468 /nfs/dbraw/zinc/67/04/68/516670468.db2.gz XWTVORWYCAUNKQ-GJZGRUSLSA-N 2 2 371.441 2.631 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2ccc(C[NH+]3CCN(Cc4[nH]cc[nH+]4)CC3)o2)c1 ZINC000536670856 516885314 /nfs/dbraw/zinc/88/53/14/516885314.db2.gz NROTUYLMLFNNLM-UHFFFAOYSA-N 2 2 367.409 2.896 20 5 FFBDLP COc1cc(C[N@@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)c([N+](=O)[O-])cc1OC ZINC000538749776 517764046 /nfs/dbraw/zinc/76/40/46/517764046.db2.gz GBGFXWLJHBIFHZ-HNNXBMFYSA-N 2 2 363.458 2.776 20 5 FFBDLP COc1cc(C[N@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)c([N+](=O)[O-])cc1OC ZINC000538749776 517764056 /nfs/dbraw/zinc/76/40/56/517764056.db2.gz GBGFXWLJHBIFHZ-HNNXBMFYSA-N 2 2 363.458 2.776 20 5 FFBDLP COc1cc(C[NH+]2CC[C@@H](C[N@H+](C)CC3CC3)C2)c([N+](=O)[O-])cc1OC ZINC000538749776 517764063 /nfs/dbraw/zinc/76/40/63/517764063.db2.gz GBGFXWLJHBIFHZ-HNNXBMFYSA-N 2 2 363.458 2.776 20 5 FFBDLP COc1cc(C[NH+]2CC[C@@H](C[N@@H+](C)CC3CC3)C2)c([N+](=O)[O-])cc1OC ZINC000538749776 517764071 /nfs/dbraw/zinc/76/40/71/517764071.db2.gz GBGFXWLJHBIFHZ-HNNXBMFYSA-N 2 2 363.458 2.776 20 5 FFBDLP Cc1[nH+]ccn1CCCC[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000560530039 517876604 /nfs/dbraw/zinc/87/66/04/517876604.db2.gz YJIQKAPJSQEZGW-GOSISDBHSA-N 2 2 368.441 2.993 20 5 FFBDLP CC(C)[N@@H+]1CC[C@H](CNc2cc(C[NH+]3CCOCC3)ccc2[N+](=O)[O-])C1 ZINC000584331053 518284535 /nfs/dbraw/zinc/28/45/35/518284535.db2.gz AOTCZYHJOLPYCO-QGZVFWFLSA-N 2 2 362.474 2.569 20 5 FFBDLP CC(C)[N@H+]1CC[C@H](CNc2cc(C[NH+]3CCOCC3)ccc2[N+](=O)[O-])C1 ZINC000584331053 518284542 /nfs/dbraw/zinc/28/45/42/518284542.db2.gz AOTCZYHJOLPYCO-QGZVFWFLSA-N 2 2 362.474 2.569 20 5 FFBDLP O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]C2CCN(c3cccc[nH+]3)CC2)n1 ZINC000585794122 518602251 /nfs/dbraw/zinc/60/22/51/518602251.db2.gz FTMDPYXHQXSCMY-IRXDYDNUSA-N 2 2 370.457 2.929 20 5 FFBDLP C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@H]1CCC[N@@H+]2CCCC[C@H]12 ZINC000594517959 520012701 /nfs/dbraw/zinc/01/27/01/520012701.db2.gz FFJYSNMECBNILU-FHLIZLRMSA-N 2 2 360.458 2.918 20 5 FFBDLP C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594517959 520012707 /nfs/dbraw/zinc/01/27/07/520012707.db2.gz FFJYSNMECBNILU-FHLIZLRMSA-N 2 2 360.458 2.918 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@@H](n4cc[nH+]c4)C3)o2)cc1 ZINC000609157365 520212510 /nfs/dbraw/zinc/21/25/10/520212510.db2.gz GMLIDIQXFDNMEZ-OAHLLOKOSA-N 2 2 354.370 2.678 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@@H](n4cc[nH+]c4)C3)o2)cc1 ZINC000609157365 520212517 /nfs/dbraw/zinc/21/25/17/520212517.db2.gz GMLIDIQXFDNMEZ-OAHLLOKOSA-N 2 2 354.370 2.678 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000595003045 520250986 /nfs/dbraw/zinc/25/09/86/520250986.db2.gz BMEQGJBVWQLXHP-ZNMIVQPWSA-N 2 2 351.447 2.753 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000595003045 520250995 /nfs/dbraw/zinc/25/09/95/520250995.db2.gz BMEQGJBVWQLXHP-ZNMIVQPWSA-N 2 2 351.447 2.753 20 5 FFBDLP CCC1([NH+]2CCOCC2)CC[NH+](CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000599668512 521381298 /nfs/dbraw/zinc/38/12/98/521381298.db2.gz GPVCKCGLGHCVDM-UHFFFAOYSA-N 2 2 363.458 2.550 20 5 FFBDLP O=[N+]([O-])c1ccc(N2CCC([NH2+]C[C@@H]3CC[N@@H+]3C3CCCCC3)CC2)cn1 ZINC000602719714 521495752 /nfs/dbraw/zinc/49/57/52/521495752.db2.gz FMEJBQAOMCBKDB-IBGZPJMESA-N 2 2 373.501 2.955 20 5 FFBDLP O=[N+]([O-])c1ccc(N2CCC([NH2+]C[C@@H]3CC[N@H+]3C3CCCCC3)CC2)cn1 ZINC000602719714 521495759 /nfs/dbraw/zinc/49/57/59/521495759.db2.gz FMEJBQAOMCBKDB-IBGZPJMESA-N 2 2 373.501 2.955 20 5 FFBDLP COC(=O)CCC[NH+]1CCC([NH2+]C[C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000897466128 981133139 /nfs/dbraw/zinc/13/31/39/981133139.db2.gz OQLAMSBFKJFAQM-OAHLLOKOSA-N 2 2 363.458 2.706 20 5 FFBDLP Cc1nn(C[N@H+]2CC[C@@H](C)[C@H](n3cc[nH+]c3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000765084587 984956984 /nfs/dbraw/zinc/95/69/84/984956984.db2.gz WEDJSFZCPNKNSV-FZKQIMNGSA-N 2 2 354.414 2.990 20 5 FFBDLP Cc1nn(C[N@@H+]2CC[C@@H](C)[C@H](n3cc[nH+]c3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000765084587 984956987 /nfs/dbraw/zinc/95/69/87/984956987.db2.gz WEDJSFZCPNKNSV-FZKQIMNGSA-N 2 2 354.414 2.990 20 5 FFBDLP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1C[C@H]2C[NH+](Cc3ccccn3)C[C@@H]2C1 ZINC001173228527 1012363623 /nfs/dbraw/zinc/36/36/23/1012363623.db2.gz YVFYSBMWCUNEOL-BHIYHBOVSA-N 2 2 366.465 2.985 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2cnn(C[N@@H+]3CCC[C@@H](n4cc[nH+]c4)C3)c2)c1 ZINC000777956284 1020329994 /nfs/dbraw/zinc/32/99/94/1020329994.db2.gz DIHRUJFDVIJDMZ-GOSISDBHSA-N 2 2 352.398 2.949 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2cnn(C[N@H+]3CCC[C@@H](n4cc[nH+]c4)C3)c2)c1 ZINC000777956284 1020329997 /nfs/dbraw/zinc/32/99/97/1020329997.db2.gz DIHRUJFDVIJDMZ-GOSISDBHSA-N 2 2 352.398 2.949 20 5 FFBDLP Cc1cccc(NC[C@H]2CCC[N@@H+]2C[C@@H](O)c2cccc([N+](=O)[O-])c2)[nH+]1 ZINC001116351694 1021175759 /nfs/dbraw/zinc/17/57/59/1021175759.db2.gz ISHFVUOFCWVLBW-QZTJIDSGSA-N 2 2 356.426 2.908 20 5 FFBDLP Cc1cccc(NC[C@H]2CCC[N@H+]2C[C@@H](O)c2cccc([N+](=O)[O-])c2)[nH+]1 ZINC001116351694 1021175766 /nfs/dbraw/zinc/17/57/66/1021175766.db2.gz ISHFVUOFCWVLBW-QZTJIDSGSA-N 2 2 356.426 2.908 20 5 FFBDLP O=[N+]([O-])c1cc2c(Cl)ncnc2c(-n2c[nH+]cc2C2CC[NH2+]CC2)c1 ZINC001155063626 1028563990 /nfs/dbraw/zinc/56/39/90/1028563990.db2.gz UNSOIDZHUQTIHL-UHFFFAOYSA-N 2 2 358.789 2.844 20 5 FFBDLP COc1cc(N2CCC([NH2+][C@H]3CC[N@@H+](C(C)C)C3)CC2)ccc1[N+](=O)[O-] ZINC001256087032 1038370711 /nfs/dbraw/zinc/37/07/11/1038370711.db2.gz MQXMRZRLNPCFQF-INIZCTEOSA-N 2 2 362.474 2.645 20 5 FFBDLP COc1cc(N2CCC([NH2+][C@H]3CC[N@H+](C(C)C)C3)CC2)ccc1[N+](=O)[O-] ZINC001256087032 1038370720 /nfs/dbraw/zinc/37/07/20/1038370720.db2.gz MQXMRZRLNPCFQF-INIZCTEOSA-N 2 2 362.474 2.645 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@H+]1C[C@H]3C[NH+](Cc4ccccn4)C[C@H]3C1)C2 ZINC001254596681 1040824372 /nfs/dbraw/zinc/82/43/72/1040824372.db2.gz QETVJCVPVMIFKN-UEXGIBASSA-N 2 2 364.449 2.521 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@@H+]1C[C@H]3C[NH+](Cc4ccccn4)C[C@H]3C1)C2 ZINC001254596681 1040824392 /nfs/dbraw/zinc/82/43/92/1040824392.db2.gz QETVJCVPVMIFKN-UEXGIBASSA-N 2 2 364.449 2.521 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH+]1C[C@H]3C[N@@H+](Cc4ccccn4)C[C@H]3C1)C2 ZINC001254596681 1040824409 /nfs/dbraw/zinc/82/44/09/1040824409.db2.gz QETVJCVPVMIFKN-UEXGIBASSA-N 2 2 364.449 2.521 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH+]1C[C@H]3C[N@H+](Cc4ccccn4)C[C@H]3C1)C2 ZINC001254596681 1040824421 /nfs/dbraw/zinc/82/44/21/1040824421.db2.gz QETVJCVPVMIFKN-UEXGIBASSA-N 2 2 364.449 2.521 20 5 FFBDLP CC1CC[NH+](CC[C@@H]2CCC[N@@H+]2Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1 ZINC001560068547 1076220833 /nfs/dbraw/zinc/22/08/33/1076220833.db2.gz DPGLREXOJDDFJS-SFHVURJKSA-N 2 2 374.485 2.780 20 5 FFBDLP CC1CC[NH+](CC[C@@H]2CCC[N@H+]2Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1 ZINC001560068547 1076220837 /nfs/dbraw/zinc/22/08/37/1076220837.db2.gz DPGLREXOJDDFJS-SFHVURJKSA-N 2 2 374.485 2.780 20 5 FFBDLP Cn1ccnc1[C@@H]([NH2+]CCCNc1cccc[nH+]1)c1ccc([N+](=O)[O-])cc1 ZINC000272573408 252071238 /nfs/dbraw/zinc/07/12/38/252071238.db2.gz WJHXRMVXFWLKAY-SFHVURJKSA-N 2 2 366.425 2.905 20 5 FFBDLP O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](Cc3ccc(-n4cc[nH+]c4)cc3)C2)nc1 ZINC000118866043 508688053 /nfs/dbraw/zinc/68/80/53/508688053.db2.gz NTDPNJNHCNGKAK-MRXNPFEDSA-N 2 2 364.409 2.862 20 5 FFBDLP O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3ccc(-n4cc[nH+]c4)cc3)C2)nc1 ZINC000118866043 508688054 /nfs/dbraw/zinc/68/80/54/508688054.db2.gz NTDPNJNHCNGKAK-MRXNPFEDSA-N 2 2 364.409 2.862 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@H](Oc2cc[nH+]cc2)C1 ZINC000156321375 509159996 /nfs/dbraw/zinc/15/99/96/509159996.db2.gz CSMOOTNPRSLFMV-QGZVFWFLSA-N 2 2 370.409 2.780 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](Oc2cc[nH+]cc2)C1 ZINC000156321375 509159999 /nfs/dbraw/zinc/15/99/99/509159999.db2.gz CSMOOTNPRSLFMV-QGZVFWFLSA-N 2 2 370.409 2.780 20 5 FFBDLP C[N@H+](CC[C@H]1CCCC[NH+]1C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000245453901 509943825 /nfs/dbraw/zinc/94/38/25/509943825.db2.gz ROSABGVFFJKBRH-QAPCUYQASA-N 2 2 360.458 2.506 20 5 FFBDLP C[N@@H+](CC[C@H]1CCCC[NH+]1C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000245453901 509943830 /nfs/dbraw/zinc/94/38/30/509943830.db2.gz ROSABGVFFJKBRH-QAPCUYQASA-N 2 2 360.458 2.506 20 5 FFBDLP C[NH+](CC[C@H]1CCCC[N@@H+]1C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000245453901 509943836 /nfs/dbraw/zinc/94/38/36/509943836.db2.gz ROSABGVFFJKBRH-QAPCUYQASA-N 2 2 360.458 2.506 20 5 FFBDLP C[NH+](CC[C@H]1CCCC[N@H+]1C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000245453901 509943842 /nfs/dbraw/zinc/94/38/42/509943842.db2.gz ROSABGVFFJKBRH-QAPCUYQASA-N 2 2 360.458 2.506 20 5 FFBDLP C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246812587 510689548 /nfs/dbraw/zinc/68/95/48/510689548.db2.gz NJYNWJUTOZPPFZ-ZRGWGRIASA-N 2 2 372.469 2.871 20 5 FFBDLP C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246812587 510689553 /nfs/dbraw/zinc/68/95/53/510689553.db2.gz NJYNWJUTOZPPFZ-ZRGWGRIASA-N 2 2 372.469 2.871 20 5 FFBDLP C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246812587 510689557 /nfs/dbraw/zinc/68/95/57/510689557.db2.gz NJYNWJUTOZPPFZ-ZRGWGRIASA-N 2 2 372.469 2.871 20 5 FFBDLP C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246812587 510689559 /nfs/dbraw/zinc/68/95/59/510689559.db2.gz NJYNWJUTOZPPFZ-ZRGWGRIASA-N 2 2 372.469 2.871 20 5 FFBDLP COCC[NH+](CCOC)C1CC[NH+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000285469801 510919489 /nfs/dbraw/zinc/91/94/89/510919489.db2.gz KLNKRUBKXRMKFL-INIZCTEOSA-N 2 2 365.474 2.715 20 5 FFBDLP C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000292212270 511507911 /nfs/dbraw/zinc/50/79/11/511507911.db2.gz UESHDRGNVAKQTG-FZKQIMNGSA-N 2 2 357.414 2.733 20 5 FFBDLP C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000292212270 511507916 /nfs/dbraw/zinc/50/79/16/511507916.db2.gz UESHDRGNVAKQTG-FZKQIMNGSA-N 2 2 357.414 2.733 20 5 FFBDLP C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CC[C@@]2(CC[N@H+](C)C2)C1 ZINC000292212270 511507919 /nfs/dbraw/zinc/50/79/19/511507919.db2.gz UESHDRGNVAKQTG-FZKQIMNGSA-N 2 2 357.414 2.733 20 5 FFBDLP C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000292212270 511507921 /nfs/dbraw/zinc/50/79/21/511507921.db2.gz UESHDRGNVAKQTG-FZKQIMNGSA-N 2 2 357.414 2.733 20 5 FFBDLP COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000363562306 511629174 /nfs/dbraw/zinc/62/91/74/511629174.db2.gz LLLIARJLBOAOFQ-STQMWFEESA-N 2 2 373.413 2.533 20 5 FFBDLP COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000363562306 511629179 /nfs/dbraw/zinc/62/91/79/511629179.db2.gz LLLIARJLBOAOFQ-STQMWFEESA-N 2 2 373.413 2.533 20 5 FFBDLP C[C@@H]1CN(c2nccc3c2cccc3[N+](=O)[O-])CC[N@@H+]1C1CC[NH+](C)CC1 ZINC000450417561 513185259 /nfs/dbraw/zinc/18/52/59/513185259.db2.gz JVJVYYYSMXEZKN-OAHLLOKOSA-N 2 2 369.469 2.748 20 5 FFBDLP C[C@@H]1CN(c2nccc3c2cccc3[N+](=O)[O-])CC[N@H+]1C1CC[NH+](C)CC1 ZINC000450417561 513185269 /nfs/dbraw/zinc/18/52/69/513185269.db2.gz JVJVYYYSMXEZKN-OAHLLOKOSA-N 2 2 369.469 2.748 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CCOCC2)cc1NCC1CC[NH+](C2CC2)CC1 ZINC000447816674 513579350 /nfs/dbraw/zinc/57/93/50/513579350.db2.gz MFHVMAWCONKINK-UHFFFAOYSA-N 2 2 374.485 2.713 20 5 FFBDLP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]C[C@H]2[NH2+]CCc3ccccc32)n1 ZINC000423415027 514134577 /nfs/dbraw/zinc/13/45/77/514134577.db2.gz DDFBFZZFPWSOAA-KZNAEPCWSA-N 2 2 355.442 2.752 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCCC[C@H]3[C@@H]3CC[NH2+]C3)n2)c1 ZINC000420413084 514138932 /nfs/dbraw/zinc/13/89/32/514138932.db2.gz ZPFVPAUHDQNXPO-ZBFHGGJFSA-N 2 2 357.414 2.609 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCCC[C@H]3[C@@H]3CC[NH2+]C3)n2)c1 ZINC000420413084 514138934 /nfs/dbraw/zinc/13/89/34/514138934.db2.gz ZPFVPAUHDQNXPO-ZBFHGGJFSA-N 2 2 357.414 2.609 20 5 FFBDLP COc1cc(C[NH2+][C@@H]2CC[NH2+]C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414894009 514344928 /nfs/dbraw/zinc/34/49/28/514344928.db2.gz ZTRMVYQFAIJDAE-MRXNPFEDSA-N 2 2 357.410 2.634 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](CCC[NH3+])Cc1ccccc1 ZINC000479776070 514720565 /nfs/dbraw/zinc/72/05/65/514720565.db2.gz NLSFVQCJXYLAJB-UHFFFAOYSA-N 2 2 356.426 2.693 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](CCC[NH3+])Cc1ccccc1 ZINC000479776070 514720574 /nfs/dbraw/zinc/72/05/74/514720574.db2.gz NLSFVQCJXYLAJB-UHFFFAOYSA-N 2 2 356.426 2.693 20 5 FFBDLP C[N@H+](CCN1CC[NH+](Cc2ccccc2)CC1)Cc1ccccc1[N+](=O)[O-] ZINC000511881257 516063354 /nfs/dbraw/zinc/06/33/54/516063354.db2.gz ZNRBFIWNMCATPA-UHFFFAOYSA-N 2 2 368.481 2.844 20 5 FFBDLP C[N@@H+](CCN1CC[NH+](Cc2ccccc2)CC1)Cc1ccccc1[N+](=O)[O-] ZINC000511881257 516063362 /nfs/dbraw/zinc/06/33/62/516063362.db2.gz ZNRBFIWNMCATPA-UHFFFAOYSA-N 2 2 368.481 2.844 20 5 FFBDLP C[N@H+](CC1CC1)C[C@H]1CC[NH+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000531340097 516416820 /nfs/dbraw/zinc/41/68/20/516416820.db2.gz YKFRFJUBDVQKPX-OAHLLOKOSA-N 2 2 361.442 2.625 20 5 FFBDLP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000531340097 516416832 /nfs/dbraw/zinc/41/68/32/516416832.db2.gz YKFRFJUBDVQKPX-OAHLLOKOSA-N 2 2 361.442 2.625 20 5 FFBDLP C[NH+](CC1CC1)C[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000531340097 516416846 /nfs/dbraw/zinc/41/68/46/516416846.db2.gz YKFRFJUBDVQKPX-OAHLLOKOSA-N 2 2 361.442 2.625 20 5 FFBDLP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000531340097 516416852 /nfs/dbraw/zinc/41/68/52/516416852.db2.gz YKFRFJUBDVQKPX-OAHLLOKOSA-N 2 2 361.442 2.625 20 5 FFBDLP C[NH+](C)[C@@H](C[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000557875511 516484072 /nfs/dbraw/zinc/48/40/72/516484072.db2.gz FFJCQKUCOQZNSN-QGZVFWFLSA-N 2 2 370.453 2.686 20 5 FFBDLP C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1c[nH+]c2n1CCCC2 ZINC000556610194 517517256 /nfs/dbraw/zinc/51/72/56/517517256.db2.gz REFSWWTZCUBHNW-CYBMUJFWSA-N 2 2 357.414 2.635 20 5 FFBDLP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cc(O)ccc2[N+](=O)[O-])[C@H](C)C1 ZINC000549553456 517615245 /nfs/dbraw/zinc/61/52/45/517615245.db2.gz BDTFBUOTBGYNOP-RHSMWYFYSA-N 2 2 351.447 2.527 20 5 FFBDLP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2cc(O)ccc2[N+](=O)[O-])[C@H](C)C1 ZINC000549553456 517615253 /nfs/dbraw/zinc/61/52/53/517615253.db2.gz BDTFBUOTBGYNOP-RHSMWYFYSA-N 2 2 351.447 2.527 20 5 FFBDLP Cc1cc2[nH+]cn(C[C@@H](O)C[NH2+]CCc3ccccc3[N+](=O)[O-])c2cc1C ZINC000574150678 519012099 /nfs/dbraw/zinc/01/20/99/519012099.db2.gz FCTARFPICDPTJJ-KRWDZBQOSA-N 2 2 368.437 2.755 20 5 FFBDLP COc1cc(C[N@@H+]2CC[C@]3(C2)CCC[NH2+]C3)c([N+](=O)[O-])cc1OC(F)F ZINC000572121529 519454907 /nfs/dbraw/zinc/45/49/07/519454907.db2.gz ZUKKLMJTUICGES-QGZVFWFLSA-N 2 2 371.384 2.780 20 5 FFBDLP COc1cc(C[N@H+]2CC[C@]3(C2)CCC[NH2+]C3)c([N+](=O)[O-])cc1OC(F)F ZINC000572121529 519454918 /nfs/dbraw/zinc/45/49/18/519454918.db2.gz ZUKKLMJTUICGES-QGZVFWFLSA-N 2 2 371.384 2.780 20 5 FFBDLP Cc1ccc(NC(=O)[C@@H](c2ccccc2)[N@@H+]2CC[C@H](C[NH3+])C2)c([N+](=O)[O-])c1 ZINC000592471488 520403941 /nfs/dbraw/zinc/40/39/41/520403941.db2.gz MCKOUYMGZWODON-DNVCBOLYSA-N 2 2 368.437 2.864 20 5 FFBDLP Cc1ccc(NC(=O)[C@@H](c2ccccc2)[N@H+]2CC[C@H](C[NH3+])C2)c([N+](=O)[O-])c1 ZINC000592471488 520403947 /nfs/dbraw/zinc/40/39/47/520403947.db2.gz MCKOUYMGZWODON-DNVCBOLYSA-N 2 2 368.437 2.864 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@H]([C@@H]4CCC[NH2+]4)C3)n2)cc1 ZINC000592478413 520406961 /nfs/dbraw/zinc/40/69/61/520406961.db2.gz APRVUNOHHGYVIQ-HOCLYGCPSA-N 2 2 357.414 2.609 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@H]([C@@H]4CCC[NH2+]4)C3)n2)cc1 ZINC000592478413 520406967 /nfs/dbraw/zinc/40/69/67/520406967.db2.gz APRVUNOHHGYVIQ-HOCLYGCPSA-N 2 2 357.414 2.609 20 5 FFBDLP C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@@H]1CC[N@@H+]1C1CCCC1 ZINC000599072880 521016895 /nfs/dbraw/zinc/01/68/95/521016895.db2.gz BDTXCARKOZXVRH-KSSFIOAISA-N 2 2 360.458 2.918 20 5 FFBDLP C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@@H]1CC[N@H+]1C1CCCC1 ZINC000599072880 521016903 /nfs/dbraw/zinc/01/69/03/521016903.db2.gz BDTXCARKOZXVRH-KSSFIOAISA-N 2 2 360.458 2.918 20 5 FFBDLP Cn1cc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)c([N+](=O)[O-])n1 ZINC000602825407 521554973 /nfs/dbraw/zinc/55/49/73/521554973.db2.gz SLOQMIALZQBOAL-QGZVFWFLSA-N 2 2 357.458 2.719 20 5 FFBDLP Cn1cc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)c([N+](=O)[O-])n1 ZINC000602825407 521554984 /nfs/dbraw/zinc/55/49/84/521554984.db2.gz SLOQMIALZQBOAL-QGZVFWFLSA-N 2 2 357.458 2.719 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CCC([N@@H+]4CC[C@@H](O)C4)CC3)o2)cc1 ZINC000597234451 521588747 /nfs/dbraw/zinc/58/87/47/521588747.db2.gz AERYGFQZENEDDZ-GOSISDBHSA-N 2 2 371.437 2.886 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CCC([N@H+]4CC[C@@H](O)C4)CC3)o2)cc1 ZINC000597234451 521588754 /nfs/dbraw/zinc/58/87/54/521588754.db2.gz AERYGFQZENEDDZ-GOSISDBHSA-N 2 2 371.437 2.886 20 5 FFBDLP Cn1cc[nH+]c1N1CC[NH+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000597248974 521595589 /nfs/dbraw/zinc/59/55/89/521595589.db2.gz DTYXEWLINFNPLD-UHFFFAOYSA-N 2 2 367.409 2.911 20 5 FFBDLP O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]CCc2cn3c([nH+]2)CCCC3)n1 ZINC000616008181 521600723 /nfs/dbraw/zinc/60/07/23/521600723.db2.gz WNOZOCCQKYAXEO-HOTGVXAUSA-N 2 2 358.446 2.640 20 5 FFBDLP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]CCc2cn3c([nH+]2)CCCC3)n1 ZINC000616008183 521601072 /nfs/dbraw/zinc/60/10/72/521601072.db2.gz WNOZOCCQKYAXEO-JKSUJKDBSA-N 2 2 358.446 2.640 20 5 FFBDLP C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[NH+]1CCC(CC[NH3+])CC1 ZINC000846225714 748434036 /nfs/dbraw/zinc/43/40/36/748434036.db2.gz QYDIWOVARCSZGA-NSHDSACASA-N 2 2 354.838 2.636 20 5 FFBDLP Cc1nn(C[N@H+]2CC[C@H](C)[C@H](n3cc[nH+]c3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000765084589 984956554 /nfs/dbraw/zinc/95/65/54/984956554.db2.gz WEDJSFZCPNKNSV-SCLBCKFNSA-N 2 2 354.414 2.990 20 5 FFBDLP Cc1nn(C[N@@H+]2CC[C@H](C)[C@H](n3cc[nH+]c3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000765084589 984956560 /nfs/dbraw/zinc/95/65/60/984956560.db2.gz WEDJSFZCPNKNSV-SCLBCKFNSA-N 2 2 354.414 2.990 20 5 FFBDLP CC(C)[N@H+](C)CC1CC[NH+](Cn2c3cc([N+](=O)[O-])ccc3oc2=O)CC1 ZINC000738088455 999616269 /nfs/dbraw/zinc/61/62/69/999616269.db2.gz DWMPHNLCIFVUJA-UHFFFAOYSA-N 2 2 362.430 2.512 20 5 FFBDLP CC(C)[N@@H+](C)CC1CC[NH+](Cn2c3cc([N+](=O)[O-])ccc3oc2=O)CC1 ZINC000738088455 999616270 /nfs/dbraw/zinc/61/62/70/999616270.db2.gz DWMPHNLCIFVUJA-UHFFFAOYSA-N 2 2 362.430 2.512 20 5 FFBDLP C[C@H](c1ccncc1)[NH+]1CCC([NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000819184251 1008061365 /nfs/dbraw/zinc/06/13/65/1008061365.db2.gz XQSNWOZQPCEQNZ-QRWLVFNGSA-N 2 2 370.453 2.838 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@@H](C)n2c(C)[nH+]c3c2CC[NH2+]CC3)c1F ZINC001173183047 1012325754 /nfs/dbraw/zinc/32/57/54/1012325754.db2.gz VYWFIZUYQODQNR-LLVKDONJSA-N 2 2 362.405 2.739 20 5 FFBDLP Cc1[nH+]c2c(n1-c1cc(C)nc(-c3ccc([N+](=O)[O-])cc3)n1)CC[NH2+]CC2 ZINC001165354919 1029956239 /nfs/dbraw/zinc/95/62/39/1029956239.db2.gz MTHIQWSOSMFAAN-UHFFFAOYSA-N 2 2 364.409 2.543 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CCC[C@@]3(CC[NH2+]C3)C2)c1F ZINC001246626660 1039420490 /nfs/dbraw/zinc/42/04/90/1039420490.db2.gz HGPSFURMHCPGSW-UGSOOPFHSA-N 2 2 351.422 2.749 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC[C@@]3(CC[NH2+]C3)C2)c1F ZINC001246626660 1039420493 /nfs/dbraw/zinc/42/04/93/1039420493.db2.gz HGPSFURMHCPGSW-UGSOOPFHSA-N 2 2 351.422 2.749 20 5 FFBDLP CC[NH+](CC)C1CCN(C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)CC1 ZINC001324645230 1046144461 /nfs/dbraw/zinc/14/44/61/1046144461.db2.gz OEQKBGGQMPOTGU-UHFFFAOYSA-N 2 2 371.441 2.727 20 5 FFBDLP O=C(c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)N1CCCC[C@@]12CCC[NH2+]C2 ZINC001343677325 1052369955 /nfs/dbraw/zinc/36/99/55/1052369955.db2.gz USPDYJGAOURKPP-IBGZPJMESA-N 2 2 369.425 2.529 20 5 FFBDLP C[N@@H+]1CC[C@@H]2C[NH+](Cc3ccc([N+](=O)[O-])cc3Br)C[C@@H]2C1 ZINC001307986922 1052376945 /nfs/dbraw/zinc/37/69/45/1052376945.db2.gz FZTYHDUFXUTGHA-YPMHNXCESA-N 2 2 354.248 2.741 20 5 FFBDLP C[N@H+]1CC[C@@H]2C[NH+](Cc3ccc([N+](=O)[O-])cc3Br)C[C@@H]2C1 ZINC001307986922 1052376948 /nfs/dbraw/zinc/37/69/48/1052376948.db2.gz FZTYHDUFXUTGHA-YPMHNXCESA-N 2 2 354.248 2.741 20 5 FFBDLP C[NH+]1CC[C@@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3Br)C[C@@H]2C1 ZINC001307986922 1052376954 /nfs/dbraw/zinc/37/69/54/1052376954.db2.gz FZTYHDUFXUTGHA-YPMHNXCESA-N 2 2 354.248 2.741 20 5 FFBDLP C[NH+]1CC[C@@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3Br)C[C@@H]2C1 ZINC001307986922 1052376958 /nfs/dbraw/zinc/37/69/58/1052376958.db2.gz FZTYHDUFXUTGHA-YPMHNXCESA-N 2 2 354.248 2.741 20 5 FFBDLP Cn1cc[nH+]c1[C@H]1CCC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001473432320 1056384106 /nfs/dbraw/zinc/38/41/06/1056384106.db2.gz IZPKNQAPOHPLPU-ZDUSSCGKSA-N 2 2 368.397 2.758 20 5 FFBDLP Cn1cc[nH+]c1[C@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001473432320 1056384119 /nfs/dbraw/zinc/38/41/19/1056384119.db2.gz IZPKNQAPOHPLPU-ZDUSSCGKSA-N 2 2 368.397 2.758 20 5 FFBDLP Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001473896399 1065411080 /nfs/dbraw/zinc/41/10/80/1065411080.db2.gz CLRUBLVNMLXSDX-HNNXBMFYSA-N 2 2 360.462 2.931 20 5 FFBDLP Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H](c2c[nH+]cn2C(C)(C)C)C1 ZINC001473896399 1065411084 /nfs/dbraw/zinc/41/10/84/1065411084.db2.gz CLRUBLVNMLXSDX-HNNXBMFYSA-N 2 2 360.462 2.931 20 5 FFBDLP CC1CC[NH+](C[C@H]2CCC[N@H+](Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C2)CC1 ZINC000112657864 508206399 /nfs/dbraw/zinc/20/63/99/508206399.db2.gz PQWFTVIPYSUPIJ-MRXNPFEDSA-N 2 2 374.485 2.638 20 5 FFBDLP CC1CC[NH+](C[C@H]2CCC[N@@H+](Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C2)CC1 ZINC000112657864 508206402 /nfs/dbraw/zinc/20/64/02/508206402.db2.gz PQWFTVIPYSUPIJ-MRXNPFEDSA-N 2 2 374.485 2.638 20 5 FFBDLP CCOc1ccc([C@H](C)[NH2+]C[C@@H](O)C[NH+]2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000153702878 508629534 /nfs/dbraw/zinc/62/95/34/508629534.db2.gz BUAAZTKKEPMLAV-DOTOQJQBSA-N 2 2 365.474 2.737 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CC[C@H](Oc4cc[nH+]cc4)C3)o2)cc1 ZINC000120197881 508948301 /nfs/dbraw/zinc/94/83/01/508948301.db2.gz MGTBADLTDJOTAJ-INIZCTEOSA-N 2 2 367.365 2.693 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CC[C@H](Oc4cc[nH+]cc4)C3)o2)cc1 ZINC000120197881 508948303 /nfs/dbraw/zinc/94/83/03/508948303.db2.gz MGTBADLTDJOTAJ-INIZCTEOSA-N 2 2 367.365 2.693 20 5 FFBDLP Cc1cc(C(=O)NCC2([NH+]3CCCCC3)CC[NH+](C)CC2)ccc1[N+](=O)[O-] ZINC000172750400 509210554 /nfs/dbraw/zinc/21/05/54/509210554.db2.gz LZDIGSUGQVPHJK-UHFFFAOYSA-N 2 2 374.485 2.583 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@H](c4[nH]cc[nH+]4)C3)o2)cc1 ZINC000266920027 509259668 /nfs/dbraw/zinc/25/96/68/509259668.db2.gz LPYZYWOJMDGIRM-ZDUSSCGKSA-N 2 2 354.370 2.748 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@H](c4[nH]cc[nH+]4)C3)o2)cc1 ZINC000266920027 509259671 /nfs/dbraw/zinc/25/96/71/509259671.db2.gz LPYZYWOJMDGIRM-ZDUSSCGKSA-N 2 2 354.370 2.748 20 5 FFBDLP C[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185697402 509310796 /nfs/dbraw/zinc/31/07/96/509310796.db2.gz ZUKWNLUWLYRZKR-HUUCEWRRSA-N 2 2 360.458 2.776 20 5 FFBDLP C[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185697402 509310805 /nfs/dbraw/zinc/31/08/05/509310805.db2.gz ZUKWNLUWLYRZKR-HUUCEWRRSA-N 2 2 360.458 2.776 20 5 FFBDLP Cn1cc(C[NH2+]CCCNc2cccc[nH+]2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000177591144 510150000 /nfs/dbraw/zinc/15/00/00/510150000.db2.gz GREZUOVDPDLPFU-UHFFFAOYSA-N 2 2 366.425 2.982 20 5 FFBDLP C[C@@H]([NH2+]C1CC[NH+](Cc2ccncc2)CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000284303333 511675586 /nfs/dbraw/zinc/67/55/86/511675586.db2.gz YTZBCURLWCAHTG-CQSZACIVSA-N 2 2 355.442 2.887 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@H](Oc2cc[nH+]cc2)C1 ZINC000367862068 512693999 /nfs/dbraw/zinc/69/39/99/512693999.db2.gz GAMFGJHQTPRDTC-QGZVFWFLSA-N 2 2 370.409 2.780 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](Oc2cc[nH+]cc2)C1 ZINC000367862068 512694005 /nfs/dbraw/zinc/69/40/05/512694005.db2.gz GAMFGJHQTPRDTC-QGZVFWFLSA-N 2 2 370.409 2.780 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@@H+]2Cc1ccc([N+](=O)[O-])cc1Cl ZINC000374695360 512959856 /nfs/dbraw/zinc/95/98/56/512959856.db2.gz FKVAHQZXROFEJP-XYPHTWIQSA-N 2 2 353.850 2.932 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@H+]2Cc1ccc([N+](=O)[O-])cc1Cl ZINC000374695360 512959861 /nfs/dbraw/zinc/95/98/61/512959861.db2.gz FKVAHQZXROFEJP-XYPHTWIQSA-N 2 2 353.850 2.932 20 5 FFBDLP C[C@H]1CN(c2nccc3cc([N+](=O)[O-])ccc32)CC[N@@H+]1C1CC[NH+](C)CC1 ZINC000450423263 513188414 /nfs/dbraw/zinc/18/84/14/513188414.db2.gz WZPMYUZVYPRDRF-HNNXBMFYSA-N 2 2 369.469 2.748 20 5 FFBDLP C[C@H]1CN(c2nccc3cc([N+](=O)[O-])ccc32)CC[N@H+]1C1CC[NH+](C)CC1 ZINC000450423263 513188421 /nfs/dbraw/zinc/18/84/21/513188421.db2.gz WZPMYUZVYPRDRF-HNNXBMFYSA-N 2 2 369.469 2.748 20 5 FFBDLP C[C@H](C[NH+]1CCCCCC1)NC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000450743233 513322411 /nfs/dbraw/zinc/32/24/11/513322411.db2.gz GGUUUUVGFZTXFZ-OAHLLOKOSA-N 2 2 371.441 2.775 20 5 FFBDLP Cn1cc[nH+]c1CN(Cc1csc([N+](=O)[O-])c1)[C@H]1CC12CC[NH2+]CC2 ZINC000435430976 513582348 /nfs/dbraw/zinc/58/23/48/513582348.db2.gz GIXBPUYJEITJOC-AWEZNQCLSA-N 2 2 361.471 2.534 20 5 FFBDLP C[N@H+](CCNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)C1CCCCC1 ZINC000448805001 513907052 /nfs/dbraw/zinc/90/70/52/513907052.db2.gz LVWSDKNYFZAKGG-UHFFFAOYSA-N 2 2 371.441 2.775 20 5 FFBDLP C[N@@H+](CCNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)C1CCCCC1 ZINC000448805001 513907057 /nfs/dbraw/zinc/90/70/57/513907057.db2.gz LVWSDKNYFZAKGG-UHFFFAOYSA-N 2 2 371.441 2.775 20 5 FFBDLP CNc1cc(N2CCC[C@@H]2C[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])nc[nH+]1 ZINC000449125362 514081501 /nfs/dbraw/zinc/08/15/01/514081501.db2.gz RWOPJXHIJQSLMM-GOEBONIOSA-N 2 2 370.457 2.616 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCC[N@H+]1CCCO ZINC000449386006 514189668 /nfs/dbraw/zinc/18/96/68/514189668.db2.gz HBSZHWGOTIQTDG-UHOSZYNNSA-N 2 2 361.486 2.742 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCC[N@@H+]1CCCO ZINC000449386006 514189669 /nfs/dbraw/zinc/18/96/69/514189669.db2.gz HBSZHWGOTIQTDG-UHOSZYNNSA-N 2 2 361.486 2.742 20 5 FFBDLP CC1CC[NH+](C[C@@H](O)C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000433181197 514408429 /nfs/dbraw/zinc/40/84/29/514408429.db2.gz XGKJKDZNBQVWKG-QFBILLFUSA-N 2 2 361.486 3.000 20 5 FFBDLP CN(c1ccccc1)c1ccc(C[N@@H+]2CCCO[C@H](C[NH3+])C2)cc1[N+](=O)[O-] ZINC000415106998 514447188 /nfs/dbraw/zinc/44/71/88/514447188.db2.gz KHGVXKPCKNJVSG-GOSISDBHSA-N 2 2 370.453 2.912 20 5 FFBDLP CN(c1ccccc1)c1ccc(C[N@H+]2CCCO[C@H](C[NH3+])C2)cc1[N+](=O)[O-] ZINC000415106998 514447195 /nfs/dbraw/zinc/44/71/95/514447195.db2.gz KHGVXKPCKNJVSG-GOSISDBHSA-N 2 2 370.453 2.912 20 5 FFBDLP COc1cc(C[N@@H+]2CC[C@@H](C)[C@@H](C[NH3+])C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000415132392 514458963 /nfs/dbraw/zinc/45/89/63/514458963.db2.gz UCNCEBFSJDLQEB-YPMHNXCESA-N 2 2 373.400 2.664 20 5 FFBDLP COc1cc(C[N@H+]2CC[C@@H](C)[C@@H](C[NH3+])C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000415132392 514458971 /nfs/dbraw/zinc/45/89/71/514458971.db2.gz UCNCEBFSJDLQEB-YPMHNXCESA-N 2 2 373.400 2.664 20 5 FFBDLP C[NH+](C)[C@H](CNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-])c1ccco1 ZINC000472041388 515094897 /nfs/dbraw/zinc/09/48/97/515094897.db2.gz FDWULKXGQRWXFT-GOSISDBHSA-N 2 2 374.441 2.735 20 5 FFBDLP O=C(C[NH+]1CCC(CCCn2cc[nH+]c2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000542132003 517397753 /nfs/dbraw/zinc/39/77/53/517397753.db2.gz FUXNQNWZRYRUAE-UHFFFAOYSA-N 2 2 371.441 2.922 20 5 FFBDLP O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](Cc3cc(-n4cc[nH+]c4)cs3)C2)nc1 ZINC000542466684 517582038 /nfs/dbraw/zinc/58/20/38/517582038.db2.gz QIBUAGYWNZXSDF-CYBMUJFWSA-N 2 2 370.438 2.923 20 5 FFBDLP O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3cc(-n4cc[nH+]c4)cs3)C2)nc1 ZINC000542466684 517582040 /nfs/dbraw/zinc/58/20/40/517582040.db2.gz QIBUAGYWNZXSDF-CYBMUJFWSA-N 2 2 370.438 2.923 20 5 FFBDLP [NH3+]CC12CCC(CC1)C[N@@H+]2CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000569988285 518389886 /nfs/dbraw/zinc/38/98/86/518389886.db2.gz NGEBOMGUAVQRNU-UHFFFAOYSA-N 2 2 356.426 2.996 20 5 FFBDLP [NH3+]CC12CCC(CC1)C[N@H+]2CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000569988285 518389891 /nfs/dbraw/zinc/38/98/91/518389891.db2.gz NGEBOMGUAVQRNU-UHFFFAOYSA-N 2 2 356.426 2.996 20 5 FFBDLP COc1cc(C[NH2+]CC2([NH3+])CCCC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000594739232 520124926 /nfs/dbraw/zinc/12/49/26/520124926.db2.gz PMWYQJHUCCKRKO-UHFFFAOYSA-N 2 2 359.373 2.608 20 5 FFBDLP O=C(NC[C@@H]1CC[N@@H+]1C1CCCC1)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000600470893 520278920 /nfs/dbraw/zinc/27/89/20/520278920.db2.gz JOBZAGAWPVBHOJ-INIZCTEOSA-N 2 2 369.425 2.527 20 5 FFBDLP O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000600470893 520278925 /nfs/dbraw/zinc/27/89/25/520278925.db2.gz JOBZAGAWPVBHOJ-INIZCTEOSA-N 2 2 369.425 2.527 20 5 FFBDLP CC[N@H+](CC1CCN(c2cccc[nH+]2)CC1)Cn1nc(C)c([N+](=O)[O-])c1C ZINC000173511869 985852708 /nfs/dbraw/zinc/85/27/08/985852708.db2.gz MLOMZEMLNHNMLF-UHFFFAOYSA-N 2 2 372.473 2.999 20 5 FFBDLP CC[N@@H+](CC1CCN(c2cccc[nH+]2)CC1)Cn1nc(C)c([N+](=O)[O-])c1C ZINC000173511869 985852726 /nfs/dbraw/zinc/85/27/26/985852726.db2.gz MLOMZEMLNHNMLF-UHFFFAOYSA-N 2 2 372.473 2.999 20 5 FFBDLP Cc1c(NC(=O)CC[NH+]2C[C@]3(C)C[NH+](C)C[C@@]3(C)C2)cccc1[N+](=O)[O-] ZINC000823755630 999074599 /nfs/dbraw/zinc/07/45/99/999074599.db2.gz UZBUEFWPCLERTO-OALUTQOASA-N 2 2 360.458 2.505 20 5 FFBDLP Cc1nn(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)c(C)c1[N+](=O)[O-] ZINC000788381851 1001797740 /nfs/dbraw/zinc/79/77/40/1001797740.db2.gz IEWPCKCEGQPSSS-UHFFFAOYSA-N 2 2 358.446 2.778 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC000850434500 1005815405 /nfs/dbraw/zinc/81/54/05/1005815405.db2.gz UKQYXDDELKCIGT-YOEHRIQHSA-N 2 2 363.458 2.897 20 5 FFBDLP C[C@@H](c1ccncc1)[NH+]1CCC([NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000819183519 1008060510 /nfs/dbraw/zinc/06/05/10/1008060510.db2.gz PQODVHIDTWTWCD-MGPUTAFESA-N 2 2 370.453 2.838 20 5 FFBDLP COc1cc(C[N@@H+]2C[C@@H]3CC[NH+](C)C[C@@H]3C2)c([N+](=O)[O-])cc1OC(F)F ZINC000931431307 1020462226 /nfs/dbraw/zinc/46/22/26/1020462226.db2.gz KPDCNXQBZVNPEP-WCQYABFASA-N 2 2 371.384 2.588 20 5 FFBDLP COc1cc(C[N@H+]2C[C@@H]3CC[NH+](C)C[C@@H]3C2)c([N+](=O)[O-])cc1OC(F)F ZINC000931431307 1020462231 /nfs/dbraw/zinc/46/22/31/1020462231.db2.gz KPDCNXQBZVNPEP-WCQYABFASA-N 2 2 371.384 2.588 20 5 FFBDLP COc1cc(C[NH+]2C[C@@H]3CC[N@H+](C)C[C@@H]3C2)c([N+](=O)[O-])cc1OC(F)F ZINC000931431307 1020462235 /nfs/dbraw/zinc/46/22/35/1020462235.db2.gz KPDCNXQBZVNPEP-WCQYABFASA-N 2 2 371.384 2.588 20 5 FFBDLP COc1cc(C[NH+]2C[C@@H]3CC[N@@H+](C)C[C@@H]3C2)c([N+](=O)[O-])cc1OC(F)F ZINC000931431307 1020462240 /nfs/dbraw/zinc/46/22/40/1020462240.db2.gz KPDCNXQBZVNPEP-WCQYABFASA-N 2 2 371.384 2.588 20 5 FFBDLP CC[NH+](CC)CC[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC001522858255 1062310079 /nfs/dbraw/zinc/31/00/79/1062310079.db2.gz QNQOGUYGCFDRNA-CQSZACIVSA-N 2 2 359.430 2.631 20 5 FFBDLP C[NH+](C)C1CC[NH+](CCNc2cc(Br)ccc2[N+](=O)[O-])CC1 ZINC000301684380 258062636 /nfs/dbraw/zinc/06/26/36/258062636.db2.gz TUPHYMABVREPLG-UHFFFAOYSA-N 2 2 371.279 2.795 20 5 FFBDLP CC[C@H]([NH2+]CCC[N@@H+]1CCC[C@@H]1C(=O)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000155337078 508979918 /nfs/dbraw/zinc/97/99/18/508979918.db2.gz QWEWMYGCHQCPPJ-ZWKOTPCHSA-N 2 2 362.474 2.578 20 5 FFBDLP CC[C@H]([NH2+]CCC[N@H+]1CCC[C@@H]1C(=O)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000155337078 508979920 /nfs/dbraw/zinc/97/99/20/508979920.db2.gz QWEWMYGCHQCPPJ-ZWKOTPCHSA-N 2 2 362.474 2.578 20 5 FFBDLP COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000266959812 509278359 /nfs/dbraw/zinc/27/83/59/509278359.db2.gz WOOLULUMSVHYMB-CYBMUJFWSA-N 2 2 373.413 2.535 20 5 FFBDLP COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000266959812 509278363 /nfs/dbraw/zinc/27/83/63/509278363.db2.gz WOOLULUMSVHYMB-CYBMUJFWSA-N 2 2 373.413 2.535 20 5 FFBDLP C[NH+](C)C1CC[NH+](CCNc2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000267229597 509403280 /nfs/dbraw/zinc/40/32/80/509403280.db2.gz VJDUTAVFDNTCGO-UHFFFAOYSA-N 2 2 358.389 2.634 20 5 FFBDLP O=[N+]([O-])c1cc(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c2c(c1)COCO2 ZINC000173880879 509832290 /nfs/dbraw/zinc/83/22/90/509832290.db2.gz MDFJNWNVGXJXQG-OAHLLOKOSA-N 2 2 361.442 2.769 20 5 FFBDLP O=[N+]([O-])c1cc(C[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c2c(c1)COCO2 ZINC000173880879 509832294 /nfs/dbraw/zinc/83/22/94/509832294.db2.gz MDFJNWNVGXJXQG-OAHLLOKOSA-N 2 2 361.442 2.769 20 5 FFBDLP COc1cc(C[N@@H+]2CCC[C@@H](Cc3[nH+]ccn3C)C2)c([N+](=O)[O-])cc1F ZINC000184289081 510242235 /nfs/dbraw/zinc/24/22/35/510242235.db2.gz NJANADIQNMNMSX-ZDUSSCGKSA-N 2 2 362.405 2.931 20 5 FFBDLP COc1cc(C[N@H+]2CCC[C@@H](Cc3[nH+]ccn3C)C2)c([N+](=O)[O-])cc1F ZINC000184289081 510242241 /nfs/dbraw/zinc/24/22/41/510242241.db2.gz NJANADIQNMNMSX-ZDUSSCGKSA-N 2 2 362.405 2.931 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000246571789 510562810 /nfs/dbraw/zinc/56/28/10/510562810.db2.gz BQPBFFUWVFHFRU-CABCVRRESA-N 2 2 371.441 2.610 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000246571789 510562812 /nfs/dbraw/zinc/56/28/12/510562812.db2.gz BQPBFFUWVFHFRU-CABCVRRESA-N 2 2 371.441 2.610 20 5 FFBDLP C[NH+](C)CC[C@@H](NC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)C(C)(C)C ZINC000172267192 510639000 /nfs/dbraw/zinc/63/90/00/510639000.db2.gz DNYACJVPUAWAFJ-QGZVFWFLSA-N 2 2 373.457 2.877 20 5 FFBDLP O=C1[C@H]([N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000247186790 510850079 /nfs/dbraw/zinc/85/00/79/510850079.db2.gz VCFASGCALNDLNG-VQIMIIECSA-N 2 2 372.469 2.650 20 5 FFBDLP O=C1[C@H]([N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000247186790 510850080 /nfs/dbraw/zinc/85/00/80/510850080.db2.gz VCFASGCALNDLNG-VQIMIIECSA-N 2 2 372.469 2.650 20 5 FFBDLP CN(CC[N@H+](C)C1CC[NH+](C)CC1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000271615437 511264025 /nfs/dbraw/zinc/26/40/25/511264025.db2.gz DAQSBZYIOQKLKS-UHFFFAOYSA-N 2 2 354.882 2.706 20 5 FFBDLP CN(CC[N@@H+](C)C1CC[NH+](C)CC1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000271615437 511264029 /nfs/dbraw/zinc/26/40/29/511264029.db2.gz DAQSBZYIOQKLKS-UHFFFAOYSA-N 2 2 354.882 2.706 20 5 FFBDLP CN(CC[N@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-])C1CC[NH+](C)CC1 ZINC000271615437 511264034 /nfs/dbraw/zinc/26/40/34/511264034.db2.gz DAQSBZYIOQKLKS-UHFFFAOYSA-N 2 2 354.882 2.706 20 5 FFBDLP CN(CC[N@@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-])C1CC[NH+](C)CC1 ZINC000271615437 511264039 /nfs/dbraw/zinc/26/40/39/511264039.db2.gz DAQSBZYIOQKLKS-UHFFFAOYSA-N 2 2 354.882 2.706 20 5 FFBDLP C[C@H](Nc1ccc(N2CC[C@@H]([NH+](C)C)C2)c[nH+]1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000284985874 511957388 /nfs/dbraw/zinc/95/73/88/511957388.db2.gz GHDVTXUSDOLILN-XJKSGUPXSA-N 2 2 370.457 2.885 20 5 FFBDLP CN(Cc1cc([N+](=O)[O-])ccc1Cl)[C@@H]1CC[N@@H+](C2CC[NH+](C)CC2)C1 ZINC000378427749 512754300 /nfs/dbraw/zinc/75/43/00/512754300.db2.gz JLPRGVZVFWMQOG-QGZVFWFLSA-N 2 2 366.893 2.849 20 5 FFBDLP CN(Cc1cc([N+](=O)[O-])ccc1Cl)[C@@H]1CC[N@H+](C2CC[NH+](C)CC2)C1 ZINC000378427749 512754305 /nfs/dbraw/zinc/75/43/05/512754305.db2.gz JLPRGVZVFWMQOG-QGZVFWFLSA-N 2 2 366.893 2.849 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@@H+]2Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000374426293 512828218 /nfs/dbraw/zinc/82/82/18/512828218.db2.gz DCFVKCCDCGNGLO-INMHGKMJSA-N 2 2 353.850 2.932 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@H+]2Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000374426293 512828220 /nfs/dbraw/zinc/82/82/20/512828220.db2.gz DCFVKCCDCGNGLO-INMHGKMJSA-N 2 2 353.850 2.932 20 5 FFBDLP CC[NH+]1CCC([N@@H+]2CCCN(C(=O)c3cccc([N+](=O)[O-])c3C)CC2)CC1 ZINC000422010873 513520438 /nfs/dbraw/zinc/52/04/38/513520438.db2.gz TZSUTGPUZPRNKJ-UHFFFAOYSA-N 2 2 374.485 2.535 20 5 FFBDLP CC[NH+]1CCC([N@H+]2CCCN(C(=O)c3cccc([N+](=O)[O-])c3C)CC2)CC1 ZINC000422010873 513520443 /nfs/dbraw/zinc/52/04/43/513520443.db2.gz TZSUTGPUZPRNKJ-UHFFFAOYSA-N 2 2 374.485 2.535 20 5 FFBDLP COc1cc(C[N@H+](C)[C@@H](C)C[NH3+])ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000435377194 513568836 /nfs/dbraw/zinc/56/88/36/513568836.db2.gz YZYONDQQYXCGPI-AWEZNQCLSA-N 2 2 359.426 2.961 20 5 FFBDLP COc1cc(C[N@@H+](C)[C@@H](C)C[NH3+])ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000435377194 513568842 /nfs/dbraw/zinc/56/88/42/513568842.db2.gz YZYONDQQYXCGPI-AWEZNQCLSA-N 2 2 359.426 2.961 20 5 FFBDLP O=C(NC[C@@H]1CCCC[N@@H+]1C1CC1)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000451203834 513586133 /nfs/dbraw/zinc/58/61/33/513586133.db2.gz RDFHZEKTSLLPTL-INIZCTEOSA-N 2 2 369.425 2.527 20 5 FFBDLP O=C(NC[C@@H]1CCCC[N@H+]1C1CC1)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000451203834 513586140 /nfs/dbraw/zinc/58/61/40/513586140.db2.gz RDFHZEKTSLLPTL-INIZCTEOSA-N 2 2 369.425 2.527 20 5 FFBDLP O=C(NC[C@H]1CCCC[N@@H+]1C1CC1)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000451203835 513587317 /nfs/dbraw/zinc/58/73/17/513587317.db2.gz RDFHZEKTSLLPTL-MRXNPFEDSA-N 2 2 369.425 2.527 20 5 FFBDLP O=C(NC[C@H]1CCCC[N@H+]1C1CC1)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000451203835 513587320 /nfs/dbraw/zinc/58/73/20/513587320.db2.gz RDFHZEKTSLLPTL-MRXNPFEDSA-N 2 2 369.425 2.527 20 5 FFBDLP CC1(C)CCC[NH2+][C@H]1CNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000420233723 514056449 /nfs/dbraw/zinc/05/64/49/514056449.db2.gz ATBRXOHSTMCWME-SFHVURJKSA-N 2 2 362.474 2.617 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1C[C@H](O)C[N@@H+]1Cc1ccccc1 ZINC000449214765 514116599 /nfs/dbraw/zinc/11/65/99/514116599.db2.gz ZFXITLRAXJXCQE-AHRSYUTCSA-N 2 2 369.465 2.751 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1C[C@H](O)C[N@H+]1Cc1ccccc1 ZINC000449214765 514116607 /nfs/dbraw/zinc/11/66/07/514116607.db2.gz ZFXITLRAXJXCQE-AHRSYUTCSA-N 2 2 369.465 2.751 20 5 FFBDLP Cn1cc[nH+]c1[C@@H](NC[C@H]1[NH2+]CCCC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000423403172 514130713 /nfs/dbraw/zinc/13/07/13/514130713.db2.gz ZAGDFUXJWYGIRM-SJORKVTESA-N 2 2 357.458 2.786 20 5 FFBDLP Cc1cc(N[C@@H]2CC[N@@H+]3CCC[C@H]3C2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000489179378 514741563 /nfs/dbraw/zinc/74/15/63/514741563.db2.gz ZAEKPCMZZXICNV-WBVHZDCISA-N 2 2 353.426 2.821 20 5 FFBDLP Cc1cc(N[C@@H]2CC[N@H+]3CCC[C@H]3C2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000489179378 514741573 /nfs/dbraw/zinc/74/15/73/514741573.db2.gz ZAEKPCMZZXICNV-WBVHZDCISA-N 2 2 353.426 2.821 20 5 FFBDLP C[N@@H+]1CCCC(C)(C)[C@H]1CNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000468483330 515380021 /nfs/dbraw/zinc/38/00/21/515380021.db2.gz JWKGTNNGYXWMLT-QGZVFWFLSA-N 2 2 371.441 2.631 20 5 FFBDLP C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000468483330 515380025 /nfs/dbraw/zinc/38/00/25/515380025.db2.gz JWKGTNNGYXWMLT-QGZVFWFLSA-N 2 2 371.441 2.631 20 5 FFBDLP C[C@@H]1C[N@H+](Cc2c(Cl)cccc2[N+](=O)[O-])CC[C@H]1N1CC[NH+](C)CC1 ZINC000491978285 515486993 /nfs/dbraw/zinc/48/69/93/515486993.db2.gz JHLAQOUXOHNYKB-RHSMWYFYSA-N 2 2 366.893 2.706 20 5 FFBDLP C[C@@H]1C[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])CC[C@H]1N1CC[NH+](C)CC1 ZINC000491978285 515487002 /nfs/dbraw/zinc/48/70/02/515487002.db2.gz JHLAQOUXOHNYKB-RHSMWYFYSA-N 2 2 366.893 2.706 20 5 FFBDLP Cc1cn2c([nH+]1)[C@H](C[NH2+][C@@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000531988149 516744490 /nfs/dbraw/zinc/74/44/90/516744490.db2.gz DNKZNUGFDDFGKY-ZFWWWQNUSA-N 2 2 371.441 2.984 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CCOCC2)cc1NCCCCn1cc[nH+]c1 ZINC000569915373 518353241 /nfs/dbraw/zinc/35/32/41/518353241.db2.gz CKFKCTBHPAMRAH-UHFFFAOYSA-N 2 2 359.430 2.516 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@H](n4cc[nH+]c4)C3)n2)c1 ZINC000609157488 520214321 /nfs/dbraw/zinc/21/43/21/520214321.db2.gz VLQPOAVHVNSNBZ-HNNXBMFYSA-N 2 2 354.370 2.678 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@H](n4cc[nH+]c4)C3)n2)c1 ZINC000609157488 520214326 /nfs/dbraw/zinc/21/43/26/520214326.db2.gz VLQPOAVHVNSNBZ-HNNXBMFYSA-N 2 2 354.370 2.678 20 5 FFBDLP C[C@H](C[NH+]1CCC(C)CC1)NC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000598260340 520525260 /nfs/dbraw/zinc/52/52/60/520525260.db2.gz AYEDYTYQZUSNCY-OAHLLOKOSA-N 2 2 371.441 2.631 20 5 FFBDLP O=[N+]([O-])c1ccc(N2CCC([NH2+][C@@H]3CCC[N@@H+]4CCCC[C@@H]34)CC2)cn1 ZINC000602708498 521489935 /nfs/dbraw/zinc/48/99/35/521489935.db2.gz HWFLWNSMBLCCSA-MSOLQXFVSA-N 2 2 359.474 2.565 20 5 FFBDLP O=[N+]([O-])c1ccc(N2CCC([NH2+][C@@H]3CCC[N@H+]4CCCC[C@@H]34)CC2)cn1 ZINC000602708498 521489939 /nfs/dbraw/zinc/48/99/39/521489939.db2.gz HWFLWNSMBLCCSA-MSOLQXFVSA-N 2 2 359.474 2.565 20 5 FFBDLP Cc1cc[nH+]cc1N1CC[NH+](CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000619623773 521800671 /nfs/dbraw/zinc/80/06/71/521800671.db2.gz GZYVEHBBLRPUAY-UHFFFAOYSA-N 2 2 356.426 2.889 20 5 FFBDLP CC(C)(C)[C@H](Cn1cc[nH+]c1)[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000876957060 1014433069 /nfs/dbraw/zinc/43/30/69/1014433069.db2.gz SNMZQWWIVUHCPH-KRWDZBQOSA-N 2 2 372.473 2.860 20 5 FFBDLP C[C@H](c1ccncc1)[NH+]1CCC([NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)CC1 ZINC000877115880 1014479248 /nfs/dbraw/zinc/47/92/48/1014479248.db2.gz UXTIPJPADYKRFK-RWBZWWBESA-N 2 2 370.457 2.705 20 5 FFBDLP C[C@H]1C[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CCN1c1cc[nH+]cc1 ZINC000880263400 1015793485 /nfs/dbraw/zinc/79/34/85/1015793485.db2.gz XLAGUNHLIPWJEX-ZDUSSCGKSA-N 2 2 353.382 2.842 20 5 FFBDLP C[C@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CCN1c1cc[nH+]cc1 ZINC000880263400 1015793490 /nfs/dbraw/zinc/79/34/90/1015793490.db2.gz XLAGUNHLIPWJEX-ZDUSSCGKSA-N 2 2 353.382 2.842 20 5 FFBDLP C[C@@H](c1ccncc1)[NH+]1CCC([NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000819184250 1008061007 /nfs/dbraw/zinc/06/10/07/1008061007.db2.gz XQSNWOZQPCEQNZ-MGPUTAFESA-N 2 2 370.453 2.838 20 5 FFBDLP O=C(c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)N1CCC([NH2+]C2CCC2)CC1 ZINC000889823640 1010140488 /nfs/dbraw/zinc/14/04/88/1010140488.db2.gz LMNRNORREBQUNF-UHFFFAOYSA-N 2 2 369.425 2.527 20 5 FFBDLP C[C@H]1CC[N@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H]1n1cc[nH+]c1 ZINC000121676929 1011068731 /nfs/dbraw/zinc/06/87/31/1011068731.db2.gz OOZXQPLWAAWOJO-YOEHRIQHSA-N 2 2 367.413 2.590 20 5 FFBDLP C[C@H]1CC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H]1n1cc[nH+]c1 ZINC000121676929 1011068734 /nfs/dbraw/zinc/06/87/34/1011068734.db2.gz OOZXQPLWAAWOJO-YOEHRIQHSA-N 2 2 367.413 2.590 20 5 FFBDLP Cn1cc[nH+]c1[C@@H]1CC[N@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000755790737 1023636213 /nfs/dbraw/zinc/63/62/13/1023636213.db2.gz QJFPWWIXWGQSPI-OAHLLOKOSA-N 2 2 352.398 2.639 20 5 FFBDLP Cn1cc[nH+]c1[C@@H]1CC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000755790737 1023636216 /nfs/dbraw/zinc/63/62/16/1023636216.db2.gz QJFPWWIXWGQSPI-OAHLLOKOSA-N 2 2 352.398 2.639 20 5 FFBDLP C[NH+](C)C1(CNc2nc(Cl)cc(Cl)c2[N+](=O)[O-])CC[NH+](C)CC1 ZINC001156181962 1029078781 /nfs/dbraw/zinc/07/87/81/1029078781.db2.gz LMHSCIRLBZURGT-UHFFFAOYSA-N 2 2 362.261 2.735 20 5 FFBDLP O=C(O[C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000835396344 1035744974 /nfs/dbraw/zinc/74/49/74/1035744974.db2.gz MFGJSKNLEAEVKH-HUUCEWRRSA-N 2 2 356.382 2.564 20 5 FFBDLP O=C(O[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000835396344 1035744979 /nfs/dbraw/zinc/74/49/79/1035744979.db2.gz MFGJSKNLEAEVKH-HUUCEWRRSA-N 2 2 356.382 2.564 20 5 FFBDLP C[C@@H](COC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)[NH+]1CCCCC1 ZINC000847962408 1058526348 /nfs/dbraw/zinc/52/63/48/1058526348.db2.gz GDPVERWLISTBQU-AWEZNQCLSA-N 2 2 358.398 2.812 20 5 FFBDLP Cc1c(NC(=O)CC[NH+]2CCC(c3c[nH+]cn3C)CC2)cccc1[N+](=O)[O-] ZINC001560233769 1076253352 /nfs/dbraw/zinc/25/33/52/1076253352.db2.gz KWGUGHYUGJFWGW-UHFFFAOYSA-N 2 2 371.441 2.845 20 5 FFBDLP Cc1[nH+]ccn1-c1cc[nH+]cc1NC(=O)c1cc(Cl)c(N)c([N+](=O)[O-])c1 ZINC001586300793 1079594053 /nfs/dbraw/zinc/59/40/53/1079594053.db2.gz XCMCBIRSIGZDGH-UHFFFAOYSA-N 2 2 372.772 2.972 20 5 FFBDLP C[C@@H]1C[NH+](CC2CC[NH+](Cc3csc([N+](=O)[O-])c3)CC2)C[C@@H](C)O1 ZINC000330427434 258163808 /nfs/dbraw/zinc/16/38/08/258163808.db2.gz KLCXZVCISANDLQ-ZIAGYGMSSA-N 2 2 353.488 2.978 20 5 FFBDLP Cn1cc[nH+]c1C[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000090004487 507900235 /nfs/dbraw/zinc/90/02/35/507900235.db2.gz RQFILFRXCUVBEG-CQSZACIVSA-N 2 2 372.425 2.650 20 5 FFBDLP Cn1cc[nH+]c1C[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000090004487 507900238 /nfs/dbraw/zinc/90/02/38/507900238.db2.gz RQFILFRXCUVBEG-CQSZACIVSA-N 2 2 372.425 2.650 20 5 FFBDLP C[NH+](C)CC[C@@H]([NH2+][C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)C(C)(C)C ZINC000116396830 508507535 /nfs/dbraw/zinc/50/75/35/508507535.db2.gz FRIIVFNHBFOMMO-IAGOWNOFSA-N 2 2 362.474 2.656 20 5 FFBDLP Cc1ccc(CN2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4C)CC2)cc1[N+](=O)[O-] ZINC000377705561 512410085 /nfs/dbraw/zinc/41/00/85/512410085.db2.gz XOJINNRIFGPUNO-DFNIBXOVSA-N 2 2 358.486 2.646 20 5 FFBDLP Cc1ccc(CN2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)cc1[N+](=O)[O-] ZINC000377705561 512410090 /nfs/dbraw/zinc/41/00/90/512410090.db2.gz XOJINNRIFGPUNO-DFNIBXOVSA-N 2 2 358.486 2.646 20 5 FFBDLP Cc1ccc(C[NH+]2CCN(C3C[C@H]4CC[C@@H](C3)[N@H+]4C)CC2)cc1[N+](=O)[O-] ZINC000377705561 512410092 /nfs/dbraw/zinc/41/00/92/512410092.db2.gz XOJINNRIFGPUNO-DFNIBXOVSA-N 2 2 358.486 2.646 20 5 FFBDLP Cc1ccc(C[NH+]2CCN(C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)cc1[N+](=O)[O-] ZINC000377705561 512410096 /nfs/dbraw/zinc/41/00/96/512410096.db2.gz XOJINNRIFGPUNO-DFNIBXOVSA-N 2 2 358.486 2.646 20 5 FFBDLP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)CC[C@@H]21 ZINC000158661904 508736208 /nfs/dbraw/zinc/73/62/08/508736208.db2.gz SDFZJKDHEZVBTR-ZBFHGGJFSA-N 2 2 357.414 2.561 20 5 FFBDLP C[N@H+]1CCC[C@@H]2C[NH+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)CC[C@@H]21 ZINC000158661904 508736211 /nfs/dbraw/zinc/73/62/11/508736211.db2.gz SDFZJKDHEZVBTR-ZBFHGGJFSA-N 2 2 357.414 2.561 20 5 FFBDLP C[NH+]1CCC[C@@H]2C[N@H+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)CC[C@@H]21 ZINC000158661904 508736216 /nfs/dbraw/zinc/73/62/16/508736216.db2.gz SDFZJKDHEZVBTR-ZBFHGGJFSA-N 2 2 357.414 2.561 20 5 FFBDLP C[NH+]1CCC[C@@H]2C[N@@H+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)CC[C@@H]21 ZINC000158661904 508736220 /nfs/dbraw/zinc/73/62/20/508736220.db2.gz SDFZJKDHEZVBTR-ZBFHGGJFSA-N 2 2 357.414 2.561 20 5 FFBDLP COc1cc(C[N@@H+]2CC[C@H](C)[C@H](n3cc[nH+]c3)C2)c([N+](=O)[O-])cc1OC ZINC000245687239 510085143 /nfs/dbraw/zinc/08/51/43/510085143.db2.gz AJYAHHVFNQUKTA-XJKSGUPXSA-N 2 2 360.414 2.892 20 5 FFBDLP COc1cc(C[N@H+]2CC[C@H](C)[C@H](n3cc[nH+]c3)C2)c([N+](=O)[O-])cc1OC ZINC000245687239 510085150 /nfs/dbraw/zinc/08/51/50/510085150.db2.gz AJYAHHVFNQUKTA-XJKSGUPXSA-N 2 2 360.414 2.892 20 5 FFBDLP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000245803147 510151318 /nfs/dbraw/zinc/15/13/18/510151318.db2.gz YBZOQNDGQFZZMT-DZGCQCFKSA-N 2 2 351.447 2.774 20 5 FFBDLP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000245803147 510151322 /nfs/dbraw/zinc/15/13/22/510151322.db2.gz YBZOQNDGQFZZMT-DZGCQCFKSA-N 2 2 351.447 2.774 20 5 FFBDLP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000245803147 510151328 /nfs/dbraw/zinc/15/13/28/510151328.db2.gz YBZOQNDGQFZZMT-DZGCQCFKSA-N 2 2 351.447 2.774 20 5 FFBDLP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000245803147 510151334 /nfs/dbraw/zinc/15/13/34/510151334.db2.gz YBZOQNDGQFZZMT-DZGCQCFKSA-N 2 2 351.447 2.774 20 5 FFBDLP Cn1cc(C[N@@H+]2CC[C@H](c3[nH+]ccn3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000377890443 512500528 /nfs/dbraw/zinc/50/05/28/512500528.db2.gz VHFLFAAHJNITDD-HNNXBMFYSA-N 2 2 366.425 2.718 20 5 FFBDLP Cn1cc(C[N@H+]2CC[C@H](c3[nH+]ccn3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000377890443 512500532 /nfs/dbraw/zinc/50/05/32/512500532.db2.gz VHFLFAAHJNITDD-HNNXBMFYSA-N 2 2 366.425 2.718 20 5 FFBDLP CCOc1ccc(NC(=O)C[NH+]2CCC(c3c[nH]c[nH+]3)CC2)c([N+](=O)[O-])c1 ZINC000374208563 512707848 /nfs/dbraw/zinc/70/78/48/512707848.db2.gz MTRGKAOZXDOQNB-UHFFFAOYSA-N 2 2 373.413 2.535 20 5 FFBDLP Cc1c(NC(=O)[C@@H](C)[N@@H+]2CC[C@@H](Oc3cc[nH+]cc3)C2)cccc1[N+](=O)[O-] ZINC000376559510 512873665 /nfs/dbraw/zinc/87/36/65/512873665.db2.gz WNVPWLPUKDIDCY-GDBMZVCRSA-N 2 2 370.409 2.779 20 5 FFBDLP Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@@H](Oc3cc[nH+]cc3)C2)cccc1[N+](=O)[O-] ZINC000376559510 512873669 /nfs/dbraw/zinc/87/36/69/512873669.db2.gz WNVPWLPUKDIDCY-GDBMZVCRSA-N 2 2 370.409 2.779 20 5 FFBDLP Cc1cccc(NCCNc2cc(C[NH+]3CCOCC3)ccc2[N+](=O)[O-])[nH+]1 ZINC000447816832 513580183 /nfs/dbraw/zinc/58/01/83/513580183.db2.gz LIHBUKUEBWEBDA-UHFFFAOYSA-N 2 2 371.441 2.654 20 5 FFBDLP C[C@H]1CCC[C@H](C)[NH+]1CCNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000448934253 513978341 /nfs/dbraw/zinc/97/83/41/513978341.db2.gz UPKHYVPYDRELBY-GJZGRUSLSA-N 2 2 371.441 2.773 20 5 FFBDLP Cn1cc[nH+]c1[C@@H](NC[C@H]1[NH2+]CCCC1(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000423392856 514126517 /nfs/dbraw/zinc/12/65/17/514126517.db2.gz QUWJQURYWVHMJK-SJORKVTESA-N 2 2 357.458 2.786 20 5 FFBDLP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CCN1C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423481863 514150125 /nfs/dbraw/zinc/15/01/25/514150125.db2.gz QYFDOSCQDUNVHX-KGLIPLIRSA-N 2 2 360.483 2.878 20 5 FFBDLP COc1c[nH+]ccc1N1CC[NH+](C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000475619609 514737317 /nfs/dbraw/zinc/73/73/17/514737317.db2.gz DHVUDNKVQCXYDZ-XQRVVYSFSA-N 2 2 354.410 2.834 20 5 FFBDLP Cc1cc(NC(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)cn2cc[nH+]c12 ZINC000502825985 514795401 /nfs/dbraw/zinc/79/54/01/514795401.db2.gz BFWNQTKYRWFBAI-UHFFFAOYSA-N 2 2 362.349 2.989 20 5 FFBDLP COc1cc(C[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000493707243 515658595 /nfs/dbraw/zinc/65/85/95/515658595.db2.gz OACIBGFAHWKVOP-DGCLKSJQSA-N 2 2 373.400 2.820 20 5 FFBDLP COc1cc(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000493707243 515658602 /nfs/dbraw/zinc/65/86/02/515658602.db2.gz OACIBGFAHWKVOP-DGCLKSJQSA-N 2 2 373.400 2.820 20 5 FFBDLP C[C@@H]([NH2+]C[C@]1(O)CC[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000484135245 516302881 /nfs/dbraw/zinc/30/28/81/516302881.db2.gz QXUMMAZSEFIAAK-OXQOHEQNSA-N 2 2 355.438 2.882 20 5 FFBDLP C[C@@H]([NH2+]C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000484135245 516302886 /nfs/dbraw/zinc/30/28/86/516302886.db2.gz QXUMMAZSEFIAAK-OXQOHEQNSA-N 2 2 355.438 2.882 20 5 FFBDLP Cn1cc[nH+]c1[C@@H](N[C@@H]1CCC[C@@H]([NH+](C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000560531850 517876514 /nfs/dbraw/zinc/87/65/14/517876514.db2.gz ZYPDRTHMLLVQKR-NUJGCVRESA-N 2 2 357.458 2.880 20 5 FFBDLP Cn1c[nH+]cc1[C@@H]1C[C@H]([NH2+][C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)CCO1 ZINC000575941676 518353749 /nfs/dbraw/zinc/35/37/49/518353749.db2.gz GSIKUJVZNTWDKO-AESZEHBQSA-N 2 2 374.445 2.518 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CCOCC2)cc1N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000582042655 518558141 /nfs/dbraw/zinc/55/81/41/518558141.db2.gz SORPMHCBRZQIQC-MRXNPFEDSA-N 2 2 371.441 2.534 20 5 FFBDLP Cc1c(NC(=O)CC[N@@H+]2CCCC[C@@H]2[C@@H]2CCC[NH2+]2)cccc1[N+](=O)[O-] ZINC000573670265 518778175 /nfs/dbraw/zinc/77/81/75/518778175.db2.gz PFBSNDUGAYMIPI-FUHWJXTLSA-N 2 2 360.458 2.838 20 5 FFBDLP Cc1c(NC(=O)CC[N@H+]2CCCC[C@@H]2[C@@H]2CCC[NH2+]2)cccc1[N+](=O)[O-] ZINC000573670265 518778182 /nfs/dbraw/zinc/77/81/82/518778182.db2.gz PFBSNDUGAYMIPI-FUHWJXTLSA-N 2 2 360.458 2.838 20 5 FFBDLP Cc1[nH+]cn(CC(=O)Nc2cc(-n3c[nH+]c(C)c3C)ccc2[N+](=O)[O-])c1C ZINC000573899937 518890848 /nfs/dbraw/zinc/89/08/48/518890848.db2.gz GQXYQSUTCHOLKA-UHFFFAOYSA-N 2 2 368.397 2.849 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)c1 ZINC000589502639 519019689 /nfs/dbraw/zinc/01/96/89/519019689.db2.gz ATGGYAJOFFSSDW-HNNXBMFYSA-N 2 2 361.442 2.545 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)c1 ZINC000589502639 519019695 /nfs/dbraw/zinc/01/96/95/519019695.db2.gz ATGGYAJOFFSSDW-HNNXBMFYSA-N 2 2 361.442 2.545 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CC[C@@H](C[N@H+](C)CC3CC3)C2)c1 ZINC000589502639 519019701 /nfs/dbraw/zinc/01/97/01/519019701.db2.gz ATGGYAJOFFSSDW-HNNXBMFYSA-N 2 2 361.442 2.545 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CC[C@@H](C[N@@H+](C)CC3CC3)C2)c1 ZINC000589502639 519019706 /nfs/dbraw/zinc/01/97/06/519019706.db2.gz ATGGYAJOFFSSDW-HNNXBMFYSA-N 2 2 361.442 2.545 20 5 FFBDLP COc1cc(C[NH2+]CCc2cn3c(cccc3C)[nH+]2)c([N+](=O)[O-])cc1O ZINC000592380719 520359346 /nfs/dbraw/zinc/35/93/46/520359346.db2.gz YSJDJLHCMIFKEQ-UHFFFAOYSA-N 2 2 356.382 2.597 20 5 FFBDLP O=C(CC[NH2+]C[C@@H]1CC[N@@H+]1C1CCCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000600751342 520447855 /nfs/dbraw/zinc/44/78/55/520447855.db2.gz PWSINWWHRBKPGE-INIZCTEOSA-N 2 2 360.458 2.920 20 5 FFBDLP O=C(CC[NH2+]C[C@@H]1CC[N@H+]1C1CCCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000600751342 520447863 /nfs/dbraw/zinc/44/78/63/520447863.db2.gz PWSINWWHRBKPGE-INIZCTEOSA-N 2 2 360.458 2.920 20 5 FFBDLP C[C@@H]([NH2+]C[C@]1(O)CC[N@H+](Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000610422075 520676127 /nfs/dbraw/zinc/67/61/27/520676127.db2.gz UQBGJHKCKVKUQR-OXQOHEQNSA-N 2 2 355.438 2.882 20 5 FFBDLP C[C@@H]([NH2+]C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000610422075 520676130 /nfs/dbraw/zinc/67/61/30/520676130.db2.gz UQBGJHKCKVKUQR-OXQOHEQNSA-N 2 2 355.438 2.882 20 5 FFBDLP C[N@H+](CC1CC1)C[C@H]1CC[NH+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC000611274782 521075386 /nfs/dbraw/zinc/07/53/86/521075386.db2.gz HXWFVFIULSOGOG-OAHLLOKOSA-N 2 2 361.442 2.530 20 5 FFBDLP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC000611274782 521075397 /nfs/dbraw/zinc/07/53/97/521075397.db2.gz HXWFVFIULSOGOG-OAHLLOKOSA-N 2 2 361.442 2.530 20 5 FFBDLP C[NH+](CC1CC1)C[C@H]1CC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC000611274782 521075407 /nfs/dbraw/zinc/07/54/07/521075407.db2.gz HXWFVFIULSOGOG-OAHLLOKOSA-N 2 2 361.442 2.530 20 5 FFBDLP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC000611274782 521075419 /nfs/dbraw/zinc/07/54/19/521075419.db2.gz HXWFVFIULSOGOG-OAHLLOKOSA-N 2 2 361.442 2.530 20 5 FFBDLP O=[N+]([O-])c1ccccc1-c1ccc(C[NH+]2CCC([N@@H+]3CC[C@H](O)C3)CC2)o1 ZINC000597235522 521588349 /nfs/dbraw/zinc/58/83/49/521588349.db2.gz IWAZPIXJTQKITK-INIZCTEOSA-N 2 2 371.437 2.886 20 5 FFBDLP O=[N+]([O-])c1ccccc1-c1ccc(C[NH+]2CCC([N@H+]3CC[C@H](O)C3)CC2)o1 ZINC000597235522 521588353 /nfs/dbraw/zinc/58/83/53/521588353.db2.gz IWAZPIXJTQKITK-INIZCTEOSA-N 2 2 371.437 2.886 20 5 FFBDLP Cn1cc[nH+]c1N1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000597250786 521596178 /nfs/dbraw/zinc/59/61/78/521596178.db2.gz ZRZJBJKJQRIBIZ-UHFFFAOYSA-N 2 2 367.409 2.911 20 5 FFBDLP Cc1[nH+]ccn1CCC[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000130609327 728720145 /nfs/dbraw/zinc/72/01/45/728720145.db2.gz WKDNGJCAMIDLKW-UHFFFAOYSA-N 2 2 365.821 2.714 20 5 FFBDLP Cc1[nH+]ccn1CCC[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000130609327 728720146 /nfs/dbraw/zinc/72/01/46/728720146.db2.gz WKDNGJCAMIDLKW-UHFFFAOYSA-N 2 2 365.821 2.714 20 5 FFBDLP CC[NH2+]CC1CC[NH+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000843352101 747815397 /nfs/dbraw/zinc/81/53/97/747815397.db2.gz FCIWFAWVKZPTPX-UHFFFAOYSA-N 2 2 354.838 2.508 20 5 FFBDLP C[C@]12C[NH+](Cc3ccccc3)C[C@@]1(C)C[N@H+](CCn1ccc([N+](=O)[O-])n1)C2 ZINC001196962959 1004025514 /nfs/dbraw/zinc/02/55/14/1004025514.db2.gz WCDNDQWHMAMDPH-BGYRXZFFSA-N 2 2 369.469 2.635 20 5 FFBDLP C[C@]12C[NH+](Cc3ccccc3)C[C@@]1(C)C[N@@H+](CCn1ccc([N+](=O)[O-])n1)C2 ZINC001196962959 1004025518 /nfs/dbraw/zinc/02/55/18/1004025518.db2.gz WCDNDQWHMAMDPH-BGYRXZFFSA-N 2 2 369.469 2.635 20 5 FFBDLP C[C@@]12C[NH+](CCn3ccc([N+](=O)[O-])n3)C[C@]1(C)C[N@@H+](Cc1ccccc1)C2 ZINC001196962959 1004025531 /nfs/dbraw/zinc/02/55/31/1004025531.db2.gz WCDNDQWHMAMDPH-BGYRXZFFSA-N 2 2 369.469 2.635 20 5 FFBDLP C[C@@]12C[NH+](CCn3ccc([N+](=O)[O-])n3)C[C@]1(C)C[N@H+](Cc1ccccc1)C2 ZINC001196962959 1004025542 /nfs/dbraw/zinc/02/55/42/1004025542.db2.gz WCDNDQWHMAMDPH-BGYRXZFFSA-N 2 2 369.469 2.635 20 5 FFBDLP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1C[C@H]2C[NH+](Cc3cccnc3)C[C@@H]2C1 ZINC001173220753 1012351319 /nfs/dbraw/zinc/35/13/19/1012351319.db2.gz CDCGTHDLOJNRSX-NSISKUIASA-N 2 2 366.465 2.985 20 5 FFBDLP C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777963457 1020333135 /nfs/dbraw/zinc/33/31/35/1020333135.db2.gz LRKRULMXVJTOFP-LPHOPBHVSA-N 2 2 355.442 2.832 20 5 FFBDLP C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777963457 1020333137 /nfs/dbraw/zinc/33/31/37/1020333137.db2.gz LRKRULMXVJTOFP-LPHOPBHVSA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777963457 1020333143 /nfs/dbraw/zinc/33/31/43/1020333143.db2.gz LRKRULMXVJTOFP-LPHOPBHVSA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777963457 1020333144 /nfs/dbraw/zinc/33/31/44/1020333144.db2.gz LRKRULMXVJTOFP-LPHOPBHVSA-N 2 2 355.442 2.832 20 5 FFBDLP C[N@@H+]1CCC[C@@H]2C[NH+](Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)CC[C@H]21 ZINC000777963014 1020353684 /nfs/dbraw/zinc/35/36/84/1020353684.db2.gz FORBQYITJLOWBY-VQIMIIECSA-N 2 2 355.442 2.832 20 5 FFBDLP C[N@H+]1CCC[C@@H]2C[NH+](Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)CC[C@H]21 ZINC000777963014 1020353700 /nfs/dbraw/zinc/35/37/00/1020353700.db2.gz FORBQYITJLOWBY-VQIMIIECSA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CCC[C@@H]2C[N@H+](Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)CC[C@H]21 ZINC000777963014 1020353710 /nfs/dbraw/zinc/35/37/10/1020353710.db2.gz FORBQYITJLOWBY-VQIMIIECSA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CCC[C@@H]2C[N@@H+](Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)CC[C@H]21 ZINC000777963014 1020353721 /nfs/dbraw/zinc/35/37/21/1020353721.db2.gz FORBQYITJLOWBY-VQIMIIECSA-N 2 2 355.442 2.832 20 5 FFBDLP C[N@@H+]1CCC[C@H]2C[NH+](Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)CC[C@@H]21 ZINC000777963011 1020356845 /nfs/dbraw/zinc/35/68/45/1020356845.db2.gz FORBQYITJLOWBY-LPHOPBHVSA-N 2 2 355.442 2.832 20 5 FFBDLP C[N@H+]1CCC[C@H]2C[NH+](Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)CC[C@@H]21 ZINC000777963011 1020356857 /nfs/dbraw/zinc/35/68/57/1020356857.db2.gz FORBQYITJLOWBY-LPHOPBHVSA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CCC[C@H]2C[N@H+](Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)CC[C@@H]21 ZINC000777963011 1020356871 /nfs/dbraw/zinc/35/68/71/1020356871.db2.gz FORBQYITJLOWBY-LPHOPBHVSA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CCC[C@H]2C[N@@H+](Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)CC[C@@H]21 ZINC000777963011 1020356883 /nfs/dbraw/zinc/35/68/83/1020356883.db2.gz FORBQYITJLOWBY-LPHOPBHVSA-N 2 2 355.442 2.832 20 5 FFBDLP O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]Cc2ccc(-n3cc[nH+]c3)c(F)c2)c1 ZINC000749688273 1021020834 /nfs/dbraw/zinc/02/08/34/1021020834.db2.gz KMDAWVIBVKCKMY-SFHVURJKSA-N 2 2 356.357 2.743 20 5 FFBDLP Nc1cc2nc3ccccc3nc2cc1NC(=O)c1ccc([C@@H]([NH3+])C[NH3+])cc1 ZINC001218859486 1033382387 /nfs/dbraw/zinc/38/23/87/1033382387.db2.gz OKKZHBGRJNZFBS-HNNXBMFYSA-N 2 2 372.432 2.576 20 5 FFBDLP C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H]2C[NH+](Cc3ccccn3)C[C@H]2C1 ZINC001254560958 1040799766 /nfs/dbraw/zinc/79/97/66/1040799766.db2.gz IOPSDROTWBMVTC-YTQUADARSA-N 2 2 366.465 2.985 20 5 FFBDLP C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H]2C[NH+](Cc3ccccn3)C[C@H]2C1 ZINC001254560958 1040799778 /nfs/dbraw/zinc/79/97/78/1040799778.db2.gz IOPSDROTWBMVTC-YTQUADARSA-N 2 2 366.465 2.985 20 5 FFBDLP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH+]1C[C@H]2C[N@@H+](Cc3ccccn3)C[C@H]2C1 ZINC001254560958 1040799794 /nfs/dbraw/zinc/79/97/94/1040799794.db2.gz IOPSDROTWBMVTC-YTQUADARSA-N 2 2 366.465 2.985 20 5 FFBDLP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH+]1C[C@H]2C[N@H+](Cc3ccccn3)C[C@H]2C1 ZINC001254560958 1040799810 /nfs/dbraw/zinc/79/98/10/1040799810.db2.gz IOPSDROTWBMVTC-YTQUADARSA-N 2 2 366.465 2.985 20 5 FFBDLP C[NH+]1CCN(c2cccc3[nH+]c(Cc4ccc([N+](=O)[O-])cc4)[nH]c32)CC1 ZINC001250606701 1041266367 /nfs/dbraw/zinc/26/63/67/1041266367.db2.gz DYXIUSCHPXUWRA-UHFFFAOYSA-N 2 2 351.410 2.814 20 5 FFBDLP Cn1c[nH+]cc1C1CC[NH+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC001308167517 1052423251 /nfs/dbraw/zinc/42/32/51/1052423251.db2.gz TWKRNPLJLFATIU-UHFFFAOYSA-N 2 2 368.397 2.758 20 5 FFBDLP C[NH+](C)CC(C)(C)[NH2+]CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001308805508 1052501801 /nfs/dbraw/zinc/50/18/01/1052501801.db2.gz BDOHPGGFOWMNIZ-UHFFFAOYSA-N 3 2 362.518 2.779 20 5 FFBDLP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272566825 252068700 /nfs/dbraw/zinc/06/87/00/252068700.db2.gz VARMKELQEGTKLC-KSSFIOAISA-N 2 2 368.441 2.849 20 5 FFBDLP Cc1c([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC(=O)N(C)C)cccc1[N+](=O)[O-] ZINC000285766612 257003653 /nfs/dbraw/zinc/00/36/53/257003653.db2.gz SYOKZQPTAQGVBD-MGNMYUMUSA-N 2 2 374.485 2.637 20 5 FFBDLP Cc1c([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC(=O)N(C)C)cccc1[N+](=O)[O-] ZINC000285766612 257003654 /nfs/dbraw/zinc/00/36/54/257003654.db2.gz SYOKZQPTAQGVBD-MGNMYUMUSA-N 2 2 374.485 2.637 20 5 FFBDLP Cc1c[nH+]ccc1OC1CC[NH+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000289402932 257279127 /nfs/dbraw/zinc/27/91/27/257279127.db2.gz OFCZZPPGBJDKKY-GOSISDBHSA-N 2 2 357.410 2.875 20 5 FFBDLP Cn1cc[nH+]c1C[C@H]1CCC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000090003581 507900210 /nfs/dbraw/zinc/90/02/10/507900210.db2.gz RWKLRSAWXQGHJF-OAHLLOKOSA-N 2 2 371.441 2.612 20 5 FFBDLP Cn1cc[nH+]c1C[C@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000090003581 507900212 /nfs/dbraw/zinc/90/02/12/507900212.db2.gz RWKLRSAWXQGHJF-OAHLLOKOSA-N 2 2 371.441 2.612 20 5 FFBDLP CCCC[N@H+](C)CC1CC[NH+](CC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000074319848 508011969 /nfs/dbraw/zinc/01/19/69/508011969.db2.gz BAPZVSAHPRHSIU-UHFFFAOYSA-N 2 2 362.474 2.977 20 5 FFBDLP CCCC[N@@H+](C)CC1CC[NH+](CC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000074319848 508011970 /nfs/dbraw/zinc/01/19/70/508011970.db2.gz BAPZVSAHPRHSIU-UHFFFAOYSA-N 2 2 362.474 2.977 20 5 FFBDLP C[C@@H]1C[NH+](CC2CC[NH+](Cc3cc(O)ccc3[N+](=O)[O-])CC2)C[C@@H](C)O1 ZINC000092586998 508084368 /nfs/dbraw/zinc/08/43/68/508084368.db2.gz KNKSHHSNXHKHEO-HUUCEWRRSA-N 2 2 363.458 2.622 20 5 FFBDLP CC[N@@H+]1CC[C@H]([NH+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000245439945 509935220 /nfs/dbraw/zinc/93/52/20/509935220.db2.gz UAPKAZZVTKUAJJ-WFASDCNBSA-N 2 2 368.865 2.849 20 5 FFBDLP CC[N@H+]1CC[C@H]([NH+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000245439945 509935225 /nfs/dbraw/zinc/93/52/25/509935225.db2.gz UAPKAZZVTKUAJJ-WFASDCNBSA-N 2 2 368.865 2.849 20 5 FFBDLP CC[NH+]1CC[C@H]([N@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000245439945 509935228 /nfs/dbraw/zinc/93/52/28/509935228.db2.gz UAPKAZZVTKUAJJ-WFASDCNBSA-N 2 2 368.865 2.849 20 5 FFBDLP CC[NH+]1CC[C@H]([N@@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000245439945 509935231 /nfs/dbraw/zinc/93/52/31/509935231.db2.gz UAPKAZZVTKUAJJ-WFASDCNBSA-N 2 2 368.865 2.849 20 5 FFBDLP C[C@@H]1CC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H]1n1cc[nH+]c1 ZINC000245711214 510100456 /nfs/dbraw/zinc/10/04/56/510100456.db2.gz STPCRHRMIOFILM-RHSMWYFYSA-N 2 2 357.414 2.703 20 5 FFBDLP C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H]1n1cc[nH+]c1 ZINC000245711214 510100464 /nfs/dbraw/zinc/10/04/64/510100464.db2.gz STPCRHRMIOFILM-RHSMWYFYSA-N 2 2 357.414 2.703 20 5 FFBDLP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H](C)C1 ZINC000174782403 510307691 /nfs/dbraw/zinc/30/76/91/510307691.db2.gz RYRGAODWMDIWLJ-CZUORRHYSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[N@H+]1CC[C@@H]([NH+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H](C)C1 ZINC000174782403 510307700 /nfs/dbraw/zinc/30/77/00/510307700.db2.gz RYRGAODWMDIWLJ-CZUORRHYSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[NH+]1CC[C@@H]([N@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H](C)C1 ZINC000174782403 510307710 /nfs/dbraw/zinc/30/77/10/510307710.db2.gz RYRGAODWMDIWLJ-CZUORRHYSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H](C)C1 ZINC000174782403 510307719 /nfs/dbraw/zinc/30/77/19/510307719.db2.gz RYRGAODWMDIWLJ-CZUORRHYSA-N 2 2 359.430 2.807 20 5 FFBDLP C[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CC[C@H]1N1CC[NH+](C)CC1 ZINC000364725627 511045108 /nfs/dbraw/zinc/04/51/08/511045108.db2.gz ZXXYXNBCELMKJM-KBXCAEBGSA-N 2 2 366.893 2.706 20 5 FFBDLP C[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CC[C@H]1N1CC[NH+](C)CC1 ZINC000364725627 511045111 /nfs/dbraw/zinc/04/51/11/511045111.db2.gz ZXXYXNBCELMKJM-KBXCAEBGSA-N 2 2 366.893 2.706 20 5 FFBDLP CC(C)[NH+]1CCN([C@@H]2CC[N@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)CC1 ZINC000377830022 512471987 /nfs/dbraw/zinc/47/19/87/512471987.db2.gz AFKGEUCTJQCEEJ-QGZVFWFLSA-N 2 2 366.893 2.849 20 5 FFBDLP CC(C)[NH+]1CCN([C@@H]2CC[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)CC1 ZINC000377830022 512471991 /nfs/dbraw/zinc/47/19/91/512471991.db2.gz AFKGEUCTJQCEEJ-QGZVFWFLSA-N 2 2 366.893 2.849 20 5 FFBDLP CN(Cc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CC[N@@H+](C2CC[NH+](C)CC2)C1 ZINC000371702595 512535393 /nfs/dbraw/zinc/53/53/93/512535393.db2.gz FQGACNRXFBCRIS-KRWDZBQOSA-N 2 2 366.893 2.849 20 5 FFBDLP CN(Cc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CC[N@H+](C2CC[NH+](C)CC2)C1 ZINC000371702595 512535397 /nfs/dbraw/zinc/53/53/97/512535397.db2.gz FQGACNRXFBCRIS-KRWDZBQOSA-N 2 2 366.893 2.849 20 5 FFBDLP C[C@H](C[NH+]1CCCCC1)Nc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000447807176 513576903 /nfs/dbraw/zinc/57/69/03/513576903.db2.gz QHCFQLMAPRQVRJ-MRXNPFEDSA-N 2 2 362.474 2.713 20 5 FFBDLP C[C@H]1CCCC[N@@H+]1CCCNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000448592652 513797210 /nfs/dbraw/zinc/79/72/10/513797210.db2.gz QYIASAICGXGGBL-HNNXBMFYSA-N 2 2 371.441 2.775 20 5 FFBDLP C[C@H]1CCCC[N@H+]1CCCNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000448592652 513797215 /nfs/dbraw/zinc/79/72/15/513797215.db2.gz QYIASAICGXGGBL-HNNXBMFYSA-N 2 2 371.441 2.775 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](O)C[N@@H+]1CCc2ccccc2C1 ZINC000449071329 514059406 /nfs/dbraw/zinc/05/94/06/514059406.db2.gz AZEKDWPYHWUQOF-UZLBHIALSA-N 2 2 369.465 2.535 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000449071329 514059411 /nfs/dbraw/zinc/05/94/11/514059411.db2.gz AZEKDWPYHWUQOF-UZLBHIALSA-N 2 2 369.465 2.535 20 5 FFBDLP Cc1cc(N2CC[C@H]3C[NH2+]C[C@H]3CC2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000420256564 514061562 /nfs/dbraw/zinc/06/15/62/514061562.db2.gz HLBMCRQMJRDQEE-IYBDPMFKSA-N 2 2 353.426 2.796 20 5 FFBDLP [NH3+]C[C@@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CCCCC1 ZINC000420354718 514107710 /nfs/dbraw/zinc/10/77/10/514107710.db2.gz BJKYCWITQCTICR-OAHLLOKOSA-N 2 2 354.838 2.684 20 5 FFBDLP CC1CC[NH+](C[C@H](O)C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000433181190 514407128 /nfs/dbraw/zinc/40/71/28/514407128.db2.gz XGKJKDZNBQVWKG-APWZRJJASA-N 2 2 361.486 3.000 20 5 FFBDLP [NH3+]C1(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)CC[NH+](Cc2ccccc2)CC1 ZINC000415140314 514464847 /nfs/dbraw/zinc/46/48/47/514464847.db2.gz YQLAKRHPWZFMEU-UHFFFAOYSA-N 3 2 354.454 2.678 20 5 FFBDLP COc1cc(C[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000493707247 515659078 /nfs/dbraw/zinc/65/90/78/515659078.db2.gz OACIBGFAHWKVOP-YPMHNXCESA-N 2 2 373.400 2.820 20 5 FFBDLP COc1cc(C[NH2+][C@H]2CC[N@@H+](C)[C@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000493707247 515659089 /nfs/dbraw/zinc/65/90/89/515659089.db2.gz OACIBGFAHWKVOP-YPMHNXCESA-N 2 2 373.400 2.820 20 5 FFBDLP COc1ccc([N+](=O)[O-])cc1C[NH2+]C1CC[NH+](Cc2cccnc2)CC1 ZINC000482513514 515703746 /nfs/dbraw/zinc/70/37/46/515703746.db2.gz SYXAZOROBHAVKQ-UHFFFAOYSA-N 2 2 356.426 2.753 20 5 FFBDLP C[C@H]1C[N@H+](Cc2ccccn2)CC[C@H]1[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000540168290 516462027 /nfs/dbraw/zinc/46/20/27/516462027.db2.gz HWRNOWAEFQFYFW-OXJNMPFZSA-N 2 2 370.453 2.869 20 5 FFBDLP C[C@H]1C[N@@H+](Cc2ccccn2)CC[C@H]1[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000540168290 516462035 /nfs/dbraw/zinc/46/20/35/516462035.db2.gz HWRNOWAEFQFYFW-OXJNMPFZSA-N 2 2 370.453 2.869 20 5 FFBDLP C[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1CC[NH+](CCO)CC1 ZINC000513524689 516659429 /nfs/dbraw/zinc/65/94/29/516659429.db2.gz JZTAVWPUQLHKOS-UHFFFAOYSA-N 2 2 359.426 2.743 20 5 FFBDLP C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1CC[NH+](CCO)CC1 ZINC000513524689 516659437 /nfs/dbraw/zinc/65/94/37/516659437.db2.gz JZTAVWPUQLHKOS-UHFFFAOYSA-N 2 2 359.426 2.743 20 5 FFBDLP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000513656237 516708374 /nfs/dbraw/zinc/70/83/74/516708374.db2.gz QVBYEZRUHQTCAT-KSSFIOAISA-N 2 2 368.441 2.849 20 5 FFBDLP C[C@@H]1CCC[C@@H](C)[NH+]1CCNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000518596615 516716589 /nfs/dbraw/zinc/71/65/89/516716589.db2.gz GRNLUWOADMWEGW-HUUCEWRRSA-N 2 2 371.441 2.773 20 5 FFBDLP C[N@H+](CC[NH2+][C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)Cc1ccccc1 ZINC000572732060 518335930 /nfs/dbraw/zinc/33/59/30/518335930.db2.gz PJVAZPMSLYGULX-QZTJIDSGSA-N 2 2 357.458 2.997 20 5 FFBDLP C[N@@H+](CC[NH2+][C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)Cc1ccccc1 ZINC000572732060 518335932 /nfs/dbraw/zinc/33/59/32/518335932.db2.gz PJVAZPMSLYGULX-QZTJIDSGSA-N 2 2 357.458 2.997 20 5 FFBDLP Cn1c[nH+]cc1[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)CCO1 ZINC000575941677 518353385 /nfs/dbraw/zinc/35/33/85/518353385.db2.gz GSIKUJVZNTWDKO-AIANPOQGSA-N 2 2 374.445 2.518 20 5 FFBDLP C[N@@H+]1CC[C@H]([NH2+]CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1 ZINC000589267638 518968568 /nfs/dbraw/zinc/96/85/68/518968568.db2.gz CMDHYZBUXSCCDU-AZUAARDMSA-N 2 2 368.437 2.958 20 5 FFBDLP C[N@H+]1CC[C@H]([NH2+]CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1 ZINC000589267638 518968574 /nfs/dbraw/zinc/96/85/74/518968574.db2.gz CMDHYZBUXSCCDU-AZUAARDMSA-N 2 2 368.437 2.958 20 5 FFBDLP C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C[C@@H]1CCCC[N@@H+]1C1CC1 ZINC000580399540 519155290 /nfs/dbraw/zinc/15/52/90/519155290.db2.gz INQRCXYUQMKSRB-KSSFIOAISA-N 2 2 360.458 2.918 20 5 FFBDLP C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C[C@@H]1CCCC[N@H+]1C1CC1 ZINC000580399540 519155294 /nfs/dbraw/zinc/15/52/94/519155294.db2.gz INQRCXYUQMKSRB-KSSFIOAISA-N 2 2 360.458 2.918 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CCOCC2)cc1N[C@@H]1CCC[N@@H+]2CCCC[C@H]12 ZINC000594604057 520049852 /nfs/dbraw/zinc/04/98/52/520049852.db2.gz XRPKZDRUBPUBKI-IEBWSBKVSA-N 2 2 374.485 2.856 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CCOCC2)cc1N[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594604057 520049859 /nfs/dbraw/zinc/04/98/59/520049859.db2.gz XRPKZDRUBPUBKI-IEBWSBKVSA-N 2 2 374.485 2.856 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[N@@H+](CCCn1cc[nH+]c1)[C@H]1CC[C@H](O)CC1 ZINC000592133628 520210664 /nfs/dbraw/zinc/21/06/64/520210664.db2.gz ZJUBVIUQMSRVMK-IYARVYRRSA-N 2 2 358.442 2.987 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[N@H+](CCCn1cc[nH+]c1)[C@H]1CC[C@H](O)CC1 ZINC000592133628 520210670 /nfs/dbraw/zinc/21/06/70/520210670.db2.gz ZJUBVIUQMSRVMK-IYARVYRRSA-N 2 2 358.442 2.987 20 5 FFBDLP COCCC[NH+]1CCC([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)CC1 ZINC000595035368 520263173 /nfs/dbraw/zinc/26/31/73/520263173.db2.gz IMYFYTIJZYAXBN-CQSZACIVSA-N 2 2 351.447 2.755 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@H]([C@@H]3CCC[NH2+]3)C2)cccc1[N+](=O)[O-] ZINC000592479180 520407234 /nfs/dbraw/zinc/40/72/34/520407234.db2.gz UELHPKXRGZVSIC-ZOBUZTSGSA-N 2 2 360.458 2.694 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@H]([C@@H]3CCC[NH2+]3)C2)cccc1[N+](=O)[O-] ZINC000592479180 520407237 /nfs/dbraw/zinc/40/72/37/520407237.db2.gz UELHPKXRGZVSIC-ZOBUZTSGSA-N 2 2 360.458 2.694 20 5 FFBDLP O=C(C[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000592492056 520413854 /nfs/dbraw/zinc/41/38/54/520413854.db2.gz KAWLPQXRXVYHRS-CYBMUJFWSA-N 2 2 366.849 2.508 20 5 FFBDLP C[C@@H](C[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)[N@@H+]1CCCC[C@@H]1C ZINC000602513214 521388087 /nfs/dbraw/zinc/38/80/87/521388087.db2.gz ARNDWKRDYSJGIZ-HOTGVXAUSA-N 2 2 361.490 2.811 20 5 FFBDLP C[C@@H](C[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)[N@H+]1CCCC[C@@H]1C ZINC000602513214 521388095 /nfs/dbraw/zinc/38/80/95/521388095.db2.gz ARNDWKRDYSJGIZ-HOTGVXAUSA-N 2 2 361.490 2.811 20 5 FFBDLP C[C@@H]1CCC[C@H](C)[N@H+]1CC[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602568893 521415403 /nfs/dbraw/zinc/41/54/03/521415403.db2.gz ZBVCXFVRPZFUII-IYBDPMFKSA-N 2 2 361.490 2.811 20 5 FFBDLP C[C@@H]1CCC[C@H](C)[N@@H+]1CC[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602568893 521415407 /nfs/dbraw/zinc/41/54/07/521415407.db2.gz ZBVCXFVRPZFUII-IYBDPMFKSA-N 2 2 361.490 2.811 20 5 FFBDLP O=[N+]([O-])c1ccc(N2CCC([NH2+][C@@H]3CCC[N@@H+]4CCCC[C@H]34)CC2)cn1 ZINC000602708499 521489567 /nfs/dbraw/zinc/48/95/67/521489567.db2.gz HWFLWNSMBLCCSA-QZTJIDSGSA-N 2 2 359.474 2.565 20 5 FFBDLP O=[N+]([O-])c1ccc(N2CCC([NH2+][C@@H]3CCC[N@H+]4CCCC[C@H]34)CC2)cn1 ZINC000602708499 521489572 /nfs/dbraw/zinc/48/95/72/521489572.db2.gz HWFLWNSMBLCCSA-QZTJIDSGSA-N 2 2 359.474 2.565 20 5 FFBDLP Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@H]1Cn1c(C)[nH+]c2ccccc21 ZINC000602795360 521537762 /nfs/dbraw/zinc/53/77/62/521537762.db2.gz MOSONJVRTASLOL-INIZCTEOSA-N 2 2 368.441 2.922 20 5 FFBDLP Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H]1Cn1c(C)[nH+]c2ccccc21 ZINC000602795360 521537769 /nfs/dbraw/zinc/53/77/69/521537769.db2.gz MOSONJVRTASLOL-INIZCTEOSA-N 2 2 368.441 2.922 20 5 FFBDLP Cc1[nH+]ccn1CCC[N@@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000130448146 728718036 /nfs/dbraw/zinc/71/80/36/728718036.db2.gz JZFSKLQEFFMFHI-UHFFFAOYSA-N 2 2 365.821 2.714 20 5 FFBDLP Cc1[nH+]ccn1CCC[N@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000130448146 728718037 /nfs/dbraw/zinc/71/80/37/728718037.db2.gz JZFSKLQEFFMFHI-UHFFFAOYSA-N 2 2 365.821 2.714 20 5 FFBDLP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccc(Br)c([N+](=O)[O-])c3)C[C@H]21 ZINC000228546840 729549473 /nfs/dbraw/zinc/54/94/73/729549473.db2.gz AGLMCCXMLDUSEV-OUCADQQQSA-N 2 2 354.248 2.917 20 5 FFBDLP [NH3+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccc(Br)c([N+](=O)[O-])c3)C[C@H]21 ZINC000228546840 729549474 /nfs/dbraw/zinc/54/94/74/729549474.db2.gz AGLMCCXMLDUSEV-OUCADQQQSA-N 2 2 354.248 2.917 20 5 FFBDLP Cn1cc[nH+]c1C[C@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000877066042 1014468110 /nfs/dbraw/zinc/46/81/10/1014468110.db2.gz BCIPPSBDQWDJKB-HTWSVDAQSA-N 2 2 366.425 2.802 20 5 FFBDLP C[C@@H](c1ccncc1)[NH+]1CCC([NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)CC1 ZINC000877115878 1014478718 /nfs/dbraw/zinc/47/87/18/1014478718.db2.gz UXTIPJPADYKRFK-NNGSBXSVSA-N 2 2 370.457 2.705 20 5 FFBDLP O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1ccc2c[nH+]cn2c1 ZINC000813171328 995633299 /nfs/dbraw/zinc/63/32/99/995633299.db2.gz TWPCTBWSKDYELT-SFHVURJKSA-N 2 2 366.377 2.674 20 5 FFBDLP O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1ccc2c[nH+]cn2c1 ZINC000813171328 995633305 /nfs/dbraw/zinc/63/33/05/995633305.db2.gz TWPCTBWSKDYELT-SFHVURJKSA-N 2 2 366.377 2.674 20 5 FFBDLP CC[NH+]1CCC([N@@H+]2CCCN(Cc3ccc([N+](=O)[O-])c(F)c3)CC2)CC1 ZINC000817285762 1007507789 /nfs/dbraw/zinc/50/77/89/1007507789.db2.gz NQKWTQZAOLRYMR-UHFFFAOYSA-N 2 2 364.465 2.726 20 5 FFBDLP CC[NH+]1CCC([N@H+]2CCCN(Cc3ccc([N+](=O)[O-])c(F)c3)CC2)CC1 ZINC000817285762 1007507795 /nfs/dbraw/zinc/50/77/95/1007507795.db2.gz NQKWTQZAOLRYMR-UHFFFAOYSA-N 2 2 364.465 2.726 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@H]1CC[N@@H+](C3CCOCC3)C1)CC2 ZINC001172902768 1012075159 /nfs/dbraw/zinc/07/51/59/1012075159.db2.gz CBWOACRHZPDUPY-MSOLQXFVSA-N 2 2 359.470 2.685 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@H]1CC[N@H+](C3CCOCC3)C1)CC2 ZINC001172902768 1012075175 /nfs/dbraw/zinc/07/51/75/1012075175.db2.gz CBWOACRHZPDUPY-MSOLQXFVSA-N 2 2 359.470 2.685 20 5 FFBDLP Cc1[nH+]c2c(n1-c1cc3ccc(Cl)nc3cc1[N+](=O)[O-])CC[NH2+]CC2 ZINC001165357230 1029957215 /nfs/dbraw/zinc/95/72/15/1029957215.db2.gz WFXJBJZYSJMFNT-UHFFFAOYSA-N 2 2 357.801 2.979 20 5 FFBDLP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](CCC[NH3+])C(=O)OC(C)(C)C ZINC001246241453 1039286884 /nfs/dbraw/zinc/28/68/84/1039286884.db2.gz MLYXSKKOWKXRIE-BBRMVZONSA-N 2 2 351.447 2.565 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CC[C@@H]3[NH2+]CCC[C@@H]3C2)c1F ZINC001247006801 1039576103 /nfs/dbraw/zinc/57/61/03/1039576103.db2.gz AZBBGNLDDHBLJE-GUTXKFCHSA-N 2 2 351.422 2.747 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CC[C@@H]3[NH2+]CCC[C@@H]3C2)c1F ZINC001247006801 1039576120 /nfs/dbraw/zinc/57/61/20/1039576120.db2.gz AZBBGNLDDHBLJE-GUTXKFCHSA-N 2 2 351.422 2.747 20 5 FFBDLP C[NH+]1CCN(c2cccc3[nH+]c(Cc4ccccc4[N+](=O)[O-])[nH]c32)CC1 ZINC001250616652 1041267556 /nfs/dbraw/zinc/26/75/56/1041267556.db2.gz UWDWPBJYAOPXEC-UHFFFAOYSA-N 2 2 351.410 2.814 20 5 FFBDLP Cc1[nH+]ccn1CCC[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272521735 252058805 /nfs/dbraw/zinc/05/88/05/252058805.db2.gz LHCRVJCBEAWQQA-KRWDZBQOSA-N 2 2 354.414 2.603 20 5 FFBDLP CCN1CC[NH+]([C@@H](C)CNc2cc(C)[nH+]c3ccc([N+](=O)[O-])cc23)CC1 ZINC000302162903 258092336 /nfs/dbraw/zinc/09/23/36/258092336.db2.gz KHNBNTZIMHCONN-HNNXBMFYSA-N 2 2 357.458 2.889 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH+]1CCC(n2cc[nH+]c2)CC1 ZINC000109794364 507988033 /nfs/dbraw/zinc/98/80/33/507988033.db2.gz YSKPSHLHRKURNH-UHFFFAOYSA-N 2 2 357.414 2.765 20 5 FFBDLP C[C@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000116395854 508506213 /nfs/dbraw/zinc/50/62/13/508506213.db2.gz IQPWOBUXDHCCFB-XJKSGUPXSA-N 2 2 350.463 2.878 20 5 FFBDLP C[NH+](C)CC[C@@H]([NH2+][C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)C(C)(C)C ZINC000116396838 508507694 /nfs/dbraw/zinc/50/76/94/508507694.db2.gz FRIIVFNHBFOMMO-DLBZAZTESA-N 2 2 362.474 2.656 20 5 FFBDLP CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+]2CCOC)cc1[N+](=O)[O-] ZINC000153553665 508595790 /nfs/dbraw/zinc/59/57/90/508595790.db2.gz YVEAPJWMEWWIOJ-ZBFHGGJFSA-N 2 2 351.447 2.755 20 5 FFBDLP CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+]2CCOC)cc1[N+](=O)[O-] ZINC000153553665 508595791 /nfs/dbraw/zinc/59/57/91/508595791.db2.gz YVEAPJWMEWWIOJ-ZBFHGGJFSA-N 2 2 351.447 2.755 20 5 FFBDLP CCC[N@H+](C)C[C@@H]1CC[NH+](CCOc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000176271588 509413479 /nfs/dbraw/zinc/41/34/79/509413479.db2.gz SNWBGQRPRWEWBO-HNNXBMFYSA-N 2 2 351.447 2.646 20 5 FFBDLP CCC[N@@H+](C)C[C@@H]1CC[NH+](CCOc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000176271588 509413489 /nfs/dbraw/zinc/41/34/89/509413489.db2.gz SNWBGQRPRWEWBO-HNNXBMFYSA-N 2 2 351.447 2.646 20 5 FFBDLP CCC[NH+](C)C[C@@H]1CC[N@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000176271588 509413496 /nfs/dbraw/zinc/41/34/96/509413496.db2.gz SNWBGQRPRWEWBO-HNNXBMFYSA-N 2 2 351.447 2.646 20 5 FFBDLP CCC[NH+](C)C[C@@H]1CC[N@@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000176271588 509413504 /nfs/dbraw/zinc/41/35/04/509413504.db2.gz SNWBGQRPRWEWBO-HNNXBMFYSA-N 2 2 351.447 2.646 20 5 FFBDLP CC(C)c1ccc(C[NH+]2CCN(CC[NH+]3CCCC3)CC2)cc1[N+](=O)[O-] ZINC000192936326 509706262 /nfs/dbraw/zinc/70/62/62/509706262.db2.gz ZPYBNWNAIRAGJB-UHFFFAOYSA-N 2 2 360.502 2.932 20 5 FFBDLP CC[N@@H+]1CC[C@H]2CC[C@@H](C1)[NH+]2CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000177304264 509988472 /nfs/dbraw/zinc/98/84/72/509988472.db2.gz QJRRNRUZDYMVGV-WBVHZDCISA-N 2 2 360.458 2.790 20 5 FFBDLP CC[N@H+]1CC[C@H]2CC[C@@H](C1)[NH+]2CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000177304264 509988484 /nfs/dbraw/zinc/98/84/84/509988484.db2.gz QJRRNRUZDYMVGV-WBVHZDCISA-N 2 2 360.458 2.790 20 5 FFBDLP CC[NH+]1CC[C@H]2CC[C@@H](C1)[N@@H+]2CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000177304264 509988495 /nfs/dbraw/zinc/98/84/95/509988495.db2.gz QJRRNRUZDYMVGV-WBVHZDCISA-N 2 2 360.458 2.790 20 5 FFBDLP CC[NH+]1CC[C@H]2CC[C@@H](C1)[N@H+]2CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000177304264 509988504 /nfs/dbraw/zinc/98/85/04/509988504.db2.gz QJRRNRUZDYMVGV-WBVHZDCISA-N 2 2 360.458 2.790 20 5 FFBDLP CC[NH+]1CCC([NH2+][C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000266149769 510434650 /nfs/dbraw/zinc/43/46/50/510434650.db2.gz NCETUNFNGYCLGW-NSHDSACASA-N 2 2 354.838 2.649 20 5 FFBDLP O=C(CC[N@@H+]1CCC[C@H](c2[nH]cc[nH+]2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000364604032 510965149 /nfs/dbraw/zinc/96/51/49/510965149.db2.gz HIVMQIHWFVPVCV-LBPRGKRZSA-N 2 2 361.377 2.665 20 5 FFBDLP O=C(CC[N@H+]1CCC[C@H](c2[nH]cc[nH+]2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000364604032 510965153 /nfs/dbraw/zinc/96/51/53/510965153.db2.gz HIVMQIHWFVPVCV-LBPRGKRZSA-N 2 2 361.377 2.665 20 5 FFBDLP COC(=O)CCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000271808103 511330960 /nfs/dbraw/zinc/33/09/60/511330960.db2.gz MRXYWENPBCDDIW-HNNXBMFYSA-N 2 2 363.458 2.971 20 5 FFBDLP COC(=O)CCC[NH+]1CCC([NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000271808106 511331482 /nfs/dbraw/zinc/33/14/82/511331482.db2.gz MRXYWENPBCDDIW-OAHLLOKOSA-N 2 2 363.458 2.971 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@@H+]2Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000374423170 512826579 /nfs/dbraw/zinc/82/65/79/512826579.db2.gz VFKLPNBCIIMKJM-UNEWFSDZSA-N 2 2 353.850 2.932 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@H+]2Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000374423170 512826585 /nfs/dbraw/zinc/82/65/85/512826585.db2.gz VFKLPNBCIIMKJM-UNEWFSDZSA-N 2 2 353.850 2.932 20 5 FFBDLP C[C@H]1CN(c2nccc3ccc([N+](=O)[O-])cc32)CC[N@@H+]1C1CC[NH+](C)CC1 ZINC000413219383 513527183 /nfs/dbraw/zinc/52/71/83/513527183.db2.gz MJEKWXZPVSRUAK-HNNXBMFYSA-N 2 2 369.469 2.748 20 5 FFBDLP C[C@H]1CN(c2nccc3ccc([N+](=O)[O-])cc32)CC[N@H+]1C1CC[NH+](C)CC1 ZINC000413219383 513527190 /nfs/dbraw/zinc/52/71/90/513527190.db2.gz MJEKWXZPVSRUAK-HNNXBMFYSA-N 2 2 369.469 2.748 20 5 FFBDLP COc1cc(C[N@@H+]2CCC[C@H]([C@H](C)[NH3+])C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000435372943 513567675 /nfs/dbraw/zinc/56/76/75/513567675.db2.gz CDEAVCXIKUJYMR-RYUDHWBXSA-N 2 2 373.400 2.807 20 5 FFBDLP COc1cc(C[N@H+]2CCC[C@H]([C@H](C)[NH3+])C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000435372943 513567677 /nfs/dbraw/zinc/56/76/77/513567677.db2.gz CDEAVCXIKUJYMR-RYUDHWBXSA-N 2 2 373.400 2.807 20 5 FFBDLP C[N@H+](CCCCNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-])C1CC1 ZINC000413351168 513608688 /nfs/dbraw/zinc/60/86/88/513608688.db2.gz YZPSFMXVKSHWBG-UHFFFAOYSA-N 2 2 362.474 2.713 20 5 FFBDLP C[N@@H+](CCCCNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-])C1CC1 ZINC000413351168 513608695 /nfs/dbraw/zinc/60/86/95/513608695.db2.gz YZPSFMXVKSHWBG-UHFFFAOYSA-N 2 2 362.474 2.713 20 5 FFBDLP C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)[N@@H+]1CCCC[C@@H]1C ZINC000448699169 513852329 /nfs/dbraw/zinc/85/23/29/513852329.db2.gz SMHIYWVZXWZRMW-GJZGRUSLSA-N 2 2 371.441 2.773 20 5 FFBDLP C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)[N@H+]1CCCC[C@@H]1C ZINC000448699169 513852334 /nfs/dbraw/zinc/85/23/34/513852334.db2.gz SMHIYWVZXWZRMW-GJZGRUSLSA-N 2 2 371.441 2.773 20 5 FFBDLP O=C(C[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000420343732 514102044 /nfs/dbraw/zinc/10/20/44/514102044.db2.gz RDDOXRJUIXZWOC-AWEZNQCLSA-N 2 2 366.849 2.651 20 5 FFBDLP CC[NH+]1CCC([N@@H+]2CCCN(c3ncc(Cl)cc3[N+](=O)[O-])CC2)CC1 ZINC000420628464 514207037 /nfs/dbraw/zinc/20/70/37/514207037.db2.gz PGUJRUMPGZJCQZ-UHFFFAOYSA-N 2 2 367.881 2.640 20 5 FFBDLP CC[NH+]1CCC([N@H+]2CCCN(c3ncc(Cl)cc3[N+](=O)[O-])CC2)CC1 ZINC000420628464 514207038 /nfs/dbraw/zinc/20/70/38/514207038.db2.gz PGUJRUMPGZJCQZ-UHFFFAOYSA-N 2 2 367.881 2.640 20 5 FFBDLP Cn1cc(C[NH2+]C[C@@H]2[NH2+]CCCC2(C)C)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000414923043 514357858 /nfs/dbraw/zinc/35/78/58/514357858.db2.gz DRPUYJHPUKZJEZ-KRWDZBQOSA-N 2 2 357.458 2.863 20 5 FFBDLP CN(c1ccccc1)c1ccc(C[NH2+]C[C@H]2C[NH2+]CCCO2)cc1[N+](=O)[O-] ZINC000415046225 514413770 /nfs/dbraw/zinc/41/37/70/514413770.db2.gz UQTGWKKRDKGROT-GOSISDBHSA-N 2 2 370.453 2.831 20 5 FFBDLP O=[N+]([O-])c1cccc([C@@H]([NH2+]C[C@H](O)C[NH+]2CCCC2)c2ccccc2)c1 ZINC000490149311 515122049 /nfs/dbraw/zinc/12/20/49/515122049.db2.gz ITGFSVNKUFKHFO-PMACEKPBSA-N 2 2 355.438 2.731 20 5 FFBDLP COc1cc(C[N@@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)c([N+](=O)[O-])cc1OC ZINC000538749777 517762068 /nfs/dbraw/zinc/76/20/68/517762068.db2.gz GBGFXWLJHBIFHZ-OAHLLOKOSA-N 2 2 363.458 2.776 20 5 FFBDLP COc1cc(C[N@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)c([N+](=O)[O-])cc1OC ZINC000538749777 517762075 /nfs/dbraw/zinc/76/20/75/517762075.db2.gz GBGFXWLJHBIFHZ-OAHLLOKOSA-N 2 2 363.458 2.776 20 5 FFBDLP COc1cc(C[NH+]2CC[C@H](C[N@H+](C)CC3CC3)C2)c([N+](=O)[O-])cc1OC ZINC000538749777 517762082 /nfs/dbraw/zinc/76/20/82/517762082.db2.gz GBGFXWLJHBIFHZ-OAHLLOKOSA-N 2 2 363.458 2.776 20 5 FFBDLP COc1cc(C[NH+]2CC[C@H](C[N@@H+](C)CC3CC3)C2)c([N+](=O)[O-])cc1OC ZINC000538749777 517762086 /nfs/dbraw/zinc/76/20/86/517762086.db2.gz GBGFXWLJHBIFHZ-OAHLLOKOSA-N 2 2 363.458 2.776 20 5 FFBDLP COc1cc(C[NH2+]Cc2ccccc2Cn2cc[nH+]c2)c([N+](=O)[O-])cc1O ZINC000553575965 517793769 /nfs/dbraw/zinc/79/37/69/517793769.db2.gz RZMJKGRSXIWULG-UHFFFAOYSA-N 2 2 368.393 2.844 20 5 FFBDLP Cn1cc[nH+]c1[C@@H](N[C@H]1CCC[C@@H]([NH+](C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000560531848 517877006 /nfs/dbraw/zinc/87/70/06/517877006.db2.gz ZYPDRTHMLLVQKR-JZXOWHBKSA-N 2 2 357.458 2.880 20 5 FFBDLP C[N@@H+]1CC[C@@](O)(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000547284771 518058462 /nfs/dbraw/zinc/05/84/62/518058462.db2.gz JZQLXKJXMJJXNB-QGZVFWFLSA-N 2 2 365.817 2.664 20 5 FFBDLP C[N@H+]1CC[C@@](O)(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000547284771 518058471 /nfs/dbraw/zinc/05/84/71/518058471.db2.gz JZQLXKJXMJJXNB-QGZVFWFLSA-N 2 2 365.817 2.664 20 5 FFBDLP C[NH+]1CCC([NH+]2CCC(Nc3nc4c(cc3[N+](=O)[O-])CCCC4)CC2)CC1 ZINC000564206435 518350557 /nfs/dbraw/zinc/35/05/57/518350557.db2.gz WUHAPVGHLGFXHK-UHFFFAOYSA-N 2 2 373.501 2.839 20 5 FFBDLP C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCC[N@@H+]2CCCC[C@H]12 ZINC000594519482 520012262 /nfs/dbraw/zinc/01/22/62/520012262.db2.gz LCTQOTRKDXYKMO-ZTFGCOKTSA-N 2 2 360.458 2.918 20 5 FFBDLP C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594519482 520012264 /nfs/dbraw/zinc/01/22/64/520012264.db2.gz LCTQOTRKDXYKMO-ZTFGCOKTSA-N 2 2 360.458 2.918 20 5 FFBDLP COc1ccc([C@@H]2CC[NH2+]C[C@@H]2[NH2+]Cc2cccc([N+](=O)[O-])c2)cc1F ZINC000594738811 520124955 /nfs/dbraw/zinc/12/49/55/520124955.db2.gz ODZWFUPLRKLWAF-WMZOPIPTSA-N 2 2 359.401 2.978 20 5 FFBDLP O=C(C[N@@H+]1CCC[C@H](n2cc[nH+]c2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000609157397 520213860 /nfs/dbraw/zinc/21/38/60/520213860.db2.gz IUJAGZLZYXYMKG-ZDUSSCGKSA-N 2 2 363.805 2.720 20 5 FFBDLP O=C(C[N@H+]1CCC[C@H](n2cc[nH+]c2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000609157397 520213868 /nfs/dbraw/zinc/21/38/68/520213868.db2.gz IUJAGZLZYXYMKG-ZDUSSCGKSA-N 2 2 363.805 2.720 20 5 FFBDLP Cn1cc(C[NH2+]C[C@@H]2CC[N@@H+]2C(C)(C)C)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000594962846 520230407 /nfs/dbraw/zinc/23/04/07/520230407.db2.gz LUCQKGPQIIIBCZ-KRWDZBQOSA-N 2 2 357.458 2.958 20 5 FFBDLP Cn1cc(C[NH2+]C[C@@H]2CC[N@H+]2C(C)(C)C)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000594962846 520230411 /nfs/dbraw/zinc/23/04/11/520230411.db2.gz LUCQKGPQIIIBCZ-KRWDZBQOSA-N 2 2 357.458 2.958 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C1CC[NH+]([C@H]2CCC[C@H]2O)CC1 ZINC000595023344 520259926 /nfs/dbraw/zinc/25/99/26/520259926.db2.gz VZVWJHHNSDJOPR-DOPJRALCSA-N 2 2 363.458 2.632 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]C1CC[NH+]([C@H]2CCOC2)CC1)C1CC1 ZINC000595102182 520294779 /nfs/dbraw/zinc/29/47/79/520294779.db2.gz LANXIYSWSPOQIF-RBUKOAKNSA-N 2 2 359.470 2.759 20 5 FFBDLP CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](C(F)(F)F)[C@H](C[NH3+])C1 ZINC000600729386 520428395 /nfs/dbraw/zinc/42/83/95/520428395.db2.gz YLLWWWFHWFOAGT-OCCSQVGLSA-N 2 2 361.364 2.953 20 5 FFBDLP CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](C(F)(F)F)[C@H](C[NH3+])C1 ZINC000600729386 520428398 /nfs/dbraw/zinc/42/83/98/520428398.db2.gz YLLWWWFHWFOAGT-OCCSQVGLSA-N 2 2 361.364 2.953 20 5 FFBDLP CC(C)[NH+]1CCC([NH+]2CCN(Cc3ccc(F)cc3[N+](=O)[O-])CC2)CC1 ZINC000595382147 520440429 /nfs/dbraw/zinc/44/04/29/520440429.db2.gz RBPSPPZCUKWDRG-UHFFFAOYSA-N 2 2 364.465 2.724 20 5 FFBDLP CC[N@H+](CC[NH3+])Cc1ccc(OCc2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000600774614 520461139 /nfs/dbraw/zinc/46/11/39/520461139.db2.gz LFTAUQQDJXOHME-UHFFFAOYSA-N 2 2 359.426 2.963 20 5 FFBDLP CC[N@@H+](CC[NH3+])Cc1ccc(OCc2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000600774614 520461147 /nfs/dbraw/zinc/46/11/47/520461147.db2.gz LFTAUQQDJXOHME-UHFFFAOYSA-N 2 2 359.426 2.963 20 5 FFBDLP O=[N+]([O-])c1ccc2[nH+]ccc(N3CC[NH+](CC4CCOCC4)CC3)c2c1 ZINC000601118145 520645688 /nfs/dbraw/zinc/64/56/88/520645688.db2.gz IEGNFDOFAAOUNV-UHFFFAOYSA-N 2 2 356.426 2.692 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CCOCC2)cc1NC[C@@H]1CC[N@@H+]1C1CCCC1 ZINC000599164088 521065705 /nfs/dbraw/zinc/06/57/05/521065705.db2.gz JJINESOOVLGVFW-SFHVURJKSA-N 2 2 374.485 2.856 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CCOCC2)cc1NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000599164088 521065715 /nfs/dbraw/zinc/06/57/15/521065715.db2.gz JJINESOOVLGVFW-SFHVURJKSA-N 2 2 374.485 2.856 20 5 FFBDLP O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C1)OCCO2 ZINC000611287367 521081859 /nfs/dbraw/zinc/08/18/59/521081859.db2.gz ZUDJVJXEWWGKGD-YOEHRIQHSA-N 2 2 373.453 2.815 20 5 FFBDLP O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C1)OCCO2 ZINC000611287367 521081866 /nfs/dbraw/zinc/08/18/66/521081866.db2.gz ZUDJVJXEWWGKGD-YOEHRIQHSA-N 2 2 373.453 2.815 20 5 FFBDLP O=[N+]([O-])c1cc2c(cc1C[NH+]1CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C1)OCCO2 ZINC000611287367 521081871 /nfs/dbraw/zinc/08/18/71/521081871.db2.gz ZUDJVJXEWWGKGD-YOEHRIQHSA-N 2 2 373.453 2.815 20 5 FFBDLP O=[N+]([O-])c1cc2c(cc1C[NH+]1CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C1)OCCO2 ZINC000611287367 521081879 /nfs/dbraw/zinc/08/18/79/521081879.db2.gz ZUDJVJXEWWGKGD-YOEHRIQHSA-N 2 2 373.453 2.815 20 5 FFBDLP Cc1ncc([N+](=O)[O-])n1CC[NH+]1CCC(Cc2[nH]c3ccccc3[nH+]2)CC1 ZINC000602845089 521568162 /nfs/dbraw/zinc/56/81/62/521568162.db2.gz GSFUGSRNSOWDHY-UHFFFAOYSA-N 2 2 368.441 2.931 20 5 FFBDLP COc1c(O)ccc(C[NH2+]C[C@@H]2C[N@H+](C)C[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000895113592 967657930 /nfs/dbraw/zinc/65/79/30/967657930.db2.gz BAXZMYZPEMEKEE-SJORKVTESA-N 2 2 371.437 2.744 20 5 FFBDLP COc1c(O)ccc(C[NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000895113592 967657934 /nfs/dbraw/zinc/65/79/34/967657934.db2.gz BAXZMYZPEMEKEE-SJORKVTESA-N 2 2 371.437 2.744 20 5 FFBDLP C[C@@H]1CN(c2cc[nH+]cc2)CC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000887130370 1009043513 /nfs/dbraw/zinc/04/35/13/1009043513.db2.gz CCMVEBGTIQMFHB-CQSZACIVSA-N 2 2 370.409 2.567 20 5 FFBDLP C[C@@H]1CN(c2cc[nH+]cc2)CC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000887130370 1009043528 /nfs/dbraw/zinc/04/35/28/1009043528.db2.gz CCMVEBGTIQMFHB-CQSZACIVSA-N 2 2 370.409 2.567 20 5 FFBDLP CN(CC[NH+]1CC2(C1)CCOCC2)c1cc[nH+]c2ccc([N+](=O)[O-])cc21 ZINC000866257882 1010964137 /nfs/dbraw/zinc/96/41/37/1010964137.db2.gz KIQCIXNIRRZDAJ-UHFFFAOYSA-N 2 2 356.426 2.692 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH+]1C[C@@]2(C)C[NH+](C)C[C@]2(C)C1 ZINC000931307643 1020414161 /nfs/dbraw/zinc/41/41/61/1020414161.db2.gz NOKLCXGXDPBTRT-RTBURBONSA-N 2 2 360.458 2.505 20 5 FFBDLP C[C@@H]1CC[N@@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C[C@@H]1[NH3+] ZINC001246568108 1039398933 /nfs/dbraw/zinc/39/89/33/1039398933.db2.gz YRLWIESPBHOLCU-BZNIZROVSA-N 2 2 354.401 2.511 20 5 FFBDLP C[C@@H]1CC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C[C@@H]1[NH3+] ZINC001246568108 1039398946 /nfs/dbraw/zinc/39/89/46/1039398946.db2.gz YRLWIESPBHOLCU-BZNIZROVSA-N 2 2 354.401 2.511 20 5 FFBDLP COc1cc(N([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C2CC[NH2+]CC2)cc[nH+]1 ZINC001254610657 1040839676 /nfs/dbraw/zinc/83/96/76/1040839676.db2.gz MJEOQRIEAPEVSD-IBGZPJMESA-N 2 2 368.437 2.724 20 5 FFBDLP C[NH+]1CCN(c2ccc3[nH]c(Cc4ccccc4[N+](=O)[O-])[nH+]c3c2)CC1 ZINC001250617318 1041267210 /nfs/dbraw/zinc/26/72/10/1041267210.db2.gz SWGBTCKHWOZHJI-UHFFFAOYSA-N 2 2 351.410 2.814 20 5 FFBDLP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1 ZINC000093742183 250045382 /nfs/dbraw/zinc/04/53/82/250045382.db2.gz LSRJPHJNDSSDIB-AWEZNQCLSA-N 2 2 351.447 2.776 20 5 FFBDLP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1 ZINC000093742183 250045387 /nfs/dbraw/zinc/04/53/87/250045387.db2.gz LSRJPHJNDSSDIB-AWEZNQCLSA-N 2 2 351.447 2.776 20 5 FFBDLP CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1 ZINC000093742183 250045392 /nfs/dbraw/zinc/04/53/92/250045392.db2.gz LSRJPHJNDSSDIB-AWEZNQCLSA-N 2 2 351.447 2.776 20 5 FFBDLP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1 ZINC000093742183 250045395 /nfs/dbraw/zinc/04/53/95/250045395.db2.gz LSRJPHJNDSSDIB-AWEZNQCLSA-N 2 2 351.447 2.776 20 5 FFBDLP Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000129815326 508769013 /nfs/dbraw/zinc/76/90/13/508769013.db2.gz ZZKGGFRVCDNWEX-XJKSGUPXSA-N 2 2 357.414 2.621 20 5 FFBDLP Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000129815326 508769018 /nfs/dbraw/zinc/76/90/18/508769018.db2.gz ZZKGGFRVCDNWEX-XJKSGUPXSA-N 2 2 357.414 2.621 20 5 FFBDLP O=C(C[N@@H+]1CCC[C@H](c2[nH]cc[nH+]2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000266901290 509248226 /nfs/dbraw/zinc/24/82/26/509248226.db2.gz GOUYMIGUCKAIIK-NSHDSACASA-N 2 2 363.805 2.789 20 5 FFBDLP O=C(C[N@H+]1CCC[C@H](c2[nH]cc[nH+]2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000266901290 509248233 /nfs/dbraw/zinc/24/82/33/509248233.db2.gz GOUYMIGUCKAIIK-NSHDSACASA-N 2 2 363.805 2.789 20 5 FFBDLP COc1ccc(OCC[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c([N+](=O)[O-])c1 ZINC000173880986 509832655 /nfs/dbraw/zinc/83/26/55/509832655.db2.gz KKQPCZJORCGLAT-INIZCTEOSA-N 2 2 363.458 2.790 20 5 FFBDLP COc1ccc(OCC[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c([N+](=O)[O-])c1 ZINC000173880986 509832658 /nfs/dbraw/zinc/83/26/58/509832658.db2.gz KKQPCZJORCGLAT-INIZCTEOSA-N 2 2 363.458 2.790 20 5 FFBDLP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2c(F)cccc2[N+](=O)[O-])[C@H](C)C1 ZINC000187015549 510005982 /nfs/dbraw/zinc/00/59/82/510005982.db2.gz UWWDTJVYHQMCFH-PBHICJAKSA-N 2 2 353.438 2.961 20 5 FFBDLP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2c(F)cccc2[N+](=O)[O-])[C@H](C)C1 ZINC000187015549 510005990 /nfs/dbraw/zinc/00/59/90/510005990.db2.gz UWWDTJVYHQMCFH-PBHICJAKSA-N 2 2 353.438 2.961 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH+]1CCC(c2[nH]cc[nH+]2)CC1 ZINC000265522734 510097953 /nfs/dbraw/zinc/09/79/53/510097953.db2.gz TYRDFCDLKYUSLB-UHFFFAOYSA-N 2 2 373.413 2.535 20 5 FFBDLP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000246305702 510417287 /nfs/dbraw/zinc/41/72/87/510417287.db2.gz FQRADVQSLVZYJP-CVEARBPZSA-N 2 2 374.485 2.780 20 5 FFBDLP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000246305702 510417292 /nfs/dbraw/zinc/41/72/92/510417292.db2.gz FQRADVQSLVZYJP-CVEARBPZSA-N 2 2 374.485 2.780 20 5 FFBDLP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000246305702 510417300 /nfs/dbraw/zinc/41/73/00/510417300.db2.gz FQRADVQSLVZYJP-CVEARBPZSA-N 2 2 374.485 2.780 20 5 FFBDLP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000246305702 510417306 /nfs/dbraw/zinc/41/73/06/510417306.db2.gz FQRADVQSLVZYJP-CVEARBPZSA-N 2 2 374.485 2.780 20 5 FFBDLP COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CC[N@H+](Cc2ccccn2)C[C@H]1C ZINC000178730426 510743466 /nfs/dbraw/zinc/74/34/66/510743466.db2.gz HIGNNOBBQDMSSD-BEFAXECRSA-N 2 2 370.453 2.999 20 5 FFBDLP COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CC[N@@H+](Cc2ccccn2)C[C@H]1C ZINC000178730426 510743477 /nfs/dbraw/zinc/74/34/77/510743477.db2.gz HIGNNOBBQDMSSD-BEFAXECRSA-N 2 2 370.453 2.999 20 5 FFBDLP COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CC[N@H+](Cc2ccccn2)C[C@@H]1C ZINC000246935967 510754531 /nfs/dbraw/zinc/75/45/31/510754531.db2.gz HIGNNOBBQDMSSD-HNAYVOBHSA-N 2 2 370.453 2.999 20 5 FFBDLP COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccn2)C[C@@H]1C ZINC000246935967 510754541 /nfs/dbraw/zinc/75/45/41/510754541.db2.gz HIGNNOBBQDMSSD-HNAYVOBHSA-N 2 2 370.453 2.999 20 5 FFBDLP C[C@H]1CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H]1n1cc[nH+]c1 ZINC000247014326 510798944 /nfs/dbraw/zinc/79/89/44/510798944.db2.gz DFRWGSJKLRESGA-XJKSGUPXSA-N 2 2 368.397 2.924 20 5 FFBDLP C[C@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H]1n1cc[nH+]c1 ZINC000247014326 510798951 /nfs/dbraw/zinc/79/89/51/510798951.db2.gz DFRWGSJKLRESGA-XJKSGUPXSA-N 2 2 368.397 2.924 20 5 FFBDLP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC)[C@@H](C)C1 ZINC000247078840 510828201 /nfs/dbraw/zinc/82/82/01/510828201.db2.gz QSLYPOMPHPUGCX-YJBOKZPZSA-N 2 2 365.474 2.830 20 5 FFBDLP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC)[C@@H](C)C1 ZINC000247078840 510828205 /nfs/dbraw/zinc/82/82/05/510828205.db2.gz QSLYPOMPHPUGCX-YJBOKZPZSA-N 2 2 365.474 2.830 20 5 FFBDLP Cn1cc(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000247260237 510854662 /nfs/dbraw/zinc/85/46/62/510854662.db2.gz XPECEGDJMIGYJN-QFBILLFUSA-N 2 2 369.469 2.911 20 5 FFBDLP Cn1cc(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000247260237 510854663 /nfs/dbraw/zinc/85/46/63/510854663.db2.gz XPECEGDJMIGYJN-QFBILLFUSA-N 2 2 369.469 2.911 20 5 FFBDLP Cn1cc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000247260237 510854664 /nfs/dbraw/zinc/85/46/64/510854664.db2.gz XPECEGDJMIGYJN-QFBILLFUSA-N 2 2 369.469 2.911 20 5 FFBDLP Cn1cc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000247260237 510854665 /nfs/dbraw/zinc/85/46/65/510854665.db2.gz XPECEGDJMIGYJN-QFBILLFUSA-N 2 2 369.469 2.911 20 5 FFBDLP CC[NH+]1CCC([N@@H+]2CCCN(C(=O)c3cc([N+](=O)[O-])ccc3C)CC2)CC1 ZINC000422013385 513523227 /nfs/dbraw/zinc/52/32/27/513523227.db2.gz FIYLDTMOYQXEHV-UHFFFAOYSA-N 2 2 374.485 2.535 20 5 FFBDLP CC[NH+]1CCC([N@H+]2CCCN(C(=O)c3cc([N+](=O)[O-])ccc3C)CC2)CC1 ZINC000422013385 513523231 /nfs/dbraw/zinc/52/32/31/513523231.db2.gz FIYLDTMOYQXEHV-UHFFFAOYSA-N 2 2 374.485 2.535 20 5 FFBDLP CCn1cc[nH+]c1CN(Cc1ccccc1[N+](=O)[O-])[C@H]1CC12CC[NH2+]CC2 ZINC000435692091 513659308 /nfs/dbraw/zinc/65/93/08/513659308.db2.gz NURSSHZERYCHCD-SFHVURJKSA-N 2 2 369.469 2.956 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[C@H](Nc1ccc(N2CC[NH2+]CC2)c[nH+]1)C1CC1 ZINC000423237989 514089215 /nfs/dbraw/zinc/08/92/15/514089215.db2.gz UOXCXXUXGUZBMY-SFHVURJKSA-N 2 2 367.453 2.833 20 5 FFBDLP COc1cc(C[NH2+][C@@H]2CC[NH2+]CC2(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000420361385 514110199 /nfs/dbraw/zinc/11/01/99/514110199.db2.gz MEQHBOUAWAJRHK-CQSZACIVSA-N 2 2 359.373 2.683 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCCC[C@@H]3[C@@H]3CC[NH2+]C3)n2)c1 ZINC000420413081 514139442 /nfs/dbraw/zinc/13/94/42/514139442.db2.gz ZPFVPAUHDQNXPO-GDBMZVCRSA-N 2 2 357.414 2.609 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCCC[C@@H]3[C@@H]3CC[NH2+]C3)n2)c1 ZINC000420413081 514139446 /nfs/dbraw/zinc/13/94/46/514139446.db2.gz ZPFVPAUHDQNXPO-GDBMZVCRSA-N 2 2 357.414 2.609 20 5 FFBDLP [NH3+]C1(c2noc(-c3ccc([N+](=O)[O-])c(-n4cc[nH+]c4)c3)n2)CCCCC1 ZINC000424338852 514458671 /nfs/dbraw/zinc/45/86/71/514458671.db2.gz BFSWMBPBNCPBDK-UHFFFAOYSA-N 2 2 354.370 2.949 20 5 FFBDLP Cn1cc([C@@H]2C[N@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C[C@H]2[NH3+])cn1 ZINC000424377657 514465453 /nfs/dbraw/zinc/46/54/53/514465453.db2.gz MLCLZDBZPFQUJD-ZWKOTPCHSA-N 2 2 367.409 2.515 20 5 FFBDLP Cn1cc([C@@H]2C[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C[C@H]2[NH3+])cn1 ZINC000424377657 514465458 /nfs/dbraw/zinc/46/54/58/514465458.db2.gz MLCLZDBZPFQUJD-ZWKOTPCHSA-N 2 2 367.409 2.515 20 5 FFBDLP COc1c[nH+]ccc1N1CC[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000475628902 514740193 /nfs/dbraw/zinc/74/01/93/514740193.db2.gz WFPZMNVVODNWCF-UHFFFAOYSA-N 2 2 362.817 2.974 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](CC[NH3+])Cc1ccccc1 ZINC000466986063 514852297 /nfs/dbraw/zinc/85/22/97/514852297.db2.gz SBOFRHUXSVLPBI-UHFFFAOYSA-N 2 2 356.426 2.693 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](CC[NH3+])Cc1ccccc1 ZINC000466986063 514852300 /nfs/dbraw/zinc/85/23/00/514852300.db2.gz SBOFRHUXSVLPBI-UHFFFAOYSA-N 2 2 356.426 2.693 20 5 FFBDLP Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000503077568 514909439 /nfs/dbraw/zinc/90/94/39/514909439.db2.gz ZZKGGFRVCDNWEX-CJNGLKHVSA-N 2 2 357.414 2.621 20 5 FFBDLP Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000503077568 514909450 /nfs/dbraw/zinc/90/94/50/514909450.db2.gz ZZKGGFRVCDNWEX-CJNGLKHVSA-N 2 2 357.414 2.621 20 5 FFBDLP O=[N+]([O-])c1ccccc1CCNc1[nH+]cnc2c1cnn2-c1cc[nH+]cc1 ZINC000506139941 515794867 /nfs/dbraw/zinc/79/48/67/515794867.db2.gz UOXOQWKBDJYCNZ-UHFFFAOYSA-N 2 2 361.365 2.773 20 5 FFBDLP CC(C)(CNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)C[NH+]1CCCC1 ZINC000482941169 515857954 /nfs/dbraw/zinc/85/79/54/515857954.db2.gz BBNCJXRXLBJNJG-UHFFFAOYSA-N 2 2 371.441 2.632 20 5 FFBDLP Cn1cc[nH+]c1[C@H](N[C@@H]1CCC[C@@H]([NH+](C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000560531847 517876698 /nfs/dbraw/zinc/87/66/98/517876698.db2.gz ZYPDRTHMLLVQKR-JFIYKMOQSA-N 2 2 357.458 2.880 20 5 FFBDLP CC(C)C[C@H](CN[C@H](c1[nH+]ccn1C)c1cccc([N+](=O)[O-])c1)[NH+](C)C ZINC000557393526 517988341 /nfs/dbraw/zinc/98/83/41/517988341.db2.gz SQFNXLGTFHMHHP-MSOLQXFVSA-N 2 2 359.474 2.984 20 5 FFBDLP O=C(C[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000580075540 518997053 /nfs/dbraw/zinc/99/70/53/518997053.db2.gz JOUMXQQKFLNSBP-CYBMUJFWSA-N 2 2 366.849 2.508 20 5 FFBDLP C[N@@H+]1CCN(Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)[C@@H](C[NH3+])C1 ZINC000571801507 519282309 /nfs/dbraw/zinc/28/23/09/519282309.db2.gz YESALXXQXSQFCH-INIZCTEOSA-N 2 2 374.416 2.601 20 5 FFBDLP C[N@H+]1CCN(Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)[C@@H](C[NH3+])C1 ZINC000571801507 519282314 /nfs/dbraw/zinc/28/23/14/519282314.db2.gz YESALXXQXSQFCH-INIZCTEOSA-N 2 2 374.416 2.601 20 5 FFBDLP C[NH+]1CCC([N@@H+]2CC[C@@H](Nc3ncc([N+](=O)[O-])cc3C(F)(F)F)C2)CC1 ZINC000591147579 519530164 /nfs/dbraw/zinc/53/01/64/519530164.db2.gz OJFYLLLZESRSFA-LLVKDONJSA-N 2 2 373.379 2.589 20 5 FFBDLP C[NH+]1CCC([N@H+]2CC[C@@H](Nc3ncc([N+](=O)[O-])cc3C(F)(F)F)C2)CC1 ZINC000591147579 519530172 /nfs/dbraw/zinc/53/01/72/519530172.db2.gz OJFYLLLZESRSFA-LLVKDONJSA-N 2 2 373.379 2.589 20 5 FFBDLP C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@@H]1CCC[N@@H+]2CCCC[C@@H]12 ZINC000594517961 520011421 /nfs/dbraw/zinc/01/14/21/520011421.db2.gz FFJYSNMECBNILU-OLMNPRSZSA-N 2 2 360.458 2.918 20 5 FFBDLP C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594517961 520011427 /nfs/dbraw/zinc/01/14/27/520011427.db2.gz FFJYSNMECBNILU-OLMNPRSZSA-N 2 2 360.458 2.918 20 5 FFBDLP C[N@@H+](Cc1ccccc1)C[C@@H](O)Cn1cc[nH+]c1-c1ccc([N+](=O)[O-])cc1 ZINC000608860479 520147321 /nfs/dbraw/zinc/14/73/21/520147321.db2.gz PNHMDNWEESLRBG-LJQANCHMSA-N 2 2 366.421 2.951 20 5 FFBDLP C[N@H+](Cc1ccccc1)C[C@@H](O)Cn1cc[nH+]c1-c1ccc([N+](=O)[O-])cc1 ZINC000608860479 520147331 /nfs/dbraw/zinc/14/73/31/520147331.db2.gz PNHMDNWEESLRBG-LJQANCHMSA-N 2 2 366.421 2.951 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@H](n4cc[nH+]c4)C3)o2)cc1 ZINC000609157364 520213249 /nfs/dbraw/zinc/21/32/49/520213249.db2.gz GMLIDIQXFDNMEZ-HNNXBMFYSA-N 2 2 354.370 2.678 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@H](n4cc[nH+]c4)C3)o2)cc1 ZINC000609157364 520213254 /nfs/dbraw/zinc/21/32/54/520213254.db2.gz GMLIDIQXFDNMEZ-HNNXBMFYSA-N 2 2 354.370 2.678 20 5 FFBDLP C[NH+]1CCC([N@@H+]2CC[C@@H](Nc3ccc4cnccc4c3[N+](=O)[O-])C2)CC1 ZINC000599045004 520998040 /nfs/dbraw/zinc/99/80/40/520998040.db2.gz XHJWJJDOWPWYQD-OAHLLOKOSA-N 2 2 355.442 2.723 20 5 FFBDLP C[NH+]1CCC([N@H+]2CC[C@@H](Nc3ccc4cnccc4c3[N+](=O)[O-])C2)CC1 ZINC000599045004 520998047 /nfs/dbraw/zinc/99/80/47/520998047.db2.gz XHJWJJDOWPWYQD-OAHLLOKOSA-N 2 2 355.442 2.723 20 5 FFBDLP Cc1cc(N2CCC[C@H]3C[NH2+]CC[C@@H]32)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000601982649 521056515 /nfs/dbraw/zinc/05/65/15/521056515.db2.gz KKUDHJDXJXRKCQ-RDJZCZTQSA-N 2 2 353.426 2.939 20 5 FFBDLP O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]CCC[NH+]1CCC(O)CC1 ZINC000602523855 521394897 /nfs/dbraw/zinc/39/48/97/521394897.db2.gz IUDLZPLDBNNESS-UHFFFAOYSA-N 2 2 361.364 2.550 20 5 FFBDLP CC[C@@H]1CCCC[N@@H+]1CC[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602549355 521405437 /nfs/dbraw/zinc/40/54/37/521405437.db2.gz UNKBMIQHILCHNK-QGZVFWFLSA-N 2 2 361.490 2.813 20 5 FFBDLP CC[C@@H]1CCCC[N@H+]1CC[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602549355 521405441 /nfs/dbraw/zinc/40/54/41/521405441.db2.gz UNKBMIQHILCHNK-QGZVFWFLSA-N 2 2 361.490 2.813 20 5 FFBDLP O=C(N[C@@H]1CCC[N@@H+]2CCCC[C@H]12)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000594200287 521466999 /nfs/dbraw/zinc/46/69/99/521466999.db2.gz KMSQHOWGEBEMOB-HZPDHXFCSA-N 2 2 369.425 2.527 20 5 FFBDLP O=C(N[C@@H]1CCC[N@H+]2CCCC[C@H]12)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000594200287 521467007 /nfs/dbraw/zinc/46/70/07/521467007.db2.gz KMSQHOWGEBEMOB-HZPDHXFCSA-N 2 2 369.425 2.527 20 5 FFBDLP O=[N+]([O-])c1ccccc1-c1ccc(C[NH+]2CCC([N@@H+]3CC[C@@H](O)C3)CC2)o1 ZINC000597235628 521588113 /nfs/dbraw/zinc/58/81/13/521588113.db2.gz IWAZPIXJTQKITK-MRXNPFEDSA-N 2 2 371.437 2.886 20 5 FFBDLP O=[N+]([O-])c1ccccc1-c1ccc(C[NH+]2CCC([N@H+]3CC[C@@H](O)C3)CC2)o1 ZINC000597235628 521588119 /nfs/dbraw/zinc/58/81/19/521588119.db2.gz IWAZPIXJTQKITK-MRXNPFEDSA-N 2 2 371.437 2.886 20 5 FFBDLP C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1CC[NH+]([C@H]2CCOC2)CC1 ZINC000866393736 731054716 /nfs/dbraw/zinc/05/47/16/731054716.db2.gz QESMVWSQBXULHW-GUYCJALGSA-N 2 2 351.422 2.508 20 5 FFBDLP C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1CC[NH+]([C@@H]2CCOC2)CC1 ZINC000866393734 731054729 /nfs/dbraw/zinc/05/47/29/731054729.db2.gz QESMVWSQBXULHW-CXAGYDPISA-N 2 2 351.422 2.508 20 5 FFBDLP C[NH2+]CC1CC[NH+]([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000843349120 747815223 /nfs/dbraw/zinc/81/52/23/747815223.db2.gz HTRLCJDDLHRGFT-LLVKDONJSA-N 2 2 354.838 2.507 20 5 FFBDLP C[NH2+]CC1CC[NH+]([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000843349121 747815456 /nfs/dbraw/zinc/81/54/56/747815456.db2.gz HTRLCJDDLHRGFT-NSHDSACASA-N 2 2 354.838 2.507 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1C[C@H]2CC[C@@H](C1)N2C1CC[NH2+]CC1 ZINC000903507408 1015943548 /nfs/dbraw/zinc/94/35/48/1015943548.db2.gz YKMLJTATZSLLNT-ZYSHUDEJSA-N 2 2 358.486 2.865 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@H]2CC[C@@H](C1)N2C1CC[NH2+]CC1 ZINC000903507408 1015943559 /nfs/dbraw/zinc/94/35/59/1015943559.db2.gz YKMLJTATZSLLNT-ZYSHUDEJSA-N 2 2 358.486 2.865 20 5 FFBDLP C[C@H]1CN(c2cc[nH+]cc2)CC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000887130369 1009042914 /nfs/dbraw/zinc/04/29/14/1009042914.db2.gz CCMVEBGTIQMFHB-AWEZNQCLSA-N 2 2 370.409 2.567 20 5 FFBDLP C[C@H]1CN(c2cc[nH+]cc2)CC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000887130369 1009042926 /nfs/dbraw/zinc/04/29/26/1009042926.db2.gz CCMVEBGTIQMFHB-AWEZNQCLSA-N 2 2 370.409 2.567 20 5 FFBDLP C[C@@H](C[NH+]1CCCC1)[NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173012510 1012183533 /nfs/dbraw/zinc/18/35/33/1012183533.db2.gz ULKJGNZFEVQVFV-ZDUSSCGKSA-N 2 2 368.428 2.916 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2cnn(C[N@@H+]3CCC[C@H](n4cc[nH+]c4)C3)c2)c1 ZINC000777956285 1020329900 /nfs/dbraw/zinc/32/99/00/1020329900.db2.gz DIHRUJFDVIJDMZ-SFHVURJKSA-N 2 2 352.398 2.949 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2cnn(C[N@H+]3CCC[C@H](n4cc[nH+]c4)C3)c2)c1 ZINC000777956285 1020329910 /nfs/dbraw/zinc/32/99/10/1020329910.db2.gz DIHRUJFDVIJDMZ-SFHVURJKSA-N 2 2 352.398 2.949 20 5 FFBDLP CN(Cc1c2ccccc2cc2ccccc21)C(=O)[C@]12C[NH2+]C[C@@H]1CC[NH2+]2 ZINC001160740206 1027846703 /nfs/dbraw/zinc/84/67/03/1027846703.db2.gz YWODZRBRPBCFET-MBSDFSHPSA-N 2 2 359.473 2.903 20 5 FFBDLP O=[N+]([O-])c1ccc(N2CCC([NH+]3CC4(C3)CC[N@H+](CC3CC3)C4)CC2)cc1 ZINC001254473825 1040741023 /nfs/dbraw/zinc/74/10/23/1040741023.db2.gz CCRGHOGKFFNTFU-UHFFFAOYSA-N 2 2 370.497 2.981 20 5 FFBDLP O=[N+]([O-])c1ccc(N2CCC([NH+]3CC4(C3)CC[N@@H+](CC3CC3)C4)CC2)cc1 ZINC001254473825 1040741030 /nfs/dbraw/zinc/74/10/30/1040741030.db2.gz CCRGHOGKFFNTFU-UHFFFAOYSA-N 2 2 370.497 2.981 20 5 FFBDLP CC(C)[N@@H+]1CCOC[C@@]2(CCC[NH+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1 ZINC001254592720 1040822219 /nfs/dbraw/zinc/82/22/19/1040822219.db2.gz GAANOPWFXBAFGJ-SFTDATJTSA-N 2 2 373.497 2.885 20 5 FFBDLP CC(C)[N@H+]1CCOC[C@@]2(CCC[NH+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1 ZINC001254592720 1040822236 /nfs/dbraw/zinc/82/22/36/1040822236.db2.gz GAANOPWFXBAFGJ-SFTDATJTSA-N 2 2 373.497 2.885 20 5 FFBDLP CC(C)[NH+]1CCOC[C@@]2(CCC[N@@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1 ZINC001254592720 1040822254 /nfs/dbraw/zinc/82/22/54/1040822254.db2.gz GAANOPWFXBAFGJ-SFTDATJTSA-N 2 2 373.497 2.885 20 5 FFBDLP CC(C)[NH+]1CCOC[C@@]2(CCC[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1 ZINC001254592720 1040822273 /nfs/dbraw/zinc/82/22/73/1040822273.db2.gz GAANOPWFXBAFGJ-SFTDATJTSA-N 2 2 373.497 2.885 20 5 FFBDLP C[N@@H+]1CC[C@@H]2C[NH+](Cc3c(Br)cccc3[N+](=O)[O-])C[C@@H]2C1 ZINC001307987302 1052376758 /nfs/dbraw/zinc/37/67/58/1052376758.db2.gz IRJLVEZKKAZNJC-NEPJUHHUSA-N 2 2 354.248 2.741 20 5 FFBDLP C[N@H+]1CC[C@@H]2C[NH+](Cc3c(Br)cccc3[N+](=O)[O-])C[C@@H]2C1 ZINC001307987302 1052376763 /nfs/dbraw/zinc/37/67/63/1052376763.db2.gz IRJLVEZKKAZNJC-NEPJUHHUSA-N 2 2 354.248 2.741 20 5 FFBDLP C[NH+]1CC[C@@H]2C[N@H+](Cc3c(Br)cccc3[N+](=O)[O-])C[C@@H]2C1 ZINC001307987302 1052376765 /nfs/dbraw/zinc/37/67/65/1052376765.db2.gz IRJLVEZKKAZNJC-NEPJUHHUSA-N 2 2 354.248 2.741 20 5 FFBDLP C[NH+]1CC[C@@H]2C[N@@H+](Cc3c(Br)cccc3[N+](=O)[O-])C[C@@H]2C1 ZINC001307987302 1052376771 /nfs/dbraw/zinc/37/67/71/1052376771.db2.gz IRJLVEZKKAZNJC-NEPJUHHUSA-N 2 2 354.248 2.741 20 5 FFBDLP CC1(C)CC(NC(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)CC(C)(C)[NH2+]1 ZINC000045163406 506926624 /nfs/dbraw/zinc/92/66/24/506926624.db2.gz YWYIRNWXPNNQFO-UHFFFAOYSA-N 2 2 371.441 2.820 20 5 FFBDLP C[C@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000116395849 508506494 /nfs/dbraw/zinc/50/64/94/508506494.db2.gz IQPWOBUXDHCCFB-BBRMVZONSA-N 2 2 350.463 2.878 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](O)C[N@@H+]1CCc2ccccc2C1 ZINC000151787632 509082606 /nfs/dbraw/zinc/08/26/06/509082606.db2.gz BYMUIIKQIIOLGS-OXJNMPFZSA-N 2 2 369.465 2.973 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000151787632 509082610 /nfs/dbraw/zinc/08/26/10/509082610.db2.gz BYMUIIKQIIOLGS-OXJNMPFZSA-N 2 2 369.465 2.973 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH+]1CCC(c2[nH]cc[nH+]2)CC1 ZINC000265556813 510113360 /nfs/dbraw/zinc/11/33/60/510113360.db2.gz ZSAACLLWCJHUPP-UHFFFAOYSA-N 2 2 357.414 2.835 20 5 FFBDLP C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000171389054 510127017 /nfs/dbraw/zinc/12/70/17/510127017.db2.gz PNSVACSIZSHWFX-HNNXBMFYSA-N 2 2 360.458 2.730 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000246487513 510515811 /nfs/dbraw/zinc/51/58/11/510515811.db2.gz GYGPZIODBMOILR-CLCXKQKWSA-N 2 2 372.469 2.871 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000246487513 510515815 /nfs/dbraw/zinc/51/58/15/510515815.db2.gz GYGPZIODBMOILR-CLCXKQKWSA-N 2 2 372.469 2.871 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000246487513 510515817 /nfs/dbraw/zinc/51/58/17/510515817.db2.gz GYGPZIODBMOILR-CLCXKQKWSA-N 2 2 372.469 2.871 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000246487513 510515820 /nfs/dbraw/zinc/51/58/20/510515820.db2.gz GYGPZIODBMOILR-CLCXKQKWSA-N 2 2 372.469 2.871 20 5 FFBDLP Cc1c(C[N@@H+](C)C[C@]2(O)CC[NH+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000188294247 510695060 /nfs/dbraw/zinc/69/50/60/510695060.db2.gz FBRXSKNKJVNYTK-OAQYLSRUSA-N 2 2 369.465 2.972 20 5 FFBDLP Cc1c(C[N@H+](C)C[C@]2(O)CC[NH+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000188294247 510695067 /nfs/dbraw/zinc/69/50/67/510695067.db2.gz FBRXSKNKJVNYTK-OAQYLSRUSA-N 2 2 369.465 2.972 20 5 FFBDLP Cc1c(C[NH+](C)C[C@]2(O)CC[N@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000188294247 510695074 /nfs/dbraw/zinc/69/50/74/510695074.db2.gz FBRXSKNKJVNYTK-OAQYLSRUSA-N 2 2 369.465 2.972 20 5 FFBDLP Cc1c(C[NH+](C)C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000188294247 510695080 /nfs/dbraw/zinc/69/50/80/510695080.db2.gz FBRXSKNKJVNYTK-OAQYLSRUSA-N 2 2 369.465 2.972 20 5 FFBDLP C[C@H]1CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1n1cc[nH+]c1 ZINC000246907341 510739293 /nfs/dbraw/zinc/73/92/93/510739293.db2.gz BLEBKEBRXYASDH-XJKSGUPXSA-N 2 2 368.397 2.924 20 5 FFBDLP C[C@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1n1cc[nH+]c1 ZINC000246907341 510739296 /nfs/dbraw/zinc/73/92/96/510739296.db2.gz BLEBKEBRXYASDH-XJKSGUPXSA-N 2 2 368.397 2.924 20 5 FFBDLP COCC[NH+](CCOC)C1CC[NH+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000285469804 510919346 /nfs/dbraw/zinc/91/93/46/510919346.db2.gz KLNKRUBKXRMKFL-MRXNPFEDSA-N 2 2 365.474 2.715 20 5 FFBDLP Cn1cc[nH+]c1[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000368137233 512818085 /nfs/dbraw/zinc/81/80/85/512818085.db2.gz YKUHLSSWYYGSMP-LLVKDONJSA-N 2 2 352.341 2.919 20 5 FFBDLP Cn1cc[nH+]c1[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000368137233 512818088 /nfs/dbraw/zinc/81/80/88/512818088.db2.gz YKUHLSSWYYGSMP-LLVKDONJSA-N 2 2 352.341 2.919 20 5 FFBDLP C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@H]1CCCC[N@@H+]1C1CC1 ZINC000446976935 513372671 /nfs/dbraw/zinc/37/26/71/513372671.db2.gz ZEDUSGDRFVWYLG-RDTXWAMCSA-N 2 2 360.458 2.918 20 5 FFBDLP C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@H]1CCCC[N@H+]1C1CC1 ZINC000446976935 513372675 /nfs/dbraw/zinc/37/26/75/513372675.db2.gz ZEDUSGDRFVWYLG-RDTXWAMCSA-N 2 2 360.458 2.918 20 5 FFBDLP CC[NH+]1CCC([N@@H+]2CCCN(C(=O)c3ccc([N+](=O)[O-])c(C)c3)CC2)CC1 ZINC000422005936 513516085 /nfs/dbraw/zinc/51/60/85/513516085.db2.gz KNJWVRNTOCGCES-UHFFFAOYSA-N 2 2 374.485 2.535 20 5 FFBDLP CC[NH+]1CCC([N@H+]2CCCN(C(=O)c3ccc([N+](=O)[O-])c(C)c3)CC2)CC1 ZINC000422005936 513516090 /nfs/dbraw/zinc/51/60/90/513516090.db2.gz KNJWVRNTOCGCES-UHFFFAOYSA-N 2 2 374.485 2.535 20 5 FFBDLP O=C(CNc1[nH+]ccc2ccc([N+](=O)[O-])cc21)NCC[NH+]1CCCCCC1 ZINC000413302437 513579444 /nfs/dbraw/zinc/57/94/44/513579444.db2.gz MNWPUTFAZOPXIC-UHFFFAOYSA-N 2 2 371.441 2.547 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)[C@@H](Nc1ccc(N3CC[NH2+]CC3)c[nH+]1)CCC2 ZINC000423236184 514088272 /nfs/dbraw/zinc/08/82/72/514088272.db2.gz RTFMTQKQHPAXBS-SFHVURJKSA-N 2 2 353.426 2.889 20 5 FFBDLP COc1ccc(C[NH2+][C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000414895313 514345899 /nfs/dbraw/zinc/34/58/99/514345899.db2.gz MYWMDLRUOPEHHJ-IAGOWNOFSA-N 2 2 359.401 2.978 20 5 FFBDLP CN1CC[NH2+]C[C@@H]1C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414978827 514384108 /nfs/dbraw/zinc/38/41/08/514384108.db2.gz SOSNIKNHCWXCOA-CYBMUJFWSA-N 2 2 364.833 2.501 20 5 FFBDLP CCOc1cc(N2CC[NH+](CCC[NH+](CC)CC)CC2)ccc1[N+](=O)[O-] ZINC000554847558 516662862 /nfs/dbraw/zinc/66/28/62/516662862.db2.gz ATNDWAQBOJMVSS-UHFFFAOYSA-N 2 2 364.490 2.847 20 5 FFBDLP Cn1cc(C[NH2+]CCCCn2cc[nH+]c2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000537274898 517119236 /nfs/dbraw/zinc/11/92/36/517119236.db2.gz UUXFIQAHTMPWHX-UHFFFAOYSA-N 2 2 354.414 2.762 20 5 FFBDLP C[NH+](C)C[C@@H](Cc1ccccc1)[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000548761612 517196743 /nfs/dbraw/zinc/19/67/43/517196743.db2.gz YNDFRTHAIZACST-QGZVFWFLSA-N 2 2 370.453 2.686 20 5 FFBDLP O=C(CC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000548826067 517238250 /nfs/dbraw/zinc/23/82/50/517238250.db2.gz IVMLIQCGBRBMQT-QGZVFWFLSA-N 2 2 368.437 2.788 20 5 FFBDLP O=C(CC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000548826067 517238259 /nfs/dbraw/zinc/23/82/59/517238259.db2.gz IVMLIQCGBRBMQT-QGZVFWFLSA-N 2 2 368.437 2.788 20 5 FFBDLP CS[C@@H]1CN(c2cc(C)[nH+]c(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H]1[NH+](C)C ZINC000533928436 517672354 /nfs/dbraw/zinc/67/23/54/517672354.db2.gz QQUMIOFKPNGYRY-HZPDHXFCSA-N 2 2 373.482 2.842 20 5 FFBDLP CCCN(CC[NH+]1CCCC1)C(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000553388101 517684365 /nfs/dbraw/zinc/68/43/65/517684365.db2.gz SXRGXMWZJQRGPI-UHFFFAOYSA-N 2 2 371.441 2.729 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c1 ZINC000589501891 519020601 /nfs/dbraw/zinc/02/06/01/519020601.db2.gz JQORMEMNDYDLSX-QGZVFWFLSA-N 2 2 361.442 2.832 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c1 ZINC000589501891 519020611 /nfs/dbraw/zinc/02/06/11/519020611.db2.gz JQORMEMNDYDLSX-QGZVFWFLSA-N 2 2 361.442 2.832 20 5 FFBDLP COc1cc(C[NH2+]C[C@@H]2C[N@H+](C)C[C@H]2c2ccccc2)c([N+](=O)[O-])cc1O ZINC000592376482 520358280 /nfs/dbraw/zinc/35/82/80/520358280.db2.gz SJRIHDCRGJPKLG-SJORKVTESA-N 2 2 371.437 2.744 20 5 FFBDLP COc1cc(C[NH2+]C[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)c([N+](=O)[O-])cc1O ZINC000592376482 520358287 /nfs/dbraw/zinc/35/82/87/520358287.db2.gz SJRIHDCRGJPKLG-SJORKVTESA-N 2 2 371.437 2.744 20 5 FFBDLP C[C@@H](C[NH+]1CCC(C)CC1)NC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000598260339 520525108 /nfs/dbraw/zinc/52/51/08/520525108.db2.gz AYEDYTYQZUSNCY-HNNXBMFYSA-N 2 2 371.441 2.631 20 5 FFBDLP CC(C)(C)[N@@H+]1CC[C@H]1CNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000596309861 521021554 /nfs/dbraw/zinc/02/15/54/521021554.db2.gz YSDHJNLWDCRFCV-INIZCTEOSA-N 2 2 362.474 2.712 20 5 FFBDLP CC(C)(C)[N@H+]1CC[C@H]1CNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000596309861 521021561 /nfs/dbraw/zinc/02/15/61/521021561.db2.gz YSDHJNLWDCRFCV-INIZCTEOSA-N 2 2 362.474 2.712 20 5 FFBDLP O=[N+]([O-])c1ccc2oc(C[NH2+]C3CCN(c4cccc[nH+]4)CC3)nc2c1 ZINC000602515578 521390960 /nfs/dbraw/zinc/39/09/60/521390960.db2.gz QEFPXNGABJGYGR-UHFFFAOYSA-N 2 2 353.382 2.890 20 5 FFBDLP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCC[NH+]1CCC(O)CC1 ZINC000872026537 731721716 /nfs/dbraw/zinc/72/17/16/731721716.db2.gz FULAEXALPQERHG-CYBMUJFWSA-N 2 2 353.488 2.814 20 5 FFBDLP COc1c(O)ccc(C[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)c1[N+](=O)[O-] ZINC000893200029 734667084 /nfs/dbraw/zinc/66/70/84/734667084.db2.gz LISATHOMXTZGEM-AWEZNQCLSA-N 2 2 351.447 2.767 20 5 FFBDLP COc1c(O)ccc(C[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)c1[N+](=O)[O-] ZINC000893200029 734667088 /nfs/dbraw/zinc/66/70/88/734667088.db2.gz LISATHOMXTZGEM-AWEZNQCLSA-N 2 2 351.447 2.767 20 5 FFBDLP Cc1[nH+]ccn1CCC[N@@H+](C)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000767448338 737326469 /nfs/dbraw/zinc/32/64/69/737326469.db2.gz DCZIFQKOKCCKPU-UHFFFAOYSA-N 2 2 365.821 2.714 20 5 FFBDLP Cc1[nH+]ccn1CCC[N@H+](C)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000767448338 737326476 /nfs/dbraw/zinc/32/64/76/737326476.db2.gz DCZIFQKOKCCKPU-UHFFFAOYSA-N 2 2 365.821 2.714 20 5 FFBDLP C[N@@H+]1CCCC[C@H]1CCOC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000922748262 988865561 /nfs/dbraw/zinc/86/55/61/988865561.db2.gz QVPSERTXLJFFJN-HNNXBMFYSA-N 2 2 358.398 2.812 20 5 FFBDLP C[N@H+]1CCCC[C@H]1CCOC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000922748262 988865577 /nfs/dbraw/zinc/86/55/77/988865577.db2.gz QVPSERTXLJFFJN-HNNXBMFYSA-N 2 2 358.398 2.812 20 5 FFBDLP Cc1c[nH+]ccc1OC1CC[NH+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000809995337 994662722 /nfs/dbraw/zinc/66/27/22/994662722.db2.gz PHNOGQSTSBBRNP-GOSISDBHSA-N 2 2 357.410 2.875 20 5 FFBDLP O=C(O[C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000810844092 994951791 /nfs/dbraw/zinc/95/17/91/994951791.db2.gz ZZGGYGNEJDKQIM-LSDHHAIUSA-N 2 2 356.382 2.564 20 5 FFBDLP O=C(O[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000810844092 994951804 /nfs/dbraw/zinc/95/18/04/994951804.db2.gz ZZGGYGNEJDKQIM-LSDHHAIUSA-N 2 2 356.382 2.564 20 5 FFBDLP COCC[N@H+]([C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])C1CC[NH+](C)CC1 ZINC001170342100 1003130390 /nfs/dbraw/zinc/13/03/90/1003130390.db2.gz MAKQEJLLQJLDNU-HNNXBMFYSA-N 2 2 365.474 2.577 20 5 FFBDLP COCC[N@@H+]([C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])C1CC[NH+](C)CC1 ZINC001170342100 1003130395 /nfs/dbraw/zinc/13/03/95/1003130395.db2.gz MAKQEJLLQJLDNU-HNNXBMFYSA-N 2 2 365.474 2.577 20 5 FFBDLP O=C(OCC12CCC[NH+](CCC1)C2)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000861355480 1009370518 /nfs/dbraw/zinc/37/05/18/1009370518.db2.gz QJBGSMYWIWVEFP-UHFFFAOYSA-N 2 2 370.409 2.813 20 5 FFBDLP CN(Cc1c2ccccc2cc2ccccc21)C(=O)[C@]12C[NH2+]C[C@H]1CC[NH2+]2 ZINC001160740204 1027846392 /nfs/dbraw/zinc/84/63/92/1027846392.db2.gz YWODZRBRPBCFET-JPYJTQIMSA-N 2 2 359.473 2.903 20 5 FFBDLP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CCC[NH3+])C(=O)OC(C)(C)C ZINC001246206079 1039279872 /nfs/dbraw/zinc/27/98/72/1039279872.db2.gz CTWAOLFAFPIHTH-ZFWWWQNUSA-N 2 2 351.447 2.565 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CC[C@@H]3[NH2+]CCC[C@H]3C2)c1F ZINC001247006840 1039575701 /nfs/dbraw/zinc/57/57/01/1039575701.db2.gz AZBBGNLDDHBLJE-YDHLFZDLSA-N 2 2 351.422 2.747 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CC[C@@H]3[NH2+]CCC[C@H]3C2)c1F ZINC001247006840 1039575713 /nfs/dbraw/zinc/57/57/13/1039575713.db2.gz AZBBGNLDDHBLJE-YDHLFZDLSA-N 2 2 351.422 2.747 20 5 FFBDLP C[NH+]1CCC([N@@H+]2CC[C@H](Nc3ncc([N+](=O)[O-])c4ccccc43)C2)CC1 ZINC001353245319 1056224681 /nfs/dbraw/zinc/22/46/81/1056224681.db2.gz LBTHZCOGCUYLSZ-AWEZNQCLSA-N 2 2 355.442 2.723 20 5 FFBDLP C[NH+]1CCC([N@H+]2CC[C@H](Nc3ncc([N+](=O)[O-])c4ccccc43)C2)CC1 ZINC001353245319 1056224697 /nfs/dbraw/zinc/22/46/97/1056224697.db2.gz LBTHZCOGCUYLSZ-AWEZNQCLSA-N 2 2 355.442 2.723 20 5 FFBDLP Cn1c[nH+]cc1C1CC[NH+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC001473894937 1065409796 /nfs/dbraw/zinc/40/97/96/1065409796.db2.gz VOJKZJYQFIPFOC-UHFFFAOYSA-N 2 2 368.397 2.758 20 5 FFBDLP C[NH+](C)CCC[N@H+](C)CCNC(=O)Nc1ccc([N+](=O)[O-])c2ccccc12 ZINC001563396521 1076550419 /nfs/dbraw/zinc/55/04/19/1076550419.db2.gz AGNIETRCCTZUOH-UHFFFAOYSA-N 2 2 373.457 2.753 20 5 FFBDLP C[NH+](C)CCC[N@@H+](C)CCNC(=O)Nc1ccc([N+](=O)[O-])c2ccccc12 ZINC001563396521 1076550423 /nfs/dbraw/zinc/55/04/23/1076550423.db2.gz AGNIETRCCTZUOH-UHFFFAOYSA-N 2 2 373.457 2.753 20 5 FFBDLP Cn1cc[nH+]c1[C@H](N[C@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000272564006 252069058 /nfs/dbraw/zinc/06/90/58/252069058.db2.gz UQNWXNLBPVUSOZ-CGTJXYLNSA-N 2 2 357.458 2.880 20 5 FFBDLP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272566820 252069478 /nfs/dbraw/zinc/06/94/78/252069478.db2.gz VARMKELQEGTKLC-KBXCAEBGSA-N 2 2 368.441 2.849 20 5 FFBDLP Cc1c(NC(=O)[C@@H](C)[NH+]2CCC(c3c[nH]c[nH+]3)CC2)cccc1[N+](=O)[O-] ZINC000369341283 512359433 /nfs/dbraw/zinc/35/94/33/512359433.db2.gz CVEVSZOXXKVIEE-CYBMUJFWSA-N 2 2 357.414 2.833 20 5 FFBDLP COc1cc(C[N@H+](C)C[C@H]2CCC[NH+](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000152374010 508433541 /nfs/dbraw/zinc/43/35/41/508433541.db2.gz QZARPZAOMNARQL-LBPRGKRZSA-N 2 2 373.400 2.978 20 5 FFBDLP COc1cc(C[N@@H+](C)C[C@H]2CCC[NH+](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000152374010 508433547 /nfs/dbraw/zinc/43/35/47/508433547.db2.gz QZARPZAOMNARQL-LBPRGKRZSA-N 2 2 373.400 2.978 20 5 FFBDLP COc1cc(C[NH+](C)C[C@H]2CCC[N@H+](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000152374010 508433552 /nfs/dbraw/zinc/43/35/52/508433552.db2.gz QZARPZAOMNARQL-LBPRGKRZSA-N 2 2 373.400 2.978 20 5 FFBDLP COc1cc(C[NH+](C)C[C@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000152374010 508433555 /nfs/dbraw/zinc/43/35/55/508433555.db2.gz QZARPZAOMNARQL-LBPRGKRZSA-N 2 2 373.400 2.978 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[NH+]2CCC(c3[nH]cc[nH+]3)CC2)cccc1[N+](=O)[O-] ZINC000266785914 509192753 /nfs/dbraw/zinc/19/27/53/509192753.db2.gz WBMOZTNVRAPIHV-ZDUSSCGKSA-N 2 2 357.414 2.833 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@@H](c4[nH]cc[nH+]4)C3)n2)c1 ZINC000266901436 509248978 /nfs/dbraw/zinc/24/89/78/509248978.db2.gz GSUWBODCTWHPPK-CYBMUJFWSA-N 2 2 354.370 2.748 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@@H](c4[nH]cc[nH+]4)C3)n2)c1 ZINC000266901436 509248984 /nfs/dbraw/zinc/24/89/84/509248984.db2.gz GSUWBODCTWHPPK-CYBMUJFWSA-N 2 2 354.370 2.748 20 5 FFBDLP COc1ccc(OCC[NH+]2CCN(c3cc(C)cc[nH+]3)CC2)c([N+](=O)[O-])c1 ZINC000166184291 509597932 /nfs/dbraw/zinc/59/79/32/509597932.db2.gz WMRRCBRGDHYOCP-UHFFFAOYSA-N 2 2 372.425 2.508 20 5 FFBDLP C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000265443701 510057163 /nfs/dbraw/zinc/05/71/63/510057163.db2.gz AGUFLYAOXWNGMB-CHWSQXEVSA-N 2 2 368.865 2.849 20 5 FFBDLP C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000265443701 510057168 /nfs/dbraw/zinc/05/71/68/510057168.db2.gz AGUFLYAOXWNGMB-CHWSQXEVSA-N 2 2 368.865 2.849 20 5 FFBDLP C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[NH+](C)C[C@@H]1CCC[N@H+](C)C1 ZINC000265443701 510057171 /nfs/dbraw/zinc/05/71/71/510057171.db2.gz AGUFLYAOXWNGMB-CHWSQXEVSA-N 2 2 368.865 2.849 20 5 FFBDLP C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[NH+](C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000265443701 510057176 /nfs/dbraw/zinc/05/71/76/510057176.db2.gz AGUFLYAOXWNGMB-CHWSQXEVSA-N 2 2 368.865 2.849 20 5 FFBDLP CC[C@@H]([NH2+]CCC[N@@H+]1CCC[C@H]1C(=O)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000268857830 510104405 /nfs/dbraw/zinc/10/44/05/510104405.db2.gz QWEWMYGCHQCPPJ-MSOLQXFVSA-N 2 2 362.474 2.578 20 5 FFBDLP CC[C@@H]([NH2+]CCC[N@H+]1CCC[C@H]1C(=O)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000268857830 510104410 /nfs/dbraw/zinc/10/44/10/510104410.db2.gz QWEWMYGCHQCPPJ-MSOLQXFVSA-N 2 2 362.474 2.578 20 5 FFBDLP C[C@@H]1C[C@H]([NH+](C)CCn2cc([N+](=O)[O-])cn2)CC[N@@H+]1Cc1ccccc1 ZINC000174870545 510356334 /nfs/dbraw/zinc/35/63/34/510356334.db2.gz PNJOUZXSNYLMQL-SJLPKXTDSA-N 2 2 357.458 2.776 20 5 FFBDLP C[C@@H]1C[C@H]([NH+](C)CCn2cc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1 ZINC000174870545 510356337 /nfs/dbraw/zinc/35/63/37/510356337.db2.gz PNJOUZXSNYLMQL-SJLPKXTDSA-N 2 2 357.458 2.776 20 5 FFBDLP C[C@@H]1C[C@H]([N@H+](C)CCn2cc([N+](=O)[O-])cn2)CC[NH+]1Cc1ccccc1 ZINC000174870545 510356340 /nfs/dbraw/zinc/35/63/40/510356340.db2.gz PNJOUZXSNYLMQL-SJLPKXTDSA-N 2 2 357.458 2.776 20 5 FFBDLP C[C@@H]1C[C@H]([N@@H+](C)CCn2cc([N+](=O)[O-])cn2)CC[NH+]1Cc1ccccc1 ZINC000174870545 510356341 /nfs/dbraw/zinc/35/63/41/510356341.db2.gz PNJOUZXSNYLMQL-SJLPKXTDSA-N 2 2 357.458 2.776 20 5 FFBDLP COCC[NH+](CCOC)C1CC[NH+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000285558631 510955386 /nfs/dbraw/zinc/95/53/86/510955386.db2.gz SHPYELRERSOTBH-INIZCTEOSA-N 2 2 365.474 2.715 20 5 FFBDLP C[C@@H](C1CC[NH+](C)CC1)N(C)C(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000270978091 511044869 /nfs/dbraw/zinc/04/48/69/511044869.db2.gz UYURQLMMENNALZ-AWEZNQCLSA-N 2 2 371.441 2.583 20 5 FFBDLP CC(C)[NH+]1CCN([C@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C2)CC1 ZINC000367768264 512654237 /nfs/dbraw/zinc/65/42/37/512654237.db2.gz IDJDPLWJDCQROP-KRWDZBQOSA-N 2 2 366.893 2.849 20 5 FFBDLP CC(C)[NH+]1CCN([C@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C2)CC1 ZINC000367768264 512654241 /nfs/dbraw/zinc/65/42/41/512654241.db2.gz IDJDPLWJDCQROP-KRWDZBQOSA-N 2 2 366.893 2.849 20 5 FFBDLP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000446854091 513351256 /nfs/dbraw/zinc/35/12/56/513351256.db2.gz VAKYWJDZHNYBMK-UHFFFAOYSA-N 2 2 363.381 2.650 20 5 FFBDLP CC(C)[N@@H+]1CCC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)C1 ZINC000448825085 513916252 /nfs/dbraw/zinc/91/62/52/513916252.db2.gz UWGSMTDHKHMHDD-HNNXBMFYSA-N 2 2 371.441 2.631 20 5 FFBDLP CC(C)[N@H+]1CCC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)C1 ZINC000448825085 513916261 /nfs/dbraw/zinc/91/62/61/513916261.db2.gz UWGSMTDHKHMHDD-HNNXBMFYSA-N 2 2 371.441 2.631 20 5 FFBDLP C[C@H](CCc1ccccc1[N+](=O)[O-])Nc1ccc(N2CC[NH2+]CC2)c[nH+]1 ZINC000423242625 514090679 /nfs/dbraw/zinc/09/06/79/514090679.db2.gz ZCEWCRQNEKDODX-OAHLLOKOSA-N 2 2 355.442 2.833 20 5 FFBDLP C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C[C@H]1[NH2+]CCc2ccccc21 ZINC000414941913 514366728 /nfs/dbraw/zinc/36/67/28/514366728.db2.gz BGYNRQHGHMRWPQ-IFXJQAMLSA-N 2 2 368.437 2.789 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](CC[NH3+])Cc1ccccc1 ZINC000466981666 514851591 /nfs/dbraw/zinc/85/15/91/514851591.db2.gz VRGSXTYEXMZDCK-UHFFFAOYSA-N 2 2 356.426 2.693 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](CC[NH3+])Cc1ccccc1 ZINC000466981666 514851600 /nfs/dbraw/zinc/85/16/00/514851600.db2.gz VRGSXTYEXMZDCK-UHFFFAOYSA-N 2 2 356.426 2.693 20 5 FFBDLP CCOc1cc(C[NH+]2CCN(c3cc(OC)cc[nH+]3)CC2)ccc1[N+](=O)[O-] ZINC000492792177 515564034 /nfs/dbraw/zinc/56/40/34/515564034.db2.gz SINALGHFUVAYDO-UHFFFAOYSA-N 2 2 372.425 2.719 20 5 FFBDLP C[C@H]([NH2+]CCC[NH+]1CCN(c2cc[nH+]cc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000482118389 515579844 /nfs/dbraw/zinc/57/98/44/515579844.db2.gz COFQWWRVKFMCPP-KRWDZBQOSA-N 3 2 369.469 2.853 20 5 FFBDLP O=[N+]([O-])c1ccc(N2CC[NH+](Cc3cc(-n4cc[nH+]c4)cs3)CC2)cn1 ZINC000544348731 516716328 /nfs/dbraw/zinc/71/63/28/516716328.db2.gz OCWABTUVRPIYAE-UHFFFAOYSA-N 2 2 370.438 2.559 20 5 FFBDLP C[C@@H]1CCC[C@H](C)[N@H+]1CCNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000518596613 516717838 /nfs/dbraw/zinc/71/78/38/516717838.db2.gz GRNLUWOADMWEGW-GASCZTMLSA-N 2 2 371.441 2.773 20 5 FFBDLP C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000518596613 516717843 /nfs/dbraw/zinc/71/78/43/516717843.db2.gz GRNLUWOADMWEGW-GASCZTMLSA-N 2 2 371.441 2.773 20 5 FFBDLP Cn1cc[nH+]c1[C@@H](NCC[N@H+](C)C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000552249644 517162213 /nfs/dbraw/zinc/16/22/13/517162213.db2.gz GUCOCHMWSQSCCZ-SFHVURJKSA-N 2 2 357.458 2.882 20 5 FFBDLP Cn1cc[nH+]c1[C@@H](NCC[N@@H+](C)C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000552249644 517162217 /nfs/dbraw/zinc/16/22/17/517162217.db2.gz GUCOCHMWSQSCCZ-SFHVURJKSA-N 2 2 357.458 2.882 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[NH+]1CCC(C[NH+](C)C)CC1 ZINC000532922023 517205041 /nfs/dbraw/zinc/20/50/41/517205041.db2.gz ZBQDIFNKHDBHAE-GFCCVEGCSA-N 2 2 368.865 2.849 20 5 FFBDLP Cn1cc[nH+]c1[C@@H]1CC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000542519238 517607360 /nfs/dbraw/zinc/60/73/60/517607360.db2.gz MTVDLUMBPODQME-CQSZACIVSA-N 2 2 353.382 2.973 20 5 FFBDLP Cn1cc[nH+]c1[C@@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000542519238 517607368 /nfs/dbraw/zinc/60/73/68/517607368.db2.gz MTVDLUMBPODQME-CQSZACIVSA-N 2 2 353.382 2.973 20 5 FFBDLP Cn1ccnc1[C@@H]([NH2+]CCCNc1cccc[nH+]1)c1cccc([N+](=O)[O-])c1 ZINC000560524466 517871363 /nfs/dbraw/zinc/87/13/63/517871363.db2.gz BJLDVTUZXCYKPB-SFHVURJKSA-N 2 2 366.425 2.905 20 5 FFBDLP Cc1[nH+]ccn1CCCC[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000560530041 517877165 /nfs/dbraw/zinc/87/71/65/517877165.db2.gz YJIQKAPJSQEZGW-SFHVURJKSA-N 2 2 368.441 2.993 20 5 FFBDLP Cc1ccc([C@@H](C[NH2+]C[C@H](O)COc2cccc([N+](=O)[O-])c2)[NH+](C)C)cc1 ZINC000584226833 518237596 /nfs/dbraw/zinc/23/75/96/518237596.db2.gz QSUZKNRITYLPQG-AZUAARDMSA-N 2 2 373.453 2.535 20 5 FFBDLP C[NH+](C)CCN(C(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)C1CCCC1 ZINC000609583029 520365539 /nfs/dbraw/zinc/36/55/39/520365539.db2.gz GMNYJRDMRPBVFC-UHFFFAOYSA-N 2 2 371.441 2.727 20 5 FFBDLP O=[N+]([O-])c1cc2c(cc1C[NH2+]C[C@@H]1CCC[N@H+](CC3CC3)C1)OCCO2 ZINC000596058773 520886072 /nfs/dbraw/zinc/88/60/72/520886072.db2.gz JDHOJLITJQQJEX-HNNXBMFYSA-N 2 2 361.442 2.578 20 5 FFBDLP O=[N+]([O-])c1cc2c(cc1C[NH2+]C[C@@H]1CCC[N@@H+](CC3CC3)C1)OCCO2 ZINC000596058773 520886076 /nfs/dbraw/zinc/88/60/76/520886076.db2.gz JDHOJLITJQQJEX-HNNXBMFYSA-N 2 2 361.442 2.578 20 5 FFBDLP C[NH2+]C[C@H](C)[NH2+]Cc1ccc(OC)c(OCc2ccc([N+](=O)[O-])cc2)c1 ZINC000596103185 520914603 /nfs/dbraw/zinc/91/46/03/520914603.db2.gz BYKXPZYVWRFYLJ-AWEZNQCLSA-N 2 2 359.426 2.880 20 5 FFBDLP C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@H]1CC[N@@H+]1C1CCCC1 ZINC000599072878 521016749 /nfs/dbraw/zinc/01/67/49/521016749.db2.gz BDTXCARKOZXVRH-KBXCAEBGSA-N 2 2 360.458 2.918 20 5 FFBDLP C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@H]1CC[N@H+]1C1CCCC1 ZINC000599072878 521016759 /nfs/dbraw/zinc/01/67/59/521016759.db2.gz BDTXCARKOZXVRH-KBXCAEBGSA-N 2 2 360.458 2.918 20 5 FFBDLP Cn1cc[nH+]c1[C@@H](N[C@@H]1CC[NH2+]CC(C)(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000602023517 521084325 /nfs/dbraw/zinc/08/43/25/521084325.db2.gz YVCWCIGIOUADBV-WBVHZDCISA-N 2 2 357.458 2.786 20 5 FFBDLP Cn1cc[nH+]c1[C@H](N[C@@H]1CC[NH2+]CC(C)(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000602023514 521084853 /nfs/dbraw/zinc/08/48/53/521084853.db2.gz YVCWCIGIOUADBV-NVXWUHKLSA-N 2 2 357.458 2.786 20 5 FFBDLP CC1(C)CCC[N@H+](CC[NH2+]C2CCN(c3ccc([N+](=O)[O-])nc3)CC2)C1 ZINC000602637989 521451906 /nfs/dbraw/zinc/45/19/06/521451906.db2.gz PVNNQKKCKCTMDT-UHFFFAOYSA-N 2 2 361.490 2.670 20 5 FFBDLP CC1(C)CCC[N@@H+](CC[NH2+]C2CCN(c3ccc([N+](=O)[O-])nc3)CC2)C1 ZINC000602637989 521451912 /nfs/dbraw/zinc/45/19/12/521451912.db2.gz PVNNQKKCKCTMDT-UHFFFAOYSA-N 2 2 361.490 2.670 20 5 FFBDLP O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]C1CC[NH+]([C@@H]2CCOC2)CC1 ZINC000602717881 521493353 /nfs/dbraw/zinc/49/33/53/521493353.db2.gz JPIOXBWLOMFLQG-OAHLLOKOSA-N 2 2 373.375 2.957 20 5 FFBDLP Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@@H]1Cn1c(C)[nH+]c2ccccc21 ZINC000602795361 521537884 /nfs/dbraw/zinc/53/78/84/521537884.db2.gz MOSONJVRTASLOL-MRXNPFEDSA-N 2 2 368.441 2.922 20 5 FFBDLP Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H]1Cn1c(C)[nH+]c2ccccc21 ZINC000602795361 521537892 /nfs/dbraw/zinc/53/78/92/521537892.db2.gz MOSONJVRTASLOL-MRXNPFEDSA-N 2 2 368.441 2.922 20 5 FFBDLP Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@H](c2[nH+]cc3n2CCCC3)C1 ZINC000602826204 521554913 /nfs/dbraw/zinc/55/49/13/521554913.db2.gz MYGLKDFFLBHNMZ-HNNXBMFYSA-N 2 2 358.446 2.512 20 5 FFBDLP Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H](c2[nH+]cc3n2CCCC3)C1 ZINC000602826204 521554922 /nfs/dbraw/zinc/55/49/22/521554922.db2.gz MYGLKDFFLBHNMZ-HNNXBMFYSA-N 2 2 358.446 2.512 20 5 FFBDLP Cc1nn(C[N@H+]2CC[C@@H](C)[C@H](n3cc[nH+]c3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000121258585 959405679 /nfs/dbraw/zinc/40/56/79/959405679.db2.gz ISXOBDSLDZCVEF-FZKQIMNGSA-N 2 2 354.414 2.990 20 5 FFBDLP Cc1nn(C[N@@H+]2CC[C@@H](C)[C@H](n3cc[nH+]c3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000121258585 959405684 /nfs/dbraw/zinc/40/56/84/959405684.db2.gz ISXOBDSLDZCVEF-FZKQIMNGSA-N 2 2 354.414 2.990 20 5 FFBDLP Cc1cc(NCC[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)nc(C(C)C)[nH+]1 ZINC000863575822 1010260907 /nfs/dbraw/zinc/26/09/07/1010260907.db2.gz KBZUICZTMKBZEX-INIZCTEOSA-N 2 2 359.430 2.552 20 5 FFBDLP C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777963456 1020333344 /nfs/dbraw/zinc/33/33/44/1020333344.db2.gz LRKRULMXVJTOFP-APWZRJJASA-N 2 2 355.442 2.832 20 5 FFBDLP C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777963456 1020333355 /nfs/dbraw/zinc/33/33/55/1020333355.db2.gz LRKRULMXVJTOFP-APWZRJJASA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777963456 1020333369 /nfs/dbraw/zinc/33/33/69/1020333369.db2.gz LRKRULMXVJTOFP-APWZRJJASA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777963456 1020333374 /nfs/dbraw/zinc/33/33/74/1020333374.db2.gz LRKRULMXVJTOFP-APWZRJJASA-N 2 2 355.442 2.832 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH+]1C[C@]2(C)C[NH+](C)C[C@@]2(C)C1 ZINC000931307641 1020414115 /nfs/dbraw/zinc/41/41/15/1020414115.db2.gz NOKLCXGXDPBTRT-OALUTQOASA-N 2 2 360.458 2.505 20 5 FFBDLP O=[N+]([O-])c1cccc(Br)c1C[NH2+][C@@H]1CCn2cc[nH+]c2C1 ZINC001474120416 1065458325 /nfs/dbraw/zinc/45/83/25/1065458325.db2.gz ZQNFMYMIMBMMEZ-SNVBAGLBSA-N 2 2 351.204 2.658 20 5 FFBDLP Cn1c[nH+]cc1C1CC[NH+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC001560233583 1076253130 /nfs/dbraw/zinc/25/31/30/1076253130.db2.gz GKSCRJUIXLXXPD-UHFFFAOYSA-N 2 2 357.414 2.537 20 5 FFBDLP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000093639087 250039851 /nfs/dbraw/zinc/03/98/51/250039851.db2.gz YBZOQNDGQFZZMT-HIFRSBDPSA-N 2 2 351.447 2.774 20 5 FFBDLP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000093639087 250039856 /nfs/dbraw/zinc/03/98/56/250039856.db2.gz YBZOQNDGQFZZMT-HIFRSBDPSA-N 2 2 351.447 2.774 20 5 FFBDLP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000093639087 250039860 /nfs/dbraw/zinc/03/98/60/250039860.db2.gz YBZOQNDGQFZZMT-HIFRSBDPSA-N 2 2 351.447 2.774 20 5 FFBDLP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000093639087 250039864 /nfs/dbraw/zinc/03/98/64/250039864.db2.gz YBZOQNDGQFZZMT-HIFRSBDPSA-N 2 2 351.447 2.774 20 5 FFBDLP O=[N+]([O-])c1ccc(OCC[NH2+]C2CC[NH+](Cc3ccccn3)CC2)cc1 ZINC000089580995 507847254 /nfs/dbraw/zinc/84/72/54/507847254.db2.gz YTYUBZFNJQZDEZ-UHFFFAOYSA-N 2 2 356.426 2.623 20 5 FFBDLP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000072974868 507879293 /nfs/dbraw/zinc/87/92/93/507879293.db2.gz FQRADVQSLVZYJP-HZPDHXFCSA-N 2 2 374.485 2.780 20 5 FFBDLP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000072974868 507879297 /nfs/dbraw/zinc/87/92/97/507879297.db2.gz FQRADVQSLVZYJP-HZPDHXFCSA-N 2 2 374.485 2.780 20 5 FFBDLP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000072974868 507879299 /nfs/dbraw/zinc/87/92/99/507879299.db2.gz FQRADVQSLVZYJP-HZPDHXFCSA-N 2 2 374.485 2.780 20 5 FFBDLP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000072974868 507879301 /nfs/dbraw/zinc/87/93/01/507879301.db2.gz FQRADVQSLVZYJP-HZPDHXFCSA-N 2 2 374.485 2.780 20 5 FFBDLP C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000123743852 508732850 /nfs/dbraw/zinc/73/28/50/508732850.db2.gz MQOHHRHEPCOFNP-LSDHHAIUSA-N 2 2 371.441 2.610 20 5 FFBDLP C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000123743852 508732852 /nfs/dbraw/zinc/73/28/52/508732852.db2.gz MQOHHRHEPCOFNP-LSDHHAIUSA-N 2 2 371.441 2.610 20 5 FFBDLP COc1cc(C[N@H+](C)CCCn2cc[nH+]c2)c([N+](=O)[O-])cc1OC(F)F ZINC000124304098 508812574 /nfs/dbraw/zinc/81/25/74/508812574.db2.gz RGTQOYCHHIXYJN-UHFFFAOYSA-N 2 2 370.356 2.923 20 5 FFBDLP COc1cc(C[N@@H+](C)CCCn2cc[nH+]c2)c([N+](=O)[O-])cc1OC(F)F ZINC000124304098 508812577 /nfs/dbraw/zinc/81/25/77/508812577.db2.gz RGTQOYCHHIXYJN-UHFFFAOYSA-N 2 2 370.356 2.923 20 5 FFBDLP COc1ccc(OCC[N@@H+]2CC[C@H](Oc3cc[nH+]cc3)C2)c([N+](=O)[O-])c1 ZINC000131802134 508971009 /nfs/dbraw/zinc/97/10/09/508971009.db2.gz ZGDXOVSAERBZHL-INIZCTEOSA-N 2 2 359.382 2.531 20 5 FFBDLP COc1ccc(OCC[N@H+]2CC[C@H](Oc3cc[nH+]cc3)C2)c([N+](=O)[O-])c1 ZINC000131802134 508971013 /nfs/dbraw/zinc/97/10/13/508971013.db2.gz ZGDXOVSAERBZHL-INIZCTEOSA-N 2 2 359.382 2.531 20 5 FFBDLP O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C[C@@H](O)C[N@@H+]1CCc2ccccc2C1 ZINC000238120178 509823962 /nfs/dbraw/zinc/82/39/62/509823962.db2.gz SSWLKEYAWBEIRJ-MVHVFESUSA-N 2 2 367.449 2.617 20 5 FFBDLP O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000238120178 509823971 /nfs/dbraw/zinc/82/39/71/509823971.db2.gz SSWLKEYAWBEIRJ-MVHVFESUSA-N 2 2 367.449 2.617 20 5 FFBDLP COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[NH+]1CCC(c2[nH]cc[nH+]2)CC1 ZINC000265492893 510083166 /nfs/dbraw/zinc/08/31/66/510083166.db2.gz NMVVJNZLVUJTEC-LBPRGKRZSA-N 2 2 373.413 2.533 20 5 FFBDLP C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000247781862 510870472 /nfs/dbraw/zinc/87/04/72/510870472.db2.gz XTBUISOICGAPIQ-CPUCHLNUSA-N 2 2 357.414 2.701 20 5 FFBDLP C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000247781862 510870473 /nfs/dbraw/zinc/87/04/73/510870473.db2.gz XTBUISOICGAPIQ-CPUCHLNUSA-N 2 2 357.414 2.701 20 5 FFBDLP C[C@H]1C[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000362077900 511128721 /nfs/dbraw/zinc/12/87/21/511128721.db2.gz KMUVLQZHZQQRQZ-YOEHRIQHSA-N 2 2 366.893 2.706 20 5 FFBDLP C[C@H]1C[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000362077900 511128727 /nfs/dbraw/zinc/12/87/27/511128727.db2.gz KMUVLQZHZQQRQZ-YOEHRIQHSA-N 2 2 366.893 2.706 20 5 FFBDLP C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]Cc1c[nH+]c2n1CCCC2 ZINC000367438332 512498689 /nfs/dbraw/zinc/49/86/89/512498689.db2.gz MHZDLQRVVPPGRX-CYBMUJFWSA-N 2 2 357.414 2.635 20 5 FFBDLP COc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH+]1CCC(c2c[nH]c[nH+]2)CC1 ZINC000374212252 512709748 /nfs/dbraw/zinc/70/97/48/512709748.db2.gz PLWCZIXEBAFPIU-UHFFFAOYSA-N 2 2 373.413 2.535 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@@H+]2Cc1ccc([N+](=O)[O-])cc1Cl ZINC000374695359 512960004 /nfs/dbraw/zinc/96/00/04/512960004.db2.gz FKVAHQZXROFEJP-XOKHGSTOSA-N 2 2 353.850 2.932 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@H+]2Cc1ccc([N+](=O)[O-])cc1Cl ZINC000374695359 512960007 /nfs/dbraw/zinc/96/00/07/512960007.db2.gz FKVAHQZXROFEJP-XOKHGSTOSA-N 2 2 353.850 2.932 20 5 FFBDLP CCN(CCC[NH+]1CCCC1)C(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000451111925 513532004 /nfs/dbraw/zinc/53/20/04/513532004.db2.gz HZOPRNVCTWMGDC-UHFFFAOYSA-N 2 2 371.441 2.729 20 5 FFBDLP O=C(NCCC[NH+]1CCCCCC1)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000448608531 513805813 /nfs/dbraw/zinc/80/58/13/513805813.db2.gz WMAANNFIMHRUAQ-UHFFFAOYSA-N 2 2 371.441 2.776 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@H]3C[NH2+]CCO3)o2)c(Cl)c1 ZINC000415090645 514438761 /nfs/dbraw/zinc/43/87/61/514438761.db2.gz AWPLDPRVJDGTSV-CYBMUJFWSA-N 2 2 351.790 2.586 20 5 FFBDLP CC1CC[NH+](CCNc2cc(C[NH+]3CCOCC3)ccc2[N+](=O)[O-])CC1 ZINC000472351839 515240135 /nfs/dbraw/zinc/24/01/35/515240135.db2.gz UQTCOTKKLRKIOZ-UHFFFAOYSA-N 2 2 362.474 2.571 20 5 FFBDLP C[C@@H]([NH2+]CCC[NH+]1CCN(c2cc[nH+]cc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000482118390 515580178 /nfs/dbraw/zinc/58/01/78/515580178.db2.gz COFQWWRVKFMCPP-QGZVFWFLSA-N 3 2 369.469 2.853 20 5 FFBDLP Cn1cc(C[N@H+](C)CCCn2cc[nH+]c2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000554883295 516679241 /nfs/dbraw/zinc/67/92/41/516679241.db2.gz AULDBSDPINZIPV-UHFFFAOYSA-N 2 2 354.414 2.714 20 5 FFBDLP Cn1cc(C[N@@H+](C)CCCn2cc[nH+]c2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000554883295 516679251 /nfs/dbraw/zinc/67/92/51/516679251.db2.gz AULDBSDPINZIPV-UHFFFAOYSA-N 2 2 354.414 2.714 20 5 FFBDLP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C[C@@H]1C ZINC000537618193 517263111 /nfs/dbraw/zinc/26/31/11/517263111.db2.gz PSLKXCJVJROUFU-DZGCQCFKSA-N 2 2 351.447 2.917 20 5 FFBDLP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C[C@@H]1C ZINC000537618193 517263117 /nfs/dbraw/zinc/26/31/17/517263117.db2.gz PSLKXCJVJROUFU-DZGCQCFKSA-N 2 2 351.447 2.917 20 5 FFBDLP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C[C@@H]1C ZINC000537618193 517263127 /nfs/dbraw/zinc/26/31/27/517263127.db2.gz PSLKXCJVJROUFU-DZGCQCFKSA-N 2 2 351.447 2.917 20 5 FFBDLP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C[C@@H]1C ZINC000537618193 517263138 /nfs/dbraw/zinc/26/31/38/517263138.db2.gz PSLKXCJVJROUFU-DZGCQCFKSA-N 2 2 351.447 2.917 20 5 FFBDLP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C[C@H]1C ZINC000537618195 517263229 /nfs/dbraw/zinc/26/32/29/517263229.db2.gz PSLKXCJVJROUFU-UKRRQHHQSA-N 2 2 351.447 2.917 20 5 FFBDLP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C[C@H]1C ZINC000537618195 517263237 /nfs/dbraw/zinc/26/32/37/517263237.db2.gz PSLKXCJVJROUFU-UKRRQHHQSA-N 2 2 351.447 2.917 20 5 FFBDLP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C[C@H]1C ZINC000537618195 517263245 /nfs/dbraw/zinc/26/32/45/517263245.db2.gz PSLKXCJVJROUFU-UKRRQHHQSA-N 2 2 351.447 2.917 20 5 FFBDLP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C[C@H]1C ZINC000537618195 517263254 /nfs/dbraw/zinc/26/32/54/517263254.db2.gz PSLKXCJVJROUFU-UKRRQHHQSA-N 2 2 351.447 2.917 20 5 FFBDLP C[N@@H+]1CC[C@@H]([NH2+]CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1 ZINC000589267646 518968957 /nfs/dbraw/zinc/96/89/57/518968957.db2.gz CMDHYZBUXSCCDU-UYAOXDASSA-N 2 2 368.437 2.958 20 5 FFBDLP C[N@H+]1CC[C@@H]([NH2+]CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1 ZINC000589267646 518968964 /nfs/dbraw/zinc/96/89/64/518968964.db2.gz CMDHYZBUXSCCDU-UYAOXDASSA-N 2 2 368.437 2.958 20 5 FFBDLP C[N@@H+]1CCN(Cc2ccccc2)[C@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000594993105 520246236 /nfs/dbraw/zinc/24/62/36/520246236.db2.gz BKXMMJCUIKBBKA-HXUWFJFHSA-N 2 2 354.454 2.501 20 5 FFBDLP C[N@H+]1CCN(Cc2ccccc2)[C@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000594993105 520246240 /nfs/dbraw/zinc/24/62/40/520246240.db2.gz BKXMMJCUIKBBKA-HXUWFJFHSA-N 2 2 354.454 2.501 20 5 FFBDLP CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCOC2(CC[NH+](C)CC2)C1 ZINC000592181118 520249687 /nfs/dbraw/zinc/24/96/87/520249687.db2.gz CPFADCQIQJFCJM-UHFFFAOYSA-N 2 2 363.458 2.679 20 5 FFBDLP CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCOC2(CC[NH+](C)CC2)C1 ZINC000592181118 520249694 /nfs/dbraw/zinc/24/96/94/520249694.db2.gz CPFADCQIQJFCJM-UHFFFAOYSA-N 2 2 363.458 2.679 20 5 FFBDLP COc1cc(C[N@@H+]2CCC[C@@H]3C[NH2+]CC[C@@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000601335858 520745619 /nfs/dbraw/zinc/74/56/19/520745619.db2.gz YWTNCMCIJFYJQL-YPMHNXCESA-N 2 2 371.384 2.779 20 5 FFBDLP COc1cc(C[N@H+]2CCC[C@@H]3C[NH2+]CC[C@@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000601335858 520745627 /nfs/dbraw/zinc/74/56/27/520745627.db2.gz YWTNCMCIJFYJQL-YPMHNXCESA-N 2 2 371.384 2.779 20 5 FFBDLP CC(C)C[NH2+]C1(CO)CCN(c2[nH+]ccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000596253705 520995870 /nfs/dbraw/zinc/99/58/70/520995870.db2.gz GLMPKIHLORFELI-UHFFFAOYSA-N 2 2 358.442 2.720 20 5 FFBDLP O=C(CNc1ccc2c[nH+]ccc2c1[N+](=O)[O-])NCC[NH+]1CCCCCC1 ZINC000599079477 521019747 /nfs/dbraw/zinc/01/97/47/521019747.db2.gz GLCRENXVPOJKJU-UHFFFAOYSA-N 2 2 371.441 2.547 20 5 FFBDLP C[C@H](C[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)[N@@H+]1CCC[C@@H](C)C1 ZINC000602514454 521388307 /nfs/dbraw/zinc/38/83/07/521388307.db2.gz JOFTZWNYYFOLOD-HZPDHXFCSA-N 2 2 361.490 2.669 20 5 FFBDLP C[C@H](C[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)[N@H+]1CCC[C@@H](C)C1 ZINC000602514454 521388314 /nfs/dbraw/zinc/38/83/14/521388314.db2.gz JOFTZWNYYFOLOD-HZPDHXFCSA-N 2 2 361.490 2.669 20 5 FFBDLP Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@@H](c2[nH+]cc3n2CCCC3)C1 ZINC000602826205 521554414 /nfs/dbraw/zinc/55/44/14/521554414.db2.gz MYGLKDFFLBHNMZ-OAHLLOKOSA-N 2 2 358.446 2.512 20 5 FFBDLP Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H](c2[nH+]cc3n2CCCC3)C1 ZINC000602826205 521554423 /nfs/dbraw/zinc/55/44/23/521554423.db2.gz MYGLKDFFLBHNMZ-OAHLLOKOSA-N 2 2 358.446 2.512 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH2+]C2CC[NH+](C[C@@H]3CCCO3)CC2)cc1Cl ZINC000783628805 738821158 /nfs/dbraw/zinc/82/11/58/738821158.db2.gz MFNFCUWWQRNSSE-HNNXBMFYSA-N 2 2 353.850 2.981 20 5 FFBDLP C[N@@H+]1CCC[C@@H]2C[NH+](Cn3cc(-c4ccc([N+](=O)[O-])cc4)cn3)CC[C@H]21 ZINC000765102803 984962942 /nfs/dbraw/zinc/96/29/42/984962942.db2.gz ARQINOGTULVIOJ-VQIMIIECSA-N 2 2 355.442 2.832 20 5 FFBDLP C[N@H+]1CCC[C@@H]2C[NH+](Cn3cc(-c4ccc([N+](=O)[O-])cc4)cn3)CC[C@H]21 ZINC000765102803 984962947 /nfs/dbraw/zinc/96/29/47/984962947.db2.gz ARQINOGTULVIOJ-VQIMIIECSA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CCC[C@@H]2C[N@H+](Cn3cc(-c4ccc([N+](=O)[O-])cc4)cn3)CC[C@H]21 ZINC000765102803 984962953 /nfs/dbraw/zinc/96/29/53/984962953.db2.gz ARQINOGTULVIOJ-VQIMIIECSA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CCC[C@@H]2C[N@@H+](Cn3cc(-c4ccc([N+](=O)[O-])cc4)cn3)CC[C@H]21 ZINC000765102803 984962961 /nfs/dbraw/zinc/96/29/61/984962961.db2.gz ARQINOGTULVIOJ-VQIMIIECSA-N 2 2 355.442 2.832 20 5 FFBDLP O=C(O[C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000810844091 994951425 /nfs/dbraw/zinc/95/14/25/994951425.db2.gz ZZGGYGNEJDKQIM-HUUCEWRRSA-N 2 2 356.382 2.564 20 5 FFBDLP O=C(O[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000810844091 994951435 /nfs/dbraw/zinc/95/14/35/994951435.db2.gz ZZGGYGNEJDKQIM-HUUCEWRRSA-N 2 2 356.382 2.564 20 5 FFBDLP C[N@@H+]1CCC[C@@H]1C[NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173011870 1012182364 /nfs/dbraw/zinc/18/23/64/1012182364.db2.gz MQLMVFSFBJDBPD-CYBMUJFWSA-N 2 2 354.401 2.526 20 5 FFBDLP C[N@H+]1CCC[C@@H]1C[NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173011870 1012182376 /nfs/dbraw/zinc/18/23/76/1012182376.db2.gz MQLMVFSFBJDBPD-CYBMUJFWSA-N 2 2 354.401 2.526 20 5 FFBDLP COc1cc([C@@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCCO3)CC2)cc([N+](=O)[O-])c1 ZINC000903096358 1020674301 /nfs/dbraw/zinc/67/43/01/1020674301.db2.gz BSSKFJZWTWLEJT-KDOFPFPSSA-N 2 2 363.458 2.897 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H]2C[NH+](Cc3ccccn3)C[C@H]2C1 ZINC001254560957 1040799360 /nfs/dbraw/zinc/79/93/60/1040799360.db2.gz IOPSDROTWBMVTC-QRQLOZEOSA-N 2 2 366.465 2.985 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H]2C[NH+](Cc3ccccn3)C[C@H]2C1 ZINC001254560957 1040799369 /nfs/dbraw/zinc/79/93/69/1040799369.db2.gz IOPSDROTWBMVTC-QRQLOZEOSA-N 2 2 366.465 2.985 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH+]1C[C@H]2C[N@@H+](Cc3ccccn3)C[C@H]2C1 ZINC001254560957 1040799384 /nfs/dbraw/zinc/79/93/84/1040799384.db2.gz IOPSDROTWBMVTC-QRQLOZEOSA-N 2 2 366.465 2.985 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH+]1C[C@H]2C[N@H+](Cc3ccccn3)C[C@H]2C1 ZINC001254560957 1040799401 /nfs/dbraw/zinc/79/94/01/1040799401.db2.gz IOPSDROTWBMVTC-QRQLOZEOSA-N 2 2 366.465 2.985 20 5 FFBDLP CCC[N@@H+]1CC[C@H]([NH2+]CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001462458519 1061631710 /nfs/dbraw/zinc/63/17/10/1061631710.db2.gz OVCWOEKRZGEDQR-FQEVSTJZSA-N 3 2 374.529 2.923 20 5 FFBDLP CCC[N@H+]1CC[C@H]([NH2+]CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001462458519 1061631718 /nfs/dbraw/zinc/63/17/18/1061631718.db2.gz OVCWOEKRZGEDQR-FQEVSTJZSA-N 3 2 374.529 2.923 20 5 FFBDLP CC1CC[NH+](CC[C@H]2CCC[N@@H+]2Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1 ZINC001560068546 1076220662 /nfs/dbraw/zinc/22/06/62/1076220662.db2.gz DPGLREXOJDDFJS-GOSISDBHSA-N 2 2 374.485 2.780 20 5 FFBDLP CC1CC[NH+](CC[C@H]2CCC[N@H+]2Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1 ZINC001560068546 1076220665 /nfs/dbraw/zinc/22/06/65/1076220665.db2.gz DPGLREXOJDDFJS-GOSISDBHSA-N 2 2 374.485 2.780 20 5 FFBDLP CCN1CC[NH+]([C@H]2CCN(c3cc(C)[nH+]c4ccc([N+](=O)[O-])cc43)C2)CC1 ZINC000302155537 258091638 /nfs/dbraw/zinc/09/16/38/258091638.db2.gz IRNZJNMKINTRAI-KRWDZBQOSA-N 2 2 369.469 2.668 20 5 FFBDLP COc1cc(F)c([N+](=O)[O-])c(NC2CC[NH+](C3CC[NH+](C)CC3)CC2)c1 ZINC000301429811 258049398 /nfs/dbraw/zinc/04/93/98/258049398.db2.gz FVPFXJVERPHQRS-UHFFFAOYSA-N 2 2 366.437 2.713 20 5 FFBDLP C[C@@H]1CCCC[N@@H+]1CCCNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000052842944 506261088 /nfs/dbraw/zinc/26/10/88/506261088.db2.gz KWHPXEZZFFAJTD-OAHLLOKOSA-N 2 2 371.441 2.775 20 5 FFBDLP C[C@@H]1CCCC[N@H+]1CCCNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000052842944 506261089 /nfs/dbraw/zinc/26/10/89/506261089.db2.gz KWHPXEZZFFAJTD-OAHLLOKOSA-N 2 2 371.441 2.775 20 5 FFBDLP C[C@H]1C[NH+](CC2CC[NH+](Cc3cc(O)ccc3[N+](=O)[O-])CC2)C[C@H](C)O1 ZINC000092586997 508084700 /nfs/dbraw/zinc/08/47/00/508084700.db2.gz KNKSHHSNXHKHEO-GJZGRUSLSA-N 2 2 363.458 2.622 20 5 FFBDLP C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000134929276 508576148 /nfs/dbraw/zinc/57/61/48/508576148.db2.gz NJYNWJUTOZPPFZ-QMTMVMCOSA-N 2 2 372.469 2.871 20 5 FFBDLP C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000134929276 508576153 /nfs/dbraw/zinc/57/61/53/508576153.db2.gz NJYNWJUTOZPPFZ-QMTMVMCOSA-N 2 2 372.469 2.871 20 5 FFBDLP C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000134929276 508576156 /nfs/dbraw/zinc/57/61/56/508576156.db2.gz NJYNWJUTOZPPFZ-QMTMVMCOSA-N 2 2 372.469 2.871 20 5 FFBDLP C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000134929276 508576160 /nfs/dbraw/zinc/57/61/60/508576160.db2.gz NJYNWJUTOZPPFZ-QMTMVMCOSA-N 2 2 372.469 2.871 20 5 FFBDLP C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+](C)CCCn1cc[nH+]c1 ZINC000124382669 508823722 /nfs/dbraw/zinc/82/37/22/508823722.db2.gz TVZPMYLCKUCDQK-LBPRGKRZSA-N 2 2 365.821 2.794 20 5 FFBDLP C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)CCCn1cc[nH+]c1 ZINC000124382669 508823725 /nfs/dbraw/zinc/82/37/25/508823725.db2.gz TVZPMYLCKUCDQK-LBPRGKRZSA-N 2 2 365.821 2.794 20 5 FFBDLP CC(C)[NH+]1CCC(NC(=O)C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)CC1 ZINC000130981591 508872858 /nfs/dbraw/zinc/87/28/58/508872858.db2.gz LACZQDJBEXGXRP-UHFFFAOYSA-N 2 2 374.485 2.548 20 5 FFBDLP CC(C)[NH+]1CCC(NC(=O)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)CC1 ZINC000130981591 508872861 /nfs/dbraw/zinc/87/28/61/508872861.db2.gz LACZQDJBEXGXRP-UHFFFAOYSA-N 2 2 374.485 2.548 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CC[C@H](Oc4cc[nH+]cc4)C3)n2)c1 ZINC000156336681 509161580 /nfs/dbraw/zinc/16/15/80/509161580.db2.gz MDBYNDGRZBIGDQ-INIZCTEOSA-N 2 2 367.365 2.693 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CC[C@H](Oc4cc[nH+]cc4)C3)n2)c1 ZINC000156336681 509161584 /nfs/dbraw/zinc/16/15/84/509161584.db2.gz MDBYNDGRZBIGDQ-INIZCTEOSA-N 2 2 367.365 2.693 20 5 FFBDLP CCCN(CCC[NH+](C)C)C(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000189274801 509495514 /nfs/dbraw/zinc/49/55/14/509495514.db2.gz HQCQUGVQMURCPZ-UHFFFAOYSA-N 2 2 359.430 2.584 20 5 FFBDLP O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c([N+](=O)[O-])c1 ZINC000249035607 509578439 /nfs/dbraw/zinc/57/84/39/509578439.db2.gz SNHQXWXIHBPPGF-GUYCJALGSA-N 2 2 360.414 2.952 20 5 FFBDLP O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c([N+](=O)[O-])c1 ZINC000249035607 509578444 /nfs/dbraw/zinc/57/84/44/509578444.db2.gz SNHQXWXIHBPPGF-GUYCJALGSA-N 2 2 360.414 2.952 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c([N+](=O)[O-])c1 ZINC000249035607 509578452 /nfs/dbraw/zinc/57/84/52/509578452.db2.gz SNHQXWXIHBPPGF-GUYCJALGSA-N 2 2 360.414 2.952 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c([N+](=O)[O-])c1 ZINC000249035607 509578460 /nfs/dbraw/zinc/57/84/60/509578460.db2.gz SNHQXWXIHBPPGF-GUYCJALGSA-N 2 2 360.414 2.952 20 5 FFBDLP C[C@H]1CN(c2ccc([N+](=O)[O-])c3ncccc23)CC[N@@H+]1C1CC[NH+](C)CC1 ZINC000413219061 513527401 /nfs/dbraw/zinc/52/74/01/513527401.db2.gz KSAYUFNKJSEDKH-HNNXBMFYSA-N 2 2 369.469 2.748 20 5 FFBDLP C[C@H]1CN(c2ccc([N+](=O)[O-])c3ncccc23)CC[N@H+]1C1CC[NH+](C)CC1 ZINC000413219061 513527404 /nfs/dbraw/zinc/52/74/04/513527404.db2.gz KSAYUFNKJSEDKH-HNNXBMFYSA-N 2 2 369.469 2.748 20 5 FFBDLP Cn1cc(C[NH+]2CCC([NH2+]CC3CC3)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000435372848 513567443 /nfs/dbraw/zinc/56/74/43/513567443.db2.gz LDYBGDOIVISMNT-UHFFFAOYSA-N 2 2 369.469 2.959 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CCOCC2)cc1NCCC[NH+]1CCCCC1 ZINC000447803255 513575663 /nfs/dbraw/zinc/57/56/63/513575663.db2.gz RKFSZOMKDXVZBU-UHFFFAOYSA-N 2 2 362.474 2.715 20 5 FFBDLP CC[NH+](CC)C[C@@H](C)Nc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000447807803 513576421 /nfs/dbraw/zinc/57/64/21/513576421.db2.gz UFXZYGJLLQQEGK-OAHLLOKOSA-N 2 2 350.463 2.569 20 5 FFBDLP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2OC)[C@H](C)C1 ZINC000430201042 513586432 /nfs/dbraw/zinc/58/64/32/513586432.db2.gz BWBCISSAYLLLNN-CRAIPNDOSA-N 2 2 365.474 2.830 20 5 FFBDLP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2OC)[C@H](C)C1 ZINC000430201042 513586437 /nfs/dbraw/zinc/58/64/37/513586437.db2.gz BWBCISSAYLLLNN-CRAIPNDOSA-N 2 2 365.474 2.830 20 5 FFBDLP Cn1cnc([N+](=O)[O-])c1C[N@H+](Cc1ccsc1)[C@@H]1CC12CC[NH2+]CC2 ZINC000435698810 513662637 /nfs/dbraw/zinc/66/26/37/513662637.db2.gz XWVLGQVAYFEQOV-OAHLLOKOSA-N 2 2 361.471 2.534 20 5 FFBDLP Cn1cnc([N+](=O)[O-])c1C[N@@H+](Cc1ccsc1)[C@@H]1CC12CC[NH2+]CC2 ZINC000435698810 513662644 /nfs/dbraw/zinc/66/26/44/513662644.db2.gz XWVLGQVAYFEQOV-OAHLLOKOSA-N 2 2 361.471 2.534 20 5 FFBDLP CCCN(CCC[NH+](C)C)C(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000451301174 513663079 /nfs/dbraw/zinc/66/30/79/513663079.db2.gz NBSGXGHCQJCNMH-UHFFFAOYSA-N 2 2 359.430 2.584 20 5 FFBDLP C[C@@H]1CCC[C@H](C)[N@H+]1CCNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000448934252 513978432 /nfs/dbraw/zinc/97/84/32/513978432.db2.gz UPKHYVPYDRELBY-GASCZTMLSA-N 2 2 371.441 2.773 20 5 FFBDLP C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000448934252 513978434 /nfs/dbraw/zinc/97/84/34/513978434.db2.gz UPKHYVPYDRELBY-GASCZTMLSA-N 2 2 371.441 2.773 20 5 FFBDLP O=C(C[NH+]1CCC([C@H]2CCC[NH2+]2)CC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000420333672 514098512 /nfs/dbraw/zinc/09/85/12/514098512.db2.gz IATXHQDEBLKSID-OAHLLOKOSA-N 2 2 366.849 2.651 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCCC[N@H+]1CCO ZINC000449394589 514192324 /nfs/dbraw/zinc/19/23/24/514192324.db2.gz NXYYHNYBBXEHBK-WDSOQIARSA-N 2 2 361.486 2.742 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCCC[N@@H+]1CCO ZINC000449394589 514192326 /nfs/dbraw/zinc/19/23/26/514192326.db2.gz NXYYHNYBBXEHBK-WDSOQIARSA-N 2 2 361.486 2.742 20 5 FFBDLP Cc1ccc(Sc2ccc(C[N@H+](C)C[C@H](O)C[NH3+])cc2[N+](=O)[O-])cc1 ZINC000415063597 514422860 /nfs/dbraw/zinc/42/28/60/514422860.db2.gz ANTCSCWKLPYNOT-OAHLLOKOSA-N 2 2 361.467 2.806 20 5 FFBDLP Cc1ccc(Sc2ccc(C[N@@H+](C)C[C@H](O)C[NH3+])cc2[N+](=O)[O-])cc1 ZINC000415063597 514422869 /nfs/dbraw/zinc/42/28/69/514422869.db2.gz ANTCSCWKLPYNOT-OAHLLOKOSA-N 2 2 361.467 2.806 20 5 FFBDLP C[C@H]1C[N@H+](Cc2c(Cl)cccc2[N+](=O)[O-])CC[C@H]1N1CC[NH+](C)CC1 ZINC000491978286 515487435 /nfs/dbraw/zinc/48/74/35/515487435.db2.gz JHLAQOUXOHNYKB-WMLDXEAASA-N 2 2 366.893 2.706 20 5 FFBDLP C[C@H]1C[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])CC[C@H]1N1CC[NH+](C)CC1 ZINC000491978286 515487445 /nfs/dbraw/zinc/48/74/45/515487445.db2.gz JHLAQOUXOHNYKB-WMLDXEAASA-N 2 2 366.893 2.706 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@H](C)[C@H](n3cc[nH+]c3)C2)c1 ZINC000589505954 519019787 /nfs/dbraw/zinc/01/97/87/519019787.db2.gz RXBUTUCJHSEMOL-SUMWQHHRSA-N 2 2 358.398 2.661 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](C)[C@H](n3cc[nH+]c3)C2)c1 ZINC000589505954 519019792 /nfs/dbraw/zinc/01/97/92/519019792.db2.gz RXBUTUCJHSEMOL-SUMWQHHRSA-N 2 2 358.398 2.661 20 5 FFBDLP Cc1ccc(NC(=O)[C@@H](c2ccccc2)[N@H+](C)CCC[NH3+])c([N+](=O)[O-])c1 ZINC000592473845 520402566 /nfs/dbraw/zinc/40/25/66/520402566.db2.gz QUWOIYFGWTXRAL-GOSISDBHSA-N 2 2 356.426 2.864 20 5 FFBDLP Cc1ccc(NC(=O)[C@@H](c2ccccc2)[N@@H+](C)CCC[NH3+])c([N+](=O)[O-])c1 ZINC000592473845 520402572 /nfs/dbraw/zinc/40/25/72/520402572.db2.gz QUWOIYFGWTXRAL-GOSISDBHSA-N 2 2 356.426 2.864 20 5 FFBDLP COc1cc(C[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)c([N+](=O)[O-])cc1OC ZINC000596058389 520885445 /nfs/dbraw/zinc/88/54/45/520885445.db2.gz GPVVDZBDDLLWGF-HNNXBMFYSA-N 2 2 363.458 2.824 20 5 FFBDLP COc1cc(C[NH2+]C[C@@H]2CCC[N@@H+](CC3CC3)C2)c([N+](=O)[O-])cc1OC ZINC000596058389 520885449 /nfs/dbraw/zinc/88/54/49/520885449.db2.gz GPVVDZBDDLLWGF-HNNXBMFYSA-N 2 2 363.458 2.824 20 5 FFBDLP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCN([C@H]2CCC[N@@H+](C)C2)CC1 ZINC000615835651 521551405 /nfs/dbraw/zinc/55/14/05/521551405.db2.gz XVAUGACNKLJICN-NXNYUAIASA-N 2 2 358.486 2.710 20 5 FFBDLP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCN([C@H]2CCC[N@H+](C)C2)CC1 ZINC000615835651 521551415 /nfs/dbraw/zinc/55/14/15/521551415.db2.gz XVAUGACNKLJICN-NXNYUAIASA-N 2 2 358.486 2.710 20 5 FFBDLP CN(c1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CC[N@@H+](C2CC[NH+](C)CC2)C1 ZINC000615942194 521583966 /nfs/dbraw/zinc/58/39/66/521583966.db2.gz FOPLJHPTFOYUKH-HNNXBMFYSA-N 2 2 352.866 2.853 20 5 FFBDLP CN(c1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CC[NH+](C)CC2)C1 ZINC000615942194 521583972 /nfs/dbraw/zinc/58/39/72/521583972.db2.gz FOPLJHPTFOYUKH-HNNXBMFYSA-N 2 2 352.866 2.853 20 5 FFBDLP C[NH+](C)[C@]1(C[NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CCSC1 ZINC000766439070 737229796 /nfs/dbraw/zinc/22/97/96/737229796.db2.gz MXJDUMMZQXKXBN-SFHVURJKSA-N 2 2 364.515 2.591 20 5 FFBDLP C[C@@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)[C@H]1CC[NH3+] ZINC000846226686 748434128 /nfs/dbraw/zinc/43/41/28/748434128.db2.gz TWFARLKASMGXEZ-RISCZKNCSA-N 2 2 354.838 2.636 20 5 FFBDLP C[C@@H]1CCC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)[C@H]1CC[NH3+] ZINC000846226686 748434130 /nfs/dbraw/zinc/43/41/30/748434130.db2.gz TWFARLKASMGXEZ-RISCZKNCSA-N 2 2 354.838 2.636 20 5 FFBDLP CC(C)(C)[N@@H+]1CC[C@H]1COC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000845727350 998639207 /nfs/dbraw/zinc/63/92/07/998639207.db2.gz BJMWGHRZLSVBPG-AWEZNQCLSA-N 2 2 358.398 2.810 20 5 FFBDLP CC(C)(C)[N@H+]1CC[C@H]1COC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000845727350 998639211 /nfs/dbraw/zinc/63/92/11/998639211.db2.gz BJMWGHRZLSVBPG-AWEZNQCLSA-N 2 2 358.398 2.810 20 5 FFBDLP C[C@]12C[NH+](CCn3ccc([N+](=O)[O-])n3)C[C@]1(C)C[NH+](Cc1ccccc1)C2 ZINC001196962962 1004025669 /nfs/dbraw/zinc/02/56/69/1004025669.db2.gz WCDNDQWHMAMDPH-WOJBJXKFSA-N 2 2 369.469 2.635 20 5 FFBDLP C[C@@]12C[NH+](CCn3ccc([N+](=O)[O-])n3)C[C@@]1(C)C[NH+](Cc1ccccc1)C2 ZINC001196962961 1004026043 /nfs/dbraw/zinc/02/60/43/1004026043.db2.gz WCDNDQWHMAMDPH-PMACEKPBSA-N 2 2 369.469 2.635 20 5 FFBDLP Cc1[nH]c(C2CC[NH+](CC(=O)N(C)c3ccc([N+](=O)[O-])cc3)CC2)[nH+]c1C ZINC000886664533 1008801841 /nfs/dbraw/zinc/80/18/41/1008801841.db2.gz PDLIESOFBXXGHW-UHFFFAOYSA-N 2 2 371.441 2.777 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@H](C)n2c(C)[nH+]c3c2CC[NH2+]CC3)c1F ZINC001173183059 1012325736 /nfs/dbraw/zinc/32/57/36/1012325736.db2.gz VYWFIZUYQODQNR-NSHDSACASA-N 2 2 362.405 2.739 20 5 FFBDLP O=[N+]([O-])c1cc(-c2ccc(-n3c[nH+]cc3C3CC[NH2+]CC3)nn2)ccc1F ZINC001155063036 1028563384 /nfs/dbraw/zinc/56/33/84/1028563384.db2.gz KQFGWGYLPUVIHW-UHFFFAOYSA-N 2 2 368.372 2.844 20 5 FFBDLP Cc1cccc(N2CCN(c3cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn3)CC2)[nH+]1 ZINC001163666895 1029016698 /nfs/dbraw/zinc/01/66/98/1029016698.db2.gz YCDYFKZRTPETMA-BQYQJAHWSA-N 2 2 368.441 2.552 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH+]1C[C@@H]2C[NH+](Cc3ccccn3)C[C@H]2C1 ZINC001254560956 1040797488 /nfs/dbraw/zinc/79/74/88/1040797488.db2.gz IOPSDROTWBMVTC-NEWSRXKRSA-N 2 2 366.465 2.985 20 5 FFBDLP Cc1cc(N2CC[NH+]([C@@H](C)Cc3ccccc3[N+](=O)[O-])CC2)nc(C)[nH+]1 ZINC001254562133 1040798716 /nfs/dbraw/zinc/79/87/16/1040798716.db2.gz JUNFOFRCOHXTJF-HNNXBMFYSA-N 2 2 355.442 2.755 20 5 FFBDLP Cn1ccnc1[C@H]([NH2+]CCCNc1cccc[nH+]1)c1ccc([N+](=O)[O-])cc1 ZINC000272573405 252070700 /nfs/dbraw/zinc/07/07/00/252070700.db2.gz WJHXRMVXFWLKAY-GOSISDBHSA-N 2 2 366.425 2.905 20 5 FFBDLP O=C(CC[NH+]1CCC([NH+]2CCCCC2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000063516048 507740151 /nfs/dbraw/zinc/74/01/51/507740151.db2.gz NAMQHACHZYJBIB-UHFFFAOYSA-N 2 2 360.458 2.874 20 5 FFBDLP C[N@H+]1[C@@H]2CCC[C@H]1CC(NC(=O)c1ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c1)C2 ZINC000080714544 508097049 /nfs/dbraw/zinc/09/70/49/508097049.db2.gz DXXYOXIUXSTPLN-MQVJKMGUSA-N 2 2 369.425 2.526 20 5 FFBDLP C[N@@H+]1[C@@H]2CCC[C@H]1CC(NC(=O)c1ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c1)C2 ZINC000080714544 508097051 /nfs/dbraw/zinc/09/70/51/508097051.db2.gz DXXYOXIUXSTPLN-MQVJKMGUSA-N 2 2 369.425 2.526 20 5 FFBDLP C[C@@H](CNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](C)C1 ZINC000148595939 508864578 /nfs/dbraw/zinc/86/45/78/508864578.db2.gz RDYRDTDQBLKMNI-CABCVRRESA-N 2 2 371.441 2.631 20 5 FFBDLP C[C@@H](CNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](C)C1 ZINC000148595939 508864584 /nfs/dbraw/zinc/86/45/84/508864584.db2.gz RDYRDTDQBLKMNI-CABCVRRESA-N 2 2 371.441 2.631 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CCCO2)cc1 ZINC000192358125 509481585 /nfs/dbraw/zinc/48/15/85/509481585.db2.gz UXUDPMMGENUZMD-FQEVSTJZSA-N 2 2 355.438 2.976 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH2+]C[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)cc1 ZINC000192358125 509481591 /nfs/dbraw/zinc/48/15/91/509481591.db2.gz UXUDPMMGENUZMD-FQEVSTJZSA-N 2 2 355.438 2.976 20 5 FFBDLP C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261696685 510030583 /nfs/dbraw/zinc/03/05/83/510030583.db2.gz JKWNSJLAHWEFAO-GMBSWORKSA-N 2 2 368.437 2.596 20 5 FFBDLP C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261696685 510030590 /nfs/dbraw/zinc/03/05/90/510030590.db2.gz JKWNSJLAHWEFAO-GMBSWORKSA-N 2 2 368.437 2.596 20 5 FFBDLP CC[NH+](CC)CCCCNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000171980138 510483907 /nfs/dbraw/zinc/48/39/07/510483907.db2.gz VHGIRNIZVFGGHL-UHFFFAOYSA-N 2 2 359.430 2.632 20 5 FFBDLP C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246812570 510688435 /nfs/dbraw/zinc/68/84/35/510688435.db2.gz NJYNWJUTOZPPFZ-VCBZYWHSSA-N 2 2 372.469 2.871 20 5 FFBDLP C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246812570 510688445 /nfs/dbraw/zinc/68/84/45/510688445.db2.gz NJYNWJUTOZPPFZ-VCBZYWHSSA-N 2 2 372.469 2.871 20 5 FFBDLP C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246812570 510688451 /nfs/dbraw/zinc/68/84/51/510688451.db2.gz NJYNWJUTOZPPFZ-VCBZYWHSSA-N 2 2 372.469 2.871 20 5 FFBDLP C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246812570 510688458 /nfs/dbraw/zinc/68/84/58/510688458.db2.gz NJYNWJUTOZPPFZ-VCBZYWHSSA-N 2 2 372.469 2.871 20 5 FFBDLP Cn1c[nH+]cc1CC[N@@H+]1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000297787688 511069533 /nfs/dbraw/zinc/06/95/33/511069533.db2.gz WPXFYTCRDLTLDQ-UHFFFAOYSA-N 2 2 365.231 2.692 20 5 FFBDLP Cn1c[nH+]cc1CC[N@H+]1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000297787688 511069537 /nfs/dbraw/zinc/06/95/37/511069537.db2.gz WPXFYTCRDLTLDQ-UHFFFAOYSA-N 2 2 365.231 2.692 20 5 FFBDLP Cc1cn2c([nH+]1)[C@H](C[NH2+][C@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1)CCC2 ZINC000370682474 513050812 /nfs/dbraw/zinc/05/08/12/513050812.db2.gz NYULXZCHNKKASJ-HIFRSBDPSA-N 2 2 371.441 2.984 20 5 FFBDLP COc1cc[nH+]c(N2CCN(c3[nH+]ccc4ccc([N+](=O)[O-])cc43)CC2)c1 ZINC000413121325 513461010 /nfs/dbraw/zinc/46/10/10/513461010.db2.gz GBYLXAAIWWPXON-UHFFFAOYSA-N 2 2 365.393 2.873 20 5 FFBDLP COc1c[nH+]ccc1N1CCN(c2[nH+]ccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413269565 513560172 /nfs/dbraw/zinc/56/01/72/513560172.db2.gz PEYVDRFFQVTAHT-UHFFFAOYSA-N 2 2 365.393 2.873 20 5 FFBDLP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2OC)[C@H](C)C1 ZINC000430201044 513587198 /nfs/dbraw/zinc/58/71/98/513587198.db2.gz BWBCISSAYLLLNN-QAPCUYQASA-N 2 2 365.474 2.830 20 5 FFBDLP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2OC)[C@H](C)C1 ZINC000430201044 513587204 /nfs/dbraw/zinc/58/72/04/513587204.db2.gz BWBCISSAYLLLNN-QAPCUYQASA-N 2 2 365.474 2.830 20 5 FFBDLP C[NH2+]C[C@H]1CCC[N@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])C1 ZINC000430622104 513704784 /nfs/dbraw/zinc/70/47/84/513704784.db2.gz FCELIFRKPPEFPA-LLVKDONJSA-N 2 2 359.373 2.636 20 5 FFBDLP C[NH2+]C[C@H]1CCC[N@@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])C1 ZINC000430622104 513704794 /nfs/dbraw/zinc/70/47/94/513704794.db2.gz FCELIFRKPPEFPA-LLVKDONJSA-N 2 2 359.373 2.636 20 5 FFBDLP CCCC[NH+]1CCC(NC(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)CC1 ZINC000448947284 513985479 /nfs/dbraw/zinc/98/54/79/513985479.db2.gz WBLUUOSEJCOLKT-UHFFFAOYSA-N 2 2 371.441 2.775 20 5 FFBDLP CCCC[N@H+](C)C[C@H](C)NC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000451808470 513994118 /nfs/dbraw/zinc/99/41/18/513994118.db2.gz FXUVFJBKVYFGHC-AWEZNQCLSA-N 2 2 359.430 2.631 20 5 FFBDLP CCCC[N@@H+](C)C[C@H](C)NC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000451808470 513994122 /nfs/dbraw/zinc/99/41/22/513994122.db2.gz FXUVFJBKVYFGHC-AWEZNQCLSA-N 2 2 359.430 2.631 20 5 FFBDLP C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1C[NH2+]C[C@H]1c1ccccc1 ZINC000423529178 514162592 /nfs/dbraw/zinc/16/25/92/514162592.db2.gz OCLYDKZJZPRYRQ-MDASCCDHSA-N 2 2 368.437 2.657 20 5 FFBDLP CN(CC[C@@H]1CCCC[N@@H+]1C)C(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000449963539 514443439 /nfs/dbraw/zinc/44/34/39/514443439.db2.gz AOULBHQHLBLTQM-INIZCTEOSA-N 2 2 371.441 2.727 20 5 FFBDLP CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000449963539 514443445 /nfs/dbraw/zinc/44/34/45/514443445.db2.gz AOULBHQHLBLTQM-INIZCTEOSA-N 2 2 371.441 2.727 20 5 FFBDLP Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000503077567 514909555 /nfs/dbraw/zinc/90/95/55/514909555.db2.gz ZZKGGFRVCDNWEX-BBRMVZONSA-N 2 2 357.414 2.621 20 5 FFBDLP Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000503077567 514909561 /nfs/dbraw/zinc/90/95/61/514909561.db2.gz ZZKGGFRVCDNWEX-BBRMVZONSA-N 2 2 357.414 2.621 20 5 FFBDLP CC[NH+](CC)CCO[C@@H]1CC[N@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000509671733 515283302 /nfs/dbraw/zinc/28/33/02/515283302.db2.gz GOMQMXMATQVBCP-CQSZACIVSA-N 2 2 357.401 2.806 20 5 FFBDLP CC[NH+](CC)CCO[C@@H]1CC[N@@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000509671733 515283309 /nfs/dbraw/zinc/28/33/09/515283309.db2.gz GOMQMXMATQVBCP-CQSZACIVSA-N 2 2 357.401 2.806 20 5 FFBDLP CC(C)[C@H](C[N@H+](C)Cc1ccccc1)[NH2+]CCn1cc([N+](=O)[O-])ccc1=O ZINC000472553977 515310672 /nfs/dbraw/zinc/31/06/72/515310672.db2.gz IUMNMFFLMZQHEM-IBGZPJMESA-N 2 2 372.469 2.503 20 5 FFBDLP CC(C)[C@H](C[N@@H+](C)Cc1ccccc1)[NH2+]CCn1cc([N+](=O)[O-])ccc1=O ZINC000472553977 515310684 /nfs/dbraw/zinc/31/06/84/515310684.db2.gz IUMNMFFLMZQHEM-IBGZPJMESA-N 2 2 372.469 2.503 20 5 FFBDLP Cn1cc[nH+]c1[C@H](NCC1([NH+](C)C)CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000514082495 516853367 /nfs/dbraw/zinc/85/33/67/516853367.db2.gz HCHDZDKLLGGQDG-QGZVFWFLSA-N 2 2 357.458 2.882 20 5 FFBDLP Cc1ccc([C@H](C[NH2+]C[C@H](O)COc2cccc([N+](=O)[O-])c2)[NH+](C)C)cc1 ZINC000584226834 518237376 /nfs/dbraw/zinc/23/73/76/518237376.db2.gz QSUZKNRITYLPQG-ICSRJNTNSA-N 2 2 373.453 2.535 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@@H](C)[C@H](n3cc[nH+]c3)C2)c1 ZINC000589505942 519020218 /nfs/dbraw/zinc/02/02/18/519020218.db2.gz RXBUTUCJHSEMOL-CXAGYDPISA-N 2 2 358.398 2.661 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](C)[C@H](n3cc[nH+]c3)C2)c1 ZINC000589505942 519020224 /nfs/dbraw/zinc/02/02/24/519020224.db2.gz RXBUTUCJHSEMOL-CXAGYDPISA-N 2 2 358.398 2.661 20 5 FFBDLP C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C[C@@H]1CCCC[N@@H+]1C1CC1 ZINC000580399539 519154881 /nfs/dbraw/zinc/15/48/81/519154881.db2.gz INQRCXYUQMKSRB-KDOFPFPSSA-N 2 2 360.458 2.918 20 5 FFBDLP C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C[C@@H]1CCCC[N@H+]1C1CC1 ZINC000580399539 519154891 /nfs/dbraw/zinc/15/48/91/519154891.db2.gz INQRCXYUQMKSRB-KDOFPFPSSA-N 2 2 360.458 2.918 20 5 FFBDLP C[NH+]1CCC2(CC1)C[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)CCO2 ZINC000592185269 520252827 /nfs/dbraw/zinc/25/28/27/520252827.db2.gz WPKIWQNJPXCZGF-UHFFFAOYSA-N 2 2 373.375 2.910 20 5 FFBDLP C[NH+]1CCC2(CC1)C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)CCO2 ZINC000592185269 520252831 /nfs/dbraw/zinc/25/28/31/520252831.db2.gz WPKIWQNJPXCZGF-UHFFFAOYSA-N 2 2 373.375 2.910 20 5 FFBDLP Cc1cccc2[nH+]c(CC[NH2+]Cc3cc4c(cc3[N+](=O)[O-])OCCO4)cn21 ZINC000592378986 520359422 /nfs/dbraw/zinc/35/94/22/520359422.db2.gz IJJDGQRLEVXEOK-UHFFFAOYSA-N 2 2 368.393 2.654 20 5 FFBDLP C[C@H](CNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](C)C1 ZINC000604437762 520563243 /nfs/dbraw/zinc/56/32/43/520563243.db2.gz RDYRDTDQBLKMNI-HUUCEWRRSA-N 2 2 371.441 2.631 20 5 FFBDLP C[C@H](CNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](C)C1 ZINC000604437762 520563251 /nfs/dbraw/zinc/56/32/51/520563251.db2.gz RDYRDTDQBLKMNI-HUUCEWRRSA-N 2 2 371.441 2.631 20 5 FFBDLP O=[N+]([O-])c1ccc(N2CCC([NH2+][C@H]3CCC[N@@H+]4CCCC[C@@H]34)CC2)cn1 ZINC000602708500 521489533 /nfs/dbraw/zinc/48/95/33/521489533.db2.gz HWFLWNSMBLCCSA-ROUUACIJSA-N 2 2 359.474 2.565 20 5 FFBDLP O=[N+]([O-])c1ccc(N2CCC([NH2+][C@H]3CCC[N@H+]4CCCC[C@@H]34)CC2)cn1 ZINC000602708500 521489537 /nfs/dbraw/zinc/48/95/37/521489537.db2.gz HWFLWNSMBLCCSA-ROUUACIJSA-N 2 2 359.474 2.565 20 5 FFBDLP O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1 ZINC000893011524 734637547 /nfs/dbraw/zinc/63/75/47/734637547.db2.gz KRRHZGMXSREWGY-CYBMUJFWSA-N 2 2 353.850 2.839 20 5 FFBDLP COCCC[NH+]1CCC([NH2+][C@H](C)c2cc(OC)cc([N+](=O)[O-])c2)CC1 ZINC000903086861 736028466 /nfs/dbraw/zinc/02/84/66/736028466.db2.gz BBOYPAYDFDFNRK-CQSZACIVSA-N 2 2 351.447 2.755 20 5 FFBDLP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001168276120 981947699 /nfs/dbraw/zinc/94/76/99/981947699.db2.gz RCSLRGDHYUOWNZ-UHFFFAOYSA-N 2 2 356.386 2.672 20 5 FFBDLP Cc1[nH+]ccn1CCC[N@H+](C)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001168276120 981947706 /nfs/dbraw/zinc/94/77/06/981947706.db2.gz RCSLRGDHYUOWNZ-UHFFFAOYSA-N 2 2 356.386 2.672 20 5 FFBDLP COCC[N@H+](C1CC[NH+](C)CC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172912305 1012125856 /nfs/dbraw/zinc/12/58/56/1012125856.db2.gz ZAEBFWGDDLWPED-SFHVURJKSA-N 2 2 361.486 2.885 20 5 FFBDLP COCC[N@@H+](C1CC[NH+](C)CC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172912305 1012125868 /nfs/dbraw/zinc/12/58/68/1012125868.db2.gz ZAEBFWGDDLWPED-SFHVURJKSA-N 2 2 361.486 2.885 20 5 FFBDLP CC(C)[N@@H+]1CCOC[C@]2(CCC[NH+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1 ZINC001254592715 1040821400 /nfs/dbraw/zinc/82/14/00/1040821400.db2.gz GAANOPWFXBAFGJ-NHCUHLMSSA-N 2 2 373.497 2.885 20 5 FFBDLP CC(C)[N@H+]1CCOC[C@]2(CCC[NH+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1 ZINC001254592715 1040821406 /nfs/dbraw/zinc/82/14/06/1040821406.db2.gz GAANOPWFXBAFGJ-NHCUHLMSSA-N 2 2 373.497 2.885 20 5 FFBDLP CC(C)[NH+]1CCOC[C@]2(CCC[N@@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1 ZINC001254592715 1040821416 /nfs/dbraw/zinc/82/14/16/1040821416.db2.gz GAANOPWFXBAFGJ-NHCUHLMSSA-N 2 2 373.497 2.885 20 5 FFBDLP CC(C)[NH+]1CCOC[C@]2(CCC[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1 ZINC001254592715 1040821431 /nfs/dbraw/zinc/82/14/31/1040821431.db2.gz GAANOPWFXBAFGJ-NHCUHLMSSA-N 2 2 373.497 2.885 20 5 FFBDLP CC[N@H+]([C@@H]1CCOC1)C1CC[NH+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254603068 1040832573 /nfs/dbraw/zinc/83/25/73/1040832573.db2.gz LGPRKSNSKSWTQX-WOJBJXKFSA-N 2 2 359.470 2.637 20 5 FFBDLP CC[N@@H+]([C@@H]1CCOC1)C1CC[NH+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254603068 1040832584 /nfs/dbraw/zinc/83/25/84/1040832584.db2.gz LGPRKSNSKSWTQX-WOJBJXKFSA-N 2 2 359.470 2.637 20 5 FFBDLP O=[N+]([O-])c1ccccc1-c1cnn(C[NH+]2CCC(n3cc[nH+]c3)CC2)c1 ZINC000848478057 1060100670 /nfs/dbraw/zinc/10/06/70/1060100670.db2.gz BAAXDSPMFAJRAU-UHFFFAOYSA-N 2 2 352.398 2.949 20 5 FFBDLP C[C@@H]1C[N@H+](CCC[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)CCCO1 ZINC000277983714 256263469 /nfs/dbraw/zinc/26/34/69/256263469.db2.gz UBQFEEOIVGIAGN-CYBMUJFWSA-N 2 2 373.400 2.787 20 5 FFBDLP C[C@@H]1C[N@@H+](CCC[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)CCCO1 ZINC000277983714 256263470 /nfs/dbraw/zinc/26/34/70/256263470.db2.gz UBQFEEOIVGIAGN-CYBMUJFWSA-N 2 2 373.400 2.787 20 5 FFBDLP CC1CC[NH+](CCCNC(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)CC1 ZINC000033222160 506347790 /nfs/dbraw/zinc/34/77/90/506347790.db2.gz ZQPZPSBOJUNENC-UHFFFAOYSA-N 2 2 371.441 2.632 20 5 FFBDLP Cc1cc(NCCCC[NH+]2CCOCC2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000060859471 507582653 /nfs/dbraw/zinc/58/26/53/507582653.db2.gz XPHKBKTUZIUQRZ-UHFFFAOYSA-N 2 2 371.441 2.885 20 5 FFBDLP CCC[NH+]1CCC(N(C)C(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)CC1 ZINC000064310097 507789627 /nfs/dbraw/zinc/78/96/27/507789627.db2.gz ABCMZKJDAOUVGY-UHFFFAOYSA-N 2 2 371.441 2.727 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2nc(C[NH+]3CCN(c4cc[nH+]cc4)CC3)co2)cc1 ZINC000089909673 507882328 /nfs/dbraw/zinc/88/23/28/507882328.db2.gz PYNRQZNAIGZSRJ-UHFFFAOYSA-N 2 2 365.393 2.967 20 5 FFBDLP Cn1cc[nH+]c1C[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000090004486 507900266 /nfs/dbraw/zinc/90/02/66/507900266.db2.gz RQFILFRXCUVBEG-AWEZNQCLSA-N 2 2 372.425 2.650 20 5 FFBDLP Cn1cc[nH+]c1C[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000090004486 507900269 /nfs/dbraw/zinc/90/02/69/507900269.db2.gz RQFILFRXCUVBEG-AWEZNQCLSA-N 2 2 372.425 2.650 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000080959063 508117229 /nfs/dbraw/zinc/11/72/29/508117229.db2.gz MEHFGGDUIYGDQQ-CQSZACIVSA-N 2 2 357.414 2.835 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000080959063 508117232 /nfs/dbraw/zinc/11/72/32/508117232.db2.gz MEHFGGDUIYGDQQ-CQSZACIVSA-N 2 2 357.414 2.835 20 5 FFBDLP COc1cc(C[N@@H+]2CC[C@H](C[NH+](C)C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000113512329 508270060 /nfs/dbraw/zinc/27/00/60/508270060.db2.gz CKYVEUBTIOMVCF-LLVKDONJSA-N 2 2 359.373 2.588 20 5 FFBDLP COc1cc(C[N@H+]2CC[C@H](C[NH+](C)C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000113512329 508270063 /nfs/dbraw/zinc/27/00/63/508270063.db2.gz CKYVEUBTIOMVCF-LLVKDONJSA-N 2 2 359.373 2.588 20 5 FFBDLP COc1ccc(OCC[N@@H+]2CC[C@H](C)[C@@H](n3cc[nH+]c3)C2)c([N+](=O)[O-])c1 ZINC000122342604 508520199 /nfs/dbraw/zinc/52/01/99/508520199.db2.gz FLCKJRJFCIFRML-YOEHRIQHSA-N 2 2 360.414 2.762 20 5 FFBDLP COc1ccc(OCC[N@H+]2CC[C@H](C)[C@@H](n3cc[nH+]c3)C2)c([N+](=O)[O-])c1 ZINC000122342604 508520203 /nfs/dbraw/zinc/52/02/03/508520203.db2.gz FLCKJRJFCIFRML-YOEHRIQHSA-N 2 2 360.414 2.762 20 5 FFBDLP C[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H]1n1cc[nH+]c1 ZINC000136090477 508669243 /nfs/dbraw/zinc/66/92/43/508669243.db2.gz JXYLTASMCOKQSE-DYVFJYSZSA-N 2 2 358.398 2.741 20 5 FFBDLP C[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H]1n1cc[nH+]c1 ZINC000136090477 508669245 /nfs/dbraw/zinc/66/92/45/508669245.db2.gz JXYLTASMCOKQSE-DYVFJYSZSA-N 2 2 358.398 2.741 20 5 FFBDLP O=C(NCC[NH2+]C1CCCCCC1)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000159618437 508866877 /nfs/dbraw/zinc/86/68/77/508866877.db2.gz GPENMBYPDKFXHP-UHFFFAOYSA-N 2 2 371.441 2.823 20 5 FFBDLP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2c(F)cccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000249473471 509689054 /nfs/dbraw/zinc/68/90/54/509689054.db2.gz UWWDTJVYHQMCFH-YOEHRIQHSA-N 2 2 353.438 2.961 20 5 FFBDLP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2c(F)cccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000249473471 509689058 /nfs/dbraw/zinc/68/90/58/509689058.db2.gz UWWDTJVYHQMCFH-YOEHRIQHSA-N 2 2 353.438 2.961 20 5 FFBDLP COCC[N@H+](C)CCC[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000264992809 509812594 /nfs/dbraw/zinc/81/25/94/509812594.db2.gz XKWLXFQTTARCDW-UHFFFAOYSA-N 2 2 364.471 2.776 20 5 FFBDLP COCC[N@@H+](C)CCC[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000264992809 509812603 /nfs/dbraw/zinc/81/26/03/509812603.db2.gz XKWLXFQTTARCDW-UHFFFAOYSA-N 2 2 364.471 2.776 20 5 FFBDLP O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c2c(c1)COCO2 ZINC000173880897 509832072 /nfs/dbraw/zinc/83/20/72/509832072.db2.gz MDFJNWNVGXJXQG-HNNXBMFYSA-N 2 2 361.442 2.769 20 5 FFBDLP O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c2c(c1)COCO2 ZINC000173880897 509832077 /nfs/dbraw/zinc/83/20/77/509832077.db2.gz MDFJNWNVGXJXQG-HNNXBMFYSA-N 2 2 361.442 2.769 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[NH+]3CCC(c4[nH]cc[nH+]4)CC3)n2)c1 ZINC000265460334 510067058 /nfs/dbraw/zinc/06/70/58/510067058.db2.gz FGSYNBQPVBLGLO-UHFFFAOYSA-N 2 2 354.370 2.748 20 5 FFBDLP C[N@H+](Cc1cccc([N+](=O)[O-])c1)C[C@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC000188302651 510698190 /nfs/dbraw/zinc/69/81/90/510698190.db2.gz IDESMPKPADQVRQ-HXUWFJFHSA-N 2 2 355.438 2.664 20 5 FFBDLP C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C[C@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC000188302651 510698196 /nfs/dbraw/zinc/69/81/96/510698196.db2.gz IDESMPKPADQVRQ-HXUWFJFHSA-N 2 2 355.438 2.664 20 5 FFBDLP C[NH+](Cc1cccc([N+](=O)[O-])c1)C[C@]1(O)CC[N@H+](Cc2ccccc2)C1 ZINC000188302651 510698201 /nfs/dbraw/zinc/69/82/01/510698201.db2.gz IDESMPKPADQVRQ-HXUWFJFHSA-N 2 2 355.438 2.664 20 5 FFBDLP C[NH+](Cc1cccc([N+](=O)[O-])c1)C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000188302651 510698207 /nfs/dbraw/zinc/69/82/07/510698207.db2.gz IDESMPKPADQVRQ-HXUWFJFHSA-N 2 2 355.438 2.664 20 5 FFBDLP O=[N+]([O-])c1ccc2[nH]c(C[NH2+]C3CC[NH+](Cc4ccncc4)CC3)nc2c1 ZINC000365819502 511667576 /nfs/dbraw/zinc/66/75/76/511667576.db2.gz VKKRRGLXDDUTKQ-UHFFFAOYSA-N 2 2 366.425 2.620 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@@H+]2Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000374423168 512826780 /nfs/dbraw/zinc/82/67/80/512826780.db2.gz VFKLPNBCIIMKJM-KMFMINBZSA-N 2 2 353.850 2.932 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@H+]2Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000374423168 512826785 /nfs/dbraw/zinc/82/67/85/512826785.db2.gz VFKLPNBCIIMKJM-KMFMINBZSA-N 2 2 353.850 2.932 20 5 FFBDLP C[C@H]1CCCC[N@@H+]1CCNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000447812627 513578756 /nfs/dbraw/zinc/57/87/56/513578756.db2.gz NBGOKBQQBZPWAQ-INIZCTEOSA-N 2 2 362.474 2.713 20 5 FFBDLP C[C@H]1CCCC[N@H+]1CCNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000447812627 513578762 /nfs/dbraw/zinc/57/87/62/513578762.db2.gz NBGOKBQQBZPWAQ-INIZCTEOSA-N 2 2 362.474 2.713 20 5 FFBDLP CC(C)C[NH+]1CCC(NC(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)CC1 ZINC000448812755 513911353 /nfs/dbraw/zinc/91/13/53/513911353.db2.gz OUHXTVXLCPQJMD-UHFFFAOYSA-N 2 2 371.441 2.631 20 5 FFBDLP C[C@H](CNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)[NH+]1CCC(C)CC1 ZINC000448815074 513912178 /nfs/dbraw/zinc/91/21/78/513912178.db2.gz ZMYBGKPCHQFKFR-OAHLLOKOSA-N 2 2 371.441 2.631 20 5 FFBDLP O=C(N[C@@H]1CC[N@@H+](C2CCCC2)C1)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000448925123 513973108 /nfs/dbraw/zinc/97/31/08/513973108.db2.gz MCMSKMNNXXINOF-OAHLLOKOSA-N 2 2 369.425 2.527 20 5 FFBDLP O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000448925123 513973116 /nfs/dbraw/zinc/97/31/16/513973116.db2.gz MCMSKMNNXXINOF-OAHLLOKOSA-N 2 2 369.425 2.527 20 5 FFBDLP C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@H]1[NH2+]CCc2ccccc21 ZINC000423431314 514140732 /nfs/dbraw/zinc/14/07/32/514140732.db2.gz QJRMJGWVOOYDCS-IFXJQAMLSA-N 2 2 368.437 2.789 20 5 FFBDLP C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C[C@@H]1[NH2+]CCc2ccccc21 ZINC000414942081 514366993 /nfs/dbraw/zinc/36/69/93/514366993.db2.gz BGYNRQHGHMRWPQ-LIRRHRJNSA-N 2 2 368.437 2.789 20 5 FFBDLP COc1cc(C[N@@H+]2CC[C@@H](C)[C@H](C[NH3+])C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000415132388 514458470 /nfs/dbraw/zinc/45/84/70/514458470.db2.gz UCNCEBFSJDLQEB-DGCLKSJQSA-N 2 2 373.400 2.664 20 5 FFBDLP COc1cc(C[N@H+]2CC[C@@H](C)[C@H](C[NH3+])C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000415132388 514458475 /nfs/dbraw/zinc/45/84/75/514458475.db2.gz UCNCEBFSJDLQEB-DGCLKSJQSA-N 2 2 373.400 2.664 20 5 FFBDLP Cc1[nH+]ccn1CCC[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000559071537 517069258 /nfs/dbraw/zinc/06/92/58/517069258.db2.gz CZSRBZNNYCUAIT-QGZVFWFLSA-N 2 2 354.414 2.603 20 5 FFBDLP CS[C@@H]1CN(c2cc(C)[nH+]c(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H]1[NH+](C)C ZINC000533928442 517673237 /nfs/dbraw/zinc/67/32/37/517673237.db2.gz QQUMIOFKPNGYRY-JKSUJKDBSA-N 2 2 373.482 2.842 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000557331403 517960216 /nfs/dbraw/zinc/96/02/16/517960216.db2.gz WCSPHHGKIUKBIN-AEFFLSMTSA-N 2 2 360.458 2.838 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000557331403 517960226 /nfs/dbraw/zinc/96/02/26/517960226.db2.gz WCSPHHGKIUKBIN-AEFFLSMTSA-N 2 2 360.458 2.838 20 5 FFBDLP C[NH+]1CCC([NH+]2CCC(Nc3ncnc4cccc([N+](=O)[O-])c43)CC2)CC1 ZINC000543438375 518090303 /nfs/dbraw/zinc/09/03/03/518090303.db2.gz NRFXHGINZSHOIV-UHFFFAOYSA-N 2 2 370.457 2.509 20 5 FFBDLP Cc1ccc([C@H](C[NH2+]C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[NH+](C)C)cc1 ZINC000584226835 518237093 /nfs/dbraw/zinc/23/70/93/518237093.db2.gz QSUZKNRITYLPQG-QUCCMNQESA-N 2 2 373.453 2.535 20 5 FFBDLP C[NH+](Cc1ccccc1)C[C@H](O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000586773224 518636455 /nfs/dbraw/zinc/63/64/55/518636455.db2.gz JKPVVXOZEJHRPQ-LJQANCHMSA-N 2 2 357.454 2.562 20 5 FFBDLP C[NH+](Cc1ccccc1)C[C@H](O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000586773224 518636460 /nfs/dbraw/zinc/63/64/60/518636460.db2.gz JKPVVXOZEJHRPQ-LJQANCHMSA-N 2 2 357.454 2.562 20 5 FFBDLP C[NH+](CCc1ccccc1[N+](=O)[O-])C[C@@H](O)C[N@H+](C)Cc1ccccc1 ZINC000586773224 518636464 /nfs/dbraw/zinc/63/64/64/518636464.db2.gz JKPVVXOZEJHRPQ-LJQANCHMSA-N 2 2 357.454 2.562 20 5 FFBDLP C[NH+](CCc1ccccc1[N+](=O)[O-])C[C@@H](O)C[N@@H+](C)Cc1ccccc1 ZINC000586773224 518636468 /nfs/dbraw/zinc/63/64/68/518636468.db2.gz JKPVVXOZEJHRPQ-LJQANCHMSA-N 2 2 357.454 2.562 20 5 FFBDLP O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C[C@]1(O)CC[N@H+](Cc2ccccc2)C1 ZINC000579376486 518651878 /nfs/dbraw/zinc/65/18/78/518651878.db2.gz SPDCCAOKOPDTNM-TZIWHRDSSA-N 2 2 367.449 2.809 20 5 FFBDLP O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000579376486 518651881 /nfs/dbraw/zinc/65/18/81/518651881.db2.gz SPDCCAOKOPDTNM-TZIWHRDSSA-N 2 2 367.449 2.809 20 5 FFBDLP CCc1cc(NC[C@H]2C[C@@H]([NH+](C)C)C2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000594590817 520043144 /nfs/dbraw/zinc/04/31/44/520043144.db2.gz CPYXSXDUTBZIIC-XFHMXUHZSA-N 2 2 355.442 2.788 20 5 FFBDLP Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@@H+]2CC[C@@H](C[NH3+])C2)c([N+](=O)[O-])c1 ZINC000592471490 520403680 /nfs/dbraw/zinc/40/36/80/520403680.db2.gz MCKOUYMGZWODON-KXBFYZLASA-N 2 2 368.437 2.864 20 5 FFBDLP Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@H+]2CC[C@@H](C[NH3+])C2)c([N+](=O)[O-])c1 ZINC000592471490 520403688 /nfs/dbraw/zinc/40/36/88/520403688.db2.gz MCKOUYMGZWODON-KXBFYZLASA-N 2 2 368.437 2.864 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]3)C2)cccc1[N+](=O)[O-] ZINC000592479178 520407451 /nfs/dbraw/zinc/40/74/51/520407451.db2.gz UELHPKXRGZVSIC-YQQAZPJKSA-N 2 2 360.458 2.694 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@H]([C@H]3CCC[NH2+]3)C2)cccc1[N+](=O)[O-] ZINC000592479178 520407459 /nfs/dbraw/zinc/40/74/59/520407459.db2.gz UELHPKXRGZVSIC-YQQAZPJKSA-N 2 2 360.458 2.694 20 5 FFBDLP COc1cc(C[N@@H+]2CCC[C@@H]3C[NH2+]CC[C@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000601335856 520746182 /nfs/dbraw/zinc/74/61/82/520746182.db2.gz YWTNCMCIJFYJQL-DGCLKSJQSA-N 2 2 371.384 2.779 20 5 FFBDLP COc1cc(C[N@H+]2CCC[C@@H]3C[NH2+]CC[C@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000601335856 520746189 /nfs/dbraw/zinc/74/61/89/520746189.db2.gz YWTNCMCIJFYJQL-DGCLKSJQSA-N 2 2 371.384 2.779 20 5 FFBDLP CCC1([NH+](C)C)CCN(C(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)CC1 ZINC000601791664 520954840 /nfs/dbraw/zinc/95/48/40/520954840.db2.gz OKMIALOIEJGEIK-UHFFFAOYSA-N 2 2 371.441 2.727 20 5 FFBDLP Cn1cc[nH+]c1N1CCC(Nc2ccc3c[nH+]ccc3c2[N+](=O)[O-])CC1 ZINC000599081905 521021514 /nfs/dbraw/zinc/02/15/14/521021514.db2.gz VVMCTANLNNQBSJ-UHFFFAOYSA-N 2 2 352.398 2.957 20 5 FFBDLP Cc1cc(N2CCC[C@@H]3C[NH2+]CC[C@@H]32)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000601982651 521057085 /nfs/dbraw/zinc/05/70/85/521057085.db2.gz KKUDHJDXJXRKCQ-WBVHZDCISA-N 2 2 353.426 2.939 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CCOCC2)cc1NC[C@H]1CC[N@@H+]1C1CCCC1 ZINC000599164081 521066661 /nfs/dbraw/zinc/06/66/61/521066661.db2.gz JJINESOOVLGVFW-GOSISDBHSA-N 2 2 374.485 2.856 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CCOCC2)cc1NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000599164081 521066665 /nfs/dbraw/zinc/06/66/65/521066665.db2.gz JJINESOOVLGVFW-GOSISDBHSA-N 2 2 374.485 2.856 20 5 FFBDLP O=[N+]([O-])c1sc(C[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc1Br ZINC000602508696 521386614 /nfs/dbraw/zinc/38/66/14/521386614.db2.gz DNGNTHITBGZJCE-VIFPVBQESA-N 2 2 360.277 2.993 20 5 FFBDLP O=[N+]([O-])c1sc(C[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)cc1Br ZINC000602508696 521386621 /nfs/dbraw/zinc/38/66/21/521386621.db2.gz DNGNTHITBGZJCE-VIFPVBQESA-N 2 2 360.277 2.993 20 5 FFBDLP C[C@@H](C[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)[N@@H+]1CCC[C@@H](C)C1 ZINC000602514451 521387885 /nfs/dbraw/zinc/38/78/85/521387885.db2.gz JOFTZWNYYFOLOD-CVEARBPZSA-N 2 2 361.490 2.669 20 5 FFBDLP C[C@@H](C[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)[N@H+]1CCC[C@@H](C)C1 ZINC000602514451 521387894 /nfs/dbraw/zinc/38/78/94/521387894.db2.gz JOFTZWNYYFOLOD-CVEARBPZSA-N 2 2 361.490 2.669 20 5 FFBDLP O=[N+]([O-])c1ccc(N2CCC([NH2+]CCCCNc3cccc[nH+]3)CC2)cn1 ZINC000602536023 521400853 /nfs/dbraw/zinc/40/08/53/521400853.db2.gz VQFQLMBUBFSIRP-UHFFFAOYSA-N 2 2 370.457 2.836 20 5 FFBDLP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1[NH2+]Cc1cn(C)nc1[N+](=O)[O-] ZINC000602813412 521548299 /nfs/dbraw/zinc/54/82/99/521548299.db2.gz XKDCFXFFRSKBMC-GJZGRUSLSA-N 2 2 357.458 2.575 20 5 FFBDLP [NH3+]C[C@H]([NH2+]CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C1CCCCC1 ZINC000842476967 747613009 /nfs/dbraw/zinc/61/30/09/747613009.db2.gz YKJRLDRVCSHHOP-AWEZNQCLSA-N 2 2 354.838 2.684 20 5 FFBDLP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3c(Br)cccc3[N+](=O)[O-])C[C@H]21 ZINC000843059944 747758379 /nfs/dbraw/zinc/75/83/79/747758379.db2.gz VRLGGQCEAAFMFE-JTNHKYCSSA-N 2 2 354.248 2.917 20 5 FFBDLP [NH3+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3c(Br)cccc3[N+](=O)[O-])C[C@H]21 ZINC000843059944 747758386 /nfs/dbraw/zinc/75/83/86/747758386.db2.gz VRLGGQCEAAFMFE-JTNHKYCSSA-N 2 2 354.248 2.917 20 5 FFBDLP C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[NH+]1CCC([C@H](C)[NH3+])CC1 ZINC000843348374 747815319 /nfs/dbraw/zinc/81/53/19/747815319.db2.gz DWXAWPKTGQQVST-WDEREUQCSA-N 2 2 354.838 2.634 20 5 FFBDLP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1ccc(O)c(OC)c1[N+](=O)[O-] ZINC000894478464 965404881 /nfs/dbraw/zinc/40/48/81/965404881.db2.gz BCXIQEQAEUQJMW-UHFFFAOYSA-N 2 2 362.430 2.980 20 5 FFBDLP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1ccc(O)c(OC)c1[N+](=O)[O-] ZINC000894478464 965404892 /nfs/dbraw/zinc/40/48/92/965404892.db2.gz BCXIQEQAEUQJMW-UHFFFAOYSA-N 2 2 362.430 2.980 20 5 FFBDLP Cn1ncc2c1C[N@H+](CC1CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC1)C2 ZINC001183037630 1002129786 /nfs/dbraw/zinc/12/97/86/1002129786.db2.gz ZAXJBVAFYWENRC-UHFFFAOYSA-N 2 2 369.469 2.599 20 5 FFBDLP Cn1ncc2c1C[N@@H+](CC1CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC1)C2 ZINC001183037630 1002129793 /nfs/dbraw/zinc/12/97/93/1002129793.db2.gz ZAXJBVAFYWENRC-UHFFFAOYSA-N 2 2 369.469 2.599 20 5 FFBDLP CCCn1cc[nH+]c1CCC[N@H+](C)Cn1c(=O)oc2cccc([N+](=O)[O-])c21 ZINC000794645417 1010439040 /nfs/dbraw/zinc/43/90/40/1010439040.db2.gz MWSSQFMWEYJXEI-UHFFFAOYSA-N 2 2 373.413 2.631 20 5 FFBDLP CCCn1cc[nH+]c1CCC[N@@H+](C)Cn1c(=O)oc2cccc([N+](=O)[O-])c21 ZINC000794645417 1010439049 /nfs/dbraw/zinc/43/90/49/1010439049.db2.gz MWSSQFMWEYJXEI-UHFFFAOYSA-N 2 2 373.413 2.631 20 5 FFBDLP COCCC1([NH3+])CC[NH+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])CC1 ZINC001173178021 1012320884 /nfs/dbraw/zinc/32/08/84/1012320884.db2.gz FXFMNFZNMKKPEU-ZDUSSCGKSA-N 2 2 369.437 2.503 20 5 FFBDLP O=[N+]([O-])c1cccc([C@H](O)C[NH2+]Cc2ccc(-n3cc[nH+]c3)c(F)c2)c1 ZINC000749688272 1021020402 /nfs/dbraw/zinc/02/04/02/1021020402.db2.gz KMDAWVIBVKCKMY-GOSISDBHSA-N 2 2 356.357 2.743 20 5 FFBDLP Cc1nn(C[N@H+]2CC[C@H](C)[C@@H](n3cc[nH+]c3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000245847799 1025560741 /nfs/dbraw/zinc/56/07/41/1025560741.db2.gz ISXOBDSLDZCVEF-UGSOOPFHSA-N 2 2 354.414 2.990 20 5 FFBDLP Cc1nn(C[N@@H+]2CC[C@H](C)[C@@H](n3cc[nH+]c3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000245847799 1025560755 /nfs/dbraw/zinc/56/07/55/1025560755.db2.gz ISXOBDSLDZCVEF-UGSOOPFHSA-N 2 2 354.414 2.990 20 5 FFBDLP [NH3+][C@@H]1CC[N@@H+](C2CCN(c3ccc([N+](=O)[O-])c(-c4ccccc4)n3)CC2)C1 ZINC001158268114 1029780278 /nfs/dbraw/zinc/78/02/78/1029780278.db2.gz ZIHWRHMYTPXEAO-MRXNPFEDSA-N 2 2 367.453 2.659 20 5 FFBDLP [NH3+][C@@H]1CC[N@H+](C2CCN(c3ccc([N+](=O)[O-])c(-c4ccccc4)n3)CC2)C1 ZINC001158268114 1029780282 /nfs/dbraw/zinc/78/02/82/1029780282.db2.gz ZIHWRHMYTPXEAO-MRXNPFEDSA-N 2 2 367.453 2.659 20 5 FFBDLP Cc1[nH+]c2c(n1-c1ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n1)CC[NH2+]CC2 ZINC001165356261 1029957128 /nfs/dbraw/zinc/95/71/28/1029957128.db2.gz MHBBFLMZNUFSLH-UHFFFAOYSA-N 2 2 367.384 2.978 20 5 FFBDLP O=C(O[C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000835396347 1035747022 /nfs/dbraw/zinc/74/70/22/1035747022.db2.gz MFGJSKNLEAEVKH-LSDHHAIUSA-N 2 2 356.382 2.564 20 5 FFBDLP O=C(O[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000835396347 1035747033 /nfs/dbraw/zinc/74/70/33/1035747033.db2.gz MFGJSKNLEAEVKH-LSDHHAIUSA-N 2 2 356.382 2.564 20 5 FFBDLP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](CCC[NH3+])C(=O)OC(C)(C)C ZINC001246241455 1039286923 /nfs/dbraw/zinc/28/69/23/1039286923.db2.gz MLYXSKKOWKXRIE-CJNGLKHVSA-N 2 2 351.447 2.565 20 5 FFBDLP C[N@H+](C1CCOCC1)C1CC[NH+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254603811 1040832224 /nfs/dbraw/zinc/83/22/24/1040832224.db2.gz QXPRMFBWBFWLLB-FQEVSTJZSA-N 2 2 359.470 2.637 20 5 FFBDLP C[N@@H+](C1CCOCC1)C1CC[NH+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254603811 1040832230 /nfs/dbraw/zinc/83/22/30/1040832230.db2.gz QXPRMFBWBFWLLB-FQEVSTJZSA-N 2 2 359.470 2.637 20 5 FFBDLP Cn1cc[nH+]c1C[C@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC001336704071 1054151358 /nfs/dbraw/zinc/15/13/58/1054151358.db2.gz NTLLCVDYTYMQRJ-OALUTQOASA-N 2 2 366.421 2.935 20 5 FFBDLP Cn1cc[nH+]c1C[C@@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC001356532128 1055559399 /nfs/dbraw/zinc/55/93/99/1055559399.db2.gz IJTREQVZQIACIX-RTBURBONSA-N 2 2 366.421 2.935 20 5 FFBDLP [NH3+][C@@H]1C[C@H]1c1ccc(NC(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)cc1 ZINC001580401822 1078797995 /nfs/dbraw/zinc/79/79/95/1078797995.db2.gz CIDAAJYDELOTNX-JKSUJKDBSA-N 2 2 363.377 2.847 20 5 FFBDLP COc1cc(C[NH2+]CCC[NH+](C)C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000299578175 258006977 /nfs/dbraw/zinc/00/69/77/258006977.db2.gz CROHSARWVSTCOA-UHFFFAOYSA-N 2 2 365.352 2.586 20 5 FFBDLP O=C(C[NH+]1CCC(n2cc[nH+]c2)CC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000109793976 507987477 /nfs/dbraw/zinc/98/74/77/507987477.db2.gz WGBJGTHAQHXZQQ-UHFFFAOYSA-N 2 2 363.805 2.720 20 5 FFBDLP O=C(C[N@@H+]1CCC[C@H](c2[nH]cc[nH+]2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000080960603 508117614 /nfs/dbraw/zinc/11/76/14/508117614.db2.gz FKIXFGCXKWKVPR-NSHDSACASA-N 2 2 363.805 2.789 20 5 FFBDLP O=C(C[N@H+]1CCC[C@H](c2[nH]cc[nH+]2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000080960603 508117615 /nfs/dbraw/zinc/11/76/15/508117615.db2.gz FKIXFGCXKWKVPR-NSHDSACASA-N 2 2 363.805 2.789 20 5 FFBDLP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)CC[C@@H]21 ZINC000140053099 508799026 /nfs/dbraw/zinc/79/90/26/508799026.db2.gz AQULGWWXIFFQHG-ZBFHGGJFSA-N 2 2 357.414 2.561 20 5 FFBDLP C[N@H+]1CCC[C@@H]2C[NH+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)CC[C@@H]21 ZINC000140053099 508799029 /nfs/dbraw/zinc/79/90/29/508799029.db2.gz AQULGWWXIFFQHG-ZBFHGGJFSA-N 2 2 357.414 2.561 20 5 FFBDLP C[NH+]1CCC[C@@H]2C[N@H+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)CC[C@@H]21 ZINC000140053099 508799033 /nfs/dbraw/zinc/79/90/33/508799033.db2.gz AQULGWWXIFFQHG-ZBFHGGJFSA-N 2 2 357.414 2.561 20 5 FFBDLP C[NH+]1CCC[C@@H]2C[N@@H+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)CC[C@@H]21 ZINC000140053099 508799036 /nfs/dbraw/zinc/79/90/36/508799036.db2.gz AQULGWWXIFFQHG-ZBFHGGJFSA-N 2 2 357.414 2.561 20 5 FFBDLP COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000266959813 509278823 /nfs/dbraw/zinc/27/88/23/509278823.db2.gz WOOLULUMSVHYMB-ZDUSSCGKSA-N 2 2 373.413 2.535 20 5 FFBDLP COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000266959813 509278826 /nfs/dbraw/zinc/27/88/26/509278826.db2.gz WOOLULUMSVHYMB-ZDUSSCGKSA-N 2 2 373.413 2.535 20 5 FFBDLP CC[N@H+](C)C[C@@H]1CC[NH+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000245445771 509939309 /nfs/dbraw/zinc/93/93/09/509939309.db2.gz KQDCVRBBWVQABV-KGLIPLIRSA-N 2 2 359.430 2.979 20 5 FFBDLP CC[N@@H+](C)C[C@@H]1CC[NH+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000245445771 509939319 /nfs/dbraw/zinc/93/93/19/509939319.db2.gz KQDCVRBBWVQABV-KGLIPLIRSA-N 2 2 359.430 2.979 20 5 FFBDLP CC[NH+](C)C[C@@H]1CC[N@@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000245445771 509939331 /nfs/dbraw/zinc/93/93/31/509939331.db2.gz KQDCVRBBWVQABV-KGLIPLIRSA-N 2 2 359.430 2.979 20 5 FFBDLP CC[NH+](C)C[C@@H]1CC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000245445771 509939340 /nfs/dbraw/zinc/93/93/40/509939340.db2.gz KQDCVRBBWVQABV-KGLIPLIRSA-N 2 2 359.430 2.979 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH+]1CCC(c2[nH]cc[nH+]2)CC1 ZINC000265555318 510112573 /nfs/dbraw/zinc/11/25/73/510112573.db2.gz ZPPBELAUICOSIQ-UHFFFAOYSA-N 2 2 357.414 2.835 20 5 FFBDLP CC1CC[NH+](CCCNC(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)CC1 ZINC000448596724 513799739 /nfs/dbraw/zinc/79/97/39/513799739.db2.gz HHAOABDHWBRABB-UHFFFAOYSA-N 2 2 371.441 2.632 20 5 FFBDLP CCC[NH+]1CCC(N(C)C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)CC1 ZINC000448769626 513890184 /nfs/dbraw/zinc/89/01/84/513890184.db2.gz HQYGVURBAHGMHW-UHFFFAOYSA-N 2 2 371.441 2.727 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)[C@H](Nc1ccc(N3CC[NH2+]CC3)c[nH+]1)CCC2 ZINC000423236183 514088566 /nfs/dbraw/zinc/08/85/66/514088566.db2.gz RTFMTQKQHPAXBS-GOSISDBHSA-N 2 2 353.426 2.889 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCCC[C@@H]3[C@H]3CC[NH2+]C3)n2)cc1 ZINC000420390998 514126929 /nfs/dbraw/zinc/12/69/29/514126929.db2.gz IFMFNOSGOWPUJT-GOEBONIOSA-N 2 2 357.414 2.609 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCCC[C@@H]3[C@H]3CC[NH2+]C3)n2)cc1 ZINC000420390998 514126938 /nfs/dbraw/zinc/12/69/38/514126938.db2.gz IFMFNOSGOWPUJT-GOEBONIOSA-N 2 2 357.414 2.609 20 5 FFBDLP Cn1cc[nH+]c1[C@H](NC[C@H]1[NH2+]CCCC1(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000423392854 514127060 /nfs/dbraw/zinc/12/70/60/514127060.db2.gz QUWJQURYWVHMJK-IAGOWNOFSA-N 2 2 357.458 2.786 20 5 FFBDLP COc1ccc(C[NH2+][C@H]2CC[NH2+]C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414864025 514328701 /nfs/dbraw/zinc/32/87/01/514328701.db2.gz BGTCRKBTPVFRGX-INIZCTEOSA-N 2 2 357.410 2.634 20 5 FFBDLP C[N@@H+](Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)C[C@@H](O)C[NH3+] ZINC000415070957 514429547 /nfs/dbraw/zinc/42/95/47/514429547.db2.gz RUYBDEHTFITUPM-ZDUSSCGKSA-N 2 2 365.817 2.792 20 5 FFBDLP C[N@H+](Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)C[C@@H](O)C[NH3+] ZINC000415070957 514429551 /nfs/dbraw/zinc/42/95/51/514429551.db2.gz RUYBDEHTFITUPM-ZDUSSCGKSA-N 2 2 365.817 2.792 20 5 FFBDLP COc1cc(C[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000493707242 515658690 /nfs/dbraw/zinc/65/86/90/515658690.db2.gz OACIBGFAHWKVOP-AAEUAGOBSA-N 2 2 373.400 2.820 20 5 FFBDLP COc1cc(C[NH2+][C@H]2CC[N@@H+](C)[C@@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000493707242 515658700 /nfs/dbraw/zinc/65/87/00/515658700.db2.gz OACIBGFAHWKVOP-AAEUAGOBSA-N 2 2 373.400 2.820 20 5 FFBDLP Cc1cc(NC[C@H]2CC[N@@H+](C(C)C)C2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000548764972 517199221 /nfs/dbraw/zinc/19/92/21/517199221.db2.gz LRYIDFRUHPKQKN-OAHLLOKOSA-N 2 2 355.442 2.924 20 5 FFBDLP Cc1cc(NC[C@H]2CC[N@H+](C(C)C)C2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000548764972 517199231 /nfs/dbraw/zinc/19/92/31/517199231.db2.gz LRYIDFRUHPKQKN-OAHLLOKOSA-N 2 2 355.442 2.924 20 5 FFBDLP Cn1cc[nH+]c1[C@H]1CC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000542519237 517607009 /nfs/dbraw/zinc/60/70/09/517607009.db2.gz MTVDLUMBPODQME-AWEZNQCLSA-N 2 2 353.382 2.973 20 5 FFBDLP Cn1cc[nH+]c1[C@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000542519237 517607017 /nfs/dbraw/zinc/60/70/17/517607017.db2.gz MTVDLUMBPODQME-AWEZNQCLSA-N 2 2 353.382 2.973 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000557331412 517960050 /nfs/dbraw/zinc/96/00/50/517960050.db2.gz WCSPHHGKIUKBIN-WMZOPIPTSA-N 2 2 360.458 2.838 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000557331412 517960056 /nfs/dbraw/zinc/96/00/56/517960056.db2.gz WCSPHHGKIUKBIN-WMZOPIPTSA-N 2 2 360.458 2.838 20 5 FFBDLP CC[NH+]1CCC(CNc2cc(C[NH+]3CCOCC3)ccc2[N+](=O)[O-])CC1 ZINC000567118557 518361097 /nfs/dbraw/zinc/36/10/97/518361097.db2.gz GBJGPXBLQUOKBJ-UHFFFAOYSA-N 2 2 362.474 2.571 20 5 FFBDLP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000573673218 518778011 /nfs/dbraw/zinc/77/80/11/518778011.db2.gz ZGTJFHFHVYFFLN-UHFFFAOYSA-N 2 2 365.393 2.879 20 5 FFBDLP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000573673218 518778018 /nfs/dbraw/zinc/77/80/18/518778018.db2.gz ZGTJFHFHVYFFLN-UHFFFAOYSA-N 2 2 365.393 2.879 20 5 FFBDLP C[C@H]([NH2+]C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@@H](c1ccccc1)[NH+](C)C ZINC000574686173 519281611 /nfs/dbraw/zinc/28/16/11/519281611.db2.gz KLRZEZRBFBWTDP-KNBMTAEXSA-N 2 2 373.453 2.616 20 5 FFBDLP O=C(CC[NH2+]C[C@H]1CC[N@@H+]1C1CCCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000600751343 520448071 /nfs/dbraw/zinc/44/80/71/520448071.db2.gz PWSINWWHRBKPGE-MRXNPFEDSA-N 2 2 360.458 2.920 20 5 FFBDLP O=C(CC[NH2+]C[C@H]1CC[N@H+]1C1CCCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000600751343 520448079 /nfs/dbraw/zinc/44/80/79/520448079.db2.gz PWSINWWHRBKPGE-MRXNPFEDSA-N 2 2 360.458 2.920 20 5 FFBDLP CC(C)[NH+]1CCN(C2CC[NH+](Cc3c(F)cccc3[N+](=O)[O-])CC2)CC1 ZINC000611181052 521026663 /nfs/dbraw/zinc/02/66/63/521026663.db2.gz CSIDOOWHSKQUKH-UHFFFAOYSA-N 2 2 364.465 2.724 20 5 FFBDLP CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2C[C@H]3C[NH2+]C[C@H]3C2)cc1OC ZINC000611661357 521269661 /nfs/dbraw/zinc/26/96/61/521269661.db2.gz WCKKWBMOTQXFGW-CWRNSKLLSA-N 2 2 363.458 2.680 20 5 FFBDLP CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2C[C@H]3C[NH2+]C[C@H]3C2)cc1OC ZINC000611661357 521269669 /nfs/dbraw/zinc/26/96/69/521269669.db2.gz WCKKWBMOTQXFGW-CWRNSKLLSA-N 2 2 363.458 2.680 20 5 FFBDLP C[C@H](C[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)[N@@H+]1CCCC[C@@H]1C ZINC000602513219 521387470 /nfs/dbraw/zinc/38/74/70/521387470.db2.gz ARNDWKRDYSJGIZ-JKSUJKDBSA-N 2 2 361.490 2.811 20 5 FFBDLP C[C@H](C[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)[N@H+]1CCCC[C@@H]1C ZINC000602513219 521387476 /nfs/dbraw/zinc/38/74/76/521387476.db2.gz ARNDWKRDYSJGIZ-JKSUJKDBSA-N 2 2 361.490 2.811 20 5 FFBDLP C[C@H]1CCC[C@H](C)[NH+]1CC[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602568888 521415503 /nfs/dbraw/zinc/41/55/03/521415503.db2.gz ZBVCXFVRPZFUII-HOTGVXAUSA-N 2 2 361.490 2.811 20 5 FFBDLP CC[N@H+](CCn1c(C)ncc1[N+](=O)[O-])CC1CCN(c2cccc[nH+]2)CC1 ZINC000602780962 521529555 /nfs/dbraw/zinc/52/95/55/521529555.db2.gz FOBRZWKGXURKGY-UHFFFAOYSA-N 2 2 372.473 2.733 20 5 FFBDLP CC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])CC1CCN(c2cccc[nH+]2)CC1 ZINC000602780962 521529558 /nfs/dbraw/zinc/52/95/58/521529558.db2.gz FOBRZWKGXURKGY-UHFFFAOYSA-N 2 2 372.473 2.733 20 5 FFBDLP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]Cc1cn(C)nc1[N+](=O)[O-] ZINC000602813413 521548379 /nfs/dbraw/zinc/54/83/79/521548379.db2.gz XKDCFXFFRSKBMC-HUUCEWRRSA-N 2 2 357.458 2.575 20 5 FFBDLP C[NH+](C)[C@@]1(C[NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CCSC1 ZINC000766439067 737229767 /nfs/dbraw/zinc/22/97/67/737229767.db2.gz MXJDUMMZQXKXBN-GOSISDBHSA-N 2 2 364.515 2.591 20 5 FFBDLP O=C(O[C@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000810844090 994950605 /nfs/dbraw/zinc/95/06/05/994950605.db2.gz ZZGGYGNEJDKQIM-GJZGRUSLSA-N 2 2 356.382 2.564 20 5 FFBDLP O=C(O[C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000810844090 994950617 /nfs/dbraw/zinc/95/06/17/994950617.db2.gz ZZGGYGNEJDKQIM-GJZGRUSLSA-N 2 2 356.382 2.564 20 5 FFBDLP Cc1c(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2CO)cccc1[N+](=O)[O-] ZINC000788469141 1001808015 /nfs/dbraw/zinc/80/80/15/1001808015.db2.gz NTVGKWYEVUOQEJ-VQTJNVASSA-N 2 2 369.465 2.876 20 5 FFBDLP Cc1c(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2CO)cccc1[N+](=O)[O-] ZINC000788469141 1001808026 /nfs/dbraw/zinc/80/80/26/1001808026.db2.gz NTVGKWYEVUOQEJ-VQTJNVASSA-N 2 2 369.465 2.876 20 5 FFBDLP O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c1 ZINC000791624117 1002748837 /nfs/dbraw/zinc/74/88/37/1002748837.db2.gz XVWJNIFWYZXCNS-SVFBPWRDSA-N 2 2 367.449 2.692 20 5 FFBDLP O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c1 ZINC000791624117 1002748850 /nfs/dbraw/zinc/74/88/50/1002748850.db2.gz XVWJNIFWYZXCNS-SVFBPWRDSA-N 2 2 367.449 2.692 20 5 FFBDLP O=[N+]([O-])c1cccc([C@H](O)C[NH+]2C[C@H]3C[N@H+](Cc4ccccc4)C[C@H]3C2)c1 ZINC000791624117 1002748862 /nfs/dbraw/zinc/74/88/62/1002748862.db2.gz XVWJNIFWYZXCNS-SVFBPWRDSA-N 2 2 367.449 2.692 20 5 FFBDLP O=[N+]([O-])c1cccc([C@H](O)C[NH+]2C[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]3C2)c1 ZINC000791624117 1002748874 /nfs/dbraw/zinc/74/88/74/1002748874.db2.gz XVWJNIFWYZXCNS-SVFBPWRDSA-N 2 2 367.449 2.692 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC000850434492 1005815377 /nfs/dbraw/zinc/81/53/77/1005815377.db2.gz UKQYXDDELKCIGT-PBHICJAKSA-N 2 2 363.458 2.897 20 5 FFBDLP C[C@H](c1ccncc1)[NH+]1CCC([NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000819184248 1008061255 /nfs/dbraw/zinc/06/12/55/1008061255.db2.gz XQSNWOZQPCEQNZ-FOIQADDNSA-N 2 2 370.453 2.838 20 5 FFBDLP O=[N+]([O-])c1cc(F)c(N2CCC([NH2+]CCCn3cc[nH+]c3)CC2)c(F)c1 ZINC001173007357 1012177188 /nfs/dbraw/zinc/17/71/88/1012177188.db2.gz LSZONCYFHJPVHU-UHFFFAOYSA-N 2 2 365.384 2.718 20 5 FFBDLP Cn1cc[nH+]c1[C@@H]1CC[N@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777958149 1020330960 /nfs/dbraw/zinc/33/09/60/1020330960.db2.gz MGUPOTMDQUUMFV-OAHLLOKOSA-N 2 2 352.398 2.639 20 5 FFBDLP Cn1cc[nH+]c1[C@@H]1CC[N@@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777958149 1020330971 /nfs/dbraw/zinc/33/09/71/1020330971.db2.gz MGUPOTMDQUUMFV-OAHLLOKOSA-N 2 2 352.398 2.639 20 5 FFBDLP [NH3+]C[C@]1(F)CCCC[N@@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001246580951 1039403369 /nfs/dbraw/zinc/40/33/69/1039403369.db2.gz ONNHHEDISNWTOC-GOSISDBHSA-N 2 2 350.438 2.717 20 5 FFBDLP [NH3+]C[C@]1(F)CCCC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001246580951 1039403372 /nfs/dbraw/zinc/40/33/72/1039403372.db2.gz ONNHHEDISNWTOC-GOSISDBHSA-N 2 2 350.438 2.717 20 5 FFBDLP COc1ccc(CNc2ccc(N3CC[C@@H]([NH+](C)C)C3)c[nH+]2)cc1[N+](=O)[O-] ZINC001308336997 1052448112 /nfs/dbraw/zinc/44/81/12/1052448112.db2.gz HQIOBQACDLPTMP-MRXNPFEDSA-N 2 2 371.441 2.751 20 5 FFBDLP Cn1cc[nH+]c1[C@@H]1CCC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001473432310 1056384368 /nfs/dbraw/zinc/38/43/68/1056384368.db2.gz IZPKNQAPOHPLPU-CYBMUJFWSA-N 2 2 368.397 2.758 20 5 FFBDLP Cn1cc[nH+]c1[C@@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001473432310 1056384382 /nfs/dbraw/zinc/38/43/82/1056384382.db2.gz IZPKNQAPOHPLPU-CYBMUJFWSA-N 2 2 368.397 2.758 20 5 FFBDLP CC1(C)CCN(C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)CC(C)(C)[NH2+]1 ZINC001529320768 1062267418 /nfs/dbraw/zinc/26/74/18/1062267418.db2.gz NOSUCYRDCPCARY-UHFFFAOYSA-N 2 2 371.441 2.773 20 5 FFBDLP C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCC(c2c[nH+]cn2C)CC1 ZINC001560232659 1076252587 /nfs/dbraw/zinc/25/25/87/1076252587.db2.gz CWPCQPKWLDCLNH-ZDUSSCGKSA-N 2 2 357.414 2.535 20 5 FFBDLP C[N@@H+]1CCCC[C@@H]1CN1CC[NH+](C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000093146926 250020271 /nfs/dbraw/zinc/02/02/71/250020271.db2.gz AMTNCQZPQKAXQW-ZLQZBKBYSA-N 2 2 358.486 2.710 20 5 FFBDLP C[N@H+]1CCCC[C@@H]1CN1CC[NH+](C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000093146926 250020275 /nfs/dbraw/zinc/02/02/75/250020275.db2.gz AMTNCQZPQKAXQW-ZLQZBKBYSA-N 2 2 358.486 2.710 20 5 FFBDLP COc1cc(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c([N+](=O)[O-])cc1OC ZINC000093683596 250043106 /nfs/dbraw/zinc/04/31/06/250043106.db2.gz DYSXVUYPIGKNKW-HNNXBMFYSA-N 2 2 363.458 2.920 20 5 FFBDLP COc1cc(C[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c([N+](=O)[O-])cc1OC ZINC000093683596 250043110 /nfs/dbraw/zinc/04/31/10/250043110.db2.gz DYSXVUYPIGKNKW-HNNXBMFYSA-N 2 2 363.458 2.920 20 5 FFBDLP CCOc1ccc([C@@H](C)[NH2+]C2CC[NH+](CCOC)CC2)cc1[N+](=O)[O-] ZINC000153218610 251113559 /nfs/dbraw/zinc/11/35/59/251113559.db2.gz GTFIOHWTJVXFRI-CQSZACIVSA-N 2 2 351.447 2.755 20 5 FFBDLP C[C@H]1C[N@H+](Cc2ccccn2)CC[C@@H]1[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000089580802 507847073 /nfs/dbraw/zinc/84/70/73/507847073.db2.gz HWRNOWAEFQFYFW-JXFKEZNVSA-N 2 2 370.453 2.869 20 5 FFBDLP C[C@H]1C[N@@H+](Cc2ccccn2)CC[C@@H]1[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000089580802 507847075 /nfs/dbraw/zinc/84/70/75/507847075.db2.gz HWRNOWAEFQFYFW-JXFKEZNVSA-N 2 2 370.453 2.869 20 5 FFBDLP C[N@H+](CC[C@@H]1CCCC[NH+]1C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000072758953 507849697 /nfs/dbraw/zinc/84/96/97/507849697.db2.gz ROSABGVFFJKBRH-MAUKXSAKSA-N 2 2 360.458 2.506 20 5 FFBDLP C[N@@H+](CC[C@@H]1CCCC[NH+]1C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000072758953 507849699 /nfs/dbraw/zinc/84/96/99/507849699.db2.gz ROSABGVFFJKBRH-MAUKXSAKSA-N 2 2 360.458 2.506 20 5 FFBDLP C[NH+](CC[C@@H]1CCCC[N@@H+]1C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000072758953 507849701 /nfs/dbraw/zinc/84/97/01/507849701.db2.gz ROSABGVFFJKBRH-MAUKXSAKSA-N 2 2 360.458 2.506 20 5 FFBDLP C[NH+](CC[C@@H]1CCCC[N@H+]1C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000072758953 507849704 /nfs/dbraw/zinc/84/97/04/507849704.db2.gz ROSABGVFFJKBRH-MAUKXSAKSA-N 2 2 360.458 2.506 20 5 FFBDLP CC[N@H+](C)C[C@H]1CC[NH+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000072859192 507865917 /nfs/dbraw/zinc/86/59/17/507865917.db2.gz KQDCVRBBWVQABV-UONOGXRCSA-N 2 2 359.430 2.979 20 5 FFBDLP CC[N@@H+](C)C[C@H]1CC[NH+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000072859192 507865919 /nfs/dbraw/zinc/86/59/19/507865919.db2.gz KQDCVRBBWVQABV-UONOGXRCSA-N 2 2 359.430 2.979 20 5 FFBDLP CC[NH+](C)C[C@H]1CC[N@@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000072859192 507865921 /nfs/dbraw/zinc/86/59/21/507865921.db2.gz KQDCVRBBWVQABV-UONOGXRCSA-N 2 2 359.430 2.979 20 5 FFBDLP CC[NH+](C)C[C@H]1CC[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000072859192 507865924 /nfs/dbraw/zinc/86/59/24/507865924.db2.gz KQDCVRBBWVQABV-UONOGXRCSA-N 2 2 359.430 2.979 20 5 FFBDLP Cn1cc[nH+]c1C[C@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000090003544 507899625 /nfs/dbraw/zinc/89/96/25/507899625.db2.gz MCQFXCCAJKFLAQ-CYBMUJFWSA-N 2 2 355.398 2.924 20 5 FFBDLP Cn1cc[nH+]c1C[C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000090003544 507899628 /nfs/dbraw/zinc/89/96/28/507899628.db2.gz MCQFXCCAJKFLAQ-CYBMUJFWSA-N 2 2 355.398 2.924 20 5 FFBDLP COc1cc(C[NH2+]CCCc2[nH+]c3ccccc3n2C)c([N+](=O)[O-])cc1O ZINC000076901019 508261229 /nfs/dbraw/zinc/26/12/29/508261229.db2.gz LSPUMAJBTYPRTL-UHFFFAOYSA-N 2 2 370.409 2.918 20 5 FFBDLP O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c2c(c1)COCO2 ZINC000157319294 508551932 /nfs/dbraw/zinc/55/19/32/508551932.db2.gz OANYIXOQFVQYMP-QGZVFWFLSA-N 2 2 361.442 2.912 20 5 FFBDLP O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c2c(c1)COCO2 ZINC000157319294 508551935 /nfs/dbraw/zinc/55/19/35/508551935.db2.gz OANYIXOQFVQYMP-QGZVFWFLSA-N 2 2 361.442 2.912 20 5 FFBDLP Cc1c([C@H](C)[NH2+]Cc2cccnc2N2CC[NH+](C)CC2)cccc1[N+](=O)[O-] ZINC000158482830 508710856 /nfs/dbraw/zinc/71/08/56/508710856.db2.gz BIYFVRHCDVXSTL-INIZCTEOSA-N 2 2 369.469 2.901 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CCCO1 ZINC000192357659 509480377 /nfs/dbraw/zinc/48/03/77/509480377.db2.gz GMSVPQZUJDRPMX-IBGZPJMESA-N 2 2 355.438 2.976 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@@H](c2ccccc2)[C@H]([NH3+])C1 ZINC000262079752 510169729 /nfs/dbraw/zinc/16/97/29/510169729.db2.gz XNEMESONYQCWLF-ZWKOTPCHSA-N 2 2 368.437 2.659 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@@H](c2ccccc2)[C@H]([NH3+])C1 ZINC000262079752 510169735 /nfs/dbraw/zinc/16/97/35/510169735.db2.gz XNEMESONYQCWLF-ZWKOTPCHSA-N 2 2 368.437 2.659 20 5 FFBDLP C[NH2+]C[C@H]1CCC[N@H+](Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])C1 ZINC000435396259 513573308 /nfs/dbraw/zinc/57/33/08/513573308.db2.gz VRMBCLNMSYPHOW-GFCCVEGCSA-N 2 2 373.400 2.679 20 5 FFBDLP C[NH2+]C[C@H]1CCC[N@@H+](Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])C1 ZINC000435396259 513573319 /nfs/dbraw/zinc/57/33/19/513573319.db2.gz VRMBCLNMSYPHOW-GFCCVEGCSA-N 2 2 373.400 2.679 20 5 FFBDLP C[C@@H]1CCC[C@@H](C)[NH+]1CCNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000448934254 513978665 /nfs/dbraw/zinc/97/86/65/513978665.db2.gz UPKHYVPYDRELBY-HUUCEWRRSA-N 2 2 371.441 2.773 20 5 FFBDLP CNc1cc(N2CCC[C@H]2C[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])nc[nH+]1 ZINC000449125364 514081902 /nfs/dbraw/zinc/08/19/02/514081902.db2.gz RWOPJXHIJQSLMM-ZBFHGGJFSA-N 2 2 370.457 2.616 20 5 FFBDLP CC[N@@H+]1CC[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)C[C@H]1C ZINC000449971137 514448165 /nfs/dbraw/zinc/44/81/65/514448165.db2.gz JSYSWFMKGGLGER-ZBFHGGJFSA-N 2 2 371.441 2.725 20 5 FFBDLP CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)C[C@H]1C ZINC000449971137 514448171 /nfs/dbraw/zinc/44/81/71/514448171.db2.gz JSYSWFMKGGLGER-ZBFHGGJFSA-N 2 2 371.441 2.725 20 5 FFBDLP COc1cc(CNc2ccc(Cn3cc[nH+]c3)c[nH+]2)c([N+](=O)[O-])cc1O ZINC000508469257 514788948 /nfs/dbraw/zinc/78/89/48/514788948.db2.gz XLTOMZZJVAQXCB-UHFFFAOYSA-N 2 2 355.354 2.561 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@@H+]2Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000491890197 515481634 /nfs/dbraw/zinc/48/16/34/515481634.db2.gz KGMNWBWRNGPQBP-JLZZUVOBSA-N 2 2 353.850 2.932 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@H+]2Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000491890197 515481640 /nfs/dbraw/zinc/48/16/40/515481640.db2.gz KGMNWBWRNGPQBP-JLZZUVOBSA-N 2 2 353.850 2.932 20 5 FFBDLP CC[N@@H+]1CC[C@H](N(C)C(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)C[C@H]1C ZINC000524879801 516855959 /nfs/dbraw/zinc/85/59/59/516855959.db2.gz UGVOEKONXGITFT-ZBFHGGJFSA-N 2 2 371.441 2.725 20 5 FFBDLP CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)C[C@H]1C ZINC000524879801 516855967 /nfs/dbraw/zinc/85/59/67/516855967.db2.gz UGVOEKONXGITFT-ZBFHGGJFSA-N 2 2 371.441 2.725 20 5 FFBDLP Cc1cc2[nH+]cn(C[C@H](O)C[NH2+]CCc3ccc([N+](=O)[O-])cc3)c2cc1C ZINC000556859423 517712926 /nfs/dbraw/zinc/71/29/26/517712926.db2.gz NIVRLWDADUMWER-GOSISDBHSA-N 2 2 368.437 2.755 20 5 FFBDLP C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C[C@H]1CCCC[N@@H+]1C1CC1 ZINC000580399538 519154802 /nfs/dbraw/zinc/15/48/02/519154802.db2.gz INQRCXYUQMKSRB-KBXCAEBGSA-N 2 2 360.458 2.918 20 5 FFBDLP C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C[C@H]1CCCC[N@H+]1C1CC1 ZINC000580399538 519154812 /nfs/dbraw/zinc/15/48/12/519154812.db2.gz INQRCXYUQMKSRB-KBXCAEBGSA-N 2 2 360.458 2.918 20 5 FFBDLP Cn1cc[nH+]c1[C@@H](N[C@H]1CC[NH2+]C2(CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000591582652 519957787 /nfs/dbraw/zinc/95/77/87/519957787.db2.gz RSVXBLFLDZWXGF-RDJZCZTQSA-N 2 2 355.442 2.682 20 5 FFBDLP COc1cc(C[NH+]2CCC(C)([NH3+])CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000592431630 520388562 /nfs/dbraw/zinc/38/85/62/520388562.db2.gz RKZWGYOBEKSQSC-UHFFFAOYSA-N 2 2 359.373 2.561 20 5 FFBDLP O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC[C@@H]([NH+]3CCOCC3)CC2)cc1 ZINC000595469668 520491057 /nfs/dbraw/zinc/49/10/57/520491057.db2.gz IUZKHLNZIHBBOC-QGZVFWFLSA-N 2 2 363.458 2.550 20 5 FFBDLP O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@@H]([NH+]3CCOCC3)CC2)cc1 ZINC000595469668 520491061 /nfs/dbraw/zinc/49/10/61/520491061.db2.gz IUZKHLNZIHBBOC-QGZVFWFLSA-N 2 2 363.458 2.550 20 5 FFBDLP Cc1ccc(C[NH2+]C[C@@]2(O)CC[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000610162185 520564634 /nfs/dbraw/zinc/56/46/34/520564634.db2.gz FWMAWSFKENIJMA-FQEVSTJZSA-N 2 2 355.438 2.630 20 5 FFBDLP Cc1ccc(C[NH2+]C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000610162185 520564640 /nfs/dbraw/zinc/56/46/40/520564640.db2.gz FWMAWSFKENIJMA-FQEVSTJZSA-N 2 2 355.438 2.630 20 5 FFBDLP C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCN(C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1 ZINC000611522875 521202224 /nfs/dbraw/zinc/20/22/24/521202224.db2.gz IJKGQUPMDJYLFU-HRBLRVMOSA-N 2 2 358.486 2.899 20 5 FFBDLP C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCN(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)CC1 ZINC000611522875 521202233 /nfs/dbraw/zinc/20/22/33/521202233.db2.gz IJKGQUPMDJYLFU-HRBLRVMOSA-N 2 2 358.486 2.899 20 5 FFBDLP C[C@H](c1ccccc1[N+](=O)[O-])N1CC[NH+](C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1 ZINC000611522875 521202242 /nfs/dbraw/zinc/20/22/42/521202242.db2.gz IJKGQUPMDJYLFU-HRBLRVMOSA-N 2 2 358.486 2.899 20 5 FFBDLP C[C@H](c1ccccc1[N+](=O)[O-])N1CC[NH+](C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)CC1 ZINC000611522875 521202249 /nfs/dbraw/zinc/20/22/49/521202249.db2.gz IJKGQUPMDJYLFU-HRBLRVMOSA-N 2 2 358.486 2.899 20 5 FFBDLP O=[N+]([O-])c1sc(C[NH2+][C@H]2CCn3cc[nH+]c3C2)cc1Br ZINC000602624232 521441777 /nfs/dbraw/zinc/44/17/77/521441777.db2.gz SVCVMCXYEZYQRO-QMMMGPOBSA-N 2 2 357.233 2.720 20 5 FFBDLP C[C@@H]([NH3+])C1CC[NH+]([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000843348371 747814665 /nfs/dbraw/zinc/81/46/65/747814665.db2.gz DWXAWPKTGQQVST-MNOVXSKESA-N 2 2 354.838 2.634 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]CC[NH+]2CCC(C)CC2)c1F ZINC001173174802 1012319103 /nfs/dbraw/zinc/31/91/03/1012319103.db2.gz CEUQRVFYLOVQJD-CQSZACIVSA-N 2 2 353.438 2.995 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@H]2CC[N@H+](CC(C)C)C2)c1F ZINC001173182275 1012326073 /nfs/dbraw/zinc/32/60/73/1012326073.db2.gz REWRUEKEJDIZAL-KBPBESRZSA-N 2 2 353.438 2.993 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@H]2CC[N@@H+](CC(C)C)C2)c1F ZINC001173182275 1012326085 /nfs/dbraw/zinc/32/60/85/1012326085.db2.gz REWRUEKEJDIZAL-KBPBESRZSA-N 2 2 353.438 2.993 20 5 FFBDLP [NH3+]C[C@@H]([NH3+])c1ccc(C(=O)Nc2cc3cccnc3c3ncccc23)cc1 ZINC001218980022 1033441554 /nfs/dbraw/zinc/44/15/54/1033441554.db2.gz PQJPJZQCRGFMGZ-QGZVFWFLSA-N 2 2 357.417 2.994 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2CCC[C@]3(CC[NH2+]C3)C2)c1F ZINC001246626655 1039420880 /nfs/dbraw/zinc/42/08/80/1039420880.db2.gz HGPSFURMHCPGSW-FZKQIMNGSA-N 2 2 351.422 2.749 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCC[C@]3(CC[NH2+]C3)C2)c1F ZINC001246626655 1039420882 /nfs/dbraw/zinc/42/08/82/1039420882.db2.gz HGPSFURMHCPGSW-FZKQIMNGSA-N 2 2 351.422 2.749 20 5 FFBDLP Cc1[nH+]ccn1-c1cc[nH+]cc1NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC001318864917 1044913349 /nfs/dbraw/zinc/91/33/49/1044913349.db2.gz DPQWBJHWMGQOMR-UHFFFAOYSA-N 2 2 366.381 2.559 20 5 FFBDLP Cn1cc[nH+]c1C[C@@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC001336704070 1054150951 /nfs/dbraw/zinc/15/09/51/1054150951.db2.gz NTLLCVDYTYMQRJ-MOPGFXCFSA-N 2 2 366.421 2.935 20 5 FFBDLP Cn1cc[nH+]c1[C@H]1CC[N@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848482202 1060117371 /nfs/dbraw/zinc/11/73/71/1060117371.db2.gz KBBQSRDLRVQGPB-AWEZNQCLSA-N 2 2 352.398 2.639 20 5 FFBDLP Cn1cc[nH+]c1[C@H]1CC[N@@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848482202 1060117379 /nfs/dbraw/zinc/11/73/79/1060117379.db2.gz KBBQSRDLRVQGPB-AWEZNQCLSA-N 2 2 352.398 2.639 20 5 FFBDLP O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@H](Oc3cc[nH+]cc3)C2)c2c(c1)COCO2 ZINC000131898051 251028861 /nfs/dbraw/zinc/02/88/61/251028861.db2.gz ZTTSGKUHLWPVHY-QGZVFWFLSA-N 2 2 357.366 2.510 20 5 FFBDLP O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H](Oc3cc[nH+]cc3)C2)c2c(c1)COCO2 ZINC000131898051 251028864 /nfs/dbraw/zinc/02/88/64/251028864.db2.gz ZTTSGKUHLWPVHY-QGZVFWFLSA-N 2 2 357.366 2.510 20 5 FFBDLP CCOc1ccc([C@H](C)[NH2+]C2CC[NH+](CCOC)CC2)cc1[N+](=O)[O-] ZINC000153218713 251113994 /nfs/dbraw/zinc/11/39/94/251113994.db2.gz GTFIOHWTJVXFRI-AWEZNQCLSA-N 2 2 351.447 2.755 20 5 FFBDLP CN(C)C(=O)[C@H]1CCC[N@@H+]1CCC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000278160390 256283011 /nfs/dbraw/zinc/28/30/11/256283011.db2.gz AVIXKCMPLYYDDY-RTBURBONSA-N 2 2 374.485 2.505 20 5 FFBDLP CN(C)C(=O)[C@H]1CCC[N@H+]1CCC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000278160390 256283012 /nfs/dbraw/zinc/28/30/12/256283012.db2.gz AVIXKCMPLYYDDY-RTBURBONSA-N 2 2 374.485 2.505 20 5 FFBDLP Cn1cc[nH+]c1[C@@H]1CCC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000377267924 512194010 /nfs/dbraw/zinc/19/40/10/512194010.db2.gz RBYPAFAHIIOIJY-CQSZACIVSA-N 2 2 357.414 2.537 20 5 FFBDLP Cn1cc[nH+]c1[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000377267924 512194014 /nfs/dbraw/zinc/19/40/14/512194014.db2.gz RBYPAFAHIIOIJY-CQSZACIVSA-N 2 2 357.414 2.537 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[NH+]3CCC(n4cc[nH+]c4)CC3)n2)c1 ZINC000109795713 507988170 /nfs/dbraw/zinc/98/81/70/507988170.db2.gz NUULTOXYUASDEX-UHFFFAOYSA-N 2 2 354.370 2.678 20 5 FFBDLP CC[N@@H+]1CC[C@H]([NH+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)C1 ZINC000081095401 508137024 /nfs/dbraw/zinc/13/70/24/508137024.db2.gz ZMQCLQMABAHUAS-CJNGLKHVSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[N@H+]1CC[C@H]([NH+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)C1 ZINC000081095401 508137028 /nfs/dbraw/zinc/13/70/28/508137028.db2.gz ZMQCLQMABAHUAS-CJNGLKHVSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[NH+]1CC[C@H]([N@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)C1 ZINC000081095401 508137032 /nfs/dbraw/zinc/13/70/32/508137032.db2.gz ZMQCLQMABAHUAS-CJNGLKHVSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[NH+]1CC[C@H]([N@@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)C1 ZINC000081095401 508137035 /nfs/dbraw/zinc/13/70/35/508137035.db2.gz ZMQCLQMABAHUAS-CJNGLKHVSA-N 2 2 359.430 2.807 20 5 FFBDLP C[C@@H]1CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H]1n1cc[nH+]c1 ZINC000156455075 508423709 /nfs/dbraw/zinc/42/37/09/508423709.db2.gz DFRWGSJKLRESGA-CJNGLKHVSA-N 2 2 368.397 2.924 20 5 FFBDLP C[C@@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H]1n1cc[nH+]c1 ZINC000156455075 508423712 /nfs/dbraw/zinc/42/37/12/508423712.db2.gz DFRWGSJKLRESGA-CJNGLKHVSA-N 2 2 368.397 2.924 20 5 FFBDLP C[C@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000116396990 508507542 /nfs/dbraw/zinc/50/75/42/508507542.db2.gz CEYMVSGNBIKPLM-XJKSGUPXSA-N 2 2 350.463 2.878 20 5 FFBDLP C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCN(C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1 ZINC000119744640 508854971 /nfs/dbraw/zinc/85/49/71/508854971.db2.gz RWBKDWQAKXAOCG-NDGNNOQLSA-N 2 2 358.486 2.899 20 5 FFBDLP C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCN(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)CC1 ZINC000119744640 508854975 /nfs/dbraw/zinc/85/49/75/508854975.db2.gz RWBKDWQAKXAOCG-NDGNNOQLSA-N 2 2 358.486 2.899 20 5 FFBDLP C[C@@H](c1cccc([N+](=O)[O-])c1)N1CC[NH+](C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1 ZINC000119744640 508854978 /nfs/dbraw/zinc/85/49/78/508854978.db2.gz RWBKDWQAKXAOCG-NDGNNOQLSA-N 2 2 358.486 2.899 20 5 FFBDLP C[C@@H](c1cccc([N+](=O)[O-])c1)N1CC[NH+](C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)CC1 ZINC000119744640 508854980 /nfs/dbraw/zinc/85/49/80/508854980.db2.gz RWBKDWQAKXAOCG-NDGNNOQLSA-N 2 2 358.486 2.899 20 5 FFBDLP O=[N+]([O-])c1cccc(Cl)c1C[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000163324409 509362953 /nfs/dbraw/zinc/36/29/53/509362953.db2.gz DGROMMRGRAROEI-UHFFFAOYSA-N 2 2 353.850 2.792 20 5 FFBDLP COc1ccc(OCC[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC000173781950 509773777 /nfs/dbraw/zinc/77/37/77/509773777.db2.gz NBJOYZSBYMDOEB-INIZCTEOSA-N 2 2 363.458 2.933 20 5 FFBDLP COc1ccc(OCC[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC000173781950 509773785 /nfs/dbraw/zinc/77/37/85/509773785.db2.gz NBJOYZSBYMDOEB-INIZCTEOSA-N 2 2 363.458 2.933 20 5 FFBDLP CC[NH+](CC)C[C@H]1CC[N@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000174226183 510013358 /nfs/dbraw/zinc/01/33/58/510013358.db2.gz WFDKFPIWLVMMKZ-OAHLLOKOSA-N 2 2 351.447 2.646 20 5 FFBDLP CC[NH+](CC)C[C@H]1CC[N@@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000174226183 510013362 /nfs/dbraw/zinc/01/33/62/510013362.db2.gz WFDKFPIWLVMMKZ-OAHLLOKOSA-N 2 2 351.447 2.646 20 5 FFBDLP O=C(C[NH+]1CCC(c2[nH]cc[nH+]2)CC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000265471274 510072200 /nfs/dbraw/zinc/07/22/00/510072200.db2.gz IAGGPNQVXWOLSJ-UHFFFAOYSA-N 2 2 363.805 2.789 20 5 FFBDLP C[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@H]1n1cc[nH+]c1 ZINC000246254816 510392641 /nfs/dbraw/zinc/39/26/41/510392641.db2.gz JXYLTASMCOKQSE-CXAGYDPISA-N 2 2 358.398 2.741 20 5 FFBDLP C[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@H]1n1cc[nH+]c1 ZINC000246254816 510392644 /nfs/dbraw/zinc/39/26/44/510392644.db2.gz JXYLTASMCOKQSE-CXAGYDPISA-N 2 2 358.398 2.741 20 5 FFBDLP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000246305730 510417026 /nfs/dbraw/zinc/41/70/26/510417026.db2.gz FQRADVQSLVZYJP-HOTGVXAUSA-N 2 2 374.485 2.780 20 5 FFBDLP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000246305730 510417031 /nfs/dbraw/zinc/41/70/31/510417031.db2.gz FQRADVQSLVZYJP-HOTGVXAUSA-N 2 2 374.485 2.780 20 5 FFBDLP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000246305730 510417038 /nfs/dbraw/zinc/41/70/38/510417038.db2.gz FQRADVQSLVZYJP-HOTGVXAUSA-N 2 2 374.485 2.780 20 5 FFBDLP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000246305730 510417042 /nfs/dbraw/zinc/41/70/42/510417042.db2.gz FQRADVQSLVZYJP-HOTGVXAUSA-N 2 2 374.485 2.780 20 5 FFBDLP CC(C)C[N@@H+]1CCO[C@@H](C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000178328449 510548191 /nfs/dbraw/zinc/54/81/91/510548191.db2.gz RNYAJKLQHSFFLD-OALUTQOASA-N 2 2 361.486 2.862 20 5 FFBDLP CC(C)C[N@H+]1CCO[C@@H](C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000178328449 510548195 /nfs/dbraw/zinc/54/81/95/510548195.db2.gz RNYAJKLQHSFFLD-OALUTQOASA-N 2 2 361.486 2.862 20 5 FFBDLP C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC000188280870 510687798 /nfs/dbraw/zinc/68/77/98/510687798.db2.gz DEUCYHUQCXSIIG-FQEVSTJZSA-N 2 2 355.438 2.664 20 5 FFBDLP C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC000188280870 510687805 /nfs/dbraw/zinc/68/78/05/510687805.db2.gz DEUCYHUQCXSIIG-FQEVSTJZSA-N 2 2 355.438 2.664 20 5 FFBDLP C[NH+](Cc1ccc([N+](=O)[O-])cc1)C[C@@]1(O)CC[N@H+](Cc2ccccc2)C1 ZINC000188280870 510687808 /nfs/dbraw/zinc/68/78/08/510687808.db2.gz DEUCYHUQCXSIIG-FQEVSTJZSA-N 2 2 355.438 2.664 20 5 FFBDLP C[NH+](Cc1ccc([N+](=O)[O-])cc1)C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000188280870 510687815 /nfs/dbraw/zinc/68/78/15/510687815.db2.gz DEUCYHUQCXSIIG-FQEVSTJZSA-N 2 2 355.438 2.664 20 5 FFBDLP C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000247121247 510840030 /nfs/dbraw/zinc/84/00/30/510840030.db2.gz MQOHHRHEPCOFNP-CABCVRRESA-N 2 2 371.441 2.610 20 5 FFBDLP C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000247121247 510840032 /nfs/dbraw/zinc/84/00/32/510840032.db2.gz MQOHHRHEPCOFNP-CABCVRRESA-N 2 2 371.441 2.610 20 5 FFBDLP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC(=O)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000285664533 511001825 /nfs/dbraw/zinc/00/18/25/511001825.db2.gz MLZRLZNEYKSWQV-RGPMPMONSA-N 2 2 374.485 2.719 20 5 FFBDLP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC(=O)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000285664533 511001830 /nfs/dbraw/zinc/00/18/30/511001830.db2.gz MLZRLZNEYKSWQV-RGPMPMONSA-N 2 2 374.485 2.719 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[NH+]3CCC(c4c[nH]c[nH+]4)CC3)n2)cc1 ZINC000374207379 512707194 /nfs/dbraw/zinc/70/71/94/512707194.db2.gz JCBPSTMBSWURLP-UHFFFAOYSA-N 2 2 354.370 2.748 20 5 FFBDLP Cn1cnc([N+](=O)[O-])c1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000374533411 512878441 /nfs/dbraw/zinc/87/84/41/512878441.db2.gz BHMNPKBLGNPNCS-KRWDZBQOSA-N 2 2 357.458 2.719 20 5 FFBDLP Cn1cnc([N+](=O)[O-])c1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000374533411 512878444 /nfs/dbraw/zinc/87/84/44/512878444.db2.gz BHMNPKBLGNPNCS-KRWDZBQOSA-N 2 2 357.458 2.719 20 5 FFBDLP CC[NH+](CC)C[C@H](C)Nc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000447807802 513576271 /nfs/dbraw/zinc/57/62/71/513576271.db2.gz UFXZYGJLLQQEGK-HNNXBMFYSA-N 2 2 350.463 2.569 20 5 FFBDLP Cc1cc(N2CCC[C@]3(CC[NH2+]C3)C2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000420258208 514063298 /nfs/dbraw/zinc/06/32/98/514063298.db2.gz XOFJEBARMMGGGA-LJQANCHMSA-N 2 2 353.426 2.940 20 5 FFBDLP C[NH2+]CCC1CC[NH+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000420309925 514084602 /nfs/dbraw/zinc/08/46/02/514084602.db2.gz PCUPPGCKVVDFFT-UHFFFAOYSA-N 2 2 354.838 2.508 20 5 FFBDLP C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@H]1[NH2+]CCc2ccccc21 ZINC000423431312 514140505 /nfs/dbraw/zinc/14/05/05/514140505.db2.gz QJRMJGWVOOYDCS-AUUYWEPGSA-N 2 2 368.437 2.789 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCC[N@H+]1CCCO ZINC000449386008 514189686 /nfs/dbraw/zinc/18/96/86/514189686.db2.gz HBSZHWGOTIQTDG-YTQUADARSA-N 2 2 361.486 2.742 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCC[N@@H+]1CCCO ZINC000449386008 514189690 /nfs/dbraw/zinc/18/96/90/514189690.db2.gz HBSZHWGOTIQTDG-YTQUADARSA-N 2 2 361.486 2.742 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCCC[N@H+]1CCO ZINC000449394590 514192670 /nfs/dbraw/zinc/19/26/70/514192670.db2.gz NXYYHNYBBXEHBK-YTQUADARSA-N 2 2 361.486 2.742 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCCC[N@@H+]1CCO ZINC000449394590 514192676 /nfs/dbraw/zinc/19/26/76/514192676.db2.gz NXYYHNYBBXEHBK-YTQUADARSA-N 2 2 361.486 2.742 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCC[N@@H+](CCCO)C1 ZINC000449399199 514197196 /nfs/dbraw/zinc/19/71/96/514197196.db2.gz YKOWIARNXXZMSR-WDSOQIARSA-N 2 2 361.486 2.742 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCC[N@H+](CCCO)C1 ZINC000449399199 514197199 /nfs/dbraw/zinc/19/71/99/514197199.db2.gz YKOWIARNXXZMSR-WDSOQIARSA-N 2 2 361.486 2.742 20 5 FFBDLP C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C[C@@H]1[NH2+]CCc2ccccc21 ZINC000414942077 514367042 /nfs/dbraw/zinc/36/70/42/514367042.db2.gz BGYNRQHGHMRWPQ-KUHUBIRLSA-N 2 2 368.437 2.789 20 5 FFBDLP [NH3+]C[C@@H](C[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1)c1ccc(F)cc1 ZINC000424301766 514450774 /nfs/dbraw/zinc/45/07/74/514450774.db2.gz LHEIPRQQYLCHSY-INIZCTEOSA-N 2 2 358.417 2.598 20 5 FFBDLP O=[N+]([O-])c1cccc([C@@H]([NH2+]C[C@@H](O)C[NH+]2CCCC2)c2ccccc2)c1 ZINC000490149312 515121337 /nfs/dbraw/zinc/12/13/37/515121337.db2.gz ITGFSVNKUFKHFO-UXHICEINSA-N 2 2 355.438 2.731 20 5 FFBDLP CC[N@@H+]1CCCC[C@H]1CNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000472340589 515233422 /nfs/dbraw/zinc/23/34/22/515233422.db2.gz NMGIIXQONJYFML-KRWDZBQOSA-N 2 2 362.474 2.713 20 5 FFBDLP CC[N@H+]1CCCC[C@H]1CNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000472340589 515233432 /nfs/dbraw/zinc/23/34/32/515233432.db2.gz NMGIIXQONJYFML-KRWDZBQOSA-N 2 2 362.474 2.713 20 5 FFBDLP C[C@@H]1CCC[N@H+](CCNc2cc(C[NH+]3CCOCC3)ccc2[N+](=O)[O-])C1 ZINC000472371488 515248065 /nfs/dbraw/zinc/24/80/65/515248065.db2.gz ZQMSLZGREYVVQE-MRXNPFEDSA-N 2 2 362.474 2.571 20 5 FFBDLP C[C@@H]1CCC[N@@H+](CCNc2cc(C[NH+]3CCOCC3)ccc2[N+](=O)[O-])C1 ZINC000472371488 515248068 /nfs/dbraw/zinc/24/80/68/515248068.db2.gz ZQMSLZGREYVVQE-MRXNPFEDSA-N 2 2 362.474 2.571 20 5 FFBDLP CCCC[N@H+](C)C[C@@H](C)NC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000589534942 519026402 /nfs/dbraw/zinc/02/64/02/519026402.db2.gz JAFXHYNJUUAAPV-CQSZACIVSA-N 2 2 359.430 2.631 20 5 FFBDLP CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000589534942 519026409 /nfs/dbraw/zinc/02/64/09/519026409.db2.gz JAFXHYNJUUAAPV-CQSZACIVSA-N 2 2 359.430 2.631 20 5 FFBDLP O=[N+]([O-])c1ccc(O)cc1C[NH+]1CCC(CCC[NH+]2CCOCC2)CC1 ZINC000572345491 519566481 /nfs/dbraw/zinc/56/64/81/519566481.db2.gz NPBSXJJPEGHUFE-UHFFFAOYSA-N 2 2 363.458 2.625 20 5 FFBDLP C[C@H]([NH2+]C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@@H](c1ccccc1)[NH+](C)C ZINC000591761298 520026093 /nfs/dbraw/zinc/02/60/93/520026093.db2.gz HKZCLWLZRVQZQO-QSFXBCCZSA-N 2 2 373.453 2.616 20 5 FFBDLP O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+]C2CC[NH+]([C@H]3CCOC3)CC2)c1 ZINC000594994387 520247239 /nfs/dbraw/zinc/24/72/39/520247239.db2.gz UMPXEEXPMVLGKM-HNNXBMFYSA-N 2 2 371.384 2.539 20 5 FFBDLP CCC1([NH+](C)C)CCN(C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)CC1 ZINC000601791161 520954056 /nfs/dbraw/zinc/95/40/56/520954056.db2.gz HSZKWBKYQZZAOC-UHFFFAOYSA-N 2 2 371.441 2.727 20 5 FFBDLP C[NH+]1CCC([N@@H+]2CC[C@H](Nc3ccc4cnccc4c3[N+](=O)[O-])C2)CC1 ZINC000599045003 520998221 /nfs/dbraw/zinc/99/82/21/520998221.db2.gz XHJWJJDOWPWYQD-HNNXBMFYSA-N 2 2 355.442 2.723 20 5 FFBDLP C[NH+]1CCC([N@H+]2CC[C@H](Nc3ccc4cnccc4c3[N+](=O)[O-])C2)CC1 ZINC000599045003 520998226 /nfs/dbraw/zinc/99/82/26/520998226.db2.gz XHJWJJDOWPWYQD-HNNXBMFYSA-N 2 2 355.442 2.723 20 5 FFBDLP CC(C)(C)[N@@H+]1CC[C@@H]1CNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000596309862 521020802 /nfs/dbraw/zinc/02/08/02/521020802.db2.gz YSDHJNLWDCRFCV-MRXNPFEDSA-N 2 2 362.474 2.712 20 5 FFBDLP CC(C)(C)[N@H+]1CC[C@@H]1CNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000596309862 521020807 /nfs/dbraw/zinc/02/08/07/521020807.db2.gz YSDHJNLWDCRFCV-MRXNPFEDSA-N 2 2 362.474 2.712 20 5 FFBDLP O=C(OCCC[NH+]1CCCCC1)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000747758326 995317493 /nfs/dbraw/zinc/31/74/93/995317493.db2.gz FGYVNCRPNDXCET-UHFFFAOYSA-N 2 2 358.398 2.813 20 5 FFBDLP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cn1 ZINC000788556991 1001819912 /nfs/dbraw/zinc/81/99/12/1001819912.db2.gz IXXLERLQKKICEG-LBPRGKRZSA-N 2 2 352.398 2.917 20 5 FFBDLP [NH3+][C@@H]1c2ccccc2C[C@H]1[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000902438984 1020200258 /nfs/dbraw/zinc/20/02/58/1020200258.db2.gz PTLQWIPZKAEORW-WOJBJXKFSA-N 2 2 352.438 2.778 20 5 FFBDLP Cc1[nH+]c2c(n1-c1nc3ccccc3c(Cl)c1[N+](=O)[O-])CC[NH2+]CC2 ZINC001165352566 1029954354 /nfs/dbraw/zinc/95/43/54/1029954354.db2.gz CLNHKXJQOKHTKZ-UHFFFAOYSA-N 2 2 357.801 2.979 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH+]1C[C@@H]3C[NH+](Cc4cccnc4)C[C@H]3C1)C2 ZINC001254599383 1040829678 /nfs/dbraw/zinc/82/96/78/1040829678.db2.gz YNFPGGMGPPABAK-IRFCIJBXSA-N 2 2 364.449 2.521 20 5 FFBDLP C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+](C)CCCn1cc[nH+]c1 ZINC000181108630 251242773 /nfs/dbraw/zinc/24/27/73/251242773.db2.gz CVYSTDMVSJDVBM-GFCCVEGCSA-N 2 2 365.821 2.794 20 5 FFBDLP C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)CCCn1cc[nH+]c1 ZINC000181108630 251242778 /nfs/dbraw/zinc/24/27/78/251242778.db2.gz CVYSTDMVSJDVBM-GFCCVEGCSA-N 2 2 365.821 2.794 20 5 FFBDLP Cn1cc(C[N@@H+]2CC[C@@H]3CC[NH+](C)C[C@@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272625527 252084840 /nfs/dbraw/zinc/08/48/40/252084840.db2.gz MKHXDKGSVHEZJN-KSSFIOAISA-N 2 2 355.442 2.521 20 5 FFBDLP Cn1cc(C[N@H+]2CC[C@@H]3CC[NH+](C)C[C@@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272625527 252084843 /nfs/dbraw/zinc/08/48/43/252084843.db2.gz MKHXDKGSVHEZJN-KSSFIOAISA-N 2 2 355.442 2.521 20 5 FFBDLP Cn1cc(C[NH+]2CC[C@@H]3CC[N@H+](C)C[C@@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272625527 252084845 /nfs/dbraw/zinc/08/48/45/252084845.db2.gz MKHXDKGSVHEZJN-KSSFIOAISA-N 2 2 355.442 2.521 20 5 FFBDLP Cn1cc(C[NH+]2CC[C@@H]3CC[N@@H+](C)C[C@@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272625527 252084848 /nfs/dbraw/zinc/08/48/48/252084848.db2.gz MKHXDKGSVHEZJN-KSSFIOAISA-N 2 2 355.442 2.521 20 5 FFBDLP CCOc1cccc(N2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4C)CC2)c1[N+](=O)[O-] ZINC000302167420 258092362 /nfs/dbraw/zinc/09/23/62/258092362.db2.gz SDSALDCSXLQLPY-SJPCQFCGSA-N 2 2 374.485 2.741 20 5 FFBDLP CCOc1cccc(N2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)c1[N+](=O)[O-] ZINC000302167420 258092364 /nfs/dbraw/zinc/09/23/64/258092364.db2.gz SDSALDCSXLQLPY-SJPCQFCGSA-N 2 2 374.485 2.741 20 5 FFBDLP Cn1cc[nH+]c1C[C@@H]1CCC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000090003580 507899286 /nfs/dbraw/zinc/89/92/86/507899286.db2.gz RWKLRSAWXQGHJF-HNNXBMFYSA-N 2 2 371.441 2.612 20 5 FFBDLP Cn1cc[nH+]c1C[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000090003580 507899287 /nfs/dbraw/zinc/89/92/87/507899287.db2.gz RWKLRSAWXQGHJF-HNNXBMFYSA-N 2 2 371.441 2.612 20 5 FFBDLP Cc1c[nH+]ccc1OC1CC[NH+](CC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000377651511 512377212 /nfs/dbraw/zinc/37/72/12/512377212.db2.gz UNOHDAZGIITKGQ-UHFFFAOYSA-N 2 2 370.409 2.780 20 5 FFBDLP Cc1ccc([C@H](C)[NH2+]Cc2cccnc2N2CC[NH+](C)CC2)cc1[N+](=O)[O-] ZINC000158470966 508709361 /nfs/dbraw/zinc/70/93/61/508709361.db2.gz OYJXMEIFIZOISE-INIZCTEOSA-N 2 2 369.469 2.901 20 5 FFBDLP C[N@@H+]1CCC[C@H]2C[NH+](CC(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)CC[C@@H]21 ZINC000139939994 508797672 /nfs/dbraw/zinc/79/76/72/508797672.db2.gz NAMXVAZLCAUTKH-WFASDCNBSA-N 2 2 366.849 2.603 20 5 FFBDLP C[N@H+]1CCC[C@H]2C[NH+](CC(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)CC[C@@H]21 ZINC000139939994 508797675 /nfs/dbraw/zinc/79/76/75/508797675.db2.gz NAMXVAZLCAUTKH-WFASDCNBSA-N 2 2 366.849 2.603 20 5 FFBDLP C[NH+]1CCC[C@H]2C[N@H+](CC(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)CC[C@@H]21 ZINC000139939994 508797678 /nfs/dbraw/zinc/79/76/78/508797678.db2.gz NAMXVAZLCAUTKH-WFASDCNBSA-N 2 2 366.849 2.603 20 5 FFBDLP C[NH+]1CCC[C@H]2C[N@@H+](CC(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)CC[C@@H]21 ZINC000139939994 508797680 /nfs/dbraw/zinc/79/76/80/508797680.db2.gz NAMXVAZLCAUTKH-WFASDCNBSA-N 2 2 366.849 2.603 20 5 FFBDLP C[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185697434 509310340 /nfs/dbraw/zinc/31/03/40/509310340.db2.gz ZUKWNLUWLYRZKR-CABCVRRESA-N 2 2 360.458 2.776 20 5 FFBDLP C[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185697434 509310344 /nfs/dbraw/zinc/31/03/44/509310344.db2.gz ZUKWNLUWLYRZKR-CABCVRRESA-N 2 2 360.458 2.776 20 5 FFBDLP CCOc1ccc(NC(=O)C[N@@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)c([N+](=O)[O-])c1 ZINC000267416858 509468521 /nfs/dbraw/zinc/46/85/21/509468521.db2.gz JMZOGFBMTQZZRT-CYBMUJFWSA-N 2 2 373.413 2.535 20 5 FFBDLP CCOc1ccc(NC(=O)C[N@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)c([N+](=O)[O-])c1 ZINC000267416858 509468526 /nfs/dbraw/zinc/46/85/26/509468526.db2.gz JMZOGFBMTQZZRT-CYBMUJFWSA-N 2 2 373.413 2.535 20 5 FFBDLP O=[N+]([O-])c1cccc(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CCCO2)c1 ZINC000192357632 509479521 /nfs/dbraw/zinc/47/95/21/509479521.db2.gz FWPNEMPFRIDJBM-FQEVSTJZSA-N 2 2 355.438 2.976 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[NH+]3CCC(c4[nH]cc[nH+]4)CC3)n2)cc1 ZINC000265492964 510083812 /nfs/dbraw/zinc/08/38/12/510083812.db2.gz NQBMYYPJOKTNNG-UHFFFAOYSA-N 2 2 354.370 2.748 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(N2CC[NH+](C3CC[NH+](C(C)C)CC3)CC2)c1 ZINC000269323032 510339947 /nfs/dbraw/zinc/33/99/47/510339947.db2.gz JSPOPONQZWYIKI-UHFFFAOYSA-N 2 2 362.474 2.598 20 5 FFBDLP CCN(CCC[NH+]1CCCC1)C(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000188117231 510602792 /nfs/dbraw/zinc/60/27/92/510602792.db2.gz DIAHZGZJTAIAHX-UHFFFAOYSA-N 2 2 371.441 2.729 20 5 FFBDLP C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000246812554 510689347 /nfs/dbraw/zinc/68/93/47/510689347.db2.gz NJYNWJUTOZPPFZ-CLCXKQKWSA-N 2 2 372.469 2.871 20 5 FFBDLP C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000246812554 510689354 /nfs/dbraw/zinc/68/93/54/510689354.db2.gz NJYNWJUTOZPPFZ-CLCXKQKWSA-N 2 2 372.469 2.871 20 5 FFBDLP C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000246812554 510689360 /nfs/dbraw/zinc/68/93/60/510689360.db2.gz NJYNWJUTOZPPFZ-CLCXKQKWSA-N 2 2 372.469 2.871 20 5 FFBDLP C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000246812554 510689366 /nfs/dbraw/zinc/68/93/66/510689366.db2.gz NJYNWJUTOZPPFZ-CLCXKQKWSA-N 2 2 372.469 2.871 20 5 FFBDLP CN(C(=O)C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000246993748 510788256 /nfs/dbraw/zinc/78/82/56/510788256.db2.gz WNZXZSBSQSZGGJ-HNAYVOBHSA-N 2 2 372.469 2.506 20 5 FFBDLP CN(C(=O)C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000246993748 510788263 /nfs/dbraw/zinc/78/82/63/510788263.db2.gz WNZXZSBSQSZGGJ-HNAYVOBHSA-N 2 2 372.469 2.506 20 5 FFBDLP CN(C(=O)C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000246993748 510788270 /nfs/dbraw/zinc/78/82/70/510788270.db2.gz WNZXZSBSQSZGGJ-HNAYVOBHSA-N 2 2 372.469 2.506 20 5 FFBDLP CN(C(=O)C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000246993748 510788277 /nfs/dbraw/zinc/78/82/77/510788277.db2.gz WNZXZSBSQSZGGJ-HNAYVOBHSA-N 2 2 372.469 2.506 20 5 FFBDLP Cc1[nH+]c2ccccc2n1C1CC[NH+](CCn2ccc([N+](=O)[O-])n2)CC1 ZINC000280272724 511401801 /nfs/dbraw/zinc/40/18/01/511401801.db2.gz RFWLFLZROFYRSM-UHFFFAOYSA-N 2 2 354.414 2.787 20 5 FFBDLP COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[NH+]1CCC(c2c[nH]c[nH+]2)CC1 ZINC000374199715 512704211 /nfs/dbraw/zinc/70/42/11/512704211.db2.gz KYHPEUWKNWGTTA-LBPRGKRZSA-N 2 2 373.413 2.533 20 5 FFBDLP COc1ccc(NC(=O)[C@@H](C)[NH+]2CCC(c3c[nH]c[nH+]3)CC2)c([N+](=O)[O-])c1 ZINC000374207362 512707622 /nfs/dbraw/zinc/70/76/22/512707622.db2.gz IZYBYSBOHVHBFM-GFCCVEGCSA-N 2 2 373.413 2.533 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH+]1CCC(c2c[nH]c[nH+]2)CC1 ZINC000374211415 512708256 /nfs/dbraw/zinc/70/82/56/512708256.db2.gz KEIMZUOWMCSSQL-UHFFFAOYSA-N 2 2 357.414 2.835 20 5 FFBDLP COc1cc(C[N@@H+]2CCC[C@@H]([C@@H](C)[NH3+])C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000435372944 513567413 /nfs/dbraw/zinc/56/74/13/513567413.db2.gz CDEAVCXIKUJYMR-VXGBXAGGSA-N 2 2 373.400 2.807 20 5 FFBDLP COc1cc(C[N@H+]2CCC[C@@H]([C@@H](C)[NH3+])C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000435372944 513567418 /nfs/dbraw/zinc/56/74/18/513567418.db2.gz CDEAVCXIKUJYMR-VXGBXAGGSA-N 2 2 373.400 2.807 20 5 FFBDLP CC(C)C[C@H](CNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-])[NH+](C)C ZINC000447815704 513579453 /nfs/dbraw/zinc/57/94/53/513579453.db2.gz FZPBNOWPFLDRRT-QGZVFWFLSA-N 2 2 364.490 2.815 20 5 FFBDLP CC(C)(CNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)[NH+]1CCCCC1 ZINC000448581509 513793972 /nfs/dbraw/zinc/79/39/72/513793972.db2.gz KIZJMXRGUXYXIJ-UHFFFAOYSA-N 2 2 371.441 2.775 20 5 FFBDLP C[C@H](CNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)C[NH+]1CCCCC1 ZINC000448751170 513879970 /nfs/dbraw/zinc/87/99/70/513879970.db2.gz KQKZRCOGWQMOTO-OAHLLOKOSA-N 2 2 371.441 2.632 20 5 FFBDLP [NH3+]C[C@H]([NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1CCCCC1 ZINC000420356626 514109299 /nfs/dbraw/zinc/10/92/99/514109299.db2.gz GPZORLCSVFQXRC-AWEZNQCLSA-N 2 2 354.838 2.684 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCCC[N@H+]1CCO ZINC000449394587 514193690 /nfs/dbraw/zinc/19/36/90/514193690.db2.gz NXYYHNYBBXEHBK-QXAKKESOSA-N 2 2 361.486 2.742 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCCC[N@@H+]1CCO ZINC000449394587 514193693 /nfs/dbraw/zinc/19/36/93/514193693.db2.gz NXYYHNYBBXEHBK-QXAKKESOSA-N 2 2 361.486 2.742 20 5 FFBDLP COc1cc(C[NH2+]CC2([NH3+])CCCCC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000414845033 514320765 /nfs/dbraw/zinc/32/07/65/514320765.db2.gz QJWZEUFXPCHYCA-UHFFFAOYSA-N 2 2 373.400 2.999 20 5 FFBDLP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000482152916 515590084 /nfs/dbraw/zinc/59/00/84/515590084.db2.gz SSGPXTGZKCQYEG-IRXDYDNUSA-N 2 2 362.474 2.684 20 5 FFBDLP C[N@H+](CCN1CC[NH+](Cc2ccccc2)CC1)Cc1csc([N+](=O)[O-])c1 ZINC000511859393 516056541 /nfs/dbraw/zinc/05/65/41/516056541.db2.gz MSBHYOWFQGBCNM-UHFFFAOYSA-N 2 2 374.510 2.906 20 5 FFBDLP C[N@@H+](CCN1CC[NH+](Cc2ccccc2)CC1)Cc1csc([N+](=O)[O-])c1 ZINC000511859393 516056550 /nfs/dbraw/zinc/05/65/50/516056550.db2.gz MSBHYOWFQGBCNM-UHFFFAOYSA-N 2 2 374.510 2.906 20 5 FFBDLP C[C@H]1CN(c2c3ccccc3ncc2[N+](=O)[O-])CC[N@@H+]1C1CC[NH+](C)CC1 ZINC000488090917 516114863 /nfs/dbraw/zinc/11/48/63/516114863.db2.gz BNLBRDQXGVHLFU-HNNXBMFYSA-N 2 2 369.469 2.748 20 5 FFBDLP C[C@H]1CN(c2c3ccccc3ncc2[N+](=O)[O-])CC[N@H+]1C1CC[NH+](C)CC1 ZINC000488090917 516114872 /nfs/dbraw/zinc/11/48/72/516114872.db2.gz BNLBRDQXGVHLFU-HNNXBMFYSA-N 2 2 369.469 2.748 20 5 FFBDLP CCCC[N@H+](C)C[C@H](C)NC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000555114706 516787488 /nfs/dbraw/zinc/78/74/88/516787488.db2.gz JAFXHYNJUUAAPV-AWEZNQCLSA-N 2 2 359.430 2.631 20 5 FFBDLP CCCC[N@@H+](C)C[C@H](C)NC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000555114706 516787497 /nfs/dbraw/zinc/78/74/97/516787497.db2.gz JAFXHYNJUUAAPV-AWEZNQCLSA-N 2 2 359.430 2.631 20 5 FFBDLP CC[N@@H+]1CC[C@@H](N(C)C(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000524879799 516856212 /nfs/dbraw/zinc/85/62/12/516856212.db2.gz UGVOEKONXGITFT-GOEBONIOSA-N 2 2 371.441 2.725 20 5 FFBDLP CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000524879799 516856217 /nfs/dbraw/zinc/85/62/17/516856217.db2.gz UGVOEKONXGITFT-GOEBONIOSA-N 2 2 371.441 2.725 20 5 FFBDLP C[N@@H+]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)[C@H](C[NH3+])C1 ZINC000578443102 518214292 /nfs/dbraw/zinc/21/42/92/518214292.db2.gz VVABVQUQFDGWNO-CYBMUJFWSA-N 2 2 364.833 2.583 20 5 FFBDLP C[N@H+]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)[C@H](C[NH3+])C1 ZINC000578443102 518214294 /nfs/dbraw/zinc/21/42/94/518214294.db2.gz VVABVQUQFDGWNO-CYBMUJFWSA-N 2 2 364.833 2.583 20 5 FFBDLP C[C@H]([NH2+]C[C@@H](O)COc1cccc([N+](=O)[O-])c1)[C@@H](c1ccccc1)[NH+](C)C ZINC000591761296 520026484 /nfs/dbraw/zinc/02/64/84/520026484.db2.gz HKZCLWLZRVQZQO-CVAIRZPRSA-N 2 2 373.453 2.616 20 5 FFBDLP CCOc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCOC3)CC2)cc1[N+](=O)[O-] ZINC000595106581 520297529 /nfs/dbraw/zinc/29/75/29/520297529.db2.gz VKZIXAQCNATUIO-WMLDXEAASA-N 2 2 363.458 2.897 20 5 FFBDLP C[C@@H](CNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)C[NH+]1CCCCC1 ZINC000604439040 520563405 /nfs/dbraw/zinc/56/34/05/520563405.db2.gz WQUAHISHPUACAI-HNNXBMFYSA-N 2 2 371.441 2.632 20 5 FFBDLP CCO[C@@H]1C[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H]1C[NH3+] ZINC000593317741 520905560 /nfs/dbraw/zinc/90/55/60/520905560.db2.gz WFHTUJUSVJRKHR-CZUORRHYSA-N 2 2 362.455 2.514 20 5 FFBDLP CCO[C@@H]1C[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H]1C[NH3+] ZINC000593317741 520905562 /nfs/dbraw/zinc/90/55/62/520905562.db2.gz WFHTUJUSVJRKHR-CZUORRHYSA-N 2 2 362.455 2.514 20 5 FFBDLP Cc1cc(N2CCC[C@@H]3C[NH2+]CC[C@H]32)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000601982645 521056779 /nfs/dbraw/zinc/05/67/79/521056779.db2.gz KKUDHJDXJXRKCQ-NVXWUHKLSA-N 2 2 353.426 2.939 20 5 FFBDLP C[NH+]1CCC([NH+]2CCC(Nc3ncnc4ccc([N+](=O)[O-])cc43)CC2)CC1 ZINC000611711500 521291572 /nfs/dbraw/zinc/29/15/72/521291572.db2.gz VPQOHUUBHOITKB-UHFFFAOYSA-N 2 2 370.457 2.509 20 5 FFBDLP C[C@@H]1COCC[N@@H+]1C1CC[NH+](CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000593990929 521333610 /nfs/dbraw/zinc/33/36/10/521333610.db2.gz QICQLCJDWQJKPH-MRXNPFEDSA-N 2 2 363.458 2.549 20 5 FFBDLP C[C@@H]1COCC[N@H+]1C1CC[NH+](CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000593990929 521333617 /nfs/dbraw/zinc/33/36/17/521333617.db2.gz QICQLCJDWQJKPH-MRXNPFEDSA-N 2 2 363.458 2.549 20 5 FFBDLP O=C(N[C@H]1CCC[N@@H+]2CCCC[C@@H]12)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000594198700 521464506 /nfs/dbraw/zinc/46/45/06/521464506.db2.gz VCPGVBPGRAHVAS-HOTGVXAUSA-N 2 2 369.425 2.527 20 5 FFBDLP O=C(N[C@H]1CCC[N@H+]2CCCC[C@@H]12)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000594198700 521464514 /nfs/dbraw/zinc/46/45/14/521464514.db2.gz VCPGVBPGRAHVAS-HOTGVXAUSA-N 2 2 369.425 2.527 20 5 FFBDLP O=C(O[C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000810844089 994951350 /nfs/dbraw/zinc/95/13/50/994951350.db2.gz ZZGGYGNEJDKQIM-CABCVRRESA-N 2 2 356.382 2.564 20 5 FFBDLP O=C(O[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000810844089 994951359 /nfs/dbraw/zinc/95/13/59/994951359.db2.gz ZZGGYGNEJDKQIM-CABCVRRESA-N 2 2 356.382 2.564 20 5 FFBDLP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H]2C[NH+](Cc3cccnc3)C[C@H]2C1 ZINC001173220751 1012352254 /nfs/dbraw/zinc/35/22/54/1012352254.db2.gz CDCGTHDLOJNRSX-AHRSYUTCSA-N 2 2 366.465 2.985 20 5 FFBDLP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H]2C[NH+](Cc3cccnc3)C[C@H]2C1 ZINC001173220751 1012352267 /nfs/dbraw/zinc/35/22/67/1012352267.db2.gz CDCGTHDLOJNRSX-AHRSYUTCSA-N 2 2 366.465 2.985 20 5 FFBDLP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1C[C@H]2C[N@@H+](Cc3cccnc3)C[C@H]2C1 ZINC001173220751 1012352281 /nfs/dbraw/zinc/35/22/81/1012352281.db2.gz CDCGTHDLOJNRSX-AHRSYUTCSA-N 2 2 366.465 2.985 20 5 FFBDLP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1C[C@H]2C[N@H+](Cc3cccnc3)C[C@H]2C1 ZINC001173220751 1012352299 /nfs/dbraw/zinc/35/22/99/1012352299.db2.gz CDCGTHDLOJNRSX-AHRSYUTCSA-N 2 2 366.465 2.985 20 5 FFBDLP Cc1cc(N2CC[NH+]([C@H](C)Cc3ccc([N+](=O)[O-])cc3)CC2)nc(C)[nH+]1 ZINC001173226585 1012360483 /nfs/dbraw/zinc/36/04/83/1012360483.db2.gz KNIKJEVYXSCEJK-OAHLLOKOSA-N 2 2 355.442 2.755 20 5 FFBDLP COc1cc[nH+]c(N2CC[NH+]([C@H](C)Cc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC001173237745 1012386278 /nfs/dbraw/zinc/38/62/78/1012386278.db2.gz LULHKVFJUKVXKU-OAHLLOKOSA-N 2 2 356.426 2.752 20 5 FFBDLP O=C(O[C@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000835396342 1035744993 /nfs/dbraw/zinc/74/49/93/1035744993.db2.gz MFGJSKNLEAEVKH-GJZGRUSLSA-N 2 2 356.382 2.564 20 5 FFBDLP O=C(O[C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000835396342 1035745008 /nfs/dbraw/zinc/74/50/08/1035745008.db2.gz MFGJSKNLEAEVKH-GJZGRUSLSA-N 2 2 356.382 2.564 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH2+]CC1CCN(c3cccc[nH+]3)CC1)C2 ZINC001254578382 1040811881 /nfs/dbraw/zinc/81/18/81/1040811881.db2.gz KPCLXYBODQWPDV-SFHVURJKSA-N 2 2 352.438 2.963 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)C[C@@H](N(c1cc[nH+]cc1F)C1CC[NH2+]CC1)C2 ZINC001254612165 1040841421 /nfs/dbraw/zinc/84/14/21/1040841421.db2.gz VOXYWVCSSTYBPF-KRWDZBQOSA-N 2 2 356.401 2.855 20 5 FFBDLP Cc1[nH+]ccn1-c1cc[nH+]cc1NC(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC001339740127 1050165034 /nfs/dbraw/zinc/16/50/34/1050165034.db2.gz DVAGYUMERMTYIB-UHFFFAOYSA-N 2 2 367.365 2.810 20 5 FFBDLP Cc1c(NC(=O)[C@@H](C)[NH+]2CCC(c3c[nH+]cn3C)CC2)cccc1[N+](=O)[O-] ZINC001308167803 1052423293 /nfs/dbraw/zinc/42/32/93/1052423293.db2.gz JLUKXQKPMBQWCQ-CQSZACIVSA-N 2 2 371.441 2.843 20 5 FFBDLP CC[NH+](CC)CC[C@@H](C)NC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC001348855072 1054964595 /nfs/dbraw/zinc/96/45/95/1054964595.db2.gz MMUAASKXOYGHLZ-CQSZACIVSA-N 2 2 359.430 2.631 20 5 FFBDLP C[C@@H](COC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)[NH+]1CCCCC1 ZINC000847958185 1058518732 /nfs/dbraw/zinc/51/87/32/1058518732.db2.gz FJDMNUPLNVFWDI-AWEZNQCLSA-N 2 2 358.398 2.812 20 5 FFBDLP Cn1cc(C[N@@H+]2CC[C@H]3CC[NH+](C)C[C@@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272625524 252083918 /nfs/dbraw/zinc/08/39/18/252083918.db2.gz MKHXDKGSVHEZJN-KDOFPFPSSA-N 2 2 355.442 2.521 20 5 FFBDLP Cn1cc(C[N@H+]2CC[C@H]3CC[NH+](C)C[C@@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272625524 252083922 /nfs/dbraw/zinc/08/39/22/252083922.db2.gz MKHXDKGSVHEZJN-KDOFPFPSSA-N 2 2 355.442 2.521 20 5 FFBDLP Cn1cc(C[NH+]2CC[C@H]3CC[N@H+](C)C[C@@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272625524 252083925 /nfs/dbraw/zinc/08/39/25/252083925.db2.gz MKHXDKGSVHEZJN-KDOFPFPSSA-N 2 2 355.442 2.521 20 5 FFBDLP Cn1cc(C[NH+]2CC[C@H]3CC[N@@H+](C)C[C@@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272625524 252083927 /nfs/dbraw/zinc/08/39/27/252083927.db2.gz MKHXDKGSVHEZJN-KDOFPFPSSA-N 2 2 355.442 2.521 20 5 FFBDLP Cc1c(NC(=O)CC[N@@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)cccc1[N+](=O)[O-] ZINC000080959607 508117111 /nfs/dbraw/zinc/11/71/11/508117111.db2.gz AKDWPACILQYNDU-AWEZNQCLSA-N 2 2 357.414 2.835 20 5 FFBDLP Cc1c(NC(=O)CC[N@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)cccc1[N+](=O)[O-] ZINC000080959607 508117112 /nfs/dbraw/zinc/11/71/12/508117112.db2.gz AKDWPACILQYNDU-AWEZNQCLSA-N 2 2 357.414 2.835 20 5 FFBDLP COCC[N@H+](C)CCCC1CC[NH+](Cc2cc(O)ccc2[N+](=O)[O-])CC1 ZINC000093769385 508154532 /nfs/dbraw/zinc/15/45/32/508154532.db2.gz WXKDDHNDVKABKV-UHFFFAOYSA-N 2 2 365.474 2.871 20 5 FFBDLP COCC[N@@H+](C)CCCC1CC[NH+](Cc2cc(O)ccc2[N+](=O)[O-])CC1 ZINC000093769385 508154533 /nfs/dbraw/zinc/15/45/33/508154533.db2.gz WXKDDHNDVKABKV-UHFFFAOYSA-N 2 2 365.474 2.871 20 5 FFBDLP CC1CC[NH+](C[C@@H]2CCC[N@H+](Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C2)CC1 ZINC000112657861 508206698 /nfs/dbraw/zinc/20/66/98/508206698.db2.gz PQWFTVIPYSUPIJ-INIZCTEOSA-N 2 2 374.485 2.638 20 5 FFBDLP CC1CC[NH+](C[C@@H]2CCC[N@@H+](Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C2)CC1 ZINC000112657861 508206699 /nfs/dbraw/zinc/20/66/99/508206699.db2.gz PQWFTVIPYSUPIJ-INIZCTEOSA-N 2 2 374.485 2.638 20 5 FFBDLP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000136302991 508684935 /nfs/dbraw/zinc/68/49/35/508684935.db2.gz HUGHGXQBHCZXST-UHFFFAOYSA-N 2 2 356.386 2.672 20 5 FFBDLP Cc1[nH+]ccn1CCC[N@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000136302991 508684941 /nfs/dbraw/zinc/68/49/41/508684941.db2.gz HUGHGXQBHCZXST-UHFFFAOYSA-N 2 2 356.386 2.672 20 5 FFBDLP O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](Cc3ccc(-n4cc[nH+]c4)cc3)C2)nc1 ZINC000118866041 508687687 /nfs/dbraw/zinc/68/76/87/508687687.db2.gz NTDPNJNHCNGKAK-INIZCTEOSA-N 2 2 364.409 2.862 20 5 FFBDLP O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3ccc(-n4cc[nH+]c4)cc3)C2)nc1 ZINC000118866041 508687689 /nfs/dbraw/zinc/68/76/89/508687689.db2.gz NTDPNJNHCNGKAK-INIZCTEOSA-N 2 2 364.409 2.862 20 5 FFBDLP C[N@@H+]1CCC[C@H]2C[NH+](Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)CC[C@@H]21 ZINC000158593465 508725430 /nfs/dbraw/zinc/72/54/30/508725430.db2.gz SPPLINHUNNJSBU-HOCLYGCPSA-N 2 2 357.414 2.561 20 5 FFBDLP C[N@H+]1CCC[C@H]2C[NH+](Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)CC[C@@H]21 ZINC000158593465 508725433 /nfs/dbraw/zinc/72/54/33/508725433.db2.gz SPPLINHUNNJSBU-HOCLYGCPSA-N 2 2 357.414 2.561 20 5 FFBDLP C[NH+]1CCC[C@H]2C[N@H+](Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)CC[C@@H]21 ZINC000158593465 508725439 /nfs/dbraw/zinc/72/54/39/508725439.db2.gz SPPLINHUNNJSBU-HOCLYGCPSA-N 2 2 357.414 2.561 20 5 FFBDLP C[NH+]1CCC[C@H]2C[N@@H+](Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)CC[C@@H]21 ZINC000158593465 508725441 /nfs/dbraw/zinc/72/54/41/508725441.db2.gz SPPLINHUNNJSBU-HOCLYGCPSA-N 2 2 357.414 2.561 20 5 FFBDLP Cc1ccc([C@@H](C)[NH2+]C[C@@H](O)C[N@@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000151782581 509081951 /nfs/dbraw/zinc/08/19/51/509081951.db2.gz OAUBAUOTASBPRK-OXQOHEQNSA-N 2 2 369.465 2.973 20 5 FFBDLP Cc1ccc([C@@H](C)[NH2+]C[C@@H](O)C[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000151782581 509081955 /nfs/dbraw/zinc/08/19/55/509081955.db2.gz OAUBAUOTASBPRK-OXQOHEQNSA-N 2 2 369.465 2.973 20 5 FFBDLP C[C@H]([NH2+]C[C@@H](O)C[N@@H+]1CCc2ccccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000151801269 509085628 /nfs/dbraw/zinc/08/56/28/509085628.db2.gz BQPQZHQVFITUOO-MGPUTAFESA-N 2 2 355.438 2.665 20 5 FFBDLP C[C@H]([NH2+]C[C@@H](O)C[N@H+]1CCc2ccccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000151801269 509085631 /nfs/dbraw/zinc/08/56/31/509085631.db2.gz BQPQZHQVFITUOO-MGPUTAFESA-N 2 2 355.438 2.665 20 5 FFBDLP C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000265443708 510057647 /nfs/dbraw/zinc/05/76/47/510057647.db2.gz AGUFLYAOXWNGMB-QWHCGFSZSA-N 2 2 368.865 2.849 20 5 FFBDLP C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000265443708 510057649 /nfs/dbraw/zinc/05/76/49/510057649.db2.gz AGUFLYAOXWNGMB-QWHCGFSZSA-N 2 2 368.865 2.849 20 5 FFBDLP C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[NH+](C)C[C@@H]1CCC[N@H+](C)C1 ZINC000265443708 510057655 /nfs/dbraw/zinc/05/76/55/510057655.db2.gz AGUFLYAOXWNGMB-QWHCGFSZSA-N 2 2 368.865 2.849 20 5 FFBDLP C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[NH+](C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000265443708 510057660 /nfs/dbraw/zinc/05/76/60/510057660.db2.gz AGUFLYAOXWNGMB-QWHCGFSZSA-N 2 2 368.865 2.849 20 5 FFBDLP COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[NH+]1CCC(c2[nH]cc[nH+]2)CC1 ZINC000265492891 510083961 /nfs/dbraw/zinc/08/39/61/510083961.db2.gz NMVVJNZLVUJTEC-GFCCVEGCSA-N 2 2 373.413 2.533 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000245751075 510129178 /nfs/dbraw/zinc/12/91/78/510129178.db2.gz YTWTYGHLHOKVEF-YOEHRIQHSA-N 2 2 357.414 2.621 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000245751075 510129185 /nfs/dbraw/zinc/12/91/85/510129185.db2.gz YTWTYGHLHOKVEF-YOEHRIQHSA-N 2 2 357.414 2.621 20 5 FFBDLP C[NH+]1CCC([NH+]2CCC(Nc3c(F)cc([N+](=O)[O-])cc3F)CC2)CC1 ZINC000269647622 510498293 /nfs/dbraw/zinc/49/82/93/510498293.db2.gz PTPYPEOGRMNWAW-UHFFFAOYSA-N 2 2 354.401 2.844 20 5 FFBDLP COCC[NH+](CCOC)C1CC[NH+]([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000285558634 510955151 /nfs/dbraw/zinc/95/51/51/510955151.db2.gz SHPYELRERSOTBH-MRXNPFEDSA-N 2 2 365.474 2.715 20 5 FFBDLP CN(Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C2CC[NH+](C)CC2)C1 ZINC000362253499 511154997 /nfs/dbraw/zinc/15/49/97/511154997.db2.gz DWKGTYVKDFUMMQ-QGZVFWFLSA-N 2 2 366.893 2.849 20 5 FFBDLP CN(Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CC[NH+](C)CC2)C1 ZINC000362253499 511155003 /nfs/dbraw/zinc/15/50/03/511155003.db2.gz DWKGTYVKDFUMMQ-QGZVFWFLSA-N 2 2 366.893 2.849 20 5 FFBDLP C[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000362253499 511155007 /nfs/dbraw/zinc/15/50/07/511155007.db2.gz DWKGTYVKDFUMMQ-QGZVFWFLSA-N 2 2 366.893 2.849 20 5 FFBDLP C[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000362253499 511155010 /nfs/dbraw/zinc/15/50/10/511155010.db2.gz DWKGTYVKDFUMMQ-QGZVFWFLSA-N 2 2 366.893 2.849 20 5 FFBDLP CCOc1cc(N2CC[NH+](CC[C@@H]3CCC[N@@H+]3C)CC2)ccc1[N+](=O)[O-] ZINC000280322630 511420808 /nfs/dbraw/zinc/42/08/08/511420808.db2.gz YNQBIXCJRJIOPR-INIZCTEOSA-N 2 2 362.474 2.600 20 5 FFBDLP CCOc1cc(N2CC[NH+](CC[C@@H]3CCC[N@H+]3C)CC2)ccc1[N+](=O)[O-] ZINC000280322630 511420810 /nfs/dbraw/zinc/42/08/10/511420810.db2.gz YNQBIXCJRJIOPR-INIZCTEOSA-N 2 2 362.474 2.600 20 5 FFBDLP Cc1c(NC(=O)CC[N@H+]2CCC[C@@H](c3[nH+]ccn3C)C2)cccc1[N+](=O)[O-] ZINC000365625975 511567769 /nfs/dbraw/zinc/56/77/69/511567769.db2.gz IUUOGPVIVOMLBV-OAHLLOKOSA-N 2 2 371.441 2.845 20 5 FFBDLP Cc1c(NC(=O)CC[N@@H+]2CCC[C@@H](c3[nH+]ccn3C)C2)cccc1[N+](=O)[O-] ZINC000365625975 511567774 /nfs/dbraw/zinc/56/77/74/511567774.db2.gz IUUOGPVIVOMLBV-OAHLLOKOSA-N 2 2 371.441 2.845 20 5 FFBDLP Cn1cc[nH+]c1[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000365633067 511571641 /nfs/dbraw/zinc/57/16/41/511571641.db2.gz URKOPWBWVHRRDF-ZDUSSCGKSA-N 2 2 358.398 2.574 20 5 FFBDLP Cn1cc[nH+]c1[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000365633067 511571642 /nfs/dbraw/zinc/57/16/42/511571642.db2.gz URKOPWBWVHRRDF-ZDUSSCGKSA-N 2 2 358.398 2.574 20 5 FFBDLP COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000363562305 511629501 /nfs/dbraw/zinc/62/95/01/511629501.db2.gz LLLIARJLBOAOFQ-QWHCGFSZSA-N 2 2 373.413 2.533 20 5 FFBDLP COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000363562305 511629509 /nfs/dbraw/zinc/62/95/09/511629509.db2.gz LLLIARJLBOAOFQ-QWHCGFSZSA-N 2 2 373.413 2.533 20 5 FFBDLP CC(=O)c1cc(N2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4C)CC2)ccc1[N+](=O)[O-] ZINC000367330815 512448327 /nfs/dbraw/zinc/44/83/27/512448327.db2.gz BNBYDMMESQJQBO-BYICEURKSA-N 2 2 372.469 2.545 20 5 FFBDLP CC(=O)c1cc(N2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)ccc1[N+](=O)[O-] ZINC000367330815 512448331 /nfs/dbraw/zinc/44/83/31/512448331.db2.gz BNBYDMMESQJQBO-BYICEURKSA-N 2 2 372.469 2.545 20 5 FFBDLP C[C@H]1CN(c2nccc3c2cccc3[N+](=O)[O-])CC[N@@H+]1C1CC[NH+](C)CC1 ZINC000450417560 513185571 /nfs/dbraw/zinc/18/55/71/513185571.db2.gz JVJVYYYSMXEZKN-HNNXBMFYSA-N 2 2 369.469 2.748 20 5 FFBDLP C[C@H]1CN(c2nccc3c2cccc3[N+](=O)[O-])CC[N@H+]1C1CC[NH+](C)CC1 ZINC000450417560 513185577 /nfs/dbraw/zinc/18/55/77/513185577.db2.gz JVJVYYYSMXEZKN-HNNXBMFYSA-N 2 2 369.469 2.748 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CCOCC2)cc1NC1CC[NH+](CC2CC2)CC1 ZINC000447814248 513580479 /nfs/dbraw/zinc/58/04/79/513580479.db2.gz XCCSEFUBVYWONG-UHFFFAOYSA-N 2 2 374.485 2.713 20 5 FFBDLP COc1cc(C[N@H+](C)[C@@H]2CCC[NH2+]CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000435620615 513641402 /nfs/dbraw/zinc/64/14/02/513641402.db2.gz DPWYVOMNAJDBNE-GFCCVEGCSA-N 2 2 359.373 2.779 20 5 FFBDLP COc1cc(C[N@@H+](C)[C@@H]2CCC[NH2+]CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000435620615 513641410 /nfs/dbraw/zinc/64/14/10/513641410.db2.gz DPWYVOMNAJDBNE-GFCCVEGCSA-N 2 2 359.373 2.779 20 5 FFBDLP CC(C)[NH+]1CCC(N(C)C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)CC1 ZINC000448637680 513823198 /nfs/dbraw/zinc/82/31/98/513823198.db2.gz FPBPJLMZPUCJFG-UHFFFAOYSA-N 2 2 371.441 2.725 20 5 FFBDLP CC[C@H]1CCCC[N@@H+]1CCNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000448984990 514007367 /nfs/dbraw/zinc/00/73/67/514007367.db2.gz VKHNQVXHFSAYDY-INIZCTEOSA-N 2 2 371.441 2.775 20 5 FFBDLP CC[C@H]1CCCC[N@H+]1CCNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000448984990 514007373 /nfs/dbraw/zinc/00/73/73/514007373.db2.gz VKHNQVXHFSAYDY-INIZCTEOSA-N 2 2 371.441 2.775 20 5 FFBDLP CCOc1ccc([C@H](C)Nc2ccc(N3CC[NH2+]CC3)c[nH+]2)cc1[N+](=O)[O-] ZINC000423234807 514087232 /nfs/dbraw/zinc/08/72/32/514087232.db2.gz QLGUAVRYOMLTGD-AWEZNQCLSA-N 2 2 371.441 2.971 20 5 FFBDLP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]C[C@H]2[NH2+]CCc3ccccc32)n1 ZINC000423415029 514135016 /nfs/dbraw/zinc/13/50/16/514135016.db2.gz DDFBFZZFPWSOAA-RCCFBDPRSA-N 2 2 355.442 2.752 20 5 FFBDLP NC1(C[NH2+]Cc2ccc([N+](=O)[O-])cc2F)CC[NH+](Cc2ccccc2)CC1 ZINC000415136257 514461995 /nfs/dbraw/zinc/46/19/95/514461995.db2.gz RCIVXBYPMLGBRV-UHFFFAOYSA-N 2 2 372.444 2.817 20 5 FFBDLP C[NH+](C)CC1CCC(NC(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)CC1 ZINC000450192914 514534272 /nfs/dbraw/zinc/53/42/72/514534272.db2.gz BKQQAWAQRJITMN-UHFFFAOYSA-N 2 2 371.441 2.631 20 5 FFBDLP Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000533271379 517377545 /nfs/dbraw/zinc/37/75/45/517377545.db2.gz JAFTXPQMIOSDML-UHFFFAOYSA-N 2 2 362.474 2.894 20 5 FFBDLP Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC000533271379 517377551 /nfs/dbraw/zinc/37/75/51/517377551.db2.gz JAFTXPQMIOSDML-UHFFFAOYSA-N 2 2 362.474 2.894 20 5 FFBDLP CC(C)C[C@@H](CN[C@H](c1[nH+]ccn1C)c1cccc([N+](=O)[O-])c1)[NH+](C)C ZINC000557393528 517988911 /nfs/dbraw/zinc/98/89/11/517988911.db2.gz SQFNXLGTFHMHHP-ROUUACIJSA-N 2 2 359.474 2.984 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@@]1(O)CC[N@H+](Cc2ccccc2)C1 ZINC000543613948 518153008 /nfs/dbraw/zinc/15/30/08/518153008.db2.gz QMIUNWVHGRPHPX-FQEVSTJZSA-N 2 2 355.438 2.630 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000543613948 518153011 /nfs/dbraw/zinc/15/30/11/518153011.db2.gz QMIUNWVHGRPHPX-FQEVSTJZSA-N 2 2 355.438 2.630 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CCOCC2)cc1N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000582042654 518558984 /nfs/dbraw/zinc/55/89/84/518558984.db2.gz SORPMHCBRZQIQC-INIZCTEOSA-N 2 2 371.441 2.534 20 5 FFBDLP CN(C/C=C\c1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C2CC[NH+](C)CC2)C1 ZINC000589195499 518947030 /nfs/dbraw/zinc/94/70/30/518947030.db2.gz APUHAJUTOSPKKB-SUOMESGTSA-N 2 2 358.486 2.708 20 5 FFBDLP CN(C/C=C\c1ccccc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CC[NH+](C)CC2)C1 ZINC000589195499 518947035 /nfs/dbraw/zinc/94/70/35/518947035.db2.gz APUHAJUTOSPKKB-SUOMESGTSA-N 2 2 358.486 2.708 20 5 FFBDLP C[C@H]([NH2+]C[C@@H](O)COc1ccccc1[N+](=O)[O-])[C@H](c1ccccc1)[NH+](C)C ZINC000574686176 519281187 /nfs/dbraw/zinc/28/11/87/519281187.db2.gz KLRZEZRBFBWTDP-XAUMDUMWSA-N 2 2 373.453 2.616 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C1CC[NH+]([C@@H]2CCC[C@H]2O)CC1 ZINC000595023346 520260956 /nfs/dbraw/zinc/26/09/56/520260956.db2.gz VZVWJHHNSDJOPR-MORSLUCNSA-N 2 2 363.458 2.632 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]C1CC[NH+]([C@@H]2CCOC2)CC1)C1CC1 ZINC000595102183 520294976 /nfs/dbraw/zinc/29/49/76/520294976.db2.gz LANXIYSWSPOQIF-RTBURBONSA-N 2 2 359.470 2.759 20 5 FFBDLP Cc1ccc(NC(=O)[C@@H](c2ccccc2)[N@@H+]2CC[C@@H](C[NH3+])C2)c([N+](=O)[O-])c1 ZINC000592471489 520403240 /nfs/dbraw/zinc/40/32/40/520403240.db2.gz MCKOUYMGZWODON-HNAYVOBHSA-N 2 2 368.437 2.864 20 5 FFBDLP Cc1ccc(NC(=O)[C@@H](c2ccccc2)[N@H+]2CC[C@@H](C[NH3+])C2)c([N+](=O)[O-])c1 ZINC000592471489 520403248 /nfs/dbraw/zinc/40/32/48/520403248.db2.gz MCKOUYMGZWODON-HNAYVOBHSA-N 2 2 368.437 2.864 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@H]([C@@H]4CCC[NH2+]4)C3)n2)c1 ZINC000592478693 520406654 /nfs/dbraw/zinc/40/66/54/520406654.db2.gz IGEFJCQRQNEVED-HOCLYGCPSA-N 2 2 357.414 2.609 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@H]([C@@H]4CCC[NH2+]4)C3)n2)c1 ZINC000592478693 520406657 /nfs/dbraw/zinc/40/66/57/520406657.db2.gz IGEFJCQRQNEVED-HOCLYGCPSA-N 2 2 357.414 2.609 20 5 FFBDLP Cc1c(NC(=O)CC[N@@H+]2CCc3ccccc3[C@H]2C[NH3+])cccc1[N+](=O)[O-] ZINC000592494843 520419059 /nfs/dbraw/zinc/41/90/59/520419059.db2.gz ABNMEDTZMNITKY-LJQANCHMSA-N 2 2 368.437 2.790 20 5 FFBDLP Cc1c(NC(=O)CC[N@H+]2CCc3ccccc3[C@H]2C[NH3+])cccc1[N+](=O)[O-] ZINC000592494843 520419067 /nfs/dbraw/zinc/41/90/67/520419067.db2.gz ABNMEDTZMNITKY-LJQANCHMSA-N 2 2 368.437 2.790 20 5 FFBDLP CCOc1cc(C[N@@H+]2CCC[C@H]([NH+]3CCOCC3)CC2)ccc1[N+](=O)[O-] ZINC000595473003 520493439 /nfs/dbraw/zinc/49/34/39/520493439.db2.gz RZUDLFWBRNIKPW-KRWDZBQOSA-N 2 2 363.458 2.680 20 5 FFBDLP CCOc1cc(C[N@H+]2CCC[C@H]([NH+]3CCOCC3)CC2)ccc1[N+](=O)[O-] ZINC000595473003 520493445 /nfs/dbraw/zinc/49/34/45/520493445.db2.gz RZUDLFWBRNIKPW-KRWDZBQOSA-N 2 2 363.458 2.680 20 5 FFBDLP Cc1[nH+]c2ccccc2n1C[C@H]1CCC[N@H+]1Cc1cn(C)nc1[N+](=O)[O-] ZINC000602487394 521375660 /nfs/dbraw/zinc/37/56/60/521375660.db2.gz ZKJRGLAQRDXYLF-OAHLLOKOSA-N 2 2 354.414 2.651 20 5 FFBDLP Cc1[nH+]c2ccccc2n1C[C@H]1CCC[N@@H+]1Cc1cn(C)nc1[N+](=O)[O-] ZINC000602487394 521375667 /nfs/dbraw/zinc/37/56/67/521375667.db2.gz ZKJRGLAQRDXYLF-OAHLLOKOSA-N 2 2 354.414 2.651 20 5 FFBDLP C[NH+](C)CCOc1ccccc1C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602525863 521395230 /nfs/dbraw/zinc/39/52/30/521395230.db2.gz SVPDKPKEFYABOU-UHFFFAOYSA-N 2 2 370.409 2.966 20 5 FFBDLP CN(Cc1cc(Cl)ccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C2CC[NH+](C)CC2)C1 ZINC000774739904 738020822 /nfs/dbraw/zinc/02/08/22/738020822.db2.gz QHKPJAUJXFQWBB-QGZVFWFLSA-N 2 2 366.893 2.849 20 5 FFBDLP CN(Cc1cc(Cl)ccc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CC[NH+](C)CC2)C1 ZINC000774739904 738020827 /nfs/dbraw/zinc/02/08/27/738020827.db2.gz QHKPJAUJXFQWBB-QGZVFWFLSA-N 2 2 366.893 2.849 20 5 FFBDLP C[N@H+](CCc1ccccc1[N+](=O)[O-])C[C@@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC000711779437 964264567 /nfs/dbraw/zinc/26/45/67/964264567.db2.gz NKUAKRMBWSVEAM-NRFANRHFSA-N 2 2 369.465 2.706 20 5 FFBDLP C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC000711779437 964264581 /nfs/dbraw/zinc/26/45/81/964264581.db2.gz NKUAKRMBWSVEAM-NRFANRHFSA-N 2 2 369.465 2.706 20 5 FFBDLP C[NH+](CCc1ccccc1[N+](=O)[O-])C[C@@]1(O)CC[N@H+](Cc2ccccc2)C1 ZINC000711779437 964264604 /nfs/dbraw/zinc/26/46/04/964264604.db2.gz NKUAKRMBWSVEAM-NRFANRHFSA-N 2 2 369.465 2.706 20 5 FFBDLP C[NH+](CCc1ccccc1[N+](=O)[O-])C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000711779437 964264620 /nfs/dbraw/zinc/26/46/20/964264620.db2.gz NKUAKRMBWSVEAM-NRFANRHFSA-N 2 2 369.465 2.706 20 5 FFBDLP Cc1nn(C[N@H+]2CC[C@@H](C)[C@@H](n3cc[nH+]c3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000765084583 984957060 /nfs/dbraw/zinc/95/70/60/984957060.db2.gz WEDJSFZCPNKNSV-ACJLOTCBSA-N 2 2 354.414 2.990 20 5 FFBDLP Cc1nn(C[N@@H+]2CC[C@@H](C)[C@@H](n3cc[nH+]c3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000765084583 984957063 /nfs/dbraw/zinc/95/70/63/984957063.db2.gz WEDJSFZCPNKNSV-ACJLOTCBSA-N 2 2 354.414 2.990 20 5 FFBDLP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cn1 ZINC000788556990 1001819686 /nfs/dbraw/zinc/81/96/86/1001819686.db2.gz IXXLERLQKKICEG-GFCCVEGCSA-N 2 2 352.398 2.917 20 5 FFBDLP Cc1cccc(NC[C@@H]2CCC[N@@H+]2C[C@@H](O)c2cccc([N+](=O)[O-])c2)[nH+]1 ZINC001116351699 1021175958 /nfs/dbraw/zinc/17/59/58/1021175958.db2.gz ISHFVUOFCWVLBW-ZWKOTPCHSA-N 2 2 356.426 2.908 20 5 FFBDLP Cc1cccc(NC[C@@H]2CCC[N@H+]2C[C@@H](O)c2cccc([N+](=O)[O-])c2)[nH+]1 ZINC001116351699 1021175962 /nfs/dbraw/zinc/17/59/62/1021175962.db2.gz ISHFVUOFCWVLBW-ZWKOTPCHSA-N 2 2 356.426 2.908 20 5 FFBDLP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](CCCC[NH3+])C(=O)OC(C)(C)C ZINC001246201225 1039277585 /nfs/dbraw/zinc/27/75/85/1039277585.db2.gz HWHISCDSLWJCBJ-PBHICJAKSA-N 2 2 365.474 2.955 20 5 FFBDLP O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1 ZINC001333680209 1049050203 /nfs/dbraw/zinc/05/02/03/1049050203.db2.gz NDXYMZZMPGJMQL-MRXNPFEDSA-N 2 2 353.850 2.981 20 5 FFBDLP O=[N+]([O-])c1ccccc1-c1cnn(C[N@@H+]2CCC[C@H](n3cc[nH+]c3)C2)c1 ZINC000848478555 1060110465 /nfs/dbraw/zinc/11/04/65/1060110465.db2.gz JZSTZRNCYRESQA-INIZCTEOSA-N 2 2 352.398 2.949 20 5 FFBDLP O=[N+]([O-])c1ccccc1-c1cnn(C[N@H+]2CCC[C@H](n3cc[nH+]c3)C2)c1 ZINC000848478555 1060110470 /nfs/dbraw/zinc/11/04/70/1060110470.db2.gz JZSTZRNCYRESQA-INIZCTEOSA-N 2 2 352.398 2.949 20 5 FFBDLP CC[N@@H+]1CC[C@H](C[NH2+]Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])C1 ZINC000272441804 252038951 /nfs/dbraw/zinc/03/89/51/252038951.db2.gz OPTUVVRBJAMCQN-GFCCVEGCSA-N 2 2 373.400 2.679 20 5 FFBDLP CC[N@H+]1CC[C@H](C[NH2+]Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])C1 ZINC000272441804 252038955 /nfs/dbraw/zinc/03/89/55/252038955.db2.gz OPTUVVRBJAMCQN-GFCCVEGCSA-N 2 2 373.400 2.679 20 5 FFBDLP Cn1cc[nH+]c1[C@@H](NCC1([NH+](C)C)CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000272531888 252061541 /nfs/dbraw/zinc/06/15/41/252061541.db2.gz NEHUKYYPYVMNOJ-KRWDZBQOSA-N 2 2 357.458 2.882 20 5 FFBDLP CCN1CC[NH+]([C@H](C)CNc2cc(C)[nH+]c3ccc([N+](=O)[O-])cc23)CC1 ZINC000302162904 258092244 /nfs/dbraw/zinc/09/22/44/258092244.db2.gz KHNBNTZIMHCONN-OAHLLOKOSA-N 2 2 357.458 2.889 20 5 FFBDLP C[C@@H]1C[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000371305410 512318112 /nfs/dbraw/zinc/31/81/12/512318112.db2.gz YRCVWEZLELBQDW-KDOFPFPSSA-N 2 2 366.893 2.706 20 5 FFBDLP C[C@@H]1C[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000371305410 512318116 /nfs/dbraw/zinc/31/81/16/512318116.db2.gz YRCVWEZLELBQDW-KDOFPFPSSA-N 2 2 366.893 2.706 20 5 FFBDLP C[N@@H+]1CCCC12CC[NH+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)CC2 ZINC000373425371 512324421 /nfs/dbraw/zinc/32/44/21/512324421.db2.gz CRYLZLUDYYNKBB-UHFFFAOYSA-N 2 2 364.421 2.623 20 5 FFBDLP C[N@H+]1CCCC12CC[NH+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)CC2 ZINC000373425371 512324423 /nfs/dbraw/zinc/32/44/23/512324423.db2.gz CRYLZLUDYYNKBB-UHFFFAOYSA-N 2 2 364.421 2.623 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000080960253 508117874 /nfs/dbraw/zinc/11/78/74/508117874.db2.gz KMNMWNZZBNVSGB-AWEZNQCLSA-N 2 2 357.414 2.835 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000080960253 508117877 /nfs/dbraw/zinc/11/78/77/508117877.db2.gz KMNMWNZZBNVSGB-AWEZNQCLSA-N 2 2 357.414 2.835 20 5 FFBDLP C[C@@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000116396638 508506590 /nfs/dbraw/zinc/50/65/90/508506590.db2.gz GNYSRCXXHFZIAQ-CJNGLKHVSA-N 2 2 350.463 2.878 20 5 FFBDLP CN1CC[N@H+](C)C[C@H]1C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000264738026 509675099 /nfs/dbraw/zinc/67/50/99/509675099.db2.gz JMWPLJDMFLKONU-CQSZACIVSA-N 2 2 360.483 2.659 20 5 FFBDLP CN1CC[N@@H+](C)C[C@H]1C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000264738026 509675106 /nfs/dbraw/zinc/67/51/06/509675106.db2.gz JMWPLJDMFLKONU-CQSZACIVSA-N 2 2 360.483 2.659 20 5 FFBDLP C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261884669 510101360 /nfs/dbraw/zinc/10/13/60/510101360.db2.gz YXNNTHLWLVRLCL-OIISXLGYSA-N 2 2 368.437 2.596 20 5 FFBDLP C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261884669 510101365 /nfs/dbraw/zinc/10/13/65/510101365.db2.gz YXNNTHLWLVRLCL-OIISXLGYSA-N 2 2 368.437 2.596 20 5 FFBDLP C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000247781861 510870483 /nfs/dbraw/zinc/87/04/83/510870483.db2.gz XTBUISOICGAPIQ-CKEIUWERSA-N 2 2 357.414 2.701 20 5 FFBDLP C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000247781861 510870484 /nfs/dbraw/zinc/87/04/84/510870484.db2.gz XTBUISOICGAPIQ-CKEIUWERSA-N 2 2 357.414 2.701 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH+]1CCC(c2c[nH]c[nH+]2)CC1 ZINC000374199767 512704913 /nfs/dbraw/zinc/70/49/13/512704913.db2.gz LADUCLGGIPBIML-UHFFFAOYSA-N 2 2 373.413 2.535 20 5 FFBDLP Cc1[nH+]ccn1CCCCNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000447809384 513576106 /nfs/dbraw/zinc/57/61/06/513576106.db2.gz YOTUYXXVCMDMAL-UHFFFAOYSA-N 2 2 373.457 2.824 20 5 FFBDLP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000513656232 516708247 /nfs/dbraw/zinc/70/82/47/516708247.db2.gz QVBYEZRUHQTCAT-KBXCAEBGSA-N 2 2 368.441 2.849 20 5 FFBDLP Cc1ccc([C@H](C[NH2+]C[C@@H](O)COc2ccccc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000579111164 518527041 /nfs/dbraw/zinc/52/70/41/518527041.db2.gz VGLGRIOTDIYSBP-MJGOQNOKSA-N 2 2 373.453 2.535 20 5 FFBDLP CCC[N@H+](CC)C[C@H](C)Nc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000579300749 518612767 /nfs/dbraw/zinc/61/27/67/518612767.db2.gz XZOOCDVGTQKKIU-INIZCTEOSA-N 2 2 364.490 2.959 20 5 FFBDLP CCC[N@@H+](CC)C[C@H](C)Nc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000579300749 518612775 /nfs/dbraw/zinc/61/27/75/518612775.db2.gz XZOOCDVGTQKKIU-INIZCTEOSA-N 2 2 364.490 2.959 20 5 FFBDLP CCC1([NH+](C)C)CC[NH+](CCOc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC000602967719 519998431 /nfs/dbraw/zinc/99/84/31/519998431.db2.gz PJKOOKKMKMUFEM-UHFFFAOYSA-N 2 2 351.447 2.788 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@@H](n4cc[nH+]c4)C3)n2)c1 ZINC000609157489 520213568 /nfs/dbraw/zinc/21/35/68/520213568.db2.gz VLQPOAVHVNSNBZ-OAHLLOKOSA-N 2 2 354.370 2.678 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@@H](n4cc[nH+]c4)C3)n2)c1 ZINC000609157489 520213575 /nfs/dbraw/zinc/21/35/75/520213575.db2.gz VLQPOAVHVNSNBZ-OAHLLOKOSA-N 2 2 354.370 2.678 20 5 FFBDLP C[NH+](C)CCC[N@H+](C)CCNC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000597990200 520364414 /nfs/dbraw/zinc/36/44/14/520364414.db2.gz QWRNQZFPXWCYAW-UHFFFAOYSA-N 2 2 364.490 2.506 20 5 FFBDLP C[NH+](C)CCC[N@@H+](C)CCNC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000597990200 520364418 /nfs/dbraw/zinc/36/44/18/520364418.db2.gz QWRNQZFPXWCYAW-UHFFFAOYSA-N 2 2 364.490 2.506 20 5 FFBDLP C[C@H](CNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](C)C1 ZINC000604437763 520563814 /nfs/dbraw/zinc/56/38/14/520563814.db2.gz RDYRDTDQBLKMNI-LSDHHAIUSA-N 2 2 371.441 2.631 20 5 FFBDLP C[C@H](CNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)[N@H+]1CCC[C@H](C)C1 ZINC000604437763 520563817 /nfs/dbraw/zinc/56/38/17/520563817.db2.gz RDYRDTDQBLKMNI-LSDHHAIUSA-N 2 2 371.441 2.631 20 5 FFBDLP C[NH2+]C[C@@H](C)[NH2+]Cc1ccc(OCc2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000596103111 520914376 /nfs/dbraw/zinc/91/43/76/520914376.db2.gz AGGAYVWMVNDPIO-CQSZACIVSA-N 2 2 359.426 2.880 20 5 FFBDLP O=C(N[C@H]1CCC[N@@H+]2CCCC[C@@H]12)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000594200284 521466653 /nfs/dbraw/zinc/46/66/53/521466653.db2.gz KMSQHOWGEBEMOB-HOTGVXAUSA-N 2 2 369.425 2.527 20 5 FFBDLP O=C(N[C@H]1CCC[N@H+]2CCCC[C@@H]12)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000594200284 521466662 /nfs/dbraw/zinc/46/66/62/521466662.db2.gz KMSQHOWGEBEMOB-HOTGVXAUSA-N 2 2 369.425 2.527 20 5 FFBDLP [NH3+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccc(Br)c([N+](=O)[O-])c3)C[C@H]21 ZINC000228546832 729549593 /nfs/dbraw/zinc/54/95/93/729549593.db2.gz AGLMCCXMLDUSEV-YRGRVCCFSA-N 2 2 354.248 2.917 20 5 FFBDLP [NH3+][C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccc(Br)c([N+](=O)[O-])c3)C[C@H]21 ZINC000228546832 729549596 /nfs/dbraw/zinc/54/95/96/729549596.db2.gz AGLMCCXMLDUSEV-YRGRVCCFSA-N 2 2 354.248 2.917 20 5 FFBDLP C[NH+]1CCC([N@@H+]2CC[C@H](Nc3nc4ccc([N+](=O)[O-])cc4s3)C2)CC1 ZINC000732804732 734766689 /nfs/dbraw/zinc/76/66/89/734766689.db2.gz DLOMMKCXDSOQNH-LBPRGKRZSA-N 2 2 361.471 2.785 20 5 FFBDLP C[NH+]1CCC([N@H+]2CC[C@H](Nc3nc4ccc([N+](=O)[O-])cc4s3)C2)CC1 ZINC000732804732 734766692 /nfs/dbraw/zinc/76/66/92/734766692.db2.gz DLOMMKCXDSOQNH-LBPRGKRZSA-N 2 2 361.471 2.785 20 5 FFBDLP COc1cc([C@H](C)[NH2+]CCC[N@@H+]2CCCO[C@@H](C)C2)cc([N+](=O)[O-])c1 ZINC000903160467 736045048 /nfs/dbraw/zinc/04/50/48/736045048.db2.gz MMOYSLOTQZGUPN-GJZGRUSLSA-N 2 2 351.447 2.755 20 5 FFBDLP COc1cc([C@H](C)[NH2+]CCC[N@H+]2CCCO[C@@H](C)C2)cc([N+](=O)[O-])c1 ZINC000903160467 736045054 /nfs/dbraw/zinc/04/50/54/736045054.db2.gz MMOYSLOTQZGUPN-GJZGRUSLSA-N 2 2 351.447 2.755 20 5 FFBDLP C[C@@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)[C@@H]1CC[NH3+] ZINC000846226684 748434054 /nfs/dbraw/zinc/43/40/54/748434054.db2.gz TWFARLKASMGXEZ-BXUZGUMPSA-N 2 2 354.838 2.636 20 5 FFBDLP C[C@@H]1CCC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)[C@@H]1CC[NH3+] ZINC000846226684 748434057 /nfs/dbraw/zinc/43/40/57/748434057.db2.gz TWFARLKASMGXEZ-BXUZGUMPSA-N 2 2 354.838 2.636 20 5 FFBDLP Cn1ncc([N+](=O)[O-])c1Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1 ZINC000892616311 969606831 /nfs/dbraw/zinc/60/68/31/969606831.db2.gz ZWUZHWLBPHOCTO-UHFFFAOYSA-N 2 2 358.446 2.850 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1 ZINC000850434498 1005815352 /nfs/dbraw/zinc/81/53/52/1005815352.db2.gz UKQYXDDELKCIGT-WMLDXEAASA-N 2 2 363.458 2.897 20 5 FFBDLP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H]2C[NH+](Cc3cccnc3)C[C@H]2C1 ZINC001173220752 1012350793 /nfs/dbraw/zinc/35/07/93/1012350793.db2.gz CDCGTHDLOJNRSX-FFZOFVMBSA-N 2 2 366.465 2.985 20 5 FFBDLP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H]2C[NH+](Cc3cccnc3)C[C@H]2C1 ZINC001173220752 1012350809 /nfs/dbraw/zinc/35/08/09/1012350809.db2.gz CDCGTHDLOJNRSX-FFZOFVMBSA-N 2 2 366.465 2.985 20 5 FFBDLP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1C[C@H]2C[N@@H+](Cc3cccnc3)C[C@H]2C1 ZINC001173220752 1012350822 /nfs/dbraw/zinc/35/08/22/1012350822.db2.gz CDCGTHDLOJNRSX-FFZOFVMBSA-N 2 2 366.465 2.985 20 5 FFBDLP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1C[C@H]2C[N@H+](Cc3cccnc3)C[C@H]2C1 ZINC001173220752 1012350840 /nfs/dbraw/zinc/35/08/40/1012350840.db2.gz CDCGTHDLOJNRSX-FFZOFVMBSA-N 2 2 366.465 2.985 20 5 FFBDLP C[NH+](C)/C=C/c1cc(NCC[C@H]2CC[NH2+]CC2(F)F)ncc1[N+](=O)[O-] ZINC001162812552 1028667015 /nfs/dbraw/zinc/66/70/15/1028667015.db2.gz MTYAYRFRKAQUCT-OQHXTRMZSA-N 2 2 355.389 2.569 20 5 FFBDLP CC[N@H+](CCn1cc[nH+]c1)C1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC001256101640 1038387057 /nfs/dbraw/zinc/38/70/57/1038387057.db2.gz QFSVQIQEQAIWLO-UHFFFAOYSA-N 2 2 373.457 2.791 20 5 FFBDLP CC[N@@H+](CCn1cc[nH+]c1)C1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC001256101640 1038387071 /nfs/dbraw/zinc/38/70/71/1038387071.db2.gz QFSVQIQEQAIWLO-UHFFFAOYSA-N 2 2 373.457 2.791 20 5 FFBDLP COc1ccc(C[C@@H](C)[N@@H+]2C[C@@H]3C[NH2+]C[C@]3(C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC001246655897 1039428734 /nfs/dbraw/zinc/42/87/34/1039428734.db2.gz MFVRZGHITPHQDV-FFSVYQOJSA-N 2 2 373.375 2.618 20 5 FFBDLP COc1ccc(C[C@@H](C)[N@H+]2C[C@@H]3C[NH2+]C[C@]3(C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC001246655897 1039428737 /nfs/dbraw/zinc/42/87/37/1039428737.db2.gz MFVRZGHITPHQDV-FFSVYQOJSA-N 2 2 373.375 2.618 20 5 FFBDLP CC1(C)CCN(C(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)CC(C)(C)[NH2+]1 ZINC001353370235 1056340203 /nfs/dbraw/zinc/34/02/03/1056340203.db2.gz QNESWVBTWZJGTC-UHFFFAOYSA-N 2 2 371.441 2.773 20 5 FFBDLP O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)o1 ZINC001559616892 1076177627 /nfs/dbraw/zinc/17/76/27/1076177627.db2.gz SLMJSNPGLTWXIK-LBPRGKRZSA-N 2 2 354.370 2.748 20 5 FFBDLP O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)o1 ZINC001559616892 1076177628 /nfs/dbraw/zinc/17/76/28/1076177628.db2.gz SLMJSNPGLTWXIK-LBPRGKRZSA-N 2 2 354.370 2.748 20 5 FFBDLP C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCC(c2c[nH+]cn2C)CC1 ZINC001560232658 1076252854 /nfs/dbraw/zinc/25/28/54/1076252854.db2.gz CWPCQPKWLDCLNH-CYBMUJFWSA-N 2 2 357.414 2.535 20 5 FFBDLP COc1cc(C[NH2+]CCCn2cc[nH+]c2)c([N+](=O)[O-])cc1OCC(F)F ZINC000272503217 252054463 /nfs/dbraw/zinc/05/44/63/252054463.db2.gz VYVCAABGSQWINK-UHFFFAOYSA-N 2 2 370.356 2.624 20 5 FFBDLP C[C@@H](CNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)[N@@H+]1CCCC[C@@H]1C ZINC000032254695 506237753 /nfs/dbraw/zinc/23/77/53/506237753.db2.gz ONRVRCBUKKZGNW-GJZGRUSLSA-N 2 2 371.441 2.773 20 5 FFBDLP C[C@@H](CNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)[N@H+]1CCCC[C@@H]1C ZINC000032254695 506237756 /nfs/dbraw/zinc/23/77/56/506237756.db2.gz ONRVRCBUKKZGNW-GJZGRUSLSA-N 2 2 371.441 2.773 20 5 FFBDLP C[C@@H](CNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)[N@@H+]1CCCC[C@H]1C ZINC000032254693 506238639 /nfs/dbraw/zinc/23/86/39/506238639.db2.gz ONRVRCBUKKZGNW-CABCVRRESA-N 2 2 371.441 2.773 20 5 FFBDLP C[C@@H](CNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)[N@H+]1CCCC[C@H]1C ZINC000032254693 506238646 /nfs/dbraw/zinc/23/86/46/506238646.db2.gz ONRVRCBUKKZGNW-CABCVRRESA-N 2 2 371.441 2.773 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H](c2[nH+]ccn2C)C1 ZINC000373100475 512171528 /nfs/dbraw/zinc/17/15/28/512171528.db2.gz RYONZTFONJYHKN-OAHLLOKOSA-N 2 2 371.441 2.845 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@@H](c2[nH+]ccn2C)C1 ZINC000373100475 512171529 /nfs/dbraw/zinc/17/15/29/512171529.db2.gz RYONZTFONJYHKN-OAHLLOKOSA-N 2 2 371.441 2.845 20 5 FFBDLP O=[N+]([O-])c1cnn(CC[NH2+]C2CC[NH+](Cc3ccc(Cl)cc3)CC2)c1 ZINC000090538366 507925958 /nfs/dbraw/zinc/92/59/58/507925958.db2.gz LMAAFCARJUWFLX-UHFFFAOYSA-N 2 2 363.849 2.699 20 5 FFBDLP C[C@@H]1CC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1n1cc[nH+]c1 ZINC000156477400 508426298 /nfs/dbraw/zinc/42/62/98/508426298.db2.gz OQFHSYQTYHQBBW-PBHICJAKSA-N 2 2 357.414 2.703 20 5 FFBDLP C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1n1cc[nH+]c1 ZINC000156477400 508426299 /nfs/dbraw/zinc/42/62/99/508426299.db2.gz OQFHSYQTYHQBBW-PBHICJAKSA-N 2 2 357.414 2.703 20 5 FFBDLP C[C@@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000116395857 508506062 /nfs/dbraw/zinc/50/60/62/508506062.db2.gz IQPWOBUXDHCCFB-CZUORRHYSA-N 2 2 350.463 2.878 20 5 FFBDLP C[C@@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000116396643 508506763 /nfs/dbraw/zinc/50/67/63/508506763.db2.gz GNYSRCXXHFZIAQ-CZUORRHYSA-N 2 2 350.463 2.878 20 5 FFBDLP Cc1c(NC(=O)[C@@H](C)[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)cccc1[N+](=O)[O-] ZINC000139914239 508796869 /nfs/dbraw/zinc/79/68/69/508796869.db2.gz FFFILKRZSWGHFJ-IIDMSEBBSA-N 2 2 360.458 2.646 20 5 FFBDLP Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)cccc1[N+](=O)[O-] ZINC000139914239 508796870 /nfs/dbraw/zinc/79/68/70/508796870.db2.gz FFFILKRZSWGHFJ-IIDMSEBBSA-N 2 2 360.458 2.646 20 5 FFBDLP Cc1c(NC(=O)[C@@H](C)[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)cccc1[N+](=O)[O-] ZINC000139914239 508796874 /nfs/dbraw/zinc/79/68/74/508796874.db2.gz FFFILKRZSWGHFJ-IIDMSEBBSA-N 2 2 360.458 2.646 20 5 FFBDLP Cc1c(NC(=O)[C@@H](C)[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)cccc1[N+](=O)[O-] ZINC000139914239 508796875 /nfs/dbraw/zinc/79/68/75/508796875.db2.gz FFFILKRZSWGHFJ-IIDMSEBBSA-N 2 2 360.458 2.646 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+](C)CCCn1cc[nH+]c1 ZINC000124382915 508823819 /nfs/dbraw/zinc/82/38/19/508823819.db2.gz TVZPMYLCKUCDQK-GFCCVEGCSA-N 2 2 365.821 2.794 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)CCCn1cc[nH+]c1 ZINC000124382915 508823823 /nfs/dbraw/zinc/82/38/23/508823823.db2.gz TVZPMYLCKUCDQK-GFCCVEGCSA-N 2 2 365.821 2.794 20 5 FFBDLP CC[N@@H+]1CC[C@H]([NH+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H](C)C1 ZINC000245438036 509932949 /nfs/dbraw/zinc/93/29/49/509932949.db2.gz RYRGAODWMDIWLJ-BBRMVZONSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[N@H+]1CC[C@H]([NH+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H](C)C1 ZINC000245438036 509932956 /nfs/dbraw/zinc/93/29/56/509932956.db2.gz RYRGAODWMDIWLJ-BBRMVZONSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[NH+]1CC[C@H]([N@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H](C)C1 ZINC000245438036 509932966 /nfs/dbraw/zinc/93/29/66/509932966.db2.gz RYRGAODWMDIWLJ-BBRMVZONSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[NH+]1CC[C@H]([N@@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H](C)C1 ZINC000245438036 509932975 /nfs/dbraw/zinc/93/29/75/509932975.db2.gz RYRGAODWMDIWLJ-BBRMVZONSA-N 2 2 359.430 2.807 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000171388699 510124321 /nfs/dbraw/zinc/12/43/21/510124321.db2.gz YSWSZIWHVMGJGZ-UHFFFAOYSA-N 2 2 360.458 2.650 20 5 FFBDLP C[C@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1n1cc[nH+]c1 ZINC000246656362 510603951 /nfs/dbraw/zinc/60/39/51/510603951.db2.gz CUWYJEIZQZVJPM-XJKSGUPXSA-N 2 2 368.397 2.924 20 5 FFBDLP C[C@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1n1cc[nH+]c1 ZINC000246656362 510603955 /nfs/dbraw/zinc/60/39/55/510603955.db2.gz CUWYJEIZQZVJPM-XJKSGUPXSA-N 2 2 368.397 2.924 20 5 FFBDLP C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC000188297419 510696636 /nfs/dbraw/zinc/69/66/36/510696636.db2.gz JIRSTRYJKCQDMI-FQEVSTJZSA-N 2 2 355.438 2.664 20 5 FFBDLP C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC000188297419 510696641 /nfs/dbraw/zinc/69/66/41/510696641.db2.gz JIRSTRYJKCQDMI-FQEVSTJZSA-N 2 2 355.438 2.664 20 5 FFBDLP C[NH+](Cc1ccccc1[N+](=O)[O-])C[C@@]1(O)CC[N@H+](Cc2ccccc2)C1 ZINC000188297419 510696646 /nfs/dbraw/zinc/69/66/46/510696646.db2.gz JIRSTRYJKCQDMI-FQEVSTJZSA-N 2 2 355.438 2.664 20 5 FFBDLP C[NH+](Cc1ccccc1[N+](=O)[O-])C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000188297419 510696652 /nfs/dbraw/zinc/69/66/52/510696652.db2.gz JIRSTRYJKCQDMI-FQEVSTJZSA-N 2 2 355.438 2.664 20 5 FFBDLP C[C@@H](C[NH+]1CCCCCC1)NC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000185435670 510844570 /nfs/dbraw/zinc/84/45/70/510844570.db2.gz COPVJRIGKPMULL-HNNXBMFYSA-N 2 2 371.441 2.775 20 5 FFBDLP CC[N@@H+]1CC[C@H](N(C)C(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000247511432 510863871 /nfs/dbraw/zinc/86/38/71/510863871.db2.gz VSCBCKWICVFMOP-HOCLYGCPSA-N 2 2 371.441 2.583 20 5 FFBDLP CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000247511432 510863872 /nfs/dbraw/zinc/86/38/72/510863872.db2.gz VSCBCKWICVFMOP-HOCLYGCPSA-N 2 2 371.441 2.583 20 5 FFBDLP CC[NH+]1CCC([N@@H+]2CCCN(C(=O)c3ccc([N+](=O)[O-])cc3C)CC2)CC1 ZINC000422022627 513528780 /nfs/dbraw/zinc/52/87/80/513528780.db2.gz PBPHDVSMBZOGJN-UHFFFAOYSA-N 2 2 374.485 2.535 20 5 FFBDLP CC[NH+]1CCC([N@H+]2CCCN(C(=O)c3ccc([N+](=O)[O-])cc3C)CC2)CC1 ZINC000422022627 513528785 /nfs/dbraw/zinc/52/87/85/513528785.db2.gz PBPHDVSMBZOGJN-UHFFFAOYSA-N 2 2 374.485 2.535 20 5 FFBDLP CCN(CCC[NH+](CC)CC)C(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000451117216 513534616 /nfs/dbraw/zinc/53/46/16/513534616.db2.gz TZLHOZSNVZOWQQ-UHFFFAOYSA-N 2 2 373.457 2.975 20 5 FFBDLP CCC[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1CC[NH2+]CC1 ZINC000431085131 513822485 /nfs/dbraw/zinc/82/24/85/513822485.db2.gz MRWFJVWDDSDKOE-UHFFFAOYSA-N 2 2 354.838 2.651 20 5 FFBDLP CCC[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1CC[NH2+]CC1 ZINC000431085131 513822490 /nfs/dbraw/zinc/82/24/90/513822490.db2.gz MRWFJVWDDSDKOE-UHFFFAOYSA-N 2 2 354.838 2.651 20 5 FFBDLP O=[N+]([O-])c1cccnc1N1CC[NH+](Cc2cc(-n3cc[nH+]c3)cs2)CC1 ZINC000453582793 514702282 /nfs/dbraw/zinc/70/22/82/514702282.db2.gz XGOFBBSQGURAPI-UHFFFAOYSA-N 2 2 370.438 2.559 20 5 FFBDLP COc1cc(C[N@@H+]2CCCC[C@H]2CC[NH3+])c([N+](=O)[O-])cc1OC(F)F ZINC000489797584 514979361 /nfs/dbraw/zinc/97/93/61/514979361.db2.gz SKWGZSWOCHOGAJ-LBPRGKRZSA-N 2 2 359.373 2.908 20 5 FFBDLP COc1cc(C[N@H+]2CCCC[C@H]2CC[NH3+])c([N+](=O)[O-])cc1OC(F)F ZINC000489797584 514979371 /nfs/dbraw/zinc/97/93/71/514979371.db2.gz SKWGZSWOCHOGAJ-LBPRGKRZSA-N 2 2 359.373 2.908 20 5 FFBDLP C[C@@H]([NH2+]CCC[NH+]1CCN(c2cc[nH+]cc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000467839942 515143348 /nfs/dbraw/zinc/14/33/48/515143348.db2.gz FXPOGFMFDOTFOF-QGZVFWFLSA-N 3 2 369.469 2.853 20 5 FFBDLP C[NH+]1CCC(CCO)([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000472612487 515337250 /nfs/dbraw/zinc/33/72/50/515337250.db2.gz MKJWBQMDARFSMG-UHFFFAOYSA-N 2 2 359.426 2.791 20 5 FFBDLP COc1cc(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000493707245 515658151 /nfs/dbraw/zinc/65/81/51/515658151.db2.gz OACIBGFAHWKVOP-WCQYABFASA-N 2 2 373.400 2.820 20 5 FFBDLP COc1cc(C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000493707245 515658160 /nfs/dbraw/zinc/65/81/60/515658160.db2.gz OACIBGFAHWKVOP-WCQYABFASA-N 2 2 373.400 2.820 20 5 FFBDLP COc1cc(C[NH2+]C[C@@H]2CCC[N@H+](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000543705693 516378345 /nfs/dbraw/zinc/37/83/45/516378345.db2.gz USQIYJDINMMJMV-LBPRGKRZSA-N 2 2 373.400 2.679 20 5 FFBDLP COc1cc(C[NH2+]C[C@@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000543705693 516378355 /nfs/dbraw/zinc/37/83/55/516378355.db2.gz USQIYJDINMMJMV-LBPRGKRZSA-N 2 2 373.400 2.679 20 5 FFBDLP CC[C@H]([NH2+][C@H]1CCCN(Cc2[nH+]ccn2C)C1=O)c1cccc([N+](=O)[O-])c1 ZINC000544017196 516540823 /nfs/dbraw/zinc/54/08/23/516540823.db2.gz TWVNPONNMILBJW-IRXDYDNUSA-N 2 2 371.441 2.560 20 5 FFBDLP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000513656239 516709148 /nfs/dbraw/zinc/70/91/48/516709148.db2.gz QVBYEZRUHQTCAT-RDTXWAMCSA-N 2 2 368.441 2.849 20 5 FFBDLP CS[C@H]1CN(c2cc(C)[nH+]c(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H]1[NH+](C)C ZINC000533928431 517672557 /nfs/dbraw/zinc/67/25/57/517672557.db2.gz QQUMIOFKPNGYRY-CVEARBPZSA-N 2 2 373.482 2.842 20 5 FFBDLP Cn1ccnc1[C@@H]([NH2+]CCCCn1cc[nH+]c1)c1ccc([N+](=O)[O-])cc1 ZINC000560514372 517864871 /nfs/dbraw/zinc/86/48/71/517864871.db2.gz KLFRRYRJTKYNHZ-KRWDZBQOSA-N 2 2 354.414 2.684 20 5 FFBDLP O=[N+]([O-])c1ccccc1-c1ccc(C[NH+]2CCN(Cc3[nH]cc[nH+]3)CC2)o1 ZINC000539829313 518169569 /nfs/dbraw/zinc/16/95/69/518169569.db2.gz NMCDGFTXORTSCV-UHFFFAOYSA-N 2 2 367.409 2.896 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCc2ccccc2[C@H]1C[NH3+] ZINC000572483594 518213684 /nfs/dbraw/zinc/21/36/84/518213684.db2.gz GXOFOIARYDCOIW-LJQANCHMSA-N 2 2 368.437 2.790 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCc2ccccc2[C@H]1C[NH3+] ZINC000572483594 518213687 /nfs/dbraw/zinc/21/36/87/518213687.db2.gz GXOFOIARYDCOIW-LJQANCHMSA-N 2 2 368.437 2.790 20 5 FFBDLP CC(C)[N@@H+]1CC[C@@H](CNc2cc(C[NH+]3CCOCC3)ccc2[N+](=O)[O-])C1 ZINC000584331052 518284623 /nfs/dbraw/zinc/28/46/23/518284623.db2.gz AOTCZYHJOLPYCO-KRWDZBQOSA-N 2 2 362.474 2.569 20 5 FFBDLP CC(C)[N@H+]1CC[C@@H](CNc2cc(C[NH+]3CCOCC3)ccc2[N+](=O)[O-])C1 ZINC000584331052 518284629 /nfs/dbraw/zinc/28/46/29/518284629.db2.gz AOTCZYHJOLPYCO-KRWDZBQOSA-N 2 2 362.474 2.569 20 5 FFBDLP CC(C)C[C@H](CN[C@@H](c1[nH+]ccn1C)c1ccc([N+](=O)[O-])cc1)[NH+](C)C ZINC000582137955 518606660 /nfs/dbraw/zinc/60/66/60/518606660.db2.gz NDABLOJDKGMBLD-QZTJIDSGSA-N 2 2 359.474 2.984 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@H](n4cc[nH+]c4)C3)n2)cc1 ZINC000609157408 520214203 /nfs/dbraw/zinc/21/42/03/520214203.db2.gz KJYWXYPRTMNBHZ-HNNXBMFYSA-N 2 2 354.370 2.678 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@H](n4cc[nH+]c4)C3)n2)cc1 ZINC000609157408 520214207 /nfs/dbraw/zinc/21/42/07/520214207.db2.gz KJYWXYPRTMNBHZ-HNNXBMFYSA-N 2 2 354.370 2.678 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCC[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000595003042 520250592 /nfs/dbraw/zinc/25/05/92/520250592.db2.gz BMEQGJBVWQLXHP-KFWWJZLASA-N 2 2 351.447 2.753 20 5 FFBDLP CCC[N@H+](C)CC(C)(C)NC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000598466960 520630676 /nfs/dbraw/zinc/63/06/76/520630676.db2.gz XVTQEKUIBFSMBY-UHFFFAOYSA-N 2 2 359.430 2.631 20 5 FFBDLP CCC[N@@H+](C)CC(C)(C)NC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000598466960 520630683 /nfs/dbraw/zinc/63/06/83/520630683.db2.gz XVTQEKUIBFSMBY-UHFFFAOYSA-N 2 2 359.430 2.631 20 5 FFBDLP C[C@H]1COCC[N@@H+]1C1CC[NH+](CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000593990928 521333910 /nfs/dbraw/zinc/33/39/10/521333910.db2.gz QICQLCJDWQJKPH-INIZCTEOSA-N 2 2 363.458 2.549 20 5 FFBDLP C[C@H]1COCC[N@H+]1C1CC[NH+](CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000593990928 521333923 /nfs/dbraw/zinc/33/39/23/521333923.db2.gz QICQLCJDWQJKPH-INIZCTEOSA-N 2 2 363.458 2.549 20 5 FFBDLP O=C(N[C@@H]1CCC[N@@H+]2CCCC[C@@H]12)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000594198699 521465446 /nfs/dbraw/zinc/46/54/46/521465446.db2.gz VCPGVBPGRAHVAS-CVEARBPZSA-N 2 2 369.425 2.527 20 5 FFBDLP O=C(N[C@@H]1CCC[N@H+]2CCCC[C@@H]12)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000594198699 521465448 /nfs/dbraw/zinc/46/54/48/521465448.db2.gz VCPGVBPGRAHVAS-CVEARBPZSA-N 2 2 369.425 2.527 20 5 FFBDLP O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CCCN(c4cc[nH+]cc4)CC3)nc2c1 ZINC000602847102 521567473 /nfs/dbraw/zinc/56/74/73/521567473.db2.gz SOSJNBZSJPHTJY-UHFFFAOYSA-N 2 2 352.398 2.578 20 5 FFBDLP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccc(Br)c([N+](=O)[O-])c3)C[C@@H]21 ZINC000230132228 729550569 /nfs/dbraw/zinc/55/05/69/729550569.db2.gz AGLMCCXMLDUSEV-SGMGOOAPSA-N 2 2 354.248 2.917 20 5 FFBDLP [NH3+][C@@H]1CCC[C@H]2C[N@@H+](Cc3ccc(Br)c([N+](=O)[O-])c3)C[C@@H]21 ZINC000230132228 729550571 /nfs/dbraw/zinc/55/05/71/729550571.db2.gz AGLMCCXMLDUSEV-SGMGOOAPSA-N 2 2 354.248 2.917 20 5 FFBDLP CN(Cc1ccc([N+](=O)[O-])c(Cl)c1)[C@@H]1CC[N@@H+](C2CC[NH+](C)CC2)C1 ZINC000809741473 741338851 /nfs/dbraw/zinc/33/88/51/741338851.db2.gz OKNSKTODEVTERV-MRXNPFEDSA-N 2 2 366.893 2.849 20 5 FFBDLP CN(Cc1ccc([N+](=O)[O-])c(Cl)c1)[C@@H]1CC[N@H+](C2CC[NH+](C)CC2)C1 ZINC000809741473 741338853 /nfs/dbraw/zinc/33/88/53/741338853.db2.gz OKNSKTODEVTERV-MRXNPFEDSA-N 2 2 366.893 2.849 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(c2c[nH+]cn2C)CC1 ZINC001176977993 1013819814 /nfs/dbraw/zinc/81/98/14/1013819814.db2.gz PMITUYSGQQZENH-CYBMUJFWSA-N 2 2 357.414 2.535 20 5 FFBDLP O=C(c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)N1CCC([NH2+]C2CCC2)CC1 ZINC000889836476 1010146123 /nfs/dbraw/zinc/14/61/23/1010146123.db2.gz PKGPCSZEBKELGX-UHFFFAOYSA-N 2 2 369.425 2.527 20 5 FFBDLP Cc1ccc2c(ccnc2NCC2([NH+](C)C)CC[NH+](C)CC2)c1[N+](=O)[O-] ZINC001164207020 1029200606 /nfs/dbraw/zinc/20/06/06/1029200606.db2.gz PYVGIHXAWUVNFI-UHFFFAOYSA-N 2 2 357.458 2.889 20 5 FFBDLP O=C(CC[N@@H+]1CCCC[C@H]1[C@@H]1CCC[NH2+]1)Nc1cc([N+](=O)[O-])ccc1F ZINC000842473111 1030748303 /nfs/dbraw/zinc/74/83/03/1030748303.db2.gz PSORPNPXYLGNQQ-RDJZCZTQSA-N 2 2 364.421 2.669 20 5 FFBDLP O=C(CC[N@H+]1CCCC[C@H]1[C@@H]1CCC[NH2+]1)Nc1cc([N+](=O)[O-])ccc1F ZINC000842473111 1030748309 /nfs/dbraw/zinc/74/83/09/1030748309.db2.gz PSORPNPXYLGNQQ-RDJZCZTQSA-N 2 2 364.421 2.669 20 5 FFBDLP [NH3+]CC[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)CCc1ccccc1 ZINC000843379949 1031366469 /nfs/dbraw/zinc/36/64/69/1031366469.db2.gz JVRHCEBJJZNGNE-UHFFFAOYSA-N 2 2 374.416 2.566 20 5 FFBDLP [NH3+]CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)CCc1ccccc1 ZINC000843379949 1031366483 /nfs/dbraw/zinc/36/64/83/1031366483.db2.gz JVRHCEBJJZNGNE-UHFFFAOYSA-N 2 2 374.416 2.566 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CCC(O)(C[NH+]3CCCCC3)CC2)c(F)c1 ZINC001308150608 1052417471 /nfs/dbraw/zinc/41/74/71/1052417471.db2.gz WLXLDADDPAONGN-UHFFFAOYSA-N 2 2 351.422 2.547 20 5 FFBDLP O=[N+]([O-])c1ccc(CC[NH+]2CCC(CNc3cc(CO)cc[nH+]3)CC2)cc1 ZINC001308828595 1052504252 /nfs/dbraw/zinc/50/42/52/1052504252.db2.gz TYRKMQHOLGUATR-UHFFFAOYSA-N 2 2 370.453 2.849 20 5 FFBDLP Cn1cc(C[N@@H+]2CC[C@@H]3CC[NH+](C)C[C@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272625520 252084502 /nfs/dbraw/zinc/08/45/02/252084502.db2.gz MKHXDKGSVHEZJN-KBXCAEBGSA-N 2 2 355.442 2.521 20 5 FFBDLP Cn1cc(C[N@H+]2CC[C@@H]3CC[NH+](C)C[C@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272625520 252084506 /nfs/dbraw/zinc/08/45/06/252084506.db2.gz MKHXDKGSVHEZJN-KBXCAEBGSA-N 2 2 355.442 2.521 20 5 FFBDLP Cn1cc(C[NH+]2CC[C@@H]3CC[N@H+](C)C[C@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272625520 252084510 /nfs/dbraw/zinc/08/45/10/252084510.db2.gz MKHXDKGSVHEZJN-KBXCAEBGSA-N 2 2 355.442 2.521 20 5 FFBDLP Cn1cc(C[NH+]2CC[C@@H]3CC[N@@H+](C)C[C@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272625520 252084515 /nfs/dbraw/zinc/08/45/15/252084515.db2.gz MKHXDKGSVHEZJN-KBXCAEBGSA-N 2 2 355.442 2.521 20 5 FFBDLP Cc1c[nH+]ccc1OC1CC[NH+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000289402935 257279347 /nfs/dbraw/zinc/27/93/47/257279347.db2.gz OFCZZPPGBJDKKY-SFHVURJKSA-N 2 2 357.410 2.875 20 5 FFBDLP Cc1cc(NC[C@H](C)C[NH+]2CCOCC2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000077995480 507825269 /nfs/dbraw/zinc/82/52/69/507825269.db2.gz UHSSZQOLBYHSJU-AWEZNQCLSA-N 2 2 371.441 2.740 20 5 FFBDLP NC(=O)c1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)c([N+](=O)[O-])c1 ZINC000118834182 508681978 /nfs/dbraw/zinc/68/19/78/508681978.db2.gz BHXCVONCIWMBBQ-MRXNPFEDSA-N 2 2 374.485 2.782 20 5 FFBDLP NC(=O)c1ccc(C[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)c([N+](=O)[O-])c1 ZINC000118834182 508681980 /nfs/dbraw/zinc/68/19/80/508681980.db2.gz BHXCVONCIWMBBQ-MRXNPFEDSA-N 2 2 374.485 2.782 20 5 FFBDLP Cn1cc[nH+]c1C[C@@H]1CCC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000123816845 508742759 /nfs/dbraw/zinc/74/27/59/508742759.db2.gz NEEZZXFPMKKXPH-HNNXBMFYSA-N 2 2 371.441 2.612 20 5 FFBDLP Cn1cc[nH+]c1C[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000123816845 508742763 /nfs/dbraw/zinc/74/27/63/508742763.db2.gz NEEZZXFPMKKXPH-HNNXBMFYSA-N 2 2 371.441 2.612 20 5 FFBDLP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)CC[C@H]21 ZINC000248161113 509251382 /nfs/dbraw/zinc/25/13/82/509251382.db2.gz SDFZJKDHEZVBTR-GDBMZVCRSA-N 2 2 357.414 2.561 20 5 FFBDLP C[N@H+]1CCC[C@@H]2C[NH+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)CC[C@H]21 ZINC000248161113 509251391 /nfs/dbraw/zinc/25/13/91/509251391.db2.gz SDFZJKDHEZVBTR-GDBMZVCRSA-N 2 2 357.414 2.561 20 5 FFBDLP C[NH+]1CCC[C@@H]2C[N@H+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)CC[C@H]21 ZINC000248161113 509251394 /nfs/dbraw/zinc/25/13/94/509251394.db2.gz SDFZJKDHEZVBTR-GDBMZVCRSA-N 2 2 357.414 2.561 20 5 FFBDLP C[NH+]1CCC[C@@H]2C[N@@H+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)CC[C@H]21 ZINC000248161113 509251400 /nfs/dbraw/zinc/25/14/00/509251400.db2.gz SDFZJKDHEZVBTR-GDBMZVCRSA-N 2 2 357.414 2.561 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CCCO2)cc1 ZINC000192358121 509481748 /nfs/dbraw/zinc/48/17/48/509481748.db2.gz UXUDPMMGENUZMD-HXUWFJFHSA-N 2 2 355.438 2.976 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2C[N@@H+](Cc3ccccc3)CCCO2)cc1 ZINC000192358121 509481752 /nfs/dbraw/zinc/48/17/52/509481752.db2.gz UXUDPMMGENUZMD-HXUWFJFHSA-N 2 2 355.438 2.976 20 5 FFBDLP CN1CC[N@H+](C)C[C@H]1C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000264767521 509692244 /nfs/dbraw/zinc/69/22/44/509692244.db2.gz QETRGTNZSGRSPD-MRXNPFEDSA-N 2 2 360.483 2.659 20 5 FFBDLP CN1CC[N@@H+](C)C[C@H]1C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000264767521 509692249 /nfs/dbraw/zinc/69/22/49/509692249.db2.gz QETRGTNZSGRSPD-MRXNPFEDSA-N 2 2 360.483 2.659 20 5 FFBDLP Cc1c(NC(=O)CC[N@H+]2C[C@@H](c3ccccc3)[C@H]([NH3+])C2)cccc1[N+](=O)[O-] ZINC000261851037 510089739 /nfs/dbraw/zinc/08/97/39/510089739.db2.gz VLFOLWLOKUMWQS-DLBZAZTESA-N 2 2 368.437 2.659 20 5 FFBDLP Cc1c(NC(=O)CC[N@@H+]2C[C@@H](c3ccccc3)[C@H]([NH3+])C2)cccc1[N+](=O)[O-] ZINC000261851037 510089743 /nfs/dbraw/zinc/08/97/43/510089743.db2.gz VLFOLWLOKUMWQS-DLBZAZTESA-N 2 2 368.437 2.659 20 5 FFBDLP Cc1[nH+]c2ccccc2n1C[C@H]1CCC[N@@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000270126149 510685868 /nfs/dbraw/zinc/68/58/68/510685868.db2.gz GJKQUNLTFUEBGZ-OAHLLOKOSA-N 2 2 354.414 2.614 20 5 FFBDLP Cc1[nH+]c2ccccc2n1C[C@H]1CCC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000270126149 510685871 /nfs/dbraw/zinc/68/58/71/510685871.db2.gz GJKQUNLTFUEBGZ-OAHLLOKOSA-N 2 2 354.414 2.614 20 5 FFBDLP C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000247376553 510859054 /nfs/dbraw/zinc/85/90/54/510859054.db2.gz HWBXALBKSWUOEL-CKEIUWERSA-N 2 2 357.414 2.701 20 5 FFBDLP C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000247376553 510859055 /nfs/dbraw/zinc/85/90/55/510859055.db2.gz HWBXALBKSWUOEL-CKEIUWERSA-N 2 2 357.414 2.701 20 5 FFBDLP Cn1cc[nH+]c1[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000365627906 511568814 /nfs/dbraw/zinc/56/88/14/511568814.db2.gz KQGFYKQEWLSXPW-CQSZACIVSA-N 2 2 357.414 2.537 20 5 FFBDLP C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]Cc1c[nH+]c2n1CCCC2 ZINC000367438333 512498791 /nfs/dbraw/zinc/49/87/91/512498791.db2.gz MHZDLQRVVPPGRX-ZDUSSCGKSA-N 2 2 357.414 2.635 20 5 FFBDLP CC[NH+](CC)[C@H](C)CNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000447801802 513574095 /nfs/dbraw/zinc/57/40/95/513574095.db2.gz DXLIEDBEGIXTFT-OAHLLOKOSA-N 2 2 350.463 2.569 20 5 FFBDLP O=C(C[NH+]1CCC([C@H]2CCC[NH2+]2)CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000420343733 514103137 /nfs/dbraw/zinc/10/31/37/514103137.db2.gz RDDOXRJUIXZWOC-CQSZACIVSA-N 2 2 366.849 2.651 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+][C@@H]1CCC[N@@H+](CCCO)C1 ZINC000449399197 514197989 /nfs/dbraw/zinc/19/79/89/514197989.db2.gz YKOWIARNXXZMSR-QXAKKESOSA-N 2 2 361.486 2.742 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+][C@@H]1CCC[N@H+](CCCO)C1 ZINC000449399197 514197992 /nfs/dbraw/zinc/19/79/92/514197992.db2.gz YKOWIARNXXZMSR-QXAKKESOSA-N 2 2 361.486 2.742 20 5 FFBDLP CC[NH+]1CCC([N@@H+]2CCCN(c3nc(C)cc(C)c3[N+](=O)[O-])CC2)CC1 ZINC000420629142 514206793 /nfs/dbraw/zinc/20/67/93/514206793.db2.gz QSYQQTADAVEQGV-UHFFFAOYSA-N 2 2 361.490 2.603 20 5 FFBDLP CC[NH+]1CCC([N@H+]2CCCN(c3nc(C)cc(C)c3[N+](=O)[O-])CC2)CC1 ZINC000420629142 514206800 /nfs/dbraw/zinc/20/68/00/514206800.db2.gz QSYQQTADAVEQGV-UHFFFAOYSA-N 2 2 361.490 2.603 20 5 FFBDLP CC[N@@H+]1CC[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)[C@@H](C)C1 ZINC000449990728 514455680 /nfs/dbraw/zinc/45/56/80/514455680.db2.gz XCZKLNOJLSTKLW-HOCLYGCPSA-N 2 2 371.441 2.583 20 5 FFBDLP CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)[C@@H](C)C1 ZINC000449990728 514455689 /nfs/dbraw/zinc/45/56/89/514455689.db2.gz XCZKLNOJLSTKLW-HOCLYGCPSA-N 2 2 371.441 2.583 20 5 FFBDLP O=[N+]([O-])c1cc(F)c(C[NH+]2CCC(CC[NH+]3CCOCC3)CC2)c(F)c1 ZINC000509295194 515112354 /nfs/dbraw/zinc/11/23/54/515112354.db2.gz UGXGSYMEYHPTQZ-UHFFFAOYSA-N 2 2 369.412 2.807 20 5 FFBDLP C[C@H]1CN(Cc2c(Cl)cccc2[N+](=O)[O-])CC[N@@H+]1C1CC[NH+](C)CC1 ZINC000492175428 515510549 /nfs/dbraw/zinc/51/05/49/515510549.db2.gz JGDXMRNZDPNPHQ-AWEZNQCLSA-N 2 2 366.893 2.849 20 5 FFBDLP C[C@H]1CN(Cc2c(Cl)cccc2[N+](=O)[O-])CC[N@H+]1C1CC[NH+](C)CC1 ZINC000492175428 515510553 /nfs/dbraw/zinc/51/05/53/515510553.db2.gz JGDXMRNZDPNPHQ-AWEZNQCLSA-N 2 2 366.893 2.849 20 5 FFBDLP C[C@@H]1C[N@H+](Cc2ccccn2)CC[C@H]1[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000540168291 516461331 /nfs/dbraw/zinc/46/13/31/516461331.db2.gz HWRNOWAEFQFYFW-OXQOHEQNSA-N 2 2 370.453 2.869 20 5 FFBDLP C[C@@H]1C[N@@H+](Cc2ccccn2)CC[C@H]1[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000540168291 516461342 /nfs/dbraw/zinc/46/13/42/516461342.db2.gz HWRNOWAEFQFYFW-OXQOHEQNSA-N 2 2 370.453 2.869 20 5 FFBDLP Cc1cc2[nH+]cn(C[C@@H](O)C[NH2+]CCc3ccc([N+](=O)[O-])cc3)c2cc1C ZINC000556859425 517713033 /nfs/dbraw/zinc/71/30/33/517713033.db2.gz NIVRLWDADUMWER-SFHVURJKSA-N 2 2 368.437 2.755 20 5 FFBDLP Cn1ccnc1[C@H]([NH2+]CCCNc1cccc[nH+]1)c1cccc([N+](=O)[O-])c1 ZINC000560524465 517870696 /nfs/dbraw/zinc/87/06/96/517870696.db2.gz BJLDVTUZXCYKPB-GOSISDBHSA-N 2 2 366.425 2.905 20 5 FFBDLP C[N@H+](CC[NH2+][C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)Cc1ccccc1 ZINC000572732062 518336288 /nfs/dbraw/zinc/33/62/88/518336288.db2.gz PJVAZPMSLYGULX-ZWKOTPCHSA-N 2 2 357.458 2.997 20 5 FFBDLP C[N@@H+](CC[NH2+][C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)Cc1ccccc1 ZINC000572732062 518336292 /nfs/dbraw/zinc/33/62/92/518336292.db2.gz PJVAZPMSLYGULX-ZWKOTPCHSA-N 2 2 357.458 2.997 20 5 FFBDLP Cc1cn2c([nH+]1)[C@H](C[NH2+][C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)CCC2 ZINC000575206886 519554603 /nfs/dbraw/zinc/55/46/03/519554603.db2.gz IZWCHFSOKIWCGK-ARFHVFGLSA-N 2 2 358.446 2.947 20 5 FFBDLP O=C(NC[C@H]1CC[N@@H+]1C1CCCC1)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000600469790 520278537 /nfs/dbraw/zinc/27/85/37/520278537.db2.gz KFQSEJDOZJAHIA-MRXNPFEDSA-N 2 2 369.425 2.527 20 5 FFBDLP O=C(NC[C@H]1CC[N@H+]1C1CCCC1)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000600469790 520278542 /nfs/dbraw/zinc/27/85/42/520278542.db2.gz KFQSEJDOZJAHIA-MRXNPFEDSA-N 2 2 369.425 2.527 20 5 FFBDLP O=[N+]([O-])c1ccc2[nH+]ccc(N3CCC[C@@H](C[NH+]4CCOCC4)C3)c2c1 ZINC000601162431 520667483 /nfs/dbraw/zinc/66/74/83/520667483.db2.gz NTZXNDZYXAAMPQ-HNNXBMFYSA-N 2 2 356.426 2.692 20 5 FFBDLP Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@@H](n3cc[nH+]c3)C2)cccc1[N+](=O)[O-] ZINC000610945210 520912542 /nfs/dbraw/zinc/91/25/42/520912542.db2.gz SQLPIECGDSEDIQ-HUUCEWRRSA-N 2 2 357.414 2.764 20 5 FFBDLP Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@@H](n3cc[nH+]c3)C2)cccc1[N+](=O)[O-] ZINC000610945210 520912547 /nfs/dbraw/zinc/91/25/47/520912547.db2.gz SQLPIECGDSEDIQ-HUUCEWRRSA-N 2 2 357.414 2.764 20 5 FFBDLP C[C@H]1CC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@H]1n1cc[nH+]c1 ZINC000611286003 521080831 /nfs/dbraw/zinc/08/08/31/521080831.db2.gz QJANZDUEWRHXPM-XJKSGUPXSA-N 2 2 358.398 2.646 20 5 FFBDLP C[C@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@H]1n1cc[nH+]c1 ZINC000611286003 521080836 /nfs/dbraw/zinc/08/08/36/521080836.db2.gz QJANZDUEWRHXPM-XJKSGUPXSA-N 2 2 358.398 2.646 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CCC([N@@H+]4CC[C@H](O)C4)CC3)o2)cc1 ZINC000597234452 521588515 /nfs/dbraw/zinc/58/85/15/521588515.db2.gz AERYGFQZENEDDZ-SFHVURJKSA-N 2 2 371.437 2.886 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CCC([N@H+]4CC[C@H](O)C4)CC3)o2)cc1 ZINC000597234452 521588522 /nfs/dbraw/zinc/58/85/22/521588522.db2.gz AERYGFQZENEDDZ-SFHVURJKSA-N 2 2 371.437 2.886 20 5 FFBDLP C[C@@H]([NH3+])C1CC[NH+]([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000843348370 747814158 /nfs/dbraw/zinc/81/41/58/747814158.db2.gz DWXAWPKTGQQVST-GHMZBOCLSA-N 2 2 354.838 2.634 20 5 FFBDLP O=C(C[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000843385822 747821650 /nfs/dbraw/zinc/82/16/50/747821650.db2.gz ADGGABOVAVHDER-CYBMUJFWSA-N 2 2 366.849 2.508 20 5 FFBDLP Cc1ccc([N+](=O)[O-])c(C(=O)NC2CC[NH+](C3CC[NH+](C)CC3)CC2)c1C ZINC000896004806 971142656 /nfs/dbraw/zinc/14/26/56/971142656.db2.gz PHNQDPLEBBECJP-UHFFFAOYSA-N 2 2 374.485 2.500 20 5 FFBDLP C[C@H]1C[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CCN1c1cc[nH+]cc1 ZINC000880261996 1015792978 /nfs/dbraw/zinc/79/29/78/1015792978.db2.gz QSUCSINKQCCFMZ-AWEZNQCLSA-N 2 2 370.409 2.567 20 5 FFBDLP C[C@H]1C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CCN1c1cc[nH+]cc1 ZINC000880261996 1015792985 /nfs/dbraw/zinc/79/29/85/1015792985.db2.gz QSUCSINKQCCFMZ-AWEZNQCLSA-N 2 2 370.409 2.567 20 5 FFBDLP O=C(OCC12CCC[NH+](CCC1)C2)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000861363255 1009376826 /nfs/dbraw/zinc/37/68/26/1009376826.db2.gz RVTJYMCCHGBSRW-UHFFFAOYSA-N 2 2 370.409 2.813 20 5 FFBDLP CC[N@@H+]1CCC[C@H]1C[NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173007421 1012176531 /nfs/dbraw/zinc/17/65/31/1012176531.db2.gz OLQDLMKLUMMAIH-AWEZNQCLSA-N 2 2 368.428 2.916 20 5 FFBDLP CC[N@H+]1CCC[C@H]1C[NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173007421 1012176538 /nfs/dbraw/zinc/17/65/38/1012176538.db2.gz OLQDLMKLUMMAIH-AWEZNQCLSA-N 2 2 368.428 2.916 20 5 FFBDLP C[NH+](C)/C=C/c1cc(NCC[NH+]2CCC(F)(F)CC2)ncc1[N+](=O)[O-] ZINC001160752256 1027860425 /nfs/dbraw/zinc/86/04/25/1027860425.db2.gz LWAWHDHAOBKALE-XVNBXDOJSA-N 2 2 355.389 2.665 20 5 FFBDLP Cc1cc(NCC2([NH+](C)C)CC[NH+](C)CC2)nc2ccc([N+](=O)[O-])cc12 ZINC001156175815 1029076666 /nfs/dbraw/zinc/07/66/66/1029076666.db2.gz GEBWLGDGDTXXMB-UHFFFAOYSA-N 2 2 357.458 2.889 20 5 FFBDLP Cc1[nH+]c2c(n1C1CCN(c3ccc([N+](=O)[O-])cc3)CC1)CC[NH2+]CC2 ZINC001254474703 1040740783 /nfs/dbraw/zinc/74/07/83/1040740783.db2.gz UAFKYRUKBWYYME-UHFFFAOYSA-N 2 2 355.442 2.629 20 5 FFBDLP CC(C)[NH+]1CCC([NH+]2CCN(Cc3ccc([N+](=O)[O-])c(F)c3)CC2)CC1 ZINC000283112331 256840120 /nfs/dbraw/zinc/84/01/20/256840120.db2.gz MNDFMTKMYDKHRL-UHFFFAOYSA-N 2 2 364.465 2.724 20 5 FFBDLP CC(C)[NH+]1CCC(N2CC[NH+](Cc3ccc([N+](=O)[O-])c(F)c3)CC2)CC1 ZINC000283112331 256840121 /nfs/dbraw/zinc/84/01/21/256840121.db2.gz MNDFMTKMYDKHRL-UHFFFAOYSA-N 2 2 364.465 2.724 20 5 FFBDLP C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000118841525 508683415 /nfs/dbraw/zinc/68/34/15/508683415.db2.gz PVZGBFMRTKXPRU-UONOGXRCSA-N 2 2 359.430 2.979 20 5 FFBDLP C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000118841525 508683419 /nfs/dbraw/zinc/68/34/19/508683419.db2.gz PVZGBFMRTKXPRU-UONOGXRCSA-N 2 2 359.430 2.979 20 5 FFBDLP C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+](C)C[C@@H]1CCC[N@H+](C)C1 ZINC000118841525 508683424 /nfs/dbraw/zinc/68/34/24/508683424.db2.gz PVZGBFMRTKXPRU-UONOGXRCSA-N 2 2 359.430 2.979 20 5 FFBDLP C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+](C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000118841525 508683427 /nfs/dbraw/zinc/68/34/27/508683427.db2.gz PVZGBFMRTKXPRU-UONOGXRCSA-N 2 2 359.430 2.979 20 5 FFBDLP C[C@@H]1CC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H]1n1cc[nH+]c1 ZINC000129676644 508753397 /nfs/dbraw/zinc/75/33/97/508753397.db2.gz STPCRHRMIOFILM-PBHICJAKSA-N 2 2 357.414 2.703 20 5 FFBDLP C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H]1n1cc[nH+]c1 ZINC000129676644 508753398 /nfs/dbraw/zinc/75/33/98/508753398.db2.gz STPCRHRMIOFILM-PBHICJAKSA-N 2 2 357.414 2.703 20 5 FFBDLP Cc1c([C@H](C)[NH2+]C[C@@H](O)C[N@@H+]2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000151788244 509083540 /nfs/dbraw/zinc/08/35/40/509083540.db2.gz COTLWQBJUWKGRR-QFBILLFUSA-N 2 2 369.465 2.973 20 5 FFBDLP Cc1c([C@H](C)[NH2+]C[C@@H](O)C[N@H+]2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000151788244 509083545 /nfs/dbraw/zinc/08/35/45/509083545.db2.gz COTLWQBJUWKGRR-QFBILLFUSA-N 2 2 369.465 2.973 20 5 FFBDLP C[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185697416 509310285 /nfs/dbraw/zinc/31/02/85/509310285.db2.gz ZUKWNLUWLYRZKR-GJZGRUSLSA-N 2 2 360.458 2.776 20 5 FFBDLP C[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185697416 509310291 /nfs/dbraw/zinc/31/02/91/509310291.db2.gz ZUKWNLUWLYRZKR-GJZGRUSLSA-N 2 2 360.458 2.776 20 5 FFBDLP C[C@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000173357026 509551878 /nfs/dbraw/zinc/55/18/78/509551878.db2.gz CTOVANGBKOUNHM-HNNXBMFYSA-N 2 2 355.442 2.592 20 5 FFBDLP C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000246172487 510338409 /nfs/dbraw/zinc/33/84/09/510338409.db2.gz PVZGBFMRTKXPRU-KGLIPLIRSA-N 2 2 359.430 2.979 20 5 FFBDLP C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000246172487 510338415 /nfs/dbraw/zinc/33/84/15/510338415.db2.gz PVZGBFMRTKXPRU-KGLIPLIRSA-N 2 2 359.430 2.979 20 5 FFBDLP C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+](C)C[C@H]1CCC[N@H+](C)C1 ZINC000246172487 510338425 /nfs/dbraw/zinc/33/84/25/510338425.db2.gz PVZGBFMRTKXPRU-KGLIPLIRSA-N 2 2 359.430 2.979 20 5 FFBDLP C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+](C)C[C@H]1CCC[N@@H+](C)C1 ZINC000246172487 510338431 /nfs/dbraw/zinc/33/84/31/510338431.db2.gz PVZGBFMRTKXPRU-KGLIPLIRSA-N 2 2 359.430 2.979 20 5 FFBDLP CCOc1cc(C[N@@H+]2CCC[C@@H](C[NH+]3CCOCC3)C2)ccc1[N+](=O)[O-] ZINC000282362990 510946105 /nfs/dbraw/zinc/94/61/05/510946105.db2.gz WFSYNLNBYUEIDV-KRWDZBQOSA-N 2 2 363.458 2.538 20 5 FFBDLP CCOc1cc(C[N@H+]2CCC[C@@H](C[NH+]3CCOCC3)C2)ccc1[N+](=O)[O-] ZINC000282362990 510946110 /nfs/dbraw/zinc/94/61/10/510946110.db2.gz WFSYNLNBYUEIDV-KRWDZBQOSA-N 2 2 363.458 2.538 20 5 FFBDLP Cn1cc[nH+]c1N1CC[NH+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000293746979 512071668 /nfs/dbraw/zinc/07/16/68/512071668.db2.gz IHLNRCVDKMKALD-UHFFFAOYSA-N 2 2 369.347 2.669 20 5 FFBDLP COc1ccc(NC(=O)[C@@H](C)[N@@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)c([N+](=O)[O-])c1 ZINC000377917708 512511665 /nfs/dbraw/zinc/51/16/65/512511665.db2.gz RXYCEAYCDONAJL-OLZOCXBDSA-N 2 2 373.413 2.533 20 5 FFBDLP COc1ccc(NC(=O)[C@@H](C)[N@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)c([N+](=O)[O-])c1 ZINC000377917708 512511671 /nfs/dbraw/zinc/51/16/71/512511671.db2.gz RXYCEAYCDONAJL-OLZOCXBDSA-N 2 2 373.413 2.533 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2nnc(C[NH+]3CCC(c4c[nH]c[nH+]4)CC3)o2)cc1 ZINC000374201635 512705278 /nfs/dbraw/zinc/70/52/78/512705278.db2.gz WLVZIEMJMNFVJO-UHFFFAOYSA-N 2 2 354.370 2.748 20 5 FFBDLP O=C(C[NH+]1CCC(c2c[nH]c[nH+]2)CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000374209258 512708274 /nfs/dbraw/zinc/70/82/74/512708274.db2.gz PICVKFJGJYHAIV-UHFFFAOYSA-N 2 2 363.805 2.789 20 5 FFBDLP Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC1CC[NH+](C2CC[NH+](C)CC2)CC1 ZINC000421758244 513408230 /nfs/dbraw/zinc/40/82/30/513408230.db2.gz QSVZIKVQWMOLPM-UHFFFAOYSA-N 2 2 374.485 2.500 20 5 FFBDLP CC(C)(CNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)C[NH+]1CCCC1 ZINC000451154150 513555522 /nfs/dbraw/zinc/55/55/22/513555522.db2.gz JKIDBMSDKSJRBP-UHFFFAOYSA-N 2 2 371.441 2.632 20 5 FFBDLP CC1(C)CCC[NH2+][C@@H]1CNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000420233722 514055889 /nfs/dbraw/zinc/05/58/89/514055889.db2.gz ATBRXOHSTMCWME-GOSISDBHSA-N 2 2 362.474 2.617 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])Nc1ccc(N2CC[NH+](C)CC2)c[nH+]1 ZINC000449086718 514067265 /nfs/dbraw/zinc/06/72/65/514067265.db2.gz SMZLOPURXAQVNA-OAHLLOKOSA-N 2 2 355.442 2.785 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1C[C@@H](O)C[N@@H+]1Cc1ccccc1 ZINC000449214766 514116343 /nfs/dbraw/zinc/11/63/43/514116343.db2.gz ZFXITLRAXJXCQE-LSTHTHJFSA-N 2 2 369.465 2.751 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1C[C@@H](O)C[N@H+]1Cc1ccccc1 ZINC000449214766 514116351 /nfs/dbraw/zinc/11/63/51/514116351.db2.gz ZFXITLRAXJXCQE-LSTHTHJFSA-N 2 2 369.465 2.751 20 5 FFBDLP COc1cc(C[N@@H+]2C[C@@H](C)[C@](C)(C[NH3+])C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000415054043 514418631 /nfs/dbraw/zinc/41/86/31/514418631.db2.gz LFOOMEMNYHIZAA-PIGZYNQJSA-N 2 2 373.400 2.664 20 5 FFBDLP COc1cc(C[N@H+]2C[C@@H](C)[C@](C)(C[NH3+])C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000415054043 514418638 /nfs/dbraw/zinc/41/86/38/514418638.db2.gz LFOOMEMNYHIZAA-PIGZYNQJSA-N 2 2 373.400 2.664 20 5 FFBDLP COc1cc(C[N@@H+]2CC[C@H](C)[C@@H](C[NH3+])C2)c([N+](=O)[O-])cc1OC(F)F ZINC000415103287 514444910 /nfs/dbraw/zinc/44/49/10/514444910.db2.gz DAZFSFZHEJADGZ-JQWIXIFHSA-N 2 2 359.373 2.622 20 5 FFBDLP COc1cc(C[N@H+]2CC[C@H](C)[C@@H](C[NH3+])C2)c([N+](=O)[O-])cc1OC(F)F ZINC000415103287 514444916 /nfs/dbraw/zinc/44/49/16/514444916.db2.gz DAZFSFZHEJADGZ-JQWIXIFHSA-N 2 2 359.373 2.622 20 5 FFBDLP Cc1c(NC(=O)CC[N@H+](CC[NH3+])Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000466990422 514854450 /nfs/dbraw/zinc/85/44/50/514854450.db2.gz XYHGCXJNCYZQKR-UHFFFAOYSA-N 2 2 356.426 2.693 20 5 FFBDLP Cc1c(NC(=O)CC[N@@H+](CC[NH3+])Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000466990422 514854457 /nfs/dbraw/zinc/85/44/57/514854457.db2.gz XYHGCXJNCYZQKR-UHFFFAOYSA-N 2 2 356.426 2.693 20 5 FFBDLP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000482152913 515589659 /nfs/dbraw/zinc/58/96/59/515589659.db2.gz SSGPXTGZKCQYEG-DLBZAZTESA-N 2 2 362.474 2.684 20 5 FFBDLP O=C(CC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000548826066 517238160 /nfs/dbraw/zinc/23/81/60/517238160.db2.gz IVMLIQCGBRBMQT-KRWDZBQOSA-N 2 2 368.437 2.788 20 5 FFBDLP O=C(CC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000548826066 517238172 /nfs/dbraw/zinc/23/81/72/517238172.db2.gz IVMLIQCGBRBMQT-KRWDZBQOSA-N 2 2 368.437 2.788 20 5 FFBDLP C[N@@H+]1CC[C@](O)(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000547284770 518058687 /nfs/dbraw/zinc/05/86/87/518058687.db2.gz JZQLXKJXMJJXNB-KRWDZBQOSA-N 2 2 365.817 2.664 20 5 FFBDLP C[N@H+]1CC[C@](O)(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000547284770 518058688 /nfs/dbraw/zinc/05/86/88/518058688.db2.gz JZQLXKJXMJJXNB-KRWDZBQOSA-N 2 2 365.817 2.664 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@H](C)[C@@H](n3cc[nH+]c3)C2)c1 ZINC000589505950 519019553 /nfs/dbraw/zinc/01/95/53/519019553.db2.gz RXBUTUCJHSEMOL-GUYCJALGSA-N 2 2 358.398 2.661 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](C)[C@@H](n3cc[nH+]c3)C2)c1 ZINC000589505950 519019557 /nfs/dbraw/zinc/01/95/57/519019557.db2.gz RXBUTUCJHSEMOL-GUYCJALGSA-N 2 2 358.398 2.661 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000589505987 519019870 /nfs/dbraw/zinc/01/98/70/519019870.db2.gz SVUPVLKBWIWCPX-YJBOKZPZSA-N 2 2 373.453 2.830 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000589505987 519019877 /nfs/dbraw/zinc/01/98/77/519019877.db2.gz SVUPVLKBWIWCPX-YJBOKZPZSA-N 2 2 373.453 2.830 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000589505987 519019884 /nfs/dbraw/zinc/01/98/84/519019884.db2.gz SVUPVLKBWIWCPX-YJBOKZPZSA-N 2 2 373.453 2.830 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@@H](C)[C@@H](n3cc[nH+]c3)C2)c1 ZINC000589505949 519020036 /nfs/dbraw/zinc/02/00/36/519020036.db2.gz RXBUTUCJHSEMOL-DYVFJYSZSA-N 2 2 358.398 2.661 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](C)[C@@H](n3cc[nH+]c3)C2)c1 ZINC000589505949 519020042 /nfs/dbraw/zinc/02/00/42/519020042.db2.gz RXBUTUCJHSEMOL-DYVFJYSZSA-N 2 2 358.398 2.661 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c1 ZINC000589501888 519020344 /nfs/dbraw/zinc/02/03/44/519020344.db2.gz JQORMEMNDYDLSX-KRWDZBQOSA-N 2 2 361.442 2.832 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c1 ZINC000589501888 519020350 /nfs/dbraw/zinc/02/03/50/519020350.db2.gz JQORMEMNDYDLSX-KRWDZBQOSA-N 2 2 361.442 2.832 20 5 FFBDLP CCC[N@H+](CC)C[C@@H](C)Nc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000569164169 519408161 /nfs/dbraw/zinc/40/81/61/519408161.db2.gz XZOOCDVGTQKKIU-MRXNPFEDSA-N 2 2 364.490 2.959 20 5 FFBDLP CCC[N@@H+](CC)C[C@@H](C)Nc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000569164169 519408169 /nfs/dbraw/zinc/40/81/69/519408169.db2.gz XZOOCDVGTQKKIU-MRXNPFEDSA-N 2 2 364.490 2.959 20 5 FFBDLP Cn1cc[nH+]c1[C@H](N[C@@H]1CC[NH2+]C2(CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000591582650 519958929 /nfs/dbraw/zinc/95/89/29/519958929.db2.gz RSVXBLFLDZWXGF-NVXWUHKLSA-N 2 2 355.442 2.682 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@H](n2cc[nH+]c2)C1 ZINC000609157478 520213339 /nfs/dbraw/zinc/21/33/39/520213339.db2.gz UVIYIEFZGKHUGZ-INIZCTEOSA-N 2 2 357.414 2.765 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H](n2cc[nH+]c2)C1 ZINC000609157478 520213345 /nfs/dbraw/zinc/21/33/45/520213345.db2.gz UVIYIEFZGKHUGZ-INIZCTEOSA-N 2 2 357.414 2.765 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1 ZINC000595048854 520270868 /nfs/dbraw/zinc/27/08/68/520270868.db2.gz RQAZIEOAYOASLM-LSDHHAIUSA-N 2 2 351.447 2.755 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCC[N@H+]1CCCO[C@@H](C)C1 ZINC000595048854 520270873 /nfs/dbraw/zinc/27/08/73/520270873.db2.gz RQAZIEOAYOASLM-LSDHHAIUSA-N 2 2 351.447 2.755 20 5 FFBDLP CC[C@H]1C[N@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])CC[C@H]1[NH3+] ZINC000592427651 520387089 /nfs/dbraw/zinc/38/70/89/520387089.db2.gz NJUMTADJDFZLPM-CMPLNLGQSA-N 2 2 359.373 2.764 20 5 FFBDLP CC[C@H]1C[N@@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])CC[C@H]1[NH3+] ZINC000592427651 520387096 /nfs/dbraw/zinc/38/70/96/520387096.db2.gz NJUMTADJDFZLPM-CMPLNLGQSA-N 2 2 359.373 2.764 20 5 FFBDLP Cn1cc[nH+]c1[C@H](N[C@H]1CC[NH2+]CC(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000602019705 521081902 /nfs/dbraw/zinc/08/19/02/521081902.db2.gz GGGXVWHLYIFEHT-DOTOQJQBSA-N 2 2 357.458 2.786 20 5 FFBDLP COc1c(O)ccc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000894135131 977943199 /nfs/dbraw/zinc/94/31/99/977943199.db2.gz RJCGGJWPMZIVKW-INIZCTEOSA-N 2 2 371.437 2.921 20 5 FFBDLP COc1c(O)ccc(C[NH2+]C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000894135131 977943209 /nfs/dbraw/zinc/94/32/09/977943209.db2.gz RJCGGJWPMZIVKW-INIZCTEOSA-N 2 2 371.437 2.921 20 5 FFBDLP O=[N+]([O-])c1cnn(C2CC([NH2+]C[C@@H]3CCC[N@@H+]3Cc3ccccc3)C2)c1 ZINC000877046277 1014460880 /nfs/dbraw/zinc/46/08/80/1014460880.db2.gz KTRGXVPCRWBTJN-ADKAHSJRSA-N 2 2 355.442 2.749 20 5 FFBDLP O=[N+]([O-])c1cnn(C2CC([NH2+]C[C@@H]3CCC[N@H+]3Cc3ccccc3)C2)c1 ZINC000877046277 1014460882 /nfs/dbraw/zinc/46/08/82/1014460882.db2.gz KTRGXVPCRWBTJN-ADKAHSJRSA-N 2 2 355.442 2.749 20 5 FFBDLP O=[N+]([O-])c1ccnn1C[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000762500450 988415846 /nfs/dbraw/zinc/41/58/46/988415846.db2.gz CYTCEKSPLHAHDS-UHFFFAOYSA-N 2 2 355.442 2.737 20 5 FFBDLP O=[N+]([O-])c1ccnn1C[NH+]1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000762500450 988415852 /nfs/dbraw/zinc/41/58/52/988415852.db2.gz CYTCEKSPLHAHDS-UHFFFAOYSA-N 2 2 355.442 2.737 20 5 FFBDLP O=[N+]([O-])c1ccc([C@H](O)C[NH2+]Cc2ccc(-n3cc[nH+]c3)c(F)c2)cc1 ZINC000731678371 998142792 /nfs/dbraw/zinc/14/27/92/998142792.db2.gz LBQFBQGNWHEGKW-GOSISDBHSA-N 2 2 356.357 2.743 20 5 FFBDLP COc1cc(N2CCC([NH2+][C@@H](C)C[NH+]3CCCC3)CC2)ccc1[N+](=O)[O-] ZINC001256085275 1038370141 /nfs/dbraw/zinc/37/01/41/1038370141.db2.gz MQHSTGFTTLAEGG-HNNXBMFYSA-N 2 2 362.474 2.646 20 5 FFBDLP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CCCC[NH3+])C(=O)OC(C)(C)C ZINC001246201656 1039278276 /nfs/dbraw/zinc/27/82/76/1039278276.db2.gz INGBUIZUAQWDIO-HOCLYGCPSA-N 2 2 365.474 2.955 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH+]1C[C@H]2C[NH+](Cc3cccnc3)C[C@@H]2C1 ZINC001254561859 1040799139 /nfs/dbraw/zinc/79/91/39/1040799139.db2.gz MXXGTEIHYXXHGI-NSISKUIASA-N 2 2 366.465 2.985 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH+]1C[C@@H]2C[NH+](Cc3cccnc3)C[C@H]2C1 ZINC001254561860 1040800515 /nfs/dbraw/zinc/80/05/15/1040800515.db2.gz MXXGTEIHYXXHGI-UXPWSPDFSA-N 2 2 366.465 2.985 20 5 FFBDLP Cc1[nH+]ccn1CCCC[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272557529 252068419 /nfs/dbraw/zinc/06/84/19/252068419.db2.gz SMTCDIDYIGWHMG-GOSISDBHSA-N 2 2 368.441 2.993 20 5 FFBDLP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272566822 252069277 /nfs/dbraw/zinc/06/92/77/252069277.db2.gz VARMKELQEGTKLC-KDOFPFPSSA-N 2 2 368.441 2.849 20 5 FFBDLP CCOc1ccc([C@H](C)[NH2+]C[C@H](O)C[NH+]2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000153702670 508629590 /nfs/dbraw/zinc/62/95/90/508629590.db2.gz BUAAZTKKEPMLAV-RDJZCZTQSA-N 2 2 365.474 2.737 20 5 FFBDLP C[C@H]1C[C@H]([NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[N@@H+]1C1CC1 ZINC000151102479 508956802 /nfs/dbraw/zinc/95/68/02/508956802.db2.gz XPMHSOLAZYVRFZ-BBRMVZONSA-N 2 2 355.442 2.710 20 5 FFBDLP C[C@H]1C[C@H]([NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[N@H+]1C1CC1 ZINC000151102479 508956804 /nfs/dbraw/zinc/95/68/04/508956804.db2.gz XPMHSOLAZYVRFZ-BBRMVZONSA-N 2 2 355.442 2.710 20 5 FFBDLP COc1ccc(OCC[N@@H+]2CC[C@@H](Oc3cc[nH+]cc3)C2)c([N+](=O)[O-])c1 ZINC000131802349 508970977 /nfs/dbraw/zinc/97/09/77/508970977.db2.gz ZGDXOVSAERBZHL-MRXNPFEDSA-N 2 2 359.382 2.531 20 5 FFBDLP COc1ccc(OCC[N@H+]2CC[C@@H](Oc3cc[nH+]cc3)C2)c([N+](=O)[O-])c1 ZINC000131802349 508970982 /nfs/dbraw/zinc/97/09/82/508970982.db2.gz ZGDXOVSAERBZHL-MRXNPFEDSA-N 2 2 359.382 2.531 20 5 FFBDLP Cc1c([C@@H](C)[NH2+]C[C@@H](O)C[N@@H+]2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000151788169 509083882 /nfs/dbraw/zinc/08/38/82/509083882.db2.gz COTLWQBJUWKGRR-VQIMIIECSA-N 2 2 369.465 2.973 20 5 FFBDLP Cc1c([C@@H](C)[NH2+]C[C@@H](O)C[N@H+]2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000151788169 509083883 /nfs/dbraw/zinc/08/38/83/509083883.db2.gz COTLWQBJUWKGRR-VQIMIIECSA-N 2 2 369.465 2.973 20 5 FFBDLP COc1cc(C[N@@H+]2CC[C@@H](C[NH+](C)C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000156308876 509157674 /nfs/dbraw/zinc/15/76/74/509157674.db2.gz PRBAWDLGHYZKAM-LBPRGKRZSA-N 2 2 373.400 2.631 20 5 FFBDLP COc1cc(C[N@H+]2CC[C@@H](C[NH+](C)C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000156308876 509157677 /nfs/dbraw/zinc/15/76/77/509157677.db2.gz PRBAWDLGHYZKAM-LBPRGKRZSA-N 2 2 373.400 2.631 20 5 FFBDLP CCC[N@H+](C)C[C@H]1CC[NH+](CCOc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000176271607 509413639 /nfs/dbraw/zinc/41/36/39/509413639.db2.gz SNWBGQRPRWEWBO-OAHLLOKOSA-N 2 2 351.447 2.646 20 5 FFBDLP CCC[N@@H+](C)C[C@H]1CC[NH+](CCOc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000176271607 509413646 /nfs/dbraw/zinc/41/36/46/509413646.db2.gz SNWBGQRPRWEWBO-OAHLLOKOSA-N 2 2 351.447 2.646 20 5 FFBDLP CCC[NH+](C)C[C@H]1CC[N@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000176271607 509413651 /nfs/dbraw/zinc/41/36/51/509413651.db2.gz SNWBGQRPRWEWBO-OAHLLOKOSA-N 2 2 351.447 2.646 20 5 FFBDLP CCC[NH+](C)C[C@H]1CC[N@@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000176271607 509413659 /nfs/dbraw/zinc/41/36/59/509413659.db2.gz SNWBGQRPRWEWBO-OAHLLOKOSA-N 2 2 351.447 2.646 20 5 FFBDLP [NH3+]C1(CNC(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)CCCCCC1 ZINC000237777521 509733236 /nfs/dbraw/zinc/73/32/36/509733236.db2.gz RBBKXXRDIYNEFZ-UHFFFAOYSA-N 2 2 357.414 2.562 20 5 FFBDLP C[NH2+]CCC1CC[NH+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000262026839 510152559 /nfs/dbraw/zinc/15/25/59/510152559.db2.gz ZTGBLUJUFVWGGV-UHFFFAOYSA-N 2 2 354.838 2.508 20 5 FFBDLP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)CC[C@H]21 ZINC000246541522 510546629 /nfs/dbraw/zinc/54/66/29/510546629.db2.gz AQULGWWXIFFQHG-GDBMZVCRSA-N 2 2 357.414 2.561 20 5 FFBDLP C[N@H+]1CCC[C@@H]2C[NH+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)CC[C@H]21 ZINC000246541522 510546635 /nfs/dbraw/zinc/54/66/35/510546635.db2.gz AQULGWWXIFFQHG-GDBMZVCRSA-N 2 2 357.414 2.561 20 5 FFBDLP C[NH+]1CCC[C@@H]2C[N@H+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)CC[C@H]21 ZINC000246541522 510546646 /nfs/dbraw/zinc/54/66/46/510546646.db2.gz AQULGWWXIFFQHG-GDBMZVCRSA-N 2 2 357.414 2.561 20 5 FFBDLP C[NH+]1CCC[C@@H]2C[N@@H+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)CC[C@H]21 ZINC000246541522 510546653 /nfs/dbraw/zinc/54/66/53/510546653.db2.gz AQULGWWXIFFQHG-GDBMZVCRSA-N 2 2 357.414 2.561 20 5 FFBDLP Cc1cc(NC[C@@H](O)C[NH+]2CCCCC2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000195303226 510773627 /nfs/dbraw/zinc/77/36/27/510773627.db2.gz IMKVAOZBPXSFCD-QGZVFWFLSA-N 2 2 371.441 2.619 20 5 FFBDLP C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000247334925 510857548 /nfs/dbraw/zinc/85/75/48/510857548.db2.gz VSMYRLNAXWWUJV-GJZGRUSLSA-N 2 2 371.441 2.610 20 5 FFBDLP C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000247334925 510857549 /nfs/dbraw/zinc/85/75/49/510857549.db2.gz VSMYRLNAXWWUJV-GJZGRUSLSA-N 2 2 371.441 2.610 20 5 FFBDLP C[C@H]1C[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC[C@H]1N1CC[NH+](C)CC1 ZINC000362077899 511128080 /nfs/dbraw/zinc/12/80/80/511128080.db2.gz KMUVLQZHZQQRQZ-WMLDXEAASA-N 2 2 366.893 2.706 20 5 FFBDLP C[C@H]1C[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC[C@H]1N1CC[NH+](C)CC1 ZINC000362077899 511128083 /nfs/dbraw/zinc/12/80/83/511128083.db2.gz KMUVLQZHZQQRQZ-WMLDXEAASA-N 2 2 366.893 2.706 20 5 FFBDLP C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000292212266 511507980 /nfs/dbraw/zinc/50/79/80/511507980.db2.gz UESHDRGNVAKQTG-ACJLOTCBSA-N 2 2 357.414 2.733 20 5 FFBDLP C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000292212266 511507985 /nfs/dbraw/zinc/50/79/85/511507985.db2.gz UESHDRGNVAKQTG-ACJLOTCBSA-N 2 2 357.414 2.733 20 5 FFBDLP C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CC[C@]2(CC[N@H+](C)C2)C1 ZINC000292212266 511507986 /nfs/dbraw/zinc/50/79/86/511507986.db2.gz UESHDRGNVAKQTG-ACJLOTCBSA-N 2 2 357.414 2.733 20 5 FFBDLP C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CC[C@]2(CC[N@@H+](C)C2)C1 ZINC000292212266 511507991 /nfs/dbraw/zinc/50/79/91/511507991.db2.gz UESHDRGNVAKQTG-ACJLOTCBSA-N 2 2 357.414 2.733 20 5 FFBDLP Cc1c(NC(=O)CC[N@H+]2CCC[C@H](c3[nH+]ccn3C)C2)cccc1[N+](=O)[O-] ZINC000365625967 511566859 /nfs/dbraw/zinc/56/68/59/511566859.db2.gz IUUOGPVIVOMLBV-HNNXBMFYSA-N 2 2 371.441 2.845 20 5 FFBDLP Cc1c(NC(=O)CC[N@@H+]2CCC[C@H](c3[nH+]ccn3C)C2)cccc1[N+](=O)[O-] ZINC000365625967 511566863 /nfs/dbraw/zinc/56/68/63/511566863.db2.gz IUUOGPVIVOMLBV-HNNXBMFYSA-N 2 2 371.441 2.845 20 5 FFBDLP Cn1cc[nH+]c1[C@H]1CCC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000365628515 511569089 /nfs/dbraw/zinc/56/90/89/511569089.db2.gz LKZPYLNTMMMHGK-AWEZNQCLSA-N 2 2 368.397 2.758 20 5 FFBDLP Cn1cc[nH+]c1[C@H]1CCC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000365628515 511569094 /nfs/dbraw/zinc/56/90/94/511569094.db2.gz LKZPYLNTMMMHGK-AWEZNQCLSA-N 2 2 368.397 2.758 20 5 FFBDLP C[N@@H+]1CCC[C@]2(CC[NH+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)C2)C1 ZINC000292883174 511757544 /nfs/dbraw/zinc/75/75/44/511757544.db2.gz FEGAFLSFWOHIEW-SFHVURJKSA-N 2 2 357.414 2.563 20 5 FFBDLP C[N@H+]1CCC[C@]2(CC[NH+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)C2)C1 ZINC000292883174 511757546 /nfs/dbraw/zinc/75/75/46/511757546.db2.gz FEGAFLSFWOHIEW-SFHVURJKSA-N 2 2 357.414 2.563 20 5 FFBDLP C[NH+]1CCC[C@]2(CC[N@H+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)C2)C1 ZINC000292883174 511757554 /nfs/dbraw/zinc/75/75/54/511757554.db2.gz FEGAFLSFWOHIEW-SFHVURJKSA-N 2 2 357.414 2.563 20 5 FFBDLP C[NH+]1CCC[C@]2(CC[N@@H+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)C2)C1 ZINC000292883174 511757560 /nfs/dbraw/zinc/75/75/60/511757560.db2.gz FEGAFLSFWOHIEW-SFHVURJKSA-N 2 2 357.414 2.563 20 5 FFBDLP COc1cccc(N2CC[NH+](C3CC[NH+](C(C)C)CC3)CC2)c1[N+](=O)[O-] ZINC000274682130 511909161 /nfs/dbraw/zinc/90/91/61/511909161.db2.gz INQZRJCAIWTERM-UHFFFAOYSA-N 2 2 362.474 2.598 20 5 FFBDLP C[NH+](C)CC1(CNC(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)CCCC1 ZINC000450601121 513269185 /nfs/dbraw/zinc/26/91/85/513269185.db2.gz AHMVEIOPUMDXIT-UHFFFAOYSA-N 2 2 371.441 2.632 20 5 FFBDLP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](O)C[N@@H+]1CCc2ccccc2C1 ZINC000449071326 514060534 /nfs/dbraw/zinc/06/05/34/514060534.db2.gz AZEKDWPYHWUQOF-JXFKEZNVSA-N 2 2 369.465 2.535 20 5 FFBDLP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000449071326 514060541 /nfs/dbraw/zinc/06/05/41/514060541.db2.gz AZEKDWPYHWUQOF-JXFKEZNVSA-N 2 2 369.465 2.535 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CC[NH+](C2CC[NH+](C)CC2)CC1 ZINC000449108425 514075804 /nfs/dbraw/zinc/07/58/04/514075804.db2.gz QPBQUUITQLMQGZ-MRXNPFEDSA-N 3 2 360.502 2.674 20 5 FFBDLP NC1(C[NH2+]Cc2csc([N+](=O)[O-])c2)CC[NH+](Cc2ccccc2)CC1 ZINC000415139949 514465267 /nfs/dbraw/zinc/46/52/67/514465267.db2.gz YBYXERHEXVRFPU-UHFFFAOYSA-N 2 2 360.483 2.739 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCN(c2cc[nH+]c(N(C)C)n2)CC1 ZINC000490035499 515077394 /nfs/dbraw/zinc/07/73/94/515077394.db2.gz CSDDXUVKHXMCKN-OAHLLOKOSA-N 2 2 370.457 2.642 20 5 FFBDLP C[C@@H]1C[N@H+](Cc2c(Cl)cccc2[N+](=O)[O-])CC[C@@H]1N1CC[NH+](C)CC1 ZINC000491978284 515488041 /nfs/dbraw/zinc/48/80/41/515488041.db2.gz JHLAQOUXOHNYKB-PBHICJAKSA-N 2 2 366.893 2.706 20 5 FFBDLP C[C@@H]1C[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])CC[C@@H]1N1CC[NH+](C)CC1 ZINC000491978284 515488049 /nfs/dbraw/zinc/48/80/49/515488049.db2.gz JHLAQOUXOHNYKB-PBHICJAKSA-N 2 2 366.893 2.706 20 5 FFBDLP CN(c1ccccc1)c1ccc(C[NH2+]C[C@@]2(O)CC[N@H+](C)C2)cc1[N+](=O)[O-] ZINC000546563318 517725791 /nfs/dbraw/zinc/72/57/91/517725791.db2.gz JQUCDZQFCWBJIV-FQEVSTJZSA-N 2 2 370.453 2.519 20 5 FFBDLP CN(c1ccccc1)c1ccc(C[NH2+]C[C@@]2(O)CC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC000546563318 517725799 /nfs/dbraw/zinc/72/57/99/517725799.db2.gz JQUCDZQFCWBJIV-FQEVSTJZSA-N 2 2 370.453 2.519 20 5 FFBDLP C[NH+]1CCC([N@@H+]2CC[C@@H](Nc3nccc4ccc([N+](=O)[O-])cc43)C2)CC1 ZINC000591147591 519529738 /nfs/dbraw/zinc/52/97/38/519529738.db2.gz RKWWOEAEBORHFX-OAHLLOKOSA-N 2 2 355.442 2.723 20 5 FFBDLP C[NH+]1CCC([N@H+]2CC[C@@H](Nc3nccc4ccc([N+](=O)[O-])cc43)C2)CC1 ZINC000591147591 519529745 /nfs/dbraw/zinc/52/97/45/519529745.db2.gz RKWWOEAEBORHFX-OAHLLOKOSA-N 2 2 355.442 2.723 20 5 FFBDLP C[NH+]1CCC([N@@H+]2CC[C@H](Nc3ncc([N+](=O)[O-])cc3C(F)(F)F)C2)CC1 ZINC000591147580 519530417 /nfs/dbraw/zinc/53/04/17/519530417.db2.gz OJFYLLLZESRSFA-NSHDSACASA-N 2 2 373.379 2.589 20 5 FFBDLP C[NH+]1CCC([N@H+]2CC[C@H](Nc3ncc([N+](=O)[O-])cc3C(F)(F)F)C2)CC1 ZINC000591147580 519530422 /nfs/dbraw/zinc/53/04/22/519530422.db2.gz OJFYLLLZESRSFA-NSHDSACASA-N 2 2 373.379 2.589 20 5 FFBDLP [NH3+]CCCN(CC1CCCC1)C(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000584112432 519597686 /nfs/dbraw/zinc/59/76/86/519597686.db2.gz LDJIVFIPTLVHLW-UHFFFAOYSA-N 2 2 371.441 2.762 20 5 FFBDLP CCC(C)(C)[NH+]1CCN(C(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)CC1 ZINC000594389534 519933801 /nfs/dbraw/zinc/93/38/01/519933801.db2.gz MEJYISKAGRVMBP-UHFFFAOYSA-N 2 2 371.441 2.727 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000609157479 520213683 /nfs/dbraw/zinc/21/36/83/520213683.db2.gz UVIYIEFZGKHUGZ-MRXNPFEDSA-N 2 2 357.414 2.765 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000609157479 520213688 /nfs/dbraw/zinc/21/36/88/520213688.db2.gz UVIYIEFZGKHUGZ-MRXNPFEDSA-N 2 2 357.414 2.765 20 5 FFBDLP COc1cc(C[N@@H+]2CCC[C@H]3C[NH2+]CC[C@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000601335857 520745189 /nfs/dbraw/zinc/74/51/89/520745189.db2.gz YWTNCMCIJFYJQL-WCQYABFASA-N 2 2 371.384 2.779 20 5 FFBDLP COc1cc(C[N@H+]2CCC[C@H]3C[NH2+]CC[C@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000601335857 520745196 /nfs/dbraw/zinc/74/51/96/520745196.db2.gz YWTNCMCIJFYJQL-WCQYABFASA-N 2 2 371.384 2.779 20 5 FFBDLP CC1([NH+]2CCOCC2)CC[NH+](CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000599617881 521335652 /nfs/dbraw/zinc/33/56/52/521335652.db2.gz NUZRKZXEWNBGIR-UHFFFAOYSA-N 2 2 363.458 2.550 20 5 FFBDLP C[C@@H](C[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)[NH+]1CCC(C)CC1 ZINC000602523339 521394239 /nfs/dbraw/zinc/39/42/39/521394239.db2.gz BFMBXISJWDYMLS-INIZCTEOSA-N 2 2 361.490 2.669 20 5 FFBDLP [NH3+]Cc1nc2c(s1)CC[N@@H+]([C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)C2 ZINC000925746958 738526466 /nfs/dbraw/zinc/52/64/66/738526466.db2.gz DQAUWOOMXZNSCD-MRXNPFEDSA-N 2 2 358.467 2.889 20 5 FFBDLP [NH3+]Cc1nc2c(s1)CC[N@H+]([C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)C2 ZINC000925746958 738526470 /nfs/dbraw/zinc/52/64/70/738526470.db2.gz DQAUWOOMXZNSCD-MRXNPFEDSA-N 2 2 358.467 2.889 20 5 FFBDLP O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+]C[C@H]2C[NH2+]CCC2(F)F)c1 ZINC000903955411 736194998 /nfs/dbraw/zinc/19/49/98/736194998.db2.gz RDWGCZRYYUFDLN-SNVBAGLBSA-N 2 2 351.300 2.531 20 5 FFBDLP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1cccnc1N1CC[NH+](C)CC1 ZINC000873027348 1013354006 /nfs/dbraw/zinc/35/40/06/1013354006.db2.gz UUFXCEXOGKVRJI-UHFFFAOYSA-N 2 2 369.469 2.648 20 5 FFBDLP Cc1[nH+]c2c(n1-c1cc(Cl)nc3ccc([N+](=O)[O-])cc31)CC[NH2+]CC2 ZINC001165354682 1029956945 /nfs/dbraw/zinc/95/69/45/1029956945.db2.gz GHTHZNSQQGZGSM-UHFFFAOYSA-N 2 2 357.801 2.979 20 5 FFBDLP CC[N@@H+]1CCC[C@H]1C[NH2+]C1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC001256082694 1038367220 /nfs/dbraw/zinc/36/72/20/1038367220.db2.gz JDLYGKNPUHHPKX-KRWDZBQOSA-N 2 2 362.474 2.646 20 5 FFBDLP CC[N@H+]1CCC[C@H]1C[NH2+]C1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC001256082694 1038367233 /nfs/dbraw/zinc/36/72/33/1038367233.db2.gz JDLYGKNPUHHPKX-KRWDZBQOSA-N 2 2 362.474 2.646 20 5 FFBDLP COc1cc(N2CCC([N@@H+]3C[C@H]4CCC[NH+](C)[C@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256101343 1038387184 /nfs/dbraw/zinc/38/71/84/1038387184.db2.gz FMPGJPWTXYBQDE-BEFAXECRSA-N 2 2 374.485 2.598 20 5 FFBDLP COc1cc(N2CCC([N@H+]3C[C@H]4CCC[NH+](C)[C@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256101343 1038387196 /nfs/dbraw/zinc/38/71/96/1038387196.db2.gz FMPGJPWTXYBQDE-BEFAXECRSA-N 2 2 374.485 2.598 20 5 FFBDLP COc1cc(N2CCC([NH+]3C[C@H]4CCC[N@H+](C)[C@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256101343 1038387208 /nfs/dbraw/zinc/38/72/08/1038387208.db2.gz FMPGJPWTXYBQDE-BEFAXECRSA-N 2 2 374.485 2.598 20 5 FFBDLP COc1cc(N2CCC([NH+]3C[C@H]4CCC[N@@H+](C)[C@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256101343 1038387221 /nfs/dbraw/zinc/38/72/21/1038387221.db2.gz FMPGJPWTXYBQDE-BEFAXECRSA-N 2 2 374.485 2.598 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1C[C@H]3C[NH+](Cc4ccccn4)C[C@H]3C1)C2 ZINC001254596680 1040823861 /nfs/dbraw/zinc/82/38/61/1040823861.db2.gz QETVJCVPVMIFKN-LVCYWYKZSA-N 2 2 364.449 2.521 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@@H+]1C[C@H]3C[NH+](Cc4ccccn4)C[C@H]3C1)C2 ZINC001254596680 1040823871 /nfs/dbraw/zinc/82/38/71/1040823871.db2.gz QETVJCVPVMIFKN-LVCYWYKZSA-N 2 2 364.449 2.521 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH+]1C[C@H]3C[N@@H+](Cc4ccccn4)C[C@H]3C1)C2 ZINC001254596680 1040823880 /nfs/dbraw/zinc/82/38/80/1040823880.db2.gz QETVJCVPVMIFKN-LVCYWYKZSA-N 2 2 364.449 2.521 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH+]1C[C@H]3C[N@H+](Cc4ccccn4)C[C@H]3C1)C2 ZINC001254596680 1040823894 /nfs/dbraw/zinc/82/38/94/1040823894.db2.gz QETVJCVPVMIFKN-LVCYWYKZSA-N 2 2 364.449 2.521 20 5 FFBDLP C[N@@H+]1CC[C@@](O)(C[NH2+]Cc2ccc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC001321128752 1045555909 /nfs/dbraw/zinc/55/59/09/1045555909.db2.gz AUIZIHPIZFBSOC-QGZVFWFLSA-N 2 2 365.817 2.664 20 5 FFBDLP C[N@H+]1CC[C@@](O)(C[NH2+]Cc2ccc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC001321128752 1045555919 /nfs/dbraw/zinc/55/59/19/1045555919.db2.gz AUIZIHPIZFBSOC-QGZVFWFLSA-N 2 2 365.817 2.664 20 5 FFBDLP CC(C)C[C@@H](C[NH+](C)C)[NH2+][C@@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001308970029 1052529126 /nfs/dbraw/zinc/52/91/26/1052529126.db2.gz ADFLKMRGGOXVLX-HOCLYGCPSA-N 2 2 350.463 2.878 20 5 FFBDLP Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1C[C@H]2C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001460745987 1061086818 /nfs/dbraw/zinc/08/68/18/1061086818.db2.gz HQNKQEMASBULQA-AZUAARDMSA-N 2 2 369.469 2.554 20 5 FFBDLP Cc1ncc([N+](=O)[O-])n1CC[N@H+]1C[C@H]2C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001460745987 1061086829 /nfs/dbraw/zinc/08/68/29/1061086829.db2.gz HQNKQEMASBULQA-AZUAARDMSA-N 2 2 369.469 2.554 20 5 FFBDLP Cc1ncc([N+](=O)[O-])n1CC[NH+]1C[C@H]2C[N@H+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001460745987 1061086840 /nfs/dbraw/zinc/08/68/40/1061086840.db2.gz HQNKQEMASBULQA-AZUAARDMSA-N 2 2 369.469 2.554 20 5 FFBDLP Cc1ncc([N+](=O)[O-])n1CC[NH+]1C[C@H]2C[N@@H+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001460745987 1061086852 /nfs/dbraw/zinc/08/68/52/1061086852.db2.gz HQNKQEMASBULQA-AZUAARDMSA-N 2 2 369.469 2.554 20 5 FFBDLP Cn1cc[nH+]c1[C@@H](NCC[N@H+](C)C1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000272475880 252047166 /nfs/dbraw/zinc/04/71/66/252047166.db2.gz BEZDINIIJMEIEW-SFHVURJKSA-N 2 2 357.458 2.882 20 5 FFBDLP Cn1cc[nH+]c1[C@@H](NCC[N@@H+](C)C1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000272475880 252047168 /nfs/dbraw/zinc/04/71/68/252047168.db2.gz BEZDINIIJMEIEW-SFHVURJKSA-N 2 2 357.458 2.882 20 5 FFBDLP O=[N+]([O-])c1ccc2[nH]c(C[NH2+]C3CCN(c4cccc[nH+]4)CC3)nc2c1 ZINC000278727814 256341748 /nfs/dbraw/zinc/34/17/48/256341748.db2.gz QAEVLJOHULDAQO-UHFFFAOYSA-N 2 2 352.398 2.625 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1CN1CC[NH+](C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1 ZINC000377691218 512400723 /nfs/dbraw/zinc/40/07/23/512400723.db2.gz HMPJWRYQBPAGAK-UFRUDQCGSA-N 2 2 358.486 2.646 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1CN1CC[NH+](C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)CC1 ZINC000377691218 512400728 /nfs/dbraw/zinc/40/07/28/512400728.db2.gz HMPJWRYQBPAGAK-UFRUDQCGSA-N 2 2 358.486 2.646 20 5 FFBDLP C[C@@H](CNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](C)C1 ZINC000148596172 508864512 /nfs/dbraw/zinc/86/45/12/508864512.db2.gz RDYRDTDQBLKMNI-GJZGRUSLSA-N 2 2 371.441 2.631 20 5 FFBDLP C[C@@H](CNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)[N@H+]1CCC[C@H](C)C1 ZINC000148596172 508864515 /nfs/dbraw/zinc/86/45/15/508864515.db2.gz RDYRDTDQBLKMNI-GJZGRUSLSA-N 2 2 371.441 2.631 20 5 FFBDLP CN(CC[N@H+](C)C1CC[NH+](C)CC1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000182373547 509201404 /nfs/dbraw/zinc/20/14/04/509201404.db2.gz ALHCZIVUIVZWBV-UHFFFAOYSA-N 2 2 354.882 2.706 20 5 FFBDLP CN(CC[N@@H+](C)C1CC[NH+](C)CC1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000182373547 509201408 /nfs/dbraw/zinc/20/14/08/509201408.db2.gz ALHCZIVUIVZWBV-UHFFFAOYSA-N 2 2 354.882 2.706 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCN(CC[N@H+]2[C@H](C)CC[C@@H]2C)CC1 ZINC000183308929 509709622 /nfs/dbraw/zinc/70/96/22/509709622.db2.gz LVLOGTMOOASPDW-HDICACEKSA-N 2 2 360.502 2.894 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCN(CC[N@@H+]2[C@H](C)CC[C@@H]2C)CC1 ZINC000183308929 509709628 /nfs/dbraw/zinc/70/96/28/509709628.db2.gz LVLOGTMOOASPDW-HDICACEKSA-N 2 2 360.502 2.894 20 5 FFBDLP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000245803151 510151591 /nfs/dbraw/zinc/15/15/91/510151591.db2.gz YBZOQNDGQFZZMT-ZFWWWQNUSA-N 2 2 351.447 2.774 20 5 FFBDLP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000245803151 510151594 /nfs/dbraw/zinc/15/15/94/510151594.db2.gz YBZOQNDGQFZZMT-ZFWWWQNUSA-N 2 2 351.447 2.774 20 5 FFBDLP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000245803151 510151599 /nfs/dbraw/zinc/15/15/99/510151599.db2.gz YBZOQNDGQFZZMT-ZFWWWQNUSA-N 2 2 351.447 2.774 20 5 FFBDLP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000245803151 510151605 /nfs/dbraw/zinc/15/16/05/510151605.db2.gz YBZOQNDGQFZZMT-ZFWWWQNUSA-N 2 2 351.447 2.774 20 5 FFBDLP CC[NH+]1CCC([NH2+][C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000266149768 510434604 /nfs/dbraw/zinc/43/46/04/510434604.db2.gz NCETUNFNGYCLGW-LLVKDONJSA-N 2 2 354.838 2.649 20 5 FFBDLP Cn1cc[nH+]c1C[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000194589982 510435615 /nfs/dbraw/zinc/43/56/15/510435615.db2.gz CWORRBGUFZICEU-ZDUSSCGKSA-N 2 2 359.386 2.691 20 5 FFBDLP Cn1cc[nH+]c1C[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000194589982 510435625 /nfs/dbraw/zinc/43/56/25/510435625.db2.gz CWORRBGUFZICEU-ZDUSSCGKSA-N 2 2 359.386 2.691 20 5 FFBDLP CCOc1cc(C[N@@H+]2CCO[C@@H]3C[C@H]([NH+](C)C)CC[C@@H]32)ccc1[N+](=O)[O-] ZINC000365188766 511307460 /nfs/dbraw/zinc/30/74/60/511307460.db2.gz GAIIPLKMWKIBAR-JTDSTZFVSA-N 2 2 363.458 2.677 20 5 FFBDLP CCOc1cc(C[N@H+]2CCO[C@@H]3C[C@H]([NH+](C)C)CC[C@@H]32)ccc1[N+](=O)[O-] ZINC000365188766 511307466 /nfs/dbraw/zinc/30/74/66/511307466.db2.gz GAIIPLKMWKIBAR-JTDSTZFVSA-N 2 2 363.458 2.677 20 5 FFBDLP C[N@@H+]1CC[C@@H]([NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000283662569 511453328 /nfs/dbraw/zinc/45/33/28/511453328.db2.gz BZZAAGJLLMQGIK-XLIONFOSSA-N 2 2 368.437 2.958 20 5 FFBDLP C[N@H+]1CC[C@@H]([NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000283662569 511453331 /nfs/dbraw/zinc/45/33/31/511453331.db2.gz BZZAAGJLLMQGIK-XLIONFOSSA-N 2 2 368.437 2.958 20 5 FFBDLP CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCO[C@@H]2C[C@@H]([NH+](C)C)CC[C@@H]21 ZINC000374429937 512829739 /nfs/dbraw/zinc/82/97/39/512829739.db2.gz QOUBTSVFGHACGJ-VDZJLULYSA-N 2 2 363.458 2.677 20 5 FFBDLP CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCO[C@@H]2C[C@@H]([NH+](C)C)CC[C@@H]21 ZINC000374429937 512829742 /nfs/dbraw/zinc/82/97/42/512829742.db2.gz QOUBTSVFGHACGJ-VDZJLULYSA-N 2 2 363.458 2.677 20 5 FFBDLP C[C@@H]1C[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])CC[C@@H]1N1CC[NH+](C)CC1 ZINC000370705133 513061352 /nfs/dbraw/zinc/06/13/52/513061352.db2.gz DZXSOFJFPAQGJB-RJGJNRFASA-N 2 2 358.486 2.566 20 5 FFBDLP C[C@@H]1C[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])CC[C@@H]1N1CC[NH+](C)CC1 ZINC000370705133 513061358 /nfs/dbraw/zinc/06/13/58/513061358.db2.gz DZXSOFJFPAQGJB-RJGJNRFASA-N 2 2 358.486 2.566 20 5 FFBDLP C[C@@H]1CCCC[N@@H+]1CCCNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000448592653 513797797 /nfs/dbraw/zinc/79/77/97/513797797.db2.gz QYIASAICGXGGBL-OAHLLOKOSA-N 2 2 371.441 2.775 20 5 FFBDLP C[C@@H]1CCCC[N@H+]1CCCNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000448592653 513797806 /nfs/dbraw/zinc/79/78/06/513797806.db2.gz QYIASAICGXGGBL-OAHLLOKOSA-N 2 2 371.441 2.775 20 5 FFBDLP O=C(C[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000420333669 514098380 /nfs/dbraw/zinc/09/83/80/514098380.db2.gz IATXHQDEBLKSID-HNNXBMFYSA-N 2 2 366.849 2.651 20 5 FFBDLP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]C[C@@H]2[NH2+]CCc3ccccc32)n1 ZINC000423415028 514135252 /nfs/dbraw/zinc/13/52/52/514135252.db2.gz DDFBFZZFPWSOAA-OKZBNKHCSA-N 2 2 355.442 2.752 20 5 FFBDLP O=C(NCCCCC[NH+]1CCCC1)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000452144337 514217303 /nfs/dbraw/zinc/21/73/03/514217303.db2.gz DDKPOFWLWYQJAM-UHFFFAOYSA-N 2 2 371.441 2.776 20 5 FFBDLP COc1c[nH+]ccc1N1CC[NH+](C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000475619607 514736800 /nfs/dbraw/zinc/73/68/00/514736800.db2.gz DHVUDNKVQCXYDZ-GQCTYLIASA-N 2 2 354.410 2.834 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@@H+]2Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000491890201 515480197 /nfs/dbraw/zinc/48/01/97/515480197.db2.gz KGMNWBWRNGPQBP-OAUYIBNBSA-N 2 2 353.850 2.932 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@H+]2Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000491890201 515480203 /nfs/dbraw/zinc/48/02/03/515480203.db2.gz KGMNWBWRNGPQBP-OAUYIBNBSA-N 2 2 353.850 2.932 20 5 FFBDLP Cn1cc[nH+]c1[C@@H](N[C@@H]1CC[NH2+]C2(CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000591582653 519958721 /nfs/dbraw/zinc/95/87/21/519958721.db2.gz RSVXBLFLDZWXGF-WBVHZDCISA-N 2 2 355.442 2.682 20 5 FFBDLP C[C@H]([NH2+]C[C@@H](O)COc1cccc([N+](=O)[O-])c1)[C@H](c1ccccc1)[NH+](C)C ZINC000591761297 520026067 /nfs/dbraw/zinc/02/60/67/520026067.db2.gz HKZCLWLZRVQZQO-QKYXUNIQSA-N 2 2 373.453 2.616 20 5 FFBDLP CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](C(F)(F)F)[C@H](C[NH3+])C1 ZINC000600729387 520429075 /nfs/dbraw/zinc/42/90/75/520429075.db2.gz YLLWWWFHWFOAGT-TZMCWYRMSA-N 2 2 361.364 2.953 20 5 FFBDLP CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](C(F)(F)F)[C@H](C[NH3+])C1 ZINC000600729387 520429079 /nfs/dbraw/zinc/42/90/79/520429079.db2.gz YLLWWWFHWFOAGT-TZMCWYRMSA-N 2 2 361.364 2.953 20 5 FFBDLP O=[N+]([O-])c1cnn(CC[NH+]2CCC(Cc3[nH]c4ccccc4[nH+]3)CC2)c1 ZINC000595551825 520546882 /nfs/dbraw/zinc/54/68/82/520546882.db2.gz LFMKZGMZOCMZLH-UHFFFAOYSA-N 2 2 354.414 2.622 20 5 FFBDLP COc1cc(N[C@@H]2CC[N@H+](C3CC[NH+](C)CC3)C2)c(Cl)cc1[N+](=O)[O-] ZINC000596124311 520927746 /nfs/dbraw/zinc/92/77/46/520927746.db2.gz VHDOUZRMXUIRQV-GFCCVEGCSA-N 2 2 368.865 2.837 20 5 FFBDLP Cc1cc(N2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4C)CC2)c([N+](=O)[O-])s1 ZINC000596175170 520952145 /nfs/dbraw/zinc/95/21/45/520952145.db2.gz QJXUUMVUFSLPFJ-YIONKMFJSA-N 2 2 350.488 2.712 20 5 FFBDLP Cc1cc(N2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)c([N+](=O)[O-])s1 ZINC000596175170 520952153 /nfs/dbraw/zinc/95/21/53/520952153.db2.gz QJXUUMVUFSLPFJ-YIONKMFJSA-N 2 2 350.488 2.712 20 5 FFBDLP C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@@H]1CC[N@@H+]1C1CCCC1 ZINC000599072879 521015627 /nfs/dbraw/zinc/01/56/27/521015627.db2.gz BDTXCARKOZXVRH-KDOFPFPSSA-N 2 2 360.458 2.918 20 5 FFBDLP C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@@H]1CC[N@H+]1C1CCCC1 ZINC000599072879 521015636 /nfs/dbraw/zinc/01/56/36/521015636.db2.gz BDTXCARKOZXVRH-KDOFPFPSSA-N 2 2 360.458 2.918 20 5 FFBDLP C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C[C@@H]1CC[N@@H+]1C1CCCC1 ZINC000599072935 521015679 /nfs/dbraw/zinc/01/56/79/521015679.db2.gz COPJPJUHKBHUCF-KSSFIOAISA-N 2 2 360.458 2.918 20 5 FFBDLP C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C[C@@H]1CC[N@H+]1C1CCCC1 ZINC000599072935 521015690 /nfs/dbraw/zinc/01/56/90/521015690.db2.gz COPJPJUHKBHUCF-KSSFIOAISA-N 2 2 360.458 2.918 20 5 FFBDLP C[C@@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@@H]1CC[NH3+] ZINC000593735705 521182983 /nfs/dbraw/zinc/18/29/83/521182983.db2.gz ZHELPGDCRUUCHJ-BXUZGUMPSA-N 2 2 354.838 2.636 20 5 FFBDLP C[C@@H]1CCC[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@@H]1CC[NH3+] ZINC000593735705 521182992 /nfs/dbraw/zinc/18/29/92/521182992.db2.gz ZHELPGDCRUUCHJ-BXUZGUMPSA-N 2 2 354.838 2.636 20 5 FFBDLP C[C@H](C[NH+]1CCC(C)CC1)[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602717571 521493695 /nfs/dbraw/zinc/49/36/95/521493695.db2.gz LUHJNMYTBXDJSB-MRXNPFEDSA-N 2 2 361.490 2.669 20 5 FFBDLP O=[N+]([O-])c1ccc(Cl)c(C[NH+]2CCC(C[NH+]3CCOCC3)CC2)c1 ZINC000735493582 734948338 /nfs/dbraw/zinc/94/83/38/734948338.db2.gz YOOBGZYBJQEVLV-UHFFFAOYSA-N 2 2 353.850 2.792 20 5 FFBDLP CC(C)(C)[C@@H](Cn1cc[nH+]c1)[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000876957061 1014433573 /nfs/dbraw/zinc/43/35/73/1014433573.db2.gz SNMZQWWIVUHCPH-QGZVFWFLSA-N 2 2 372.473 2.860 20 5 FFBDLP Cc1c(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2CO)cccc1[N+](=O)[O-] ZINC000788469145 1001807483 /nfs/dbraw/zinc/80/74/83/1001807483.db2.gz NTVGKWYEVUOQEJ-WOJBJXKFSA-N 2 2 369.465 2.876 20 5 FFBDLP Cc1c(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2CO)cccc1[N+](=O)[O-] ZINC000788469145 1001807495 /nfs/dbraw/zinc/80/74/95/1001807495.db2.gz NTVGKWYEVUOQEJ-WOJBJXKFSA-N 2 2 369.465 2.876 20 5 FFBDLP Nc1cc2nc3ccccc3nc2cc1NC(=O)c1ccc([C@H]([NH3+])C[NH3+])cc1 ZINC001218859488 1033382132 /nfs/dbraw/zinc/38/21/32/1033382132.db2.gz OKKZHBGRJNZFBS-OAHLLOKOSA-N 2 2 372.432 2.576 20 5 FFBDLP Cc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2CO)cc1[N+](=O)[O-] ZINC001200704260 1059151947 /nfs/dbraw/zinc/15/19/47/1059151947.db2.gz SCUNSGSORUPPDI-VQTJNVASSA-N 2 2 369.465 2.876 20 5 FFBDLP Cc1ccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2CO)cc1[N+](=O)[O-] ZINC001200704260 1059151949 /nfs/dbraw/zinc/15/19/49/1059151949.db2.gz SCUNSGSORUPPDI-VQTJNVASSA-N 2 2 369.465 2.876 20 5 FFBDLP O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@H](Cn2cc[nH+]c2)c2ccccc2)cc1 ZINC001473748188 1065345512 /nfs/dbraw/zinc/34/55/12/1065345512.db2.gz WLJZDVREEMSSNX-RTBURBONSA-N 2 2 352.394 2.856 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[N@H+](Cc1ccc(N2CC[NH2+]CC2)o1)C1CC1 ZINC001580875162 1078882297 /nfs/dbraw/zinc/88/22/97/1078882297.db2.gz BUEQZZSIHIHQKA-UHFFFAOYSA-N 2 2 356.426 2.762 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccc(N2CC[NH2+]CC2)o1)C1CC1 ZINC001580875162 1078882303 /nfs/dbraw/zinc/88/23/03/1078882303.db2.gz BUEQZZSIHIHQKA-UHFFFAOYSA-N 2 2 356.426 2.762 20 5 FFBDLP C[NH+]1CCC([N@@H+]2CC[C@@H](Nc3ccc4ncccc4c3[N+](=O)[O-])C2)CC1 ZINC000369269019 512321726 /nfs/dbraw/zinc/32/17/26/512321726.db2.gz VCSFWQYZYXFMKC-CQSZACIVSA-N 2 2 355.442 2.723 20 5 FFBDLP C[NH+]1CCC([N@H+]2CC[C@@H](Nc3ccc4ncccc4c3[N+](=O)[O-])C2)CC1 ZINC000369269019 512321729 /nfs/dbraw/zinc/32/17/29/512321729.db2.gz VCSFWQYZYXFMKC-CQSZACIVSA-N 2 2 355.442 2.723 20 5 FFBDLP C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000156462736 508424042 /nfs/dbraw/zinc/42/40/42/508424042.db2.gz HWBXALBKSWUOEL-KEYYUXOJSA-N 2 2 357.414 2.701 20 5 FFBDLP C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000156462736 508424048 /nfs/dbraw/zinc/42/40/48/508424048.db2.gz HWBXALBKSWUOEL-KEYYUXOJSA-N 2 2 357.414 2.701 20 5 FFBDLP C[NH+](C)CC[C@H]([NH2+][C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)C(C)(C)C ZINC000116396841 508507468 /nfs/dbraw/zinc/50/74/68/508507468.db2.gz FRIIVFNHBFOMMO-IRXDYDNUSA-N 2 2 362.474 2.656 20 5 FFBDLP CC[NH+]1CCC([N@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000125198411 508945900 /nfs/dbraw/zinc/94/59/00/508945900.db2.gz LNMJTRRBPWLQGG-UHFFFAOYSA-N 2 2 357.458 2.911 20 5 FFBDLP CC[NH+]1CCC([N@@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000125198411 508945903 /nfs/dbraw/zinc/94/59/03/508945903.db2.gz LNMJTRRBPWLQGG-UHFFFAOYSA-N 2 2 357.458 2.911 20 5 FFBDLP C[C@@H]1C[C@H]([NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[N@@H+]1C1CC1 ZINC000151102424 508956565 /nfs/dbraw/zinc/95/65/65/508956565.db2.gz XPMHSOLAZYVRFZ-CJNGLKHVSA-N 2 2 355.442 2.710 20 5 FFBDLP C[C@@H]1C[C@H]([NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[N@H+]1C1CC1 ZINC000151102424 508956569 /nfs/dbraw/zinc/95/65/69/508956569.db2.gz XPMHSOLAZYVRFZ-CJNGLKHVSA-N 2 2 355.442 2.710 20 5 FFBDLP COc1ccc(OCC[N@@H+]2CC[C@@H](C)[C@H](n3cc[nH+]c3)C2)c([N+](=O)[O-])c1 ZINC000245526786 509983686 /nfs/dbraw/zinc/98/36/86/509983686.db2.gz FLCKJRJFCIFRML-RHSMWYFYSA-N 2 2 360.414 2.762 20 5 FFBDLP COc1ccc(OCC[N@H+]2CC[C@@H](C)[C@H](n3cc[nH+]c3)C2)c([N+](=O)[O-])c1 ZINC000245526786 509983691 /nfs/dbraw/zinc/98/36/91/509983691.db2.gz FLCKJRJFCIFRML-RHSMWYFYSA-N 2 2 360.414 2.762 20 5 FFBDLP C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261696689 510030502 /nfs/dbraw/zinc/03/05/02/510030502.db2.gz JKWNSJLAHWEFAO-OGWOLHLISA-N 2 2 368.437 2.596 20 5 FFBDLP C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261696689 510030509 /nfs/dbraw/zinc/03/05/09/510030509.db2.gz JKWNSJLAHWEFAO-OGWOLHLISA-N 2 2 368.437 2.596 20 5 FFBDLP O=C(CC[NH+]1CCC(n2cc[nH+]c2)CC1)Nc1cc([N+](=O)[O-])ccc1F ZINC000181736706 510566948 /nfs/dbraw/zinc/56/69/48/510566948.db2.gz XHHIHZCUCSSLFT-UHFFFAOYSA-N 2 2 361.377 2.596 20 5 FFBDLP C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC000188297389 510696278 /nfs/dbraw/zinc/69/62/78/510696278.db2.gz JIRSTRYJKCQDMI-HXUWFJFHSA-N 2 2 355.438 2.664 20 5 FFBDLP C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC000188297389 510696286 /nfs/dbraw/zinc/69/62/86/510696286.db2.gz JIRSTRYJKCQDMI-HXUWFJFHSA-N 2 2 355.438 2.664 20 5 FFBDLP C[NH+](Cc1ccccc1[N+](=O)[O-])C[C@]1(O)CC[N@H+](Cc2ccccc2)C1 ZINC000188297389 510696293 /nfs/dbraw/zinc/69/62/93/510696293.db2.gz JIRSTRYJKCQDMI-HXUWFJFHSA-N 2 2 355.438 2.664 20 5 FFBDLP C[NH+](Cc1ccccc1[N+](=O)[O-])C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000188297389 510696299 /nfs/dbraw/zinc/69/62/99/510696299.db2.gz JIRSTRYJKCQDMI-HXUWFJFHSA-N 2 2 355.438 2.664 20 5 FFBDLP CC(C)[NH+]1CCN([C@H]2CC[N@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)CC1 ZINC000377830021 512471413 /nfs/dbraw/zinc/47/14/13/512471413.db2.gz AFKGEUCTJQCEEJ-KRWDZBQOSA-N 2 2 366.893 2.849 20 5 FFBDLP CC(C)[NH+]1CCN([C@H]2CC[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)CC1 ZINC000377830021 512471418 /nfs/dbraw/zinc/47/14/18/512471418.db2.gz AFKGEUCTJQCEEJ-KRWDZBQOSA-N 2 2 366.893 2.849 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@@H+]2Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000374426294 512827854 /nfs/dbraw/zinc/82/78/54/512827854.db2.gz DCFVKCCDCGNGLO-VYDXJSESSA-N 2 2 353.850 2.932 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@H+]2Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000374426294 512827858 /nfs/dbraw/zinc/82/78/58/512827858.db2.gz DCFVKCCDCGNGLO-VYDXJSESSA-N 2 2 353.850 2.932 20 5 FFBDLP CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCO[C@@H]2C[C@H]([NH+](C)C)CC[C@H]21 ZINC000374429934 512829489 /nfs/dbraw/zinc/82/94/89/512829489.db2.gz QOUBTSVFGHACGJ-SZVBFZGTSA-N 2 2 363.458 2.677 20 5 FFBDLP CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCO[C@@H]2C[C@H]([NH+](C)C)CC[C@H]21 ZINC000374429934 512829493 /nfs/dbraw/zinc/82/94/93/512829493.db2.gz QOUBTSVFGHACGJ-SZVBFZGTSA-N 2 2 363.458 2.677 20 5 FFBDLP C[C@@H](CCNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)[NH+]1CCCCC1 ZINC000450558237 513250213 /nfs/dbraw/zinc/25/02/13/513250213.db2.gz FHTCZDJKLSABLX-HNNXBMFYSA-N 2 2 371.441 2.775 20 5 FFBDLP CCCC[N@H+](C)C[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000451821128 514002659 /nfs/dbraw/zinc/00/26/59/514002659.db2.gz FXUVFJBKVYFGHC-CQSZACIVSA-N 2 2 359.430 2.631 20 5 FFBDLP CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000451821128 514002670 /nfs/dbraw/zinc/00/26/70/514002670.db2.gz FXUVFJBKVYFGHC-CQSZACIVSA-N 2 2 359.430 2.631 20 5 FFBDLP CNc1cc(N2CCC[C@@H]2C[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])nc[nH+]1 ZINC000449125361 514081632 /nfs/dbraw/zinc/08/16/32/514081632.db2.gz RWOPJXHIJQSLMM-GDBMZVCRSA-N 2 2 370.457 2.616 20 5 FFBDLP COc1cc(C[NH2+][C@H]2CC[NH2+]CC2(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000420361383 514110130 /nfs/dbraw/zinc/11/01/30/514110130.db2.gz MEQHBOUAWAJRHK-AWEZNQCLSA-N 2 2 359.373 2.683 20 5 FFBDLP C[C@H]([NH2+]C[C@@H]1C[NH2+]CCN1C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423481859 514149493 /nfs/dbraw/zinc/14/94/93/514149493.db2.gz QYFDOSCQDUNVHX-KBPBESRZSA-N 2 2 360.483 2.878 20 5 FFBDLP Cc1cc(N[C@H]2CC[N@@H+]3CCC[C@@H]3C2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000489179375 514740563 /nfs/dbraw/zinc/74/05/63/514740563.db2.gz ZAEKPCMZZXICNV-DOTOQJQBSA-N 2 2 353.426 2.821 20 5 FFBDLP Cc1cc(N[C@H]2CC[N@H+]3CCC[C@@H]3C2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000489179375 514740577 /nfs/dbraw/zinc/74/05/77/514740577.db2.gz ZAEKPCMZZXICNV-DOTOQJQBSA-N 2 2 353.426 2.821 20 5 FFBDLP C[NH+](C)CCCC(C)(C)NC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000456211312 515026264 /nfs/dbraw/zinc/02/62/64/515026264.db2.gz XXFUMYOIRUZRPU-UHFFFAOYSA-N 2 2 359.430 2.631 20 5 FFBDLP CCN(C[C@H]1CCC[N@@H+]1CC)C(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000547799411 516570220 /nfs/dbraw/zinc/57/02/20/516570220.db2.gz ZDQRYPLGPMFSEF-MRXNPFEDSA-N 2 2 371.441 2.727 20 5 FFBDLP CCN(C[C@H]1CCC[N@H+]1CC)C(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000547799411 516570225 /nfs/dbraw/zinc/57/02/25/516570225.db2.gz ZDQRYPLGPMFSEF-MRXNPFEDSA-N 2 2 371.441 2.727 20 5 FFBDLP C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1CC[NH+](CCO)CC1 ZINC000513579127 516676572 /nfs/dbraw/zinc/67/65/72/516676572.db2.gz UHYPFCCHNIEBJX-UHFFFAOYSA-N 2 2 359.426 2.743 20 5 FFBDLP C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1CC[NH+](CCO)CC1 ZINC000513579127 516676578 /nfs/dbraw/zinc/67/65/78/516676578.db2.gz UHYPFCCHNIEBJX-UHFFFAOYSA-N 2 2 359.426 2.743 20 5 FFBDLP CC(C)[N@@H+](C)C[C@@H](C)Nc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000573738595 518811203 /nfs/dbraw/zinc/81/12/03/518811203.db2.gz RFIJTMXFKGGKBD-OAHLLOKOSA-N 2 2 350.463 2.568 20 5 FFBDLP CC(C)[N@H+](C)C[C@@H](C)Nc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000573738595 518811209 /nfs/dbraw/zinc/81/12/09/518811209.db2.gz RFIJTMXFKGGKBD-OAHLLOKOSA-N 2 2 350.463 2.568 20 5 FFBDLP C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C[C@H]1CCCC[N@@H+]1C1CC1 ZINC000580399541 519155132 /nfs/dbraw/zinc/15/51/32/519155132.db2.gz INQRCXYUQMKSRB-RDTXWAMCSA-N 2 2 360.458 2.918 20 5 FFBDLP C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C[C@H]1CCCC[N@H+]1C1CC1 ZINC000580399541 519155141 /nfs/dbraw/zinc/15/51/41/519155141.db2.gz INQRCXYUQMKSRB-RDTXWAMCSA-N 2 2 360.458 2.918 20 5 FFBDLP C[C@H]([NH2+]C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@H](c1ccccc1)[NH+](C)C ZINC000574686174 519281631 /nfs/dbraw/zinc/28/16/31/519281631.db2.gz KLRZEZRBFBWTDP-RIFZZMRRSA-N 2 2 373.453 2.616 20 5 FFBDLP CC(C)(C)[N@@H+]1CC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)C1 ZINC000597859761 520286740 /nfs/dbraw/zinc/28/67/40/520286740.db2.gz HGCDQRZCIGYINO-AWEZNQCLSA-N 2 2 371.441 2.631 20 5 FFBDLP CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)C1 ZINC000597859761 520286746 /nfs/dbraw/zinc/28/67/46/520286746.db2.gz HGCDQRZCIGYINO-AWEZNQCLSA-N 2 2 371.441 2.631 20 5 FFBDLP CCOc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCOC3)CC2)cc1[N+](=O)[O-] ZINC000595106582 520297051 /nfs/dbraw/zinc/29/70/51/520297051.db2.gz VKZIXAQCNATUIO-YOEHRIQHSA-N 2 2 363.458 2.897 20 5 FFBDLP O=C(C[NH+]1CCC([C@H]2CC[NH2+]C2)CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000592492057 520413896 /nfs/dbraw/zinc/41/38/96/520413896.db2.gz KAWLPQXRXVYHRS-ZDUSSCGKSA-N 2 2 366.849 2.508 20 5 FFBDLP C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H]1CC2(CO1)CC[NH2+]CC2 ZINC000903719106 736159493 /nfs/dbraw/zinc/15/94/93/736159493.db2.gz VYFKJEWGPNMGBC-OAHLLOKOSA-N 2 2 353.850 2.839 20 5 FFBDLP C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H]1CC2(CO1)CC[NH2+]CC2 ZINC000903719106 736159498 /nfs/dbraw/zinc/15/94/98/736159498.db2.gz VYFKJEWGPNMGBC-OAHLLOKOSA-N 2 2 353.850 2.839 20 5 FFBDLP C[N@@H+]1CCCC[C@@H]1CCOC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000922748265 988864852 /nfs/dbraw/zinc/86/48/52/988864852.db2.gz QVPSERTXLJFFJN-OAHLLOKOSA-N 2 2 358.398 2.812 20 5 FFBDLP C[N@H+]1CCCC[C@@H]1CCOC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000922748265 988864872 /nfs/dbraw/zinc/86/48/72/988864872.db2.gz QVPSERTXLJFFJN-OAHLLOKOSA-N 2 2 358.398 2.812 20 5 FFBDLP Cc1c[nH+]ccc1OC1CC[NH+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000809995340 994663152 /nfs/dbraw/zinc/66/31/52/994663152.db2.gz PHNOGQSTSBBRNP-SFHVURJKSA-N 2 2 357.410 2.875 20 5 FFBDLP [NH3+][C@@H](CO)Cc1c[nH+]cn1-c1cnc2c3ccccc3c3ccccc3c2n1 ZINC001169070828 1000019789 /nfs/dbraw/zinc/01/97/89/1000019789.db2.gz DECKKXNHIKAJSH-CQSZACIVSA-N 2 2 369.428 2.984 20 5 FFBDLP C[C@H](C[NH+]1CCCC1)[NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173012507 1012184827 /nfs/dbraw/zinc/18/48/27/1012184827.db2.gz ULKJGNZFEVQVFV-CYBMUJFWSA-N 2 2 368.428 2.916 20 5 FFBDLP C[N@@H+]1CCCC[C@H]1CCOC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000838101762 1026208074 /nfs/dbraw/zinc/20/80/74/1026208074.db2.gz LPAVEIJJGHNDBM-HNNXBMFYSA-N 2 2 358.398 2.812 20 5 FFBDLP C[N@H+]1CCCC[C@H]1CCOC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000838101762 1026208079 /nfs/dbraw/zinc/20/80/79/1026208079.db2.gz LPAVEIJJGHNDBM-HNNXBMFYSA-N 2 2 358.398 2.812 20 5 FFBDLP C[NH+](C)C1(CNc2ncc(F)c3cc([N+](=O)[O-])ccc32)CC[NH+](C)CC1 ZINC001164211041 1029202081 /nfs/dbraw/zinc/20/20/81/1029202081.db2.gz LBXGSGWCWBVZMD-UHFFFAOYSA-N 2 2 361.421 2.720 20 5 FFBDLP COc1cc(N2CCC([N@@H+]3C[C@@H]4CCC[NH+](C)[C@@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256101345 1038387616 /nfs/dbraw/zinc/38/76/16/1038387616.db2.gz FMPGJPWTXYBQDE-HNAYVOBHSA-N 2 2 374.485 2.598 20 5 FFBDLP COc1cc(N2CCC([N@H+]3C[C@@H]4CCC[NH+](C)[C@@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256101345 1038387630 /nfs/dbraw/zinc/38/76/30/1038387630.db2.gz FMPGJPWTXYBQDE-HNAYVOBHSA-N 2 2 374.485 2.598 20 5 FFBDLP COc1cc(N2CCC([NH+]3C[C@@H]4CCC[N@H+](C)[C@@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256101345 1038387640 /nfs/dbraw/zinc/38/76/40/1038387640.db2.gz FMPGJPWTXYBQDE-HNAYVOBHSA-N 2 2 374.485 2.598 20 5 FFBDLP COc1cc(N2CCC([NH+]3C[C@@H]4CCC[N@@H+](C)[C@@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256101345 1038387657 /nfs/dbraw/zinc/38/76/57/1038387657.db2.gz FMPGJPWTXYBQDE-HNAYVOBHSA-N 2 2 374.485 2.598 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH2+]Cc1cccc(C[NH+]3CCOCC3)c1)C2 ZINC001254573051 1040809631 /nfs/dbraw/zinc/80/96/31/1040809631.db2.gz WAMIBVVGMRHASI-HXUWFJFHSA-N 2 2 367.449 2.684 20 5 FFBDLP CC(C)[N@H+](C)Cc1cnc2n1CC[NH+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254595830 1040825395 /nfs/dbraw/zinc/82/53/95/1040825395.db2.gz NKATXSABTHLIGP-SFHVURJKSA-N 2 2 369.469 2.615 20 5 FFBDLP CC(C)[N@@H+](C)Cc1cnc2n1CC[NH+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254595830 1040825407 /nfs/dbraw/zinc/82/54/07/1040825407.db2.gz NKATXSABTHLIGP-SFHVURJKSA-N 2 2 369.469 2.615 20 5 FFBDLP CC(C)[NH+](C)Cc1cnc2n1CC[N@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254595830 1040825420 /nfs/dbraw/zinc/82/54/20/1040825420.db2.gz NKATXSABTHLIGP-SFHVURJKSA-N 2 2 369.469 2.615 20 5 FFBDLP CC(C)[NH+](C)Cc1cnc2n1CC[N@@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254595830 1040825429 /nfs/dbraw/zinc/82/54/29/1040825429.db2.gz NKATXSABTHLIGP-SFHVURJKSA-N 2 2 369.469 2.615 20 5 FFBDLP O=C(C[N@@H+]1CCCC2(CC[NH2+]CC2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC001332425192 1048391025 /nfs/dbraw/zinc/39/10/25/1048391025.db2.gz XABIQUXWCCDOSC-UHFFFAOYSA-N 2 2 366.849 2.652 20 5 FFBDLP O=C(C[N@H+]1CCCC2(CC[NH2+]CC2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC001332425192 1048391036 /nfs/dbraw/zinc/39/10/36/1048391036.db2.gz XABIQUXWCCDOSC-UHFFFAOYSA-N 2 2 366.849 2.652 20 5 FFBDLP O=[N+]([O-])c1cccc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2CO)c1 ZINC001308283579 1052441426 /nfs/dbraw/zinc/44/14/26/1052441426.db2.gz ZIFKFDVGXSQFAR-AZUAARDMSA-N 2 2 355.438 2.567 20 5 FFBDLP O=[N+]([O-])c1cccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2CO)c1 ZINC001308283579 1052441427 /nfs/dbraw/zinc/44/14/27/1052441427.db2.gz ZIFKFDVGXSQFAR-AZUAARDMSA-N 2 2 355.438 2.567 20 5 FFBDLP CC[NH+](CC)CC[C@H](C)NC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC001348855070 1054964447 /nfs/dbraw/zinc/96/44/47/1054964447.db2.gz MMUAASKXOYGHLZ-AWEZNQCLSA-N 2 2 359.430 2.631 20 5 FFBDLP Cc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2CO)cc1[N+](=O)[O-] ZINC001200704258 1059152097 /nfs/dbraw/zinc/15/20/97/1059152097.db2.gz SCUNSGSORUPPDI-PMACEKPBSA-N 2 2 369.465 2.876 20 5 FFBDLP Cc1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2CO)cc1[N+](=O)[O-] ZINC001200704258 1059152101 /nfs/dbraw/zinc/15/21/01/1059152101.db2.gz SCUNSGSORUPPDI-PMACEKPBSA-N 2 2 369.465 2.876 20 5 FFBDLP C[N@@H+]1CCC[C@H]2C[NH+](Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)CC[C@H]21 ZINC000848483116 1060121834 /nfs/dbraw/zinc/12/18/34/1060121834.db2.gz YOPUFPMYXUHPKC-MAUKXSAKSA-N 2 2 355.442 2.832 20 5 FFBDLP C[N@H+]1CCC[C@H]2C[NH+](Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)CC[C@H]21 ZINC000848483116 1060121848 /nfs/dbraw/zinc/12/18/48/1060121848.db2.gz YOPUFPMYXUHPKC-MAUKXSAKSA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CCC[C@H]2C[N@H+](Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)CC[C@H]21 ZINC000848483116 1060121859 /nfs/dbraw/zinc/12/18/59/1060121859.db2.gz YOPUFPMYXUHPKC-MAUKXSAKSA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CCC[C@H]2C[N@@H+](Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)CC[C@H]21 ZINC000848483116 1060121863 /nfs/dbraw/zinc/12/18/63/1060121863.db2.gz YOPUFPMYXUHPKC-MAUKXSAKSA-N 2 2 355.442 2.832 20 5 FFBDLP CN(C(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)C1(C[NH3+])CCCCC1 ZINC001578390656 1078468587 /nfs/dbraw/zinc/46/85/87/1078468587.db2.gz FWPHXCDPIFSSPY-UHFFFAOYSA-N 2 2 357.414 2.514 20 5 FFBDLP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1 ZINC000093693282 250042389 /nfs/dbraw/zinc/04/23/89/250042389.db2.gz CKCNZQVHVVNJOD-CQSZACIVSA-N 2 2 351.447 2.776 20 5 FFBDLP CC[NH+](CC)C[C@H]1CC[N@@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1 ZINC000093693282 250042392 /nfs/dbraw/zinc/04/23/92/250042392.db2.gz CKCNZQVHVVNJOD-CQSZACIVSA-N 2 2 351.447 2.776 20 5 FFBDLP CN(C)C(=O)[C@H]1CCC[N@@H+]1CCC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000278160387 256283195 /nfs/dbraw/zinc/28/31/95/256283195.db2.gz AVIXKCMPLYYDDY-RBUKOAKNSA-N 2 2 374.485 2.505 20 5 FFBDLP CN(C)C(=O)[C@H]1CCC[N@H+]1CCC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000278160387 256283196 /nfs/dbraw/zinc/28/31/96/256283196.db2.gz AVIXKCMPLYYDDY-RBUKOAKNSA-N 2 2 374.485 2.505 20 5 FFBDLP Cn1cc[nH+]c1[C@@H]1CCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000373095165 512169680 /nfs/dbraw/zinc/16/96/80/512169680.db2.gz OIUFOFCQCNLMJI-CQSZACIVSA-N 2 2 368.397 2.758 20 5 FFBDLP Cn1cc[nH+]c1[C@@H]1CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000373095165 512169685 /nfs/dbraw/zinc/16/96/85/512169685.db2.gz OIUFOFCQCNLMJI-CQSZACIVSA-N 2 2 368.397 2.758 20 5 FFBDLP Cn1cc[nH+]c1[C@H]1CCC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000377262652 512190549 /nfs/dbraw/zinc/19/05/49/512190549.db2.gz QGMFMQPBXYAPGZ-AWEZNQCLSA-N 2 2 368.397 2.758 20 5 FFBDLP Cn1cc[nH+]c1[C@H]1CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000377262652 512190555 /nfs/dbraw/zinc/19/05/55/512190555.db2.gz QGMFMQPBXYAPGZ-AWEZNQCLSA-N 2 2 368.397 2.758 20 5 FFBDLP CCC[N@H+](C)C[C@H]1CCN(C(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)C1 ZINC000081361074 508167038 /nfs/dbraw/zinc/16/70/38/508167038.db2.gz WHWZCDYLAIEFOE-OAHLLOKOSA-N 2 2 371.441 2.584 20 5 FFBDLP CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)C1 ZINC000081361074 508167041 /nfs/dbraw/zinc/16/70/41/508167041.db2.gz WHWZCDYLAIEFOE-OAHLLOKOSA-N 2 2 371.441 2.584 20 5 FFBDLP C[N@@H+]1CCC[C@H]2C[NH+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)CC[C@@H]21 ZINC000158661738 508736145 /nfs/dbraw/zinc/73/61/45/508736145.db2.gz SDFZJKDHEZVBTR-HOCLYGCPSA-N 2 2 357.414 2.561 20 5 FFBDLP C[N@H+]1CCC[C@H]2C[NH+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)CC[C@@H]21 ZINC000158661738 508736146 /nfs/dbraw/zinc/73/61/46/508736146.db2.gz SDFZJKDHEZVBTR-HOCLYGCPSA-N 2 2 357.414 2.561 20 5 FFBDLP C[NH+]1CCC[C@H]2C[N@H+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)CC[C@@H]21 ZINC000158661738 508736150 /nfs/dbraw/zinc/73/61/50/508736150.db2.gz SDFZJKDHEZVBTR-HOCLYGCPSA-N 2 2 357.414 2.561 20 5 FFBDLP C[NH+]1CCC[C@H]2C[N@@H+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)CC[C@@H]21 ZINC000158661738 508736153 /nfs/dbraw/zinc/73/61/53/508736153.db2.gz SDFZJKDHEZVBTR-HOCLYGCPSA-N 2 2 357.414 2.561 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](O)C[N@@H+]1CCc2ccccc2C1 ZINC000151787570 509082559 /nfs/dbraw/zinc/08/25/59/509082559.db2.gz BYMUIIKQIIOLGS-OXQOHEQNSA-N 2 2 369.465 2.973 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000151787570 509082562 /nfs/dbraw/zinc/08/25/62/509082562.db2.gz BYMUIIKQIIOLGS-OXQOHEQNSA-N 2 2 369.465 2.973 20 5 FFBDLP CN(CC[N@H+](C)C1CC[NH+](C)CC1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000180930981 510189154 /nfs/dbraw/zinc/18/91/54/510189154.db2.gz VVJXCWPHSIAHDH-UHFFFAOYSA-N 2 2 354.882 2.706 20 5 FFBDLP CN(CC[N@@H+](C)C1CC[NH+](C)CC1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000180930981 510189161 /nfs/dbraw/zinc/18/91/61/510189161.db2.gz VVJXCWPHSIAHDH-UHFFFAOYSA-N 2 2 354.882 2.706 20 5 FFBDLP O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c([N+](=O)[O-])c1 ZINC000194078906 510205257 /nfs/dbraw/zinc/20/52/57/510205257.db2.gz SNHQXWXIHBPPGF-CXAGYDPISA-N 2 2 360.414 2.952 20 5 FFBDLP O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c([N+](=O)[O-])c1 ZINC000194078906 510205266 /nfs/dbraw/zinc/20/52/66/510205266.db2.gz SNHQXWXIHBPPGF-CXAGYDPISA-N 2 2 360.414 2.952 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c([N+](=O)[O-])c1 ZINC000194078906 510205274 /nfs/dbraw/zinc/20/52/74/510205274.db2.gz SNHQXWXIHBPPGF-CXAGYDPISA-N 2 2 360.414 2.952 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c([N+](=O)[O-])c1 ZINC000194078906 510205281 /nfs/dbraw/zinc/20/52/81/510205281.db2.gz SNHQXWXIHBPPGF-CXAGYDPISA-N 2 2 360.414 2.952 20 5 FFBDLP Cc1[nH+]c2ccccc2n1C[C@@H]1CCC[N@@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000270345433 510771109 /nfs/dbraw/zinc/77/11/09/510771109.db2.gz OUDFUWBUHRXVJA-HNNXBMFYSA-N 2 2 354.414 2.614 20 5 FFBDLP Cc1[nH+]c2ccccc2n1C[C@@H]1CCC[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000270345433 510771115 /nfs/dbraw/zinc/77/11/15/510771115.db2.gz OUDFUWBUHRXVJA-HNNXBMFYSA-N 2 2 354.414 2.614 20 5 FFBDLP COc1cc(C[N@H+](C)C2CC[NH+](C(C)C)CC2)c([N+](=O)[O-])cc1OC ZINC000271050147 511068680 /nfs/dbraw/zinc/06/86/80/511068680.db2.gz UZURUTYLCDDLAY-UHFFFAOYSA-N 2 2 351.447 2.917 20 5 FFBDLP COc1cc(C[N@@H+](C)C2CC[NH+](C(C)C)CC2)c([N+](=O)[O-])cc1OC ZINC000271050147 511068681 /nfs/dbraw/zinc/06/86/81/511068681.db2.gz UZURUTYLCDDLAY-UHFFFAOYSA-N 2 2 351.447 2.917 20 5 FFBDLP CCOc1cc(C[N@@H+]2CCO[C@@H]3C[C@@H]([NH+](C)C)CC[C@H]32)ccc1[N+](=O)[O-] ZINC000365188764 511307548 /nfs/dbraw/zinc/30/75/48/511307548.db2.gz GAIIPLKMWKIBAR-FRQCXROJSA-N 2 2 363.458 2.677 20 5 FFBDLP CCOc1cc(C[N@H+]2CCO[C@@H]3C[C@@H]([NH+](C)C)CC[C@H]32)ccc1[N+](=O)[O-] ZINC000365188764 511307552 /nfs/dbraw/zinc/30/75/52/511307552.db2.gz GAIIPLKMWKIBAR-FRQCXROJSA-N 2 2 363.458 2.677 20 5 FFBDLP C[C@H](C1CC[NH+](C)CC1)N(C)C(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000450487110 513216675 /nfs/dbraw/zinc/21/66/75/513216675.db2.gz UGYFAKVEBWKTGP-CQSZACIVSA-N 2 2 371.441 2.583 20 5 FFBDLP COc1ccc(C[N@H+](C)[C@H](C)C[NH3+])cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000435372657 513568017 /nfs/dbraw/zinc/56/80/17/513568017.db2.gz BADLPBHLOUIEKY-CQSZACIVSA-N 2 2 359.426 2.961 20 5 FFBDLP COc1ccc(C[N@@H+](C)[C@H](C)C[NH3+])cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000435372657 513568022 /nfs/dbraw/zinc/56/80/22/513568022.db2.gz BADLPBHLOUIEKY-CQSZACIVSA-N 2 2 359.426 2.961 20 5 FFBDLP CCC[N@H+](CC)C[C@H](C)NC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000451861478 514027084 /nfs/dbraw/zinc/02/70/84/514027084.db2.gz AKTHWIBGIMYSPT-AWEZNQCLSA-N 2 2 359.430 2.631 20 5 FFBDLP CCC[N@@H+](CC)C[C@H](C)NC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000451861478 514027090 /nfs/dbraw/zinc/02/70/90/514027090.db2.gz AKTHWIBGIMYSPT-AWEZNQCLSA-N 2 2 359.430 2.631 20 5 FFBDLP Cn1cc[nH+]c1[C@H](NC[C@H]1[NH2+]CCCC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000423403170 514130188 /nfs/dbraw/zinc/13/01/88/514130188.db2.gz ZAGDFUXJWYGIRM-IAGOWNOFSA-N 2 2 357.458 2.786 20 5 FFBDLP COc1cc(C[NH2+]C[C@@H]([NH3+])C(C)C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000414800286 514299670 /nfs/dbraw/zinc/29/96/70/514299670.db2.gz SEFVNOAOFUAMMF-LLVKDONJSA-N 2 2 365.352 2.617 20 5 FFBDLP CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCN(c2cc[nH+]cc2OC)CC1 ZINC000475630191 514741444 /nfs/dbraw/zinc/74/14/44/514741444.db2.gz YDWVONYBPUDPHX-UHFFFAOYSA-N 2 2 372.425 2.719 20 5 FFBDLP O=[N+]([O-])c1cccc([C@H]([NH2+]C[C@@H](O)C[NH+]2CCCC2)c2ccccc2)c1 ZINC000490149314 515124105 /nfs/dbraw/zinc/12/41/05/515124105.db2.gz ITGFSVNKUFKHFO-WOJBJXKFSA-N 2 2 355.438 2.731 20 5 FFBDLP CC(=Cc1cccc([N+](=O)[O-])c1)CNc1ccc(N2CC[NH+](C)CC2)c[nH+]1 ZINC000468644355 515449845 /nfs/dbraw/zinc/44/98/45/515449845.db2.gz AEEWIISTKOBVFU-FOWTUZBSSA-N 2 2 367.453 2.679 20 5 FFBDLP COc1ccc([N+](=O)[O-])cc1C[NH2+]C1CC[NH+](Cc2ccccn2)CC1 ZINC000482508956 515701750 /nfs/dbraw/zinc/70/17/50/515701750.db2.gz KLDXRFWDNNIOMX-UHFFFAOYSA-N 2 2 356.426 2.753 20 5 FFBDLP C[C@@H]1CN(c2c3ccccc3ncc2[N+](=O)[O-])CC[N@@H+]1C1CC[NH+](C)CC1 ZINC000488091190 516113781 /nfs/dbraw/zinc/11/37/81/516113781.db2.gz BNLBRDQXGVHLFU-OAHLLOKOSA-N 2 2 369.469 2.748 20 5 FFBDLP C[C@@H]1CN(c2c3ccccc3ncc2[N+](=O)[O-])CC[N@H+]1C1CC[NH+](C)CC1 ZINC000488091190 516113788 /nfs/dbraw/zinc/11/37/88/516113788.db2.gz BNLBRDQXGVHLFU-OAHLLOKOSA-N 2 2 369.469 2.748 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC(=O)N(C)C ZINC000552338773 517205366 /nfs/dbraw/zinc/20/53/66/517205366.db2.gz PCEYXUQVPCDCNF-XYTVBORESA-N 2 2 374.485 2.637 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC(=O)N(C)C ZINC000552338773 517205374 /nfs/dbraw/zinc/20/53/74/517205374.db2.gz PCEYXUQVPCDCNF-XYTVBORESA-N 2 2 374.485 2.637 20 5 FFBDLP COc1cc(C[N@@H+]2CC[C@@]3(C2)CCC[NH2+]C3)c([N+](=O)[O-])cc1OC(F)F ZINC000572121528 519454847 /nfs/dbraw/zinc/45/48/47/519454847.db2.gz ZUKKLMJTUICGES-KRWDZBQOSA-N 2 2 371.384 2.780 20 5 FFBDLP COc1cc(C[N@H+]2CC[C@@]3(C2)CCC[NH2+]C3)c([N+](=O)[O-])cc1OC(F)F ZINC000572121528 519454854 /nfs/dbraw/zinc/45/48/54/519454854.db2.gz ZUKKLMJTUICGES-KRWDZBQOSA-N 2 2 371.384 2.780 20 5 FFBDLP COc1ccc([C@@H]2CC[NH2+]C[C@@H]2[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1F ZINC000594738635 520125099 /nfs/dbraw/zinc/12/50/99/520125099.db2.gz IXYFWYRWJQIMOM-WMZOPIPTSA-N 2 2 359.401 2.978 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@@H]([C@H]4CCC[NH2+]4)C3)n2)c1 ZINC000592478691 520407381 /nfs/dbraw/zinc/40/73/81/520407381.db2.gz IGEFJCQRQNEVED-GDBMZVCRSA-N 2 2 357.414 2.609 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@@H]([C@H]4CCC[NH2+]4)C3)n2)c1 ZINC000592478691 520407387 /nfs/dbraw/zinc/40/73/87/520407387.db2.gz IGEFJCQRQNEVED-GDBMZVCRSA-N 2 2 357.414 2.609 20 5 FFBDLP Cc1cc(C[NH+]2CCN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)CC2)on1 ZINC000601101440 520636720 /nfs/dbraw/zinc/63/67/20/520636720.db2.gz RGQOPYMMFBWIBX-UHFFFAOYSA-N 2 2 353.382 2.762 20 5 FFBDLP Cc1[nH+]c2ccccc2n1C[C@@H]1CCC[N@H+]1Cc1cn(C)nc1[N+](=O)[O-] ZINC000602487387 521375575 /nfs/dbraw/zinc/37/55/75/521375575.db2.gz ZKJRGLAQRDXYLF-HNNXBMFYSA-N 2 2 354.414 2.651 20 5 FFBDLP Cc1[nH+]c2ccccc2n1C[C@@H]1CCC[N@@H+]1Cc1cn(C)nc1[N+](=O)[O-] ZINC000602487387 521375583 /nfs/dbraw/zinc/37/55/83/521375583.db2.gz ZKJRGLAQRDXYLF-HNNXBMFYSA-N 2 2 354.414 2.651 20 5 FFBDLP C[N@H+](CC[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)Cc1ccccc1 ZINC000602524102 521395136 /nfs/dbraw/zinc/39/51/36/521395136.db2.gz APZIIFAVCKXNAK-UHFFFAOYSA-N 2 2 369.469 2.680 20 5 FFBDLP C[N@@H+](CC[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)Cc1ccccc1 ZINC000602524102 521395143 /nfs/dbraw/zinc/39/51/43/521395143.db2.gz APZIIFAVCKXNAK-UHFFFAOYSA-N 2 2 369.469 2.680 20 5 FFBDLP C[N@@H+]1CCCC(C)(C)[C@H]1C[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602643909 521453236 /nfs/dbraw/zinc/45/32/36/521453236.db2.gz ORYKIYODGMNGMF-QGZVFWFLSA-N 2 2 361.490 2.669 20 5 FFBDLP C[N@H+]1CCCC(C)(C)[C@H]1C[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602643909 521453246 /nfs/dbraw/zinc/45/32/46/521453246.db2.gz ORYKIYODGMNGMF-QGZVFWFLSA-N 2 2 361.490 2.669 20 5 FFBDLP C[N@@H+]1CCCC(C)(C)[C@@H]1C[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602643908 521454019 /nfs/dbraw/zinc/45/40/19/521454019.db2.gz ORYKIYODGMNGMF-KRWDZBQOSA-N 2 2 361.490 2.669 20 5 FFBDLP C[N@H+]1CCCC(C)(C)[C@@H]1C[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602643908 521454025 /nfs/dbraw/zinc/45/40/25/521454025.db2.gz ORYKIYODGMNGMF-KRWDZBQOSA-N 2 2 361.490 2.669 20 5 FFBDLP C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[NH+]1CCC(C[NH+](C)C)CC1 ZINC000729266277 734568551 /nfs/dbraw/zinc/56/85/51/734568551.db2.gz VBIUEUHLWJSEAP-LBPRGKRZSA-N 2 2 368.865 2.849 20 5 FFBDLP C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[NH+]1CCC(CC[NH3+])CC1 ZINC000846225713 748434043 /nfs/dbraw/zinc/43/40/43/748434043.db2.gz QYDIWOVARCSZGA-LLVKDONJSA-N 2 2 354.838 2.636 20 5 FFBDLP Cc1[nH+]ccn1-c1cc[nH+]cc1NC(=O)Cc1cccc(F)c1[N+](=O)[O-] ZINC001146986576 1000800166 /nfs/dbraw/zinc/80/01/66/1000800166.db2.gz FMJCPDKSOKXULL-UHFFFAOYSA-N 2 2 355.329 2.804 20 5 FFBDLP O=[N+]([O-])c1ccc([C@H](O)C[NH+]2CCC([NH2+]Cc3ccccc3)CC2)cc1 ZINC000852117345 1005942694 /nfs/dbraw/zinc/94/26/94/1005942694.db2.gz YWVGLHMQERUHMX-HXUWFJFHSA-N 2 2 355.438 2.882 20 5 FFBDLP C[N@H+](C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1)C1CC[NH+](C)CC1 ZINC001173013777 1012184429 /nfs/dbraw/zinc/18/44/29/1012184429.db2.gz FCNUMXZBONKKTN-UHFFFAOYSA-N 2 2 368.428 2.868 20 5 FFBDLP C[N@@H+](C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1)C1CC[NH+](C)CC1 ZINC001173013777 1012184438 /nfs/dbraw/zinc/18/44/38/1012184438.db2.gz FCNUMXZBONKKTN-UHFFFAOYSA-N 2 2 368.428 2.868 20 5 FFBDLP COCCC1([NH3+])CC[NH+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])CC1 ZINC001173178020 1012320966 /nfs/dbraw/zinc/32/09/66/1012320966.db2.gz FXFMNFZNMKKPEU-CYBMUJFWSA-N 2 2 369.437 2.503 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH+]2CCN(c3cc[nH+]cc3)CC2)c1F ZINC001173187332 1012328377 /nfs/dbraw/zinc/32/83/77/1012328377.db2.gz ZFNUFMLGOVOFAR-CQSZACIVSA-N 2 2 374.416 2.891 20 5 FFBDLP COc1cc(N2CCC([NH2+][C@H](C)C[NH+]3CCCC3)CC2)ccc1[N+](=O)[O-] ZINC001256085276 1038371175 /nfs/dbraw/zinc/37/11/75/1038371175.db2.gz MQHSTGFTTLAEGG-OAHLLOKOSA-N 2 2 362.474 2.646 20 5 FFBDLP Cc1[nH+]ccn1-c1cc[nH+]cc1NC(=O)CNc1ccccc1[N+](=O)[O-] ZINC001251850518 1039324164 /nfs/dbraw/zinc/32/41/64/1039324164.db2.gz LUEJJVAXQZOGPV-UHFFFAOYSA-N 2 2 352.354 2.535 20 5 FFBDLP C[N@@H+]1CCC[C@H]2C[NH+](Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)CC[C@@H]21 ZINC000848483120 1060121516 /nfs/dbraw/zinc/12/15/16/1060121516.db2.gz YOPUFPMYXUHPKC-YJBOKZPZSA-N 2 2 355.442 2.832 20 5 FFBDLP C[N@H+]1CCC[C@H]2C[NH+](Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)CC[C@@H]21 ZINC000848483120 1060121521 /nfs/dbraw/zinc/12/15/21/1060121521.db2.gz YOPUFPMYXUHPKC-YJBOKZPZSA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CCC[C@H]2C[N@H+](Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)CC[C@@H]21 ZINC000848483120 1060121525 /nfs/dbraw/zinc/12/15/25/1060121525.db2.gz YOPUFPMYXUHPKC-YJBOKZPZSA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CCC[C@H]2C[N@@H+](Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)CC[C@@H]21 ZINC000848483120 1060121530 /nfs/dbraw/zinc/12/15/30/1060121530.db2.gz YOPUFPMYXUHPKC-YJBOKZPZSA-N 2 2 355.442 2.832 20 5 FFBDLP CCC[N@@H+]1CC[C@@H]([NH2+]CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001462458520 1061631909 /nfs/dbraw/zinc/63/19/09/1061631909.db2.gz OVCWOEKRZGEDQR-HXUWFJFHSA-N 3 2 374.529 2.923 20 5 FFBDLP CCC[N@H+]1CC[C@@H]([NH2+]CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001462458520 1061631912 /nfs/dbraw/zinc/63/19/12/1061631912.db2.gz OVCWOEKRZGEDQR-HXUWFJFHSA-N 3 2 374.529 2.923 20 5 FFBDLP COc1cc(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c([N+](=O)[O-])cc1OC ZINC000093683595 250042357 /nfs/dbraw/zinc/04/23/57/250042357.db2.gz DYSXVUYPIGKNKW-OAHLLOKOSA-N 2 2 363.458 2.920 20 5 FFBDLP COc1cc(C[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c([N+](=O)[O-])cc1OC ZINC000093683595 250042360 /nfs/dbraw/zinc/04/23/60/250042360.db2.gz DYSXVUYPIGKNKW-OAHLLOKOSA-N 2 2 363.458 2.920 20 5 FFBDLP Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)cccc1[N+](=O)[O-] ZINC000267398030 251345252 /nfs/dbraw/zinc/34/52/52/251345252.db2.gz FHHSJYSHPAQTLG-KGLIPLIRSA-N 2 2 357.414 2.833 20 5 FFBDLP Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)cccc1[N+](=O)[O-] ZINC000267398030 251345257 /nfs/dbraw/zinc/34/52/57/251345257.db2.gz FHHSJYSHPAQTLG-KGLIPLIRSA-N 2 2 357.414 2.833 20 5 FFBDLP Cn1cc[nH+]c1[C@@H](N[C@@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000272564019 252069885 /nfs/dbraw/zinc/06/98/85/252069885.db2.gz UQNWXNLBPVUSOZ-NXHRZFHOSA-N 2 2 357.458 2.880 20 5 FFBDLP C[C@H]1C[N@H+](CCC[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)CCCO1 ZINC000277983718 256263817 /nfs/dbraw/zinc/26/38/17/256263817.db2.gz UBQFEEOIVGIAGN-ZDUSSCGKSA-N 2 2 373.400 2.787 20 5 FFBDLP C[C@H]1C[N@@H+](CCC[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)CCCO1 ZINC000277983718 256263819 /nfs/dbraw/zinc/26/38/19/256263819.db2.gz UBQFEEOIVGIAGN-ZDUSSCGKSA-N 2 2 373.400 2.787 20 5 FFBDLP C[NH+](C)C1CC[NH+](CCNc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000301556507 258055890 /nfs/dbraw/zinc/05/58/90/258055890.db2.gz SJGMQJRZDPOTIF-UHFFFAOYSA-N 2 2 371.279 2.795 20 5 FFBDLP Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000331927422 258206181 /nfs/dbraw/zinc/20/61/81/258206181.db2.gz VEEVFWGVLRXERR-UHFFFAOYSA-N 2 2 360.458 2.650 20 5 FFBDLP COc1ccc(OCC[N@@H+]2CCC[C@H](Cc3[nH+]ccn3C)C2)c([N+](=O)[O-])c1 ZINC000090004206 507900374 /nfs/dbraw/zinc/90/03/74/507900374.db2.gz NZCVAFPRVALXHZ-OAHLLOKOSA-N 2 2 374.441 2.670 20 5 FFBDLP COc1ccc(OCC[N@H+]2CCC[C@H](Cc3[nH+]ccn3C)C2)c([N+](=O)[O-])c1 ZINC000090004206 507900376 /nfs/dbraw/zinc/90/03/76/507900376.db2.gz NZCVAFPRVALXHZ-OAHLLOKOSA-N 2 2 374.441 2.670 20 5 FFBDLP Cc1c(NC(=O)CC[N@@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)cccc1[N+](=O)[O-] ZINC000080959611 508117333 /nfs/dbraw/zinc/11/73/33/508117333.db2.gz AKDWPACILQYNDU-CQSZACIVSA-N 2 2 357.414 2.835 20 5 FFBDLP Cc1c(NC(=O)CC[N@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)cccc1[N+](=O)[O-] ZINC000080959611 508117335 /nfs/dbraw/zinc/11/73/35/508117335.db2.gz AKDWPACILQYNDU-CQSZACIVSA-N 2 2 357.414 2.835 20 5 FFBDLP O=C(C[N@@H+]1CCC[C@@H](c2[nH]cc[nH+]2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000080960606 508117760 /nfs/dbraw/zinc/11/77/60/508117760.db2.gz FKIXFGCXKWKVPR-LLVKDONJSA-N 2 2 363.805 2.789 20 5 FFBDLP O=C(C[N@H+]1CCC[C@@H](c2[nH]cc[nH+]2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000080960606 508117763 /nfs/dbraw/zinc/11/77/63/508117763.db2.gz FKIXFGCXKWKVPR-LLVKDONJSA-N 2 2 363.805 2.789 20 5 FFBDLP CC[N@@H+]1CC[C@H](N(C)C(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000076486603 508213003 /nfs/dbraw/zinc/21/30/03/508213003.db2.gz VSCBCKWICVFMOP-ZBFHGGJFSA-N 2 2 371.441 2.583 20 5 FFBDLP CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000076486603 508213004 /nfs/dbraw/zinc/21/30/04/508213004.db2.gz VSCBCKWICVFMOP-ZBFHGGJFSA-N 2 2 371.441 2.583 20 5 FFBDLP CCOc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+]2CCOC)cc1[N+](=O)[O-] ZINC000153553892 508596337 /nfs/dbraw/zinc/59/63/37/508596337.db2.gz YVEAPJWMEWWIOJ-GDBMZVCRSA-N 2 2 351.447 2.755 20 5 FFBDLP CCOc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+]2CCOC)cc1[N+](=O)[O-] ZINC000153553892 508596340 /nfs/dbraw/zinc/59/63/40/508596340.db2.gz YVEAPJWMEWWIOJ-GDBMZVCRSA-N 2 2 351.447 2.755 20 5 FFBDLP CC[C@@H]([NH2+]CCC[N@@H+]1CCC[C@@H]1C(=O)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000155337178 508979650 /nfs/dbraw/zinc/97/96/50/508979650.db2.gz QWEWMYGCHQCPPJ-QZTJIDSGSA-N 2 2 362.474 2.578 20 5 FFBDLP CC[C@@H]([NH2+]CCC[N@H+]1CCC[C@@H]1C(=O)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000155337178 508979654 /nfs/dbraw/zinc/97/96/54/508979654.db2.gz QWEWMYGCHQCPPJ-QZTJIDSGSA-N 2 2 362.474 2.578 20 5 FFBDLP COc1ccc(NC(=O)CC[N@@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)c([N+](=O)[O-])c1 ZINC000266944796 509270806 /nfs/dbraw/zinc/27/08/06/509270806.db2.gz SIDKHURHZWKAPR-CYBMUJFWSA-N 2 2 373.413 2.535 20 5 FFBDLP COc1ccc(NC(=O)CC[N@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)c([N+](=O)[O-])c1 ZINC000266944796 509270811 /nfs/dbraw/zinc/27/08/11/509270811.db2.gz SIDKHURHZWKAPR-CYBMUJFWSA-N 2 2 373.413 2.535 20 5 FFBDLP C[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185697386 509310908 /nfs/dbraw/zinc/31/09/08/509310908.db2.gz ZUKWNLUWLYRZKR-LSDHHAIUSA-N 2 2 360.458 2.776 20 5 FFBDLP C[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185697386 509310911 /nfs/dbraw/zinc/31/09/11/509310911.db2.gz ZUKWNLUWLYRZKR-LSDHHAIUSA-N 2 2 360.458 2.776 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000246192160 510351369 /nfs/dbraw/zinc/35/13/69/510351369.db2.gz UIOHIAQFRDTFHP-OLZOCXBDSA-N 2 2 368.865 2.849 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000246192160 510351375 /nfs/dbraw/zinc/35/13/75/510351375.db2.gz UIOHIAQFRDTFHP-OLZOCXBDSA-N 2 2 368.865 2.849 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[NH+](C)C[C@H]1CCC[N@H+](C)C1 ZINC000246192160 510351384 /nfs/dbraw/zinc/35/13/84/510351384.db2.gz UIOHIAQFRDTFHP-OLZOCXBDSA-N 2 2 368.865 2.849 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[NH+](C)C[C@H]1CCC[N@@H+](C)C1 ZINC000246192160 510351392 /nfs/dbraw/zinc/35/13/92/510351392.db2.gz UIOHIAQFRDTFHP-OLZOCXBDSA-N 2 2 368.865 2.849 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C)C2)cccc1[N+](=O)[O-] ZINC000246710721 510628885 /nfs/dbraw/zinc/62/88/85/510628885.db2.gz FFFILKRZSWGHFJ-MPGHIAIKSA-N 2 2 360.458 2.646 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C)C2)cccc1[N+](=O)[O-] ZINC000246710721 510628889 /nfs/dbraw/zinc/62/88/89/510628889.db2.gz FFFILKRZSWGHFJ-MPGHIAIKSA-N 2 2 360.458 2.646 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C)C2)cccc1[N+](=O)[O-] ZINC000246710721 510628896 /nfs/dbraw/zinc/62/88/96/510628896.db2.gz FFFILKRZSWGHFJ-MPGHIAIKSA-N 2 2 360.458 2.646 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)cccc1[N+](=O)[O-] ZINC000246710721 510628898 /nfs/dbraw/zinc/62/88/98/510628898.db2.gz FFFILKRZSWGHFJ-MPGHIAIKSA-N 2 2 360.458 2.646 20 5 FFBDLP C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC000188280843 510686935 /nfs/dbraw/zinc/68/69/35/510686935.db2.gz DEUCYHUQCXSIIG-HXUWFJFHSA-N 2 2 355.438 2.664 20 5 FFBDLP C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC000188280843 510686945 /nfs/dbraw/zinc/68/69/45/510686945.db2.gz DEUCYHUQCXSIIG-HXUWFJFHSA-N 2 2 355.438 2.664 20 5 FFBDLP C[NH+](Cc1ccc([N+](=O)[O-])cc1)C[C@]1(O)CC[N@H+](Cc2ccccc2)C1 ZINC000188280843 510686955 /nfs/dbraw/zinc/68/69/55/510686955.db2.gz DEUCYHUQCXSIIG-HXUWFJFHSA-N 2 2 355.438 2.664 20 5 FFBDLP C[NH+](Cc1ccc([N+](=O)[O-])cc1)C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000188280843 510686963 /nfs/dbraw/zinc/68/69/63/510686963.db2.gz DEUCYHUQCXSIIG-HXUWFJFHSA-N 2 2 355.438 2.664 20 5 FFBDLP C[N@H+](CCc1ccc([N+](=O)[O-])cc1)C[C@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC000188294600 510693737 /nfs/dbraw/zinc/69/37/37/510693737.db2.gz VWAKRLKPMDSNCZ-OAQYLSRUSA-N 2 2 369.465 2.706 20 5 FFBDLP C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C[C@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC000188294600 510693740 /nfs/dbraw/zinc/69/37/40/510693740.db2.gz VWAKRLKPMDSNCZ-OAQYLSRUSA-N 2 2 369.465 2.706 20 5 FFBDLP C[NH+](CCc1ccc([N+](=O)[O-])cc1)C[C@]1(O)CC[N@H+](Cc2ccccc2)C1 ZINC000188294600 510693743 /nfs/dbraw/zinc/69/37/43/510693743.db2.gz VWAKRLKPMDSNCZ-OAQYLSRUSA-N 2 2 369.465 2.706 20 5 FFBDLP C[NH+](CCc1ccc([N+](=O)[O-])cc1)C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000188294600 510693747 /nfs/dbraw/zinc/69/37/47/510693747.db2.gz VWAKRLKPMDSNCZ-OAQYLSRUSA-N 2 2 369.465 2.706 20 5 FFBDLP CCC(=O)c1ccc(N[C@H]2CC[N@@H+](C3CC[NH+](C)CC3)C2)c([N+](=O)[O-])c1 ZINC000366430237 512018164 /nfs/dbraw/zinc/01/81/64/512018164.db2.gz ICOUJTODVSCRBA-HNNXBMFYSA-N 2 2 360.458 2.768 20 5 FFBDLP CCC(=O)c1ccc(N[C@H]2CC[N@H+](C3CC[NH+](C)CC3)C2)c([N+](=O)[O-])c1 ZINC000366430237 512018171 /nfs/dbraw/zinc/01/81/71/512018171.db2.gz ICOUJTODVSCRBA-HNNXBMFYSA-N 2 2 360.458 2.768 20 5 FFBDLP C[C@@H](C[NH+]1CCCCCC1)NC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000450743232 513320487 /nfs/dbraw/zinc/32/04/87/513320487.db2.gz GGUUUUVGFZTXFZ-HNNXBMFYSA-N 2 2 371.441 2.775 20 5 FFBDLP Cn1cc[nH+]c1CN(Cc1ccc([N+](=O)[O-])cc1F)[C@@H]1CC12CC[NH2+]CC2 ZINC000435432566 513584984 /nfs/dbraw/zinc/58/49/84/513584984.db2.gz NRYKXPYHJHXWSF-QGZVFWFLSA-N 2 2 373.432 2.612 20 5 FFBDLP C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)[N@@H+]1CCC[C@H](C)C1 ZINC000448706583 513857027 /nfs/dbraw/zinc/85/70/27/513857027.db2.gz ZIGMNKISNLXKOM-GJZGRUSLSA-N 2 2 371.441 2.631 20 5 FFBDLP C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)[N@H+]1CCC[C@H](C)C1 ZINC000448706583 513857035 /nfs/dbraw/zinc/85/70/35/513857035.db2.gz ZIGMNKISNLXKOM-GJZGRUSLSA-N 2 2 371.441 2.631 20 5 FFBDLP CCC[NH+]1CCC(CNC(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)CC1 ZINC000448843471 513927425 /nfs/dbraw/zinc/92/74/25/513927425.db2.gz JECODRLAYVVFNN-UHFFFAOYSA-N 2 2 371.441 2.632 20 5 FFBDLP C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@@H]1[NH2+]CCc2ccccc21 ZINC000423431318 514140753 /nfs/dbraw/zinc/14/07/53/514140753.db2.gz QJRMJGWVOOYDCS-LIRRHRJNSA-N 2 2 368.437 2.789 20 5 FFBDLP [NH3+]CC[N@H+](CCO)Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000414909200 514352457 /nfs/dbraw/zinc/35/24/57/514352457.db2.gz GBTZLCMQQGVEPI-UHFFFAOYSA-N 2 2 365.817 2.794 20 5 FFBDLP [NH3+]CC[N@@H+](CCO)Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000414909200 514352462 /nfs/dbraw/zinc/35/24/62/514352462.db2.gz GBTZLCMQQGVEPI-UHFFFAOYSA-N 2 2 365.817 2.794 20 5 FFBDLP Cc1cc(N2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4C)CC2)c(F)cc1[N+](=O)[O-] ZINC000461935081 514794896 /nfs/dbraw/zinc/79/48/96/514794896.db2.gz JEIWHEJIIIXGNJ-XYPWUTKMSA-N 2 2 362.449 2.790 20 5 FFBDLP Cc1cc(N2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)c(F)cc1[N+](=O)[O-] ZINC000461935081 514794906 /nfs/dbraw/zinc/79/49/06/514794906.db2.gz JEIWHEJIIIXGNJ-XYPWUTKMSA-N 2 2 362.449 2.790 20 5 FFBDLP CC[C@H]([NH2+][C@@H]1CCCN(Cc2[nH+]ccn2C)C1=O)c1cccc([N+](=O)[O-])c1 ZINC000544017194 516539899 /nfs/dbraw/zinc/53/98/99/516539899.db2.gz TWVNPONNMILBJW-DLBZAZTESA-N 2 2 371.441 2.560 20 5 FFBDLP Cc1ccc([C@@H](C[NH2+]C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[NH+](C)C)cc1 ZINC000584226836 518237580 /nfs/dbraw/zinc/23/75/80/518237580.db2.gz QSUZKNRITYLPQG-UYAOXDASSA-N 2 2 373.453 2.535 20 5 FFBDLP Cc1c(NC(=O)CC[N@@H+]2CCCC[C@H]2[C@@H]2CCC[NH2+]2)cccc1[N+](=O)[O-] ZINC000573670270 518778888 /nfs/dbraw/zinc/77/88/88/518778888.db2.gz PFBSNDUGAYMIPI-WMZOPIPTSA-N 2 2 360.458 2.838 20 5 FFBDLP Cc1c(NC(=O)CC[N@H+]2CCCC[C@H]2[C@@H]2CCC[NH2+]2)cccc1[N+](=O)[O-] ZINC000573670270 518778891 /nfs/dbraw/zinc/77/88/91/518778891.db2.gz PFBSNDUGAYMIPI-WMZOPIPTSA-N 2 2 360.458 2.838 20 5 FFBDLP CC[C@@H]1C[N@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])CC[C@@H]1[NH3+] ZINC000592427653 520388469 /nfs/dbraw/zinc/38/84/69/520388469.db2.gz NJUMTADJDFZLPM-PWSUYJOCSA-N 2 2 359.373 2.764 20 5 FFBDLP CC[C@@H]1C[N@@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])CC[C@@H]1[NH3+] ZINC000592427653 520388476 /nfs/dbraw/zinc/38/84/76/520388476.db2.gz NJUMTADJDFZLPM-PWSUYJOCSA-N 2 2 359.373 2.764 20 5 FFBDLP C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCN(C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1 ZINC000611522876 521200803 /nfs/dbraw/zinc/20/08/03/521200803.db2.gz IJKGQUPMDJYLFU-XNHLSEOASA-N 2 2 358.486 2.899 20 5 FFBDLP C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCN(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)CC1 ZINC000611522876 521200809 /nfs/dbraw/zinc/20/08/09/521200809.db2.gz IJKGQUPMDJYLFU-XNHLSEOASA-N 2 2 358.486 2.899 20 5 FFBDLP C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[NH+](C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1 ZINC000611522876 521200819 /nfs/dbraw/zinc/20/08/19/521200819.db2.gz IJKGQUPMDJYLFU-XNHLSEOASA-N 2 2 358.486 2.899 20 5 FFBDLP C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[NH+](C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)CC1 ZINC000611522876 521200831 /nfs/dbraw/zinc/20/08/31/521200831.db2.gz IJKGQUPMDJYLFU-XNHLSEOASA-N 2 2 358.486 2.899 20 5 FFBDLP Cn1cc[nH+]c1N1CC[NH+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602717344 521493854 /nfs/dbraw/zinc/49/38/54/521493854.db2.gz XYBFEOUTATWUDR-UHFFFAOYSA-N 2 2 369.347 2.669 20 5 FFBDLP CN(c1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CC[N@@H+](C2CC[NH+](C)CC2)C1 ZINC000733894197 734856631 /nfs/dbraw/zinc/85/66/31/734856631.db2.gz ZDJSKSQSCYCQRZ-OAHLLOKOSA-N 2 2 352.866 2.853 20 5 FFBDLP CN(c1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CC[N@H+](C2CC[NH+](C)CC2)C1 ZINC000733894197 734856635 /nfs/dbraw/zinc/85/66/35/734856635.db2.gz ZDJSKSQSCYCQRZ-OAHLLOKOSA-N 2 2 352.866 2.853 20 5 FFBDLP C[N@@H+]1CCC[C@H]2C[NH+](Cn3cc(-c4ccc([N+](=O)[O-])cc4)cn3)CC[C@H]21 ZINC000765102800 984963325 /nfs/dbraw/zinc/96/33/25/984963325.db2.gz ARQINOGTULVIOJ-QFBILLFUSA-N 2 2 355.442 2.832 20 5 FFBDLP C[N@H+]1CCC[C@H]2C[NH+](Cn3cc(-c4ccc([N+](=O)[O-])cc4)cn3)CC[C@H]21 ZINC000765102800 984963327 /nfs/dbraw/zinc/96/33/27/984963327.db2.gz ARQINOGTULVIOJ-QFBILLFUSA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CCC[C@H]2C[N@H+](Cn3cc(-c4ccc([N+](=O)[O-])cc4)cn3)CC[C@H]21 ZINC000765102800 984963334 /nfs/dbraw/zinc/96/33/34/984963334.db2.gz ARQINOGTULVIOJ-QFBILLFUSA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CCC[C@H]2C[N@@H+](Cn3cc(-c4ccc([N+](=O)[O-])cc4)cn3)CC[C@H]21 ZINC000765102800 984963338 /nfs/dbraw/zinc/96/33/38/984963338.db2.gz ARQINOGTULVIOJ-QFBILLFUSA-N 2 2 355.442 2.832 20 5 FFBDLP Cc1cc(NCC[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)nc(C(C)C)[nH+]1 ZINC000863575165 1010261292 /nfs/dbraw/zinc/26/12/92/1010261292.db2.gz FSFKQHFRXFPAFQ-MRXNPFEDSA-N 2 2 359.430 2.552 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH+]1C[C@@]2(C)C[N@@H+](C)C[C@@]2(C)C1 ZINC000931307640 1020414058 /nfs/dbraw/zinc/41/40/58/1020414058.db2.gz NOKLCXGXDPBTRT-KDURUIRLSA-N 2 2 360.458 2.505 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH+]1C[C@@]2(C)C[N@H+](C)C[C@@]2(C)C1 ZINC000931307640 1020414063 /nfs/dbraw/zinc/41/40/63/1020414063.db2.gz NOKLCXGXDPBTRT-KDURUIRLSA-N 2 2 360.458 2.505 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@@]2(C)C[NH+](C)C[C@@]2(C)C1 ZINC000931307640 1020414065 /nfs/dbraw/zinc/41/40/65/1020414065.db2.gz NOKLCXGXDPBTRT-KDURUIRLSA-N 2 2 360.458 2.505 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@@]2(C)C[NH+](C)C[C@@]2(C)C1 ZINC000931307640 1020414069 /nfs/dbraw/zinc/41/40/69/1020414069.db2.gz NOKLCXGXDPBTRT-KDURUIRLSA-N 2 2 360.458 2.505 20 5 FFBDLP C[NH+](C)CC[C@H]([NH2+][C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1cccnc1 ZINC000903381662 1020815246 /nfs/dbraw/zinc/81/52/46/1020815246.db2.gz YJILUSYDGYZVSW-KSZLIROESA-N 2 2 372.473 2.953 20 5 FFBDLP O=[N+]([O-])c1ccc(N2CC[NH+](C[C@H]3CCC[NH2+]C3)CC2)c(C(F)(F)F)c1 ZINC001118557039 1022287547 /nfs/dbraw/zinc/28/75/47/1022287547.db2.gz AUUWMUZSIDVWLK-ZDUSSCGKSA-N 2 2 372.391 2.735 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2CC[C@]3(C2)CCC[NH2+]C3)c1F ZINC001246600009 1039411595 /nfs/dbraw/zinc/41/15/95/1039411595.db2.gz CNTAXULRMWHZGN-FZKQIMNGSA-N 2 2 351.422 2.749 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CC[C@]3(C2)CCC[NH2+]C3)c1F ZINC001246600009 1039411603 /nfs/dbraw/zinc/41/16/03/1039411603.db2.gz CNTAXULRMWHZGN-FZKQIMNGSA-N 2 2 351.422 2.749 20 5 FFBDLP C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H]2C[NH+](Cc3cccnc3)C[C@H]2C1 ZINC001254561858 1040798560 /nfs/dbraw/zinc/79/85/60/1040798560.db2.gz MXXGTEIHYXXHGI-FFZOFVMBSA-N 2 2 366.465 2.985 20 5 FFBDLP C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H]2C[NH+](Cc3cccnc3)C[C@H]2C1 ZINC001254561858 1040798570 /nfs/dbraw/zinc/79/85/70/1040798570.db2.gz MXXGTEIHYXXHGI-FFZOFVMBSA-N 2 2 366.465 2.985 20 5 FFBDLP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH+]1C[C@H]2C[N@@H+](Cc3cccnc3)C[C@H]2C1 ZINC001254561858 1040798582 /nfs/dbraw/zinc/79/85/82/1040798582.db2.gz MXXGTEIHYXXHGI-FFZOFVMBSA-N 2 2 366.465 2.985 20 5 FFBDLP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH+]1C[C@H]2C[N@H+](Cc3cccnc3)C[C@H]2C1 ZINC001254561858 1040798598 /nfs/dbraw/zinc/79/85/98/1040798598.db2.gz MXXGTEIHYXXHGI-FFZOFVMBSA-N 2 2 366.465 2.985 20 5 FFBDLP COC1CC[NH+](C2CC[NH+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)CC2)CC1 ZINC001254612632 1040842039 /nfs/dbraw/zinc/84/20/39/1040842039.db2.gz XCIKBHSLGSQCEP-LJQANCHMSA-N 2 2 359.470 2.637 20 5 FFBDLP O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]C1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC001333680208 1049050443 /nfs/dbraw/zinc/05/04/43/1049050443.db2.gz NDXYMZZMPGJMQL-INIZCTEOSA-N 2 2 353.850 2.981 20 5 FFBDLP C[NH+]1CCC([N@@H+]2CC[C@@H](Nc3ncc([N+](=O)[O-])c4ccccc43)C2)CC1 ZINC001353245320 1056224283 /nfs/dbraw/zinc/22/42/83/1056224283.db2.gz LBTHZCOGCUYLSZ-CQSZACIVSA-N 2 2 355.442 2.723 20 5 FFBDLP C[NH+]1CCC([N@H+]2CC[C@@H](Nc3ncc([N+](=O)[O-])c4ccccc43)C2)CC1 ZINC001353245320 1056224300 /nfs/dbraw/zinc/22/43/00/1056224300.db2.gz LBTHZCOGCUYLSZ-CQSZACIVSA-N 2 2 355.442 2.723 20 5 FFBDLP C[NH+](C)CCC1CCN(C(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)CC1 ZINC000112924786 508233934 /nfs/dbraw/zinc/23/39/34/508233934.db2.gz SHHSRMRSUIUHAD-UHFFFAOYSA-N 2 2 371.441 2.584 20 5 FFBDLP O=[N+]([O-])c1ccc(CCNc2[nH+]cnc3c2cnn3-c2cc[nH+]cc2)cc1 ZINC000119097386 508724657 /nfs/dbraw/zinc/72/46/57/508724657.db2.gz HZCORORSVBUQRE-UHFFFAOYSA-N 2 2 361.365 2.773 20 5 FFBDLP CN(CC[N@H+](C)C1CC[NH+](C)CC1)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000119566048 508819844 /nfs/dbraw/zinc/81/98/44/508819844.db2.gz GRXYTVPNVQIYRM-UHFFFAOYSA-N 2 2 354.882 2.706 20 5 FFBDLP CN(CC[N@@H+](C)C1CC[NH+](C)CC1)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000119566048 508819848 /nfs/dbraw/zinc/81/98/48/508819848.db2.gz GRXYTVPNVQIYRM-UHFFFAOYSA-N 2 2 354.882 2.706 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CC[C@@H](Oc4cc[nH+]cc4)C3)o2)cc1 ZINC000120198028 508948370 /nfs/dbraw/zinc/94/83/70/508948370.db2.gz MGTBADLTDJOTAJ-MRXNPFEDSA-N 2 2 367.365 2.693 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CC[C@@H](Oc4cc[nH+]cc4)C3)o2)cc1 ZINC000120198028 508948374 /nfs/dbraw/zinc/94/83/74/508948374.db2.gz MGTBADLTDJOTAJ-MRXNPFEDSA-N 2 2 367.365 2.693 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CC[C@H](Oc4cc[nH+]cc4)C3)n2)cc1 ZINC000156336972 509161689 /nfs/dbraw/zinc/16/16/89/509161689.db2.gz DZUPIINUKDMRQI-INIZCTEOSA-N 2 2 367.365 2.693 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CC[C@H](Oc4cc[nH+]cc4)C3)n2)cc1 ZINC000156336972 509161693 /nfs/dbraw/zinc/16/16/93/509161693.db2.gz DZUPIINUKDMRQI-INIZCTEOSA-N 2 2 367.365 2.693 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1C(=O)NCC1([NH+]2CCCCC2)CC[NH+](C)CC1 ZINC000172750699 509213686 /nfs/dbraw/zinc/21/36/86/509213686.db2.gz VBSXKKJNHSZQGT-UHFFFAOYSA-N 2 2 374.485 2.583 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@H](c4[nH]cc[nH+]4)C3)n2)c1 ZINC000266901440 509249782 /nfs/dbraw/zinc/24/97/82/509249782.db2.gz GSUWBODCTWHPPK-ZDUSSCGKSA-N 2 2 354.370 2.748 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@H](c4[nH]cc[nH+]4)C3)n2)c1 ZINC000266901440 509249788 /nfs/dbraw/zinc/24/97/88/509249788.db2.gz GSUWBODCTWHPPK-ZDUSSCGKSA-N 2 2 354.370 2.748 20 5 FFBDLP O=[N+]([O-])c1cccc(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CCCO2)c1 ZINC000192357626 509479867 /nfs/dbraw/zinc/47/98/67/509479867.db2.gz FWPNEMPFRIDJBM-HXUWFJFHSA-N 2 2 355.438 2.976 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CCCO1 ZINC000192357653 509480236 /nfs/dbraw/zinc/48/02/36/509480236.db2.gz GMSVPQZUJDRPMX-LJQANCHMSA-N 2 2 355.438 2.976 20 5 FFBDLP C[N@@H+]1CCCC[C@@H]1CN1CC[NH+](C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000255019850 509916584 /nfs/dbraw/zinc/91/65/84/509916584.db2.gz AMTNCQZPQKAXQW-MONCILHSSA-N 2 2 358.486 2.710 20 5 FFBDLP C[N@H+]1CCCC[C@@H]1CN1CC[NH+](C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000255019850 509916587 /nfs/dbraw/zinc/91/65/87/509916587.db2.gz AMTNCQZPQKAXQW-MONCILHSSA-N 2 2 358.486 2.710 20 5 FFBDLP C[N@H+](CC[C@@H]1CCCC[NH+]1C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000245453902 509944867 /nfs/dbraw/zinc/94/48/67/509944867.db2.gz ROSABGVFFJKBRH-YJBOKZPZSA-N 2 2 360.458 2.506 20 5 FFBDLP C[N@@H+](CC[C@@H]1CCCC[NH+]1C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000245453902 509944875 /nfs/dbraw/zinc/94/48/75/509944875.db2.gz ROSABGVFFJKBRH-YJBOKZPZSA-N 2 2 360.458 2.506 20 5 FFBDLP C[NH+](CC[C@@H]1CCCC[N@@H+]1C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000245453902 509944881 /nfs/dbraw/zinc/94/48/81/509944881.db2.gz ROSABGVFFJKBRH-YJBOKZPZSA-N 2 2 360.458 2.506 20 5 FFBDLP C[NH+](CC[C@@H]1CCCC[N@H+]1C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000245453902 509944890 /nfs/dbraw/zinc/94/48/90/509944890.db2.gz ROSABGVFFJKBRH-YJBOKZPZSA-N 2 2 360.458 2.506 20 5 FFBDLP Cn1cc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000247260224 510854557 /nfs/dbraw/zinc/85/45/57/510854557.db2.gz XPECEGDJMIGYJN-LPHOPBHVSA-N 2 2 369.469 2.911 20 5 FFBDLP Cn1cc(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000247260224 510854558 /nfs/dbraw/zinc/85/45/58/510854558.db2.gz XPECEGDJMIGYJN-LPHOPBHVSA-N 2 2 369.469 2.911 20 5 FFBDLP Cn1cc(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000247260224 510854559 /nfs/dbraw/zinc/85/45/59/510854559.db2.gz XPECEGDJMIGYJN-LPHOPBHVSA-N 2 2 369.469 2.911 20 5 FFBDLP Cn1cc(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000247260224 510854560 /nfs/dbraw/zinc/85/45/60/510854560.db2.gz XPECEGDJMIGYJN-LPHOPBHVSA-N 2 2 369.469 2.911 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000363582748 511640482 /nfs/dbraw/zinc/64/04/82/511640482.db2.gz KFJDCFBVTZACGN-ZDUSSCGKSA-N 2 2 373.413 2.535 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000363582748 511640490 /nfs/dbraw/zinc/64/04/90/511640490.db2.gz KFJDCFBVTZACGN-ZDUSSCGKSA-N 2 2 373.413 2.535 20 5 FFBDLP Cc1cn2c([nH+]1)[C@@H](C[NH2+][C@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1)CCC2 ZINC000370682475 513050999 /nfs/dbraw/zinc/05/09/99/513050999.db2.gz NYULXZCHNKKASJ-UKRRQHHQSA-N 2 2 371.441 2.984 20 5 FFBDLP COc1cc(C[N@H+](C)[C@H](C)C[NH3+])ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000435377195 513568717 /nfs/dbraw/zinc/56/87/17/513568717.db2.gz YZYONDQQYXCGPI-CQSZACIVSA-N 2 2 359.426 2.961 20 5 FFBDLP COc1cc(C[N@@H+](C)[C@H](C)C[NH3+])ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000435377195 513568726 /nfs/dbraw/zinc/56/87/26/513568726.db2.gz YZYONDQQYXCGPI-CQSZACIVSA-N 2 2 359.426 2.961 20 5 FFBDLP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2OC)[C@@H](C)C1 ZINC000430201045 513586677 /nfs/dbraw/zinc/58/66/77/513586677.db2.gz BWBCISSAYLLLNN-YJBOKZPZSA-N 2 2 365.474 2.830 20 5 FFBDLP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2OC)[C@@H](C)C1 ZINC000430201045 513586685 /nfs/dbraw/zinc/58/66/85/513586685.db2.gz BWBCISSAYLLLNN-YJBOKZPZSA-N 2 2 365.474 2.830 20 5 FFBDLP CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCC[NH2+]CC1 ZINC000420306028 514082600 /nfs/dbraw/zinc/08/26/00/514082600.db2.gz HFHNHEXSFHCONP-GFCCVEGCSA-N 2 2 354.838 2.651 20 5 FFBDLP CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCC[NH2+]CC1 ZINC000420306028 514082602 /nfs/dbraw/zinc/08/26/02/514082602.db2.gz HFHNHEXSFHCONP-GFCCVEGCSA-N 2 2 354.838 2.651 20 5 FFBDLP COc1cc(C[NH2+]C[C@]2(C)CCC[NH2+]C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000414898278 514346294 /nfs/dbraw/zinc/34/62/94/514346294.db2.gz BBSMDACIMIAHED-QGZVFWFLSA-N 2 2 373.400 2.727 20 5 FFBDLP CC[N@@H+]1CC[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)[C@@H](C)C1 ZINC000449990727 514456099 /nfs/dbraw/zinc/45/60/99/514456099.db2.gz XCZKLNOJLSTKLW-GOEBONIOSA-N 2 2 371.441 2.583 20 5 FFBDLP CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)[C@@H](C)C1 ZINC000449990727 514456105 /nfs/dbraw/zinc/45/61/05/514456105.db2.gz XCZKLNOJLSTKLW-GOEBONIOSA-N 2 2 371.441 2.583 20 5 FFBDLP COc1cc(C[N@@H+]2CC[C@H](C)[C@@H](C[NH3+])C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000415132386 514458296 /nfs/dbraw/zinc/45/82/96/514458296.db2.gz UCNCEBFSJDLQEB-AAEUAGOBSA-N 2 2 373.400 2.664 20 5 FFBDLP COc1cc(C[N@H+]2CC[C@H](C)[C@@H](C[NH3+])C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000415132386 514458299 /nfs/dbraw/zinc/45/82/99/514458299.db2.gz UCNCEBFSJDLQEB-AAEUAGOBSA-N 2 2 373.400 2.664 20 5 FFBDLP CC[NH+](CC)CC1CC[NH+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])CC1 ZINC000488360095 516205445 /nfs/dbraw/zinc/20/54/45/516205445.db2.gz NHTGSRDNCIZVST-UHFFFAOYSA-N 2 2 362.474 2.896 20 5 FFBDLP C[C@H]1CCC[C@H](C)[NH+]1CCNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000518596614 516717298 /nfs/dbraw/zinc/71/72/98/516717298.db2.gz GRNLUWOADMWEGW-GJZGRUSLSA-N 2 2 371.441 2.773 20 5 FFBDLP Cn1cc[nH+]c1[C@@H](NCC1([NH+](C)C)CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000514082490 516853780 /nfs/dbraw/zinc/85/37/80/516853780.db2.gz HCHDZDKLLGGQDG-KRWDZBQOSA-N 2 2 357.458 2.882 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000557331409 517959771 /nfs/dbraw/zinc/95/97/71/517959771.db2.gz WCSPHHGKIUKBIN-SJLPKXTDSA-N 2 2 360.458 2.838 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000557331409 517959783 /nfs/dbraw/zinc/95/97/83/517959783.db2.gz WCSPHHGKIUKBIN-SJLPKXTDSA-N 2 2 360.458 2.838 20 5 FFBDLP C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCC(Nc2cccc[nH+]2)CC1 ZINC000534864102 518062978 /nfs/dbraw/zinc/06/29/78/518062978.db2.gz VGJQJRKYQGIHNS-AWEZNQCLSA-N 2 2 369.425 2.893 20 5 FFBDLP O=[N+]([O-])c1cc(C[NH2+]C2CC[NH+]([C@H]3CCOC3)CC2)cc(C(F)(F)F)c1 ZINC000594501403 520004313 /nfs/dbraw/zinc/00/43/13/520004313.db2.gz UTKLGQSAUARXII-HNNXBMFYSA-N 2 2 373.375 2.957 20 5 FFBDLP CCOc1ccc([C@@H](C)[NH2+]C2CC[NH+]([C@@H]3CCOC3)CC2)cc1[N+](=O)[O-] ZINC000595106580 520297308 /nfs/dbraw/zinc/29/73/08/520297308.db2.gz VKZIXAQCNATUIO-RHSMWYFYSA-N 2 2 363.458 2.897 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@@H]([C@@H]4CCC[NH2+]4)C3)n2)cc1 ZINC000592478414 520407563 /nfs/dbraw/zinc/40/75/63/520407563.db2.gz APRVUNOHHGYVIQ-ZBFHGGJFSA-N 2 2 357.414 2.609 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@@H]([C@@H]4CCC[NH2+]4)C3)n2)cc1 ZINC000592478414 520407567 /nfs/dbraw/zinc/40/75/67/520407567.db2.gz APRVUNOHHGYVIQ-ZBFHGGJFSA-N 2 2 357.414 2.609 20 5 FFBDLP CC(C)[NH+]1CCN(C2CC[NH+](Cc3ccc(F)cc3[N+](=O)[O-])CC2)CC1 ZINC000595404365 520449170 /nfs/dbraw/zinc/44/91/70/520449170.db2.gz WTTIOLWTSYXLCL-UHFFFAOYSA-N 2 2 364.465 2.724 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@H](n3cc[nH+]c3)C2)cccc1[N+](=O)[O-] ZINC000610945209 520912414 /nfs/dbraw/zinc/91/24/14/520912414.db2.gz SQLPIECGDSEDIQ-GJZGRUSLSA-N 2 2 357.414 2.764 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@H](n3cc[nH+]c3)C2)cccc1[N+](=O)[O-] ZINC000610945209 520912421 /nfs/dbraw/zinc/91/24/21/520912421.db2.gz SQLPIECGDSEDIQ-GJZGRUSLSA-N 2 2 357.414 2.764 20 5 FFBDLP O=[N+]([O-])c1ccccc1-c1ccc(C[NH+]2CCC([NH2+]CCO)CC2)s1 ZINC000602021506 521083089 /nfs/dbraw/zinc/08/30/89/521083089.db2.gz OZMSJCKEFXXXMB-UHFFFAOYSA-N 2 2 361.467 2.870 20 5 FFBDLP CN(c1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C2CC[NH+](C)CC2)C1 ZINC000615942195 521584000 /nfs/dbraw/zinc/58/40/00/521584000.db2.gz FOPLJHPTFOYUKH-OAHLLOKOSA-N 2 2 352.866 2.853 20 5 FFBDLP CN(c1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CC[NH+](C)CC2)C1 ZINC000615942195 521584004 /nfs/dbraw/zinc/58/40/04/521584004.db2.gz FOPLJHPTFOYUKH-OAHLLOKOSA-N 2 2 352.866 2.853 20 5 FFBDLP Cc1c(C[C@H](C[NH3+])C[N@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)cnn1C ZINC000903879364 736182855 /nfs/dbraw/zinc/18/28/55/736182855.db2.gz ZJACECBRTQWYMK-CYBMUJFWSA-N 2 2 365.865 2.540 20 5 FFBDLP Cc1c(C[C@H](C[NH3+])C[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)cnn1C ZINC000903879364 736182858 /nfs/dbraw/zinc/18/28/58/736182858.db2.gz ZJACECBRTQWYMK-CYBMUJFWSA-N 2 2 365.865 2.540 20 5 FFBDLP Cc1c(C[C@@H](C[NH3+])C[N@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)cnn1C ZINC000903879365 736182911 /nfs/dbraw/zinc/18/29/11/736182911.db2.gz ZJACECBRTQWYMK-ZDUSSCGKSA-N 2 2 365.865 2.540 20 5 FFBDLP Cc1c(C[C@@H](C[NH3+])C[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)cnn1C ZINC000903879365 736182914 /nfs/dbraw/zinc/18/29/14/736182914.db2.gz ZJACECBRTQWYMK-ZDUSSCGKSA-N 2 2 365.865 2.540 20 5 FFBDLP C[NH+](C)CC[C@H]([NH2+][C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1cccnc1 ZINC000903381664 1020815743 /nfs/dbraw/zinc/81/57/43/1020815743.db2.gz YJILUSYDGYZVSW-RCCFBDPRSA-N 2 2 372.473 2.953 20 5 FFBDLP CC[NH+](CC)C1CC[NH+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC1 ZINC001343218531 1052073334 /nfs/dbraw/zinc/07/33/34/1052073334.db2.gz IKHSLRRHNZUDON-UHFFFAOYSA-N 2 2 366.437 2.869 20 5 FFBDLP Cn1cc(C[N@@H+]2CC[C@H]3CC[NH+](C)C[C@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272625530 252084958 /nfs/dbraw/zinc/08/49/58/252084958.db2.gz MKHXDKGSVHEZJN-RDTXWAMCSA-N 2 2 355.442 2.521 20 5 FFBDLP Cn1cc(C[N@H+]2CC[C@H]3CC[NH+](C)C[C@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272625530 252084960 /nfs/dbraw/zinc/08/49/60/252084960.db2.gz MKHXDKGSVHEZJN-RDTXWAMCSA-N 2 2 355.442 2.521 20 5 FFBDLP Cn1cc(C[NH+]2CC[C@H]3CC[N@H+](C)C[C@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272625530 252084962 /nfs/dbraw/zinc/08/49/62/252084962.db2.gz MKHXDKGSVHEZJN-RDTXWAMCSA-N 2 2 355.442 2.521 20 5 FFBDLP Cn1cc(C[NH+]2CC[C@H]3CC[N@@H+](C)C[C@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272625530 252084965 /nfs/dbraw/zinc/08/49/65/252084965.db2.gz MKHXDKGSVHEZJN-RDTXWAMCSA-N 2 2 355.442 2.521 20 5 FFBDLP Cn1cc[nH+]c1[C@H]1CCC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000377267921 512193434 /nfs/dbraw/zinc/19/34/34/512193434.db2.gz RBYPAFAHIIOIJY-AWEZNQCLSA-N 2 2 357.414 2.537 20 5 FFBDLP Cn1cc[nH+]c1[C@H]1CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000377267921 512193438 /nfs/dbraw/zinc/19/34/38/512193438.db2.gz RBYPAFAHIIOIJY-AWEZNQCLSA-N 2 2 357.414 2.537 20 5 FFBDLP O=C(N[C@@H]1CC[N@@H+](C2CCCC2)C1)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000369066566 512211192 /nfs/dbraw/zinc/21/11/92/512211192.db2.gz RUBOLJVQMZJRKS-OAHLLOKOSA-N 2 2 369.425 2.527 20 5 FFBDLP O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000369066566 512211194 /nfs/dbraw/zinc/21/11/94/512211194.db2.gz RUBOLJVQMZJRKS-OAHLLOKOSA-N 2 2 369.425 2.527 20 5 FFBDLP C[C@@H]1C[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)CC[C@H]1N1CC[NH+](C)CC1 ZINC000371305412 512318317 /nfs/dbraw/zinc/31/83/17/512318317.db2.gz YRCVWEZLELBQDW-RDTXWAMCSA-N 2 2 366.893 2.706 20 5 FFBDLP C[C@@H]1C[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)CC[C@H]1N1CC[NH+](C)CC1 ZINC000371305412 512318318 /nfs/dbraw/zinc/31/83/18/512318318.db2.gz YRCVWEZLELBQDW-RDTXWAMCSA-N 2 2 366.893 2.706 20 5 FFBDLP O=C(C[NH+]1CCC(n2cc[nH+]c2)CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000109793274 507987337 /nfs/dbraw/zinc/98/73/37/507987337.db2.gz CACBVYNLDVRGSE-UHFFFAOYSA-N 2 2 363.805 2.720 20 5 FFBDLP Cc1ccc(C[NH+]2CCN(CC[N@H+]3[C@H](C)CC[C@@H]3C)CC2)cc1[N+](=O)[O-] ZINC000092664999 508092159 /nfs/dbraw/zinc/09/21/59/508092159.db2.gz UHXZMDPRMYOJGV-HDICACEKSA-N 2 2 360.502 2.894 20 5 FFBDLP Cc1ccc(C[NH+]2CCN(CC[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)cc1[N+](=O)[O-] ZINC000092664999 508092162 /nfs/dbraw/zinc/09/21/62/508092162.db2.gz UHXZMDPRMYOJGV-HDICACEKSA-N 2 2 360.502 2.894 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000245743937 510121557 /nfs/dbraw/zinc/12/15/57/510121557.db2.gz XSOBULNJHPURNJ-DYVFJYSZSA-N 2 2 357.414 2.621 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000245743937 510121563 /nfs/dbraw/zinc/12/15/63/510121563.db2.gz XSOBULNJHPURNJ-DYVFJYSZSA-N 2 2 357.414 2.621 20 5 FFBDLP C[N@H+](Cc1cccc([N+](=O)[O-])c1)C[C@@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC000188302676 510698317 /nfs/dbraw/zinc/69/83/17/510698317.db2.gz IDESMPKPADQVRQ-FQEVSTJZSA-N 2 2 355.438 2.664 20 5 FFBDLP C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C[C@@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC000188302676 510698327 /nfs/dbraw/zinc/69/83/27/510698327.db2.gz IDESMPKPADQVRQ-FQEVSTJZSA-N 2 2 355.438 2.664 20 5 FFBDLP C[NH+](Cc1cccc([N+](=O)[O-])c1)C[C@@]1(O)CC[N@H+](Cc2ccccc2)C1 ZINC000188302676 510698338 /nfs/dbraw/zinc/69/83/38/510698338.db2.gz IDESMPKPADQVRQ-FQEVSTJZSA-N 2 2 355.438 2.664 20 5 FFBDLP C[NH+](Cc1cccc([N+](=O)[O-])c1)C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000188302676 510698342 /nfs/dbraw/zinc/69/83/42/510698342.db2.gz IDESMPKPADQVRQ-FQEVSTJZSA-N 2 2 355.438 2.664 20 5 FFBDLP C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000247334914 510857660 /nfs/dbraw/zinc/85/76/60/510857660.db2.gz VSMYRLNAXWWUJV-CABCVRRESA-N 2 2 371.441 2.610 20 5 FFBDLP C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000247334914 510857661 /nfs/dbraw/zinc/85/76/61/510857661.db2.gz VSMYRLNAXWWUJV-CABCVRRESA-N 2 2 371.441 2.610 20 5 FFBDLP C[C@H]1CC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1n1cc[nH+]c1 ZINC000247643343 510867595 /nfs/dbraw/zinc/86/75/95/510867595.db2.gz OQFHSYQTYHQBBW-WMLDXEAASA-N 2 2 357.414 2.703 20 5 FFBDLP C[C@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1n1cc[nH+]c1 ZINC000247643343 510867596 /nfs/dbraw/zinc/86/75/96/510867596.db2.gz OQFHSYQTYHQBBW-WMLDXEAASA-N 2 2 357.414 2.703 20 5 FFBDLP CN(CC[N@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1)C1CC[NH+](C)CC1 ZINC000271722281 511300549 /nfs/dbraw/zinc/30/05/49/511300549.db2.gz RQXMAFVWIOUPGR-UHFFFAOYSA-N 2 2 354.882 2.706 20 5 FFBDLP CN(CC[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1)C1CC[NH+](C)CC1 ZINC000271722281 511300553 /nfs/dbraw/zinc/30/05/53/511300553.db2.gz RQXMAFVWIOUPGR-UHFFFAOYSA-N 2 2 354.882 2.706 20 5 FFBDLP CN(CC[N@H+](C)C1CC[NH+](C)CC1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000271722281 511300558 /nfs/dbraw/zinc/30/05/58/511300558.db2.gz RQXMAFVWIOUPGR-UHFFFAOYSA-N 2 2 354.882 2.706 20 5 FFBDLP CN(CC[N@@H+](C)C1CC[NH+](C)CC1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000271722281 511300559 /nfs/dbraw/zinc/30/05/59/511300559.db2.gz RQXMAFVWIOUPGR-UHFFFAOYSA-N 2 2 354.882 2.706 20 5 FFBDLP C[N@@H+]1CC[C@@H]([NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000283662573 511453275 /nfs/dbraw/zinc/45/32/75/511453275.db2.gz BZZAAGJLLMQGIK-YLJYHZDGSA-N 2 2 368.437 2.958 20 5 FFBDLP C[N@H+]1CC[C@@H]([NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000283662573 511453280 /nfs/dbraw/zinc/45/32/80/511453280.db2.gz BZZAAGJLLMQGIK-YLJYHZDGSA-N 2 2 368.437 2.958 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H](c2[nH+]ccn2C)C1 ZINC000365633340 511571328 /nfs/dbraw/zinc/57/13/28/511571328.db2.gz VHESNDUSEWTSCE-OAHLLOKOSA-N 2 2 371.441 2.845 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@@H](c2[nH+]ccn2C)C1 ZINC000365633340 511571331 /nfs/dbraw/zinc/57/13/31/511571331.db2.gz VHESNDUSEWTSCE-OAHLLOKOSA-N 2 2 371.441 2.845 20 5 FFBDLP COc1ccc(NC(=O)[C@H](C)[NH+]2CCC(c3c[nH]c[nH+]3)CC2)c([N+](=O)[O-])c1 ZINC000374207365 512707587 /nfs/dbraw/zinc/70/75/87/512707587.db2.gz IZYBYSBOHVHBFM-LBPRGKRZSA-N 2 2 373.413 2.533 20 5 FFBDLP CCn1cc[nH+]c1CN(Cc1ccccc1[N+](=O)[O-])[C@@H]1CC12CC[NH2+]CC2 ZINC000435692090 513658506 /nfs/dbraw/zinc/65/85/06/513658506.db2.gz NURSSHZERYCHCD-GOSISDBHSA-N 2 2 369.469 2.956 20 5 FFBDLP Cc1c(C[N@@H+](Cc2nccn2C)[C@@H]2CC23CC[NH2+]CC3)cccc1[N+](=O)[O-] ZINC000435695928 513660534 /nfs/dbraw/zinc/66/05/34/513660534.db2.gz OQQHCSZYOPTVIN-GOSISDBHSA-N 2 2 369.469 2.781 20 5 FFBDLP Cc1c(C[N@H+](Cc2nccn2C)[C@@H]2CC23CC[NH2+]CC3)cccc1[N+](=O)[O-] ZINC000435695928 513660537 /nfs/dbraw/zinc/66/05/37/513660537.db2.gz OQQHCSZYOPTVIN-GOSISDBHSA-N 2 2 369.469 2.781 20 5 FFBDLP Cc1c(CN(Cc2[nH+]ccn2C)[C@@H]2CC23CC[NH2+]CC3)cccc1[N+](=O)[O-] ZINC000435695928 513660542 /nfs/dbraw/zinc/66/05/42/513660542.db2.gz OQQHCSZYOPTVIN-GOSISDBHSA-N 2 2 369.469 2.781 20 5 FFBDLP C[N@@H+]1CCCC(C)(C)[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000451298219 513661083 /nfs/dbraw/zinc/66/10/83/513661083.db2.gz VSHXRUJEBKWYDO-KRWDZBQOSA-N 2 2 371.441 2.631 20 5 FFBDLP C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000451298219 513661091 /nfs/dbraw/zinc/66/10/91/513661091.db2.gz VSHXRUJEBKWYDO-KRWDZBQOSA-N 2 2 371.441 2.631 20 5 FFBDLP COc1cc(C[N@@H+]2CCC[C@H]([C@@H](C)[NH3+])C2)c([N+](=O)[O-])cc1OC(F)F ZINC000430598569 513700908 /nfs/dbraw/zinc/70/09/08/513700908.db2.gz TVYVIVWFUQZRIC-MNOVXSKESA-N 2 2 359.373 2.764 20 5 FFBDLP COc1cc(C[N@H+]2CCC[C@H]([C@@H](C)[NH3+])C2)c([N+](=O)[O-])cc1OC(F)F ZINC000430598569 513700915 /nfs/dbraw/zinc/70/09/15/513700915.db2.gz TVYVIVWFUQZRIC-MNOVXSKESA-N 2 2 359.373 2.764 20 5 FFBDLP C[C@H](CNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)[N@@H+]1CCCC[C@H]1C ZINC000448699172 513852900 /nfs/dbraw/zinc/85/29/00/513852900.db2.gz SMHIYWVZXWZRMW-HUUCEWRRSA-N 2 2 371.441 2.773 20 5 FFBDLP C[C@H](CNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)[N@H+]1CCCC[C@H]1C ZINC000448699172 513852907 /nfs/dbraw/zinc/85/29/07/513852907.db2.gz SMHIYWVZXWZRMW-HUUCEWRRSA-N 2 2 371.441 2.773 20 5 FFBDLP Cc1cc(N2CCC3(CC[NH2+]C3)CC2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000420267374 514065433 /nfs/dbraw/zinc/06/54/33/514065433.db2.gz XZSBPEBBDOEKOW-UHFFFAOYSA-N 2 2 353.426 2.940 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCCC[C@H]3[C@@H]3CC[NH2+]C3)n2)cc1 ZINC000420391000 514125987 /nfs/dbraw/zinc/12/59/87/514125987.db2.gz IFMFNOSGOWPUJT-ZBFHGGJFSA-N 2 2 357.414 2.609 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCCC[C@H]3[C@@H]3CC[NH2+]C3)n2)cc1 ZINC000420391000 514125993 /nfs/dbraw/zinc/12/59/93/514125993.db2.gz IFMFNOSGOWPUJT-ZBFHGGJFSA-N 2 2 357.414 2.609 20 5 FFBDLP Cn1cc[nH+]c1[C@H](NC[C@@H]1[NH2+]CCCC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000423403169 514130249 /nfs/dbraw/zinc/13/02/49/514130249.db2.gz ZAGDFUXJWYGIRM-DLBZAZTESA-N 2 2 357.458 2.786 20 5 FFBDLP CC[NH+]1CCC(CNc2cc(C)[nH+]c(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000554587440 516525137 /nfs/dbraw/zinc/52/51/37/516525137.db2.gz WBGBMGLIZLKNEW-UHFFFAOYSA-N 2 2 355.442 2.926 20 5 FFBDLP C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCC(Nc2cccc[nH+]2)CC1 ZINC000534864103 518061525 /nfs/dbraw/zinc/06/15/25/518061525.db2.gz VGJQJRKYQGIHNS-CQSZACIVSA-N 2 2 369.425 2.893 20 5 FFBDLP Cn1c[nH+]cc1[C@@H]1C[C@H]([NH2+][C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)CCO1 ZINC000575941679 518353993 /nfs/dbraw/zinc/35/39/93/518353993.db2.gz GSIKUJVZNTWDKO-DLTWYDFYSA-N 2 2 374.445 2.518 20 5 FFBDLP O=[N+]([O-])c1ccc(OCC[NH2+]C2CC[NH+](CCC(F)(F)F)CC2)cc1 ZINC000583539285 519299219 /nfs/dbraw/zinc/29/92/19/519299219.db2.gz JJXXMPOIWMJNBK-UHFFFAOYSA-N 2 2 361.364 2.980 20 5 FFBDLP O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CC[C@@H](n4c[nH+]c5c4CCCC5)C3)nc2c1 ZINC000578212778 519477174 /nfs/dbraw/zinc/47/71/74/519477174.db2.gz XKUQWNROOHHBDT-CQSZACIVSA-N 2 2 366.425 2.993 20 5 FFBDLP O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@@H](n4c[nH+]c5c4CCCC5)C3)nc2c1 ZINC000578212778 519477178 /nfs/dbraw/zinc/47/71/78/519477178.db2.gz XKUQWNROOHHBDT-CQSZACIVSA-N 2 2 366.425 2.993 20 5 FFBDLP Cc1cn2c([nH+]1)[C@H](C[NH2+][C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)CCC2 ZINC000575206889 519554097 /nfs/dbraw/zinc/55/40/97/519554097.db2.gz IZWCHFSOKIWCGK-XHSDSOJGSA-N 2 2 358.446 2.947 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1 ZINC000595007805 520254793 /nfs/dbraw/zinc/25/47/93/520254793.db2.gz KVZIWTZFRXWODD-HUUCEWRRSA-N 2 2 363.458 2.755 20 5 FFBDLP O=C(NCCC[NH2+]C1CCCCC1)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000609852299 520456792 /nfs/dbraw/zinc/45/67/92/520456792.db2.gz AHFCAFDEKOESGF-UHFFFAOYSA-N 2 2 371.441 2.823 20 5 FFBDLP C[NH+](C)CC[C@H]([NH3+])C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000593910387 521286047 /nfs/dbraw/zinc/28/60/47/521286047.db2.gz VLALDMFYCIZFHX-KRWDZBQOSA-N 2 2 358.398 2.605 20 5 FFBDLP O=[N+]([O-])c1ccc(N2CCC([NH2+]C[C@H]3CCCC[N@@H+]3C3CC3)CC2)cn1 ZINC000602634642 521449709 /nfs/dbraw/zinc/44/97/09/521449709.db2.gz UGIBCYCARPPSGP-GOSISDBHSA-N 2 2 359.474 2.565 20 5 FFBDLP O=[N+]([O-])c1ccc(N2CCC([NH2+]C[C@H]3CCCC[N@H+]3C3CC3)CC2)cn1 ZINC000602634642 521449716 /nfs/dbraw/zinc/44/97/16/521449716.db2.gz UGIBCYCARPPSGP-GOSISDBHSA-N 2 2 359.474 2.565 20 5 FFBDLP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCN([C@H]2CCC[N@@H+](C)C2)CC1 ZINC000615835652 521551464 /nfs/dbraw/zinc/55/14/64/521551464.db2.gz XVAUGACNKLJICN-QUHSPFQSSA-N 2 2 358.486 2.710 20 5 FFBDLP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCN([C@H]2CCC[N@H+](C)C2)CC1 ZINC000615835652 521551471 /nfs/dbraw/zinc/55/14/71/521551471.db2.gz XVAUGACNKLJICN-QUHSPFQSSA-N 2 2 358.486 2.710 20 5 FFBDLP Cc1nn(C[N@H+]2CC[C@H](C)[C@H](n3cc[nH+]c3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000121258404 959026272 /nfs/dbraw/zinc/02/62/72/959026272.db2.gz ISXOBDSLDZCVEF-SCLBCKFNSA-N 2 2 354.414 2.990 20 5 FFBDLP Cc1nn(C[N@@H+]2CC[C@H](C)[C@H](n3cc[nH+]c3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000121258404 959026285 /nfs/dbraw/zinc/02/62/85/959026285.db2.gz ISXOBDSLDZCVEF-SCLBCKFNSA-N 2 2 354.414 2.990 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2cnn(C[N@@H+]3CCC[C@@H](n4cc[nH+]c4)C3)c2)cc1 ZINC000738159231 999621997 /nfs/dbraw/zinc/62/19/97/999621997.db2.gz REGVOSDXTUMUKO-GOSISDBHSA-N 2 2 352.398 2.949 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CCC[C@@H](n4cc[nH+]c4)C3)c2)cc1 ZINC000738159231 999622000 /nfs/dbraw/zinc/62/20/00/999622000.db2.gz REGVOSDXTUMUKO-GOSISDBHSA-N 2 2 352.398 2.949 20 5 FFBDLP Cc1c(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2CO)cccc1[N+](=O)[O-] ZINC000788469138 1001808845 /nfs/dbraw/zinc/80/88/45/1001808845.db2.gz NTVGKWYEVUOQEJ-UXHICEINSA-N 2 2 369.465 2.876 20 5 FFBDLP Cc1c(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2CO)cccc1[N+](=O)[O-] ZINC000788469138 1001808856 /nfs/dbraw/zinc/80/88/56/1001808856.db2.gz NTVGKWYEVUOQEJ-UXHICEINSA-N 2 2 369.465 2.876 20 5 FFBDLP COCC[N@H+]([C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])C1CC[NH+](C)CC1 ZINC001170342102 1003129970 /nfs/dbraw/zinc/12/99/70/1003129970.db2.gz MAKQEJLLQJLDNU-OAHLLOKOSA-N 2 2 365.474 2.577 20 5 FFBDLP COCC[N@@H+]([C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])C1CC[NH+](C)CC1 ZINC001170342102 1003129975 /nfs/dbraw/zinc/12/99/75/1003129975.db2.gz MAKQEJLLQJLDNU-OAHLLOKOSA-N 2 2 365.474 2.577 20 5 FFBDLP COc1cc(N2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4C)CC2)c([N+](=O)[O-])cc1C ZINC000853456681 1006396376 /nfs/dbraw/zinc/39/63/76/1006396376.db2.gz AVAPAOZYFRFTBA-SJPCQFCGSA-N 2 2 374.485 2.659 20 5 FFBDLP COc1cc(N2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)c([N+](=O)[O-])cc1C ZINC000853456681 1006396390 /nfs/dbraw/zinc/39/63/90/1006396390.db2.gz AVAPAOZYFRFTBA-SJPCQFCGSA-N 2 2 374.485 2.659 20 5 FFBDLP Cc1[nH+]ccn1-c1cc[nH+]cc1NC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC001116343096 1021173107 /nfs/dbraw/zinc/17/31/07/1021173107.db2.gz WRDHHLDFHKAFSV-UHFFFAOYSA-N 2 2 351.366 2.974 20 5 FFBDLP CC[N@H+]([C@H]1CCOC1)C1CC[NH+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254603065 1040831872 /nfs/dbraw/zinc/83/18/72/1040831872.db2.gz LGPRKSNSKSWTQX-PMACEKPBSA-N 2 2 359.470 2.637 20 5 FFBDLP CC[N@@H+]([C@H]1CCOC1)C1CC[NH+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254603065 1040831889 /nfs/dbraw/zinc/83/18/89/1040831889.db2.gz LGPRKSNSKSWTQX-PMACEKPBSA-N 2 2 359.470 2.637 20 5 FFBDLP Cn1cc[nH+]c1C[C@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC001336704072 1054151402 /nfs/dbraw/zinc/15/14/02/1054151402.db2.gz NTLLCVDYTYMQRJ-RBUKOAKNSA-N 2 2 366.421 2.935 20 5 FFBDLP C[N@@H+]1CCC[C@@H]2C[NH+](Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)CC[C@H]21 ZINC000848483114 1060121055 /nfs/dbraw/zinc/12/10/55/1060121055.db2.gz YOPUFPMYXUHPKC-CRAIPNDOSA-N 2 2 355.442 2.832 20 5 FFBDLP C[N@H+]1CCC[C@@H]2C[NH+](Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)CC[C@H]21 ZINC000848483114 1060121060 /nfs/dbraw/zinc/12/10/60/1060121060.db2.gz YOPUFPMYXUHPKC-CRAIPNDOSA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CCC[C@@H]2C[N@H+](Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)CC[C@H]21 ZINC000848483114 1060121068 /nfs/dbraw/zinc/12/10/68/1060121068.db2.gz YOPUFPMYXUHPKC-CRAIPNDOSA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CCC[C@@H]2C[N@@H+](Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)CC[C@H]21 ZINC000848483114 1060121077 /nfs/dbraw/zinc/12/10/77/1060121077.db2.gz YOPUFPMYXUHPKC-CRAIPNDOSA-N 2 2 355.442 2.832 20 5 FFBDLP Cc1[nH+]ccn1CCCC[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272557537 252068330 /nfs/dbraw/zinc/06/83/30/252068330.db2.gz SMTCDIDYIGWHMG-SFHVURJKSA-N 2 2 368.441 2.993 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[NH+]2CCC(c3c[nH]c[nH+]3)CC2)cccc1[N+](=O)[O-] ZINC000369341284 512359078 /nfs/dbraw/zinc/35/90/78/512359078.db2.gz CVEVSZOXXKVIEE-ZDUSSCGKSA-N 2 2 357.414 2.833 20 5 FFBDLP CC[N@H+](C)C[C@@H]1CC[NH+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000072859190 507865629 /nfs/dbraw/zinc/86/56/29/507865629.db2.gz KQDCVRBBWVQABV-KBPBESRZSA-N 2 2 359.430 2.979 20 5 FFBDLP CC[N@@H+](C)C[C@@H]1CC[NH+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000072859190 507865633 /nfs/dbraw/zinc/86/56/33/507865633.db2.gz KQDCVRBBWVQABV-KBPBESRZSA-N 2 2 359.430 2.979 20 5 FFBDLP CC[NH+](C)C[C@@H]1CC[N@@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000072859190 507865635 /nfs/dbraw/zinc/86/56/35/507865635.db2.gz KQDCVRBBWVQABV-KBPBESRZSA-N 2 2 359.430 2.979 20 5 FFBDLP CC[NH+](C)C[C@@H]1CC[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000072859190 507865638 /nfs/dbraw/zinc/86/56/38/507865638.db2.gz KQDCVRBBWVQABV-KBPBESRZSA-N 2 2 359.430 2.979 20 5 FFBDLP COc1ccc(OCC[N@@H+]2CC[C@@H](C)[C@@H](n3cc[nH+]c3)C2)c([N+](=O)[O-])c1 ZINC000122342402 508520081 /nfs/dbraw/zinc/52/00/81/508520081.db2.gz FLCKJRJFCIFRML-PBHICJAKSA-N 2 2 360.414 2.762 20 5 FFBDLP COc1ccc(OCC[N@H+]2CC[C@@H](C)[C@@H](n3cc[nH+]c3)C2)c([N+](=O)[O-])c1 ZINC000122342402 508520083 /nfs/dbraw/zinc/52/00/83/508520083.db2.gz FLCKJRJFCIFRML-PBHICJAKSA-N 2 2 360.414 2.762 20 5 FFBDLP Cc1ccc([C@@H](C)[NH2+]Cc2cccnc2N2CC[NH+](C)CC2)cc1[N+](=O)[O-] ZINC000158470818 508709305 /nfs/dbraw/zinc/70/93/05/508709305.db2.gz OYJXMEIFIZOISE-MRXNPFEDSA-N 2 2 369.469 2.901 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CC[C@@H](Oc4cc[nH+]cc4)C3)n2)c1 ZINC000156336822 509161946 /nfs/dbraw/zinc/16/19/46/509161946.db2.gz MDBYNDGRZBIGDQ-MRXNPFEDSA-N 2 2 367.365 2.693 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CC[C@@H](Oc4cc[nH+]cc4)C3)n2)c1 ZINC000156336822 509161948 /nfs/dbraw/zinc/16/19/48/509161948.db2.gz MDBYNDGRZBIGDQ-MRXNPFEDSA-N 2 2 367.365 2.693 20 5 FFBDLP CC(C)C[N@@H+]1CCO[C@H](C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000248035724 509221304 /nfs/dbraw/zinc/22/13/04/509221304.db2.gz RNYAJKLQHSFFLD-RTBURBONSA-N 2 2 361.486 2.862 20 5 FFBDLP CC(C)C[N@H+]1CCO[C@H](C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000248035724 509221314 /nfs/dbraw/zinc/22/13/14/509221314.db2.gz RNYAJKLQHSFFLD-RTBURBONSA-N 2 2 361.486 2.862 20 5 FFBDLP Cc1ccc(C[N@@H+](C)C[C@]2(O)CC[NH+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000190314996 510058412 /nfs/dbraw/zinc/05/84/12/510058412.db2.gz NVNMLFOJDSPQFH-OAQYLSRUSA-N 2 2 369.465 2.972 20 5 FFBDLP Cc1ccc(C[N@H+](C)C[C@]2(O)CC[NH+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000190314996 510058418 /nfs/dbraw/zinc/05/84/18/510058418.db2.gz NVNMLFOJDSPQFH-OAQYLSRUSA-N 2 2 369.465 2.972 20 5 FFBDLP Cc1ccc(C[NH+](C)C[C@]2(O)CC[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000190314996 510058427 /nfs/dbraw/zinc/05/84/27/510058427.db2.gz NVNMLFOJDSPQFH-OAQYLSRUSA-N 2 2 369.465 2.972 20 5 FFBDLP Cc1ccc(C[NH+](C)C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000190314996 510058435 /nfs/dbraw/zinc/05/84/35/510058435.db2.gz NVNMLFOJDSPQFH-OAQYLSRUSA-N 2 2 369.465 2.972 20 5 FFBDLP Cn1cnc([N+](=O)[O-])c1Nc1ccc([NH+]2CCC(C[NH+](C)C)CC2)cc1 ZINC000265569923 510120492 /nfs/dbraw/zinc/12/04/92/510120492.db2.gz LFHKXGGDXLARGG-UHFFFAOYSA-N 2 2 358.446 2.850 20 5 FFBDLP O=C(CC[N@@H+]1CCC[C@@H](c2[nH]cc[nH+]2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000364604031 510965539 /nfs/dbraw/zinc/96/55/39/510965539.db2.gz HIVMQIHWFVPVCV-GFCCVEGCSA-N 2 2 361.377 2.665 20 5 FFBDLP O=C(CC[N@H+]1CCC[C@@H](c2[nH]cc[nH+]2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000364604031 510965545 /nfs/dbraw/zinc/96/55/45/510965545.db2.gz HIVMQIHWFVPVCV-GFCCVEGCSA-N 2 2 361.377 2.665 20 5 FFBDLP C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000292212278 511507809 /nfs/dbraw/zinc/50/78/09/511507809.db2.gz UESHDRGNVAKQTG-UGSOOPFHSA-N 2 2 357.414 2.733 20 5 FFBDLP C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000292212278 511507812 /nfs/dbraw/zinc/50/78/12/511507812.db2.gz UESHDRGNVAKQTG-UGSOOPFHSA-N 2 2 357.414 2.733 20 5 FFBDLP C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CC[C@]2(CC[N@H+](C)C2)C1 ZINC000292212278 511507815 /nfs/dbraw/zinc/50/78/15/511507815.db2.gz UESHDRGNVAKQTG-UGSOOPFHSA-N 2 2 357.414 2.733 20 5 FFBDLP C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CC[C@]2(CC[N@@H+](C)C2)C1 ZINC000292212278 511507818 /nfs/dbraw/zinc/50/78/18/511507818.db2.gz UESHDRGNVAKQTG-UGSOOPFHSA-N 2 2 357.414 2.733 20 5 FFBDLP COc1ccc(NC(=O)[C@H](C)[N@@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)c([N+](=O)[O-])c1 ZINC000377917709 512511617 /nfs/dbraw/zinc/51/16/17/512511617.db2.gz RXYCEAYCDONAJL-QWHCGFSZSA-N 2 2 373.413 2.533 20 5 FFBDLP COc1ccc(NC(=O)[C@H](C)[N@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)c([N+](=O)[O-])c1 ZINC000377917709 512511621 /nfs/dbraw/zinc/51/16/21/512511621.db2.gz RXYCEAYCDONAJL-QWHCGFSZSA-N 2 2 373.413 2.533 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@@H+]2Cc1ccc([N+](=O)[O-])cc1Cl ZINC000374695357 512959612 /nfs/dbraw/zinc/95/96/12/512959612.db2.gz FKVAHQZXROFEJP-COXVUDFISA-N 2 2 353.850 2.932 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@H+]2Cc1ccc([N+](=O)[O-])cc1Cl ZINC000374695357 512959616 /nfs/dbraw/zinc/95/96/16/512959616.db2.gz FKVAHQZXROFEJP-COXVUDFISA-N 2 2 353.850 2.932 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CCOCC2)cc1NC1CC[NH+](C2CCC2)CC1 ZINC000450883993 513382843 /nfs/dbraw/zinc/38/28/43/513382843.db2.gz YONYZWHOORQBFW-UHFFFAOYSA-N 2 2 374.485 2.856 20 5 FFBDLP CCn1cc[nH+]c1CN(Cc1cccc([N+](=O)[O-])c1)[C@H]1CC12CC[NH2+]CC2 ZINC000435428139 513580702 /nfs/dbraw/zinc/58/07/02/513580702.db2.gz QQUOKMTYFMUUAI-SFHVURJKSA-N 2 2 369.469 2.956 20 5 FFBDLP CCn1ccnc1C[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@H]1CC12CC[NH2+]CC2 ZINC000435428139 513580710 /nfs/dbraw/zinc/58/07/10/513580710.db2.gz QQUOKMTYFMUUAI-SFHVURJKSA-N 2 2 369.469 2.956 20 5 FFBDLP CCn1ccnc1C[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@H]1CC12CC[NH2+]CC2 ZINC000435428139 513580718 /nfs/dbraw/zinc/58/07/18/513580718.db2.gz QQUOKMTYFMUUAI-SFHVURJKSA-N 2 2 369.469 2.956 20 5 FFBDLP Cc1ccc(C[N@@H+](Cc2nccn2C)[C@@H]2CC23CC[NH2+]CC3)cc1[N+](=O)[O-] ZINC000435431767 513583736 /nfs/dbraw/zinc/58/37/36/513583736.db2.gz FTNPNHAGNZPXPP-GOSISDBHSA-N 2 2 369.469 2.781 20 5 FFBDLP Cc1ccc(C[N@H+](Cc2nccn2C)[C@@H]2CC23CC[NH2+]CC3)cc1[N+](=O)[O-] ZINC000435431767 513583742 /nfs/dbraw/zinc/58/37/42/513583742.db2.gz FTNPNHAGNZPXPP-GOSISDBHSA-N 2 2 369.469 2.781 20 5 FFBDLP Cc1ccc(CN(Cc2[nH+]ccn2C)[C@@H]2CC23CC[NH2+]CC3)cc1[N+](=O)[O-] ZINC000435431767 513583746 /nfs/dbraw/zinc/58/37/46/513583746.db2.gz FTNPNHAGNZPXPP-GOSISDBHSA-N 2 2 369.469 2.781 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CCOCC2)cc1NCc1ccc2c[nH+]cn2c1 ZINC000413402963 513638525 /nfs/dbraw/zinc/63/85/25/513638525.db2.gz KEEMGOQKBDMWQW-UHFFFAOYSA-N 2 2 367.409 2.687 20 5 FFBDLP C[C@H](C[N@@H+]1CCC[C@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000448780394 513896195 /nfs/dbraw/zinc/89/61/95/513896195.db2.gz JTEABVRVSHWLKH-LSDHHAIUSA-N 2 2 371.441 2.631 20 5 FFBDLP C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000448780394 513896201 /nfs/dbraw/zinc/89/62/01/513896201.db2.gz JTEABVRVSHWLKH-LSDHHAIUSA-N 2 2 371.441 2.631 20 5 FFBDLP O=C(NCCC[NH2+]C1CCCCC1)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000419885288 513961210 /nfs/dbraw/zinc/96/12/10/513961210.db2.gz AUKJAXAWZRMRKL-UHFFFAOYSA-N 2 2 371.441 2.823 20 5 FFBDLP COc1ccc([C@@H]2CC[NH2+]C[C@H]2[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000414884971 514341007 /nfs/dbraw/zinc/34/10/07/514341007.db2.gz OTHCGPRAXODBEB-ZWKOTPCHSA-N 2 2 371.437 2.847 20 5 FFBDLP CC1CC[NH+](C[C@H](O)C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000433181200 514407631 /nfs/dbraw/zinc/40/76/31/514407631.db2.gz XGKJKDZNBQVWKG-VQIMIIECSA-N 2 2 361.486 3.000 20 5 FFBDLP CC[N@@H+]1CC[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)C[C@@H]1C ZINC000449971136 514447562 /nfs/dbraw/zinc/44/75/62/514447562.db2.gz JSYSWFMKGGLGER-HOCLYGCPSA-N 2 2 371.441 2.725 20 5 FFBDLP CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)C[C@@H]1C ZINC000449971136 514447569 /nfs/dbraw/zinc/44/75/69/514447569.db2.gz JSYSWFMKGGLGER-HOCLYGCPSA-N 2 2 371.441 2.725 20 5 FFBDLP CC[NH+](CC)C[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)C1 ZINC000449990901 514456021 /nfs/dbraw/zinc/45/60/21/514456021.db2.gz KNBLULBSTJSHGI-OAHLLOKOSA-N 2 2 371.441 2.584 20 5 FFBDLP CC(C)[NH+]1CCC([NH+]2CCN(c3ccc(F)cc3[N+](=O)[O-])CC2)CC1 ZINC000433525495 514508981 /nfs/dbraw/zinc/50/89/81/514508981.db2.gz OZOQGFUJBWPUTE-UHFFFAOYSA-N 2 2 350.438 2.729 20 5 FFBDLP C[NH+](C)C1CC[NH+](CCNc2ccc([N+](=O)[O-])cc2OC(F)F)CC1 ZINC000544843985 516955782 /nfs/dbraw/zinc/95/57/82/516955782.db2.gz FHXUBPORAHZSIW-UHFFFAOYSA-N 2 2 358.389 2.634 20 5 FFBDLP Cc1ccc(C[NH+]2CCN(C3CC[NH+](C(C)C)CC3)CC2)cc1[N+](=O)[O-] ZINC000537659050 517285547 /nfs/dbraw/zinc/28/55/47/517285547.db2.gz REJGALFVKNAKPM-UHFFFAOYSA-N 2 2 360.502 2.894 20 5 FFBDLP C[N@H+](CC[NH2+][C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)Cc1ccccc1 ZINC000572732059 518336053 /nfs/dbraw/zinc/33/60/53/518336053.db2.gz PJVAZPMSLYGULX-MSOLQXFVSA-N 2 2 357.458 2.997 20 5 FFBDLP C[N@@H+](CC[NH2+][C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)Cc1ccccc1 ZINC000572732059 518336056 /nfs/dbraw/zinc/33/60/56/518336056.db2.gz PJVAZPMSLYGULX-MSOLQXFVSA-N 2 2 357.458 2.997 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)c1 ZINC000589502640 519020255 /nfs/dbraw/zinc/02/02/55/519020255.db2.gz ATGGYAJOFFSSDW-OAHLLOKOSA-N 2 2 361.442 2.545 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)c1 ZINC000589502640 519020261 /nfs/dbraw/zinc/02/02/61/519020261.db2.gz ATGGYAJOFFSSDW-OAHLLOKOSA-N 2 2 361.442 2.545 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CC[C@H](C[N@H+](C)CC3CC3)C2)c1 ZINC000589502640 519020266 /nfs/dbraw/zinc/02/02/66/519020266.db2.gz ATGGYAJOFFSSDW-OAHLLOKOSA-N 2 2 361.442 2.545 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CC[C@H](C[N@@H+](C)CC3CC3)C2)c1 ZINC000589502640 519020271 /nfs/dbraw/zinc/02/02/71/519020271.db2.gz ATGGYAJOFFSSDW-OAHLLOKOSA-N 2 2 361.442 2.545 20 5 FFBDLP CC(C)C[N@H+](C)CCCN[C@H](c1[nH+]ccn1C)c1cccc([N+](=O)[O-])c1 ZINC000593646940 521128999 /nfs/dbraw/zinc/12/89/99/521128999.db2.gz UFWNLTZNZIQAEB-SFHVURJKSA-N 2 2 359.474 2.985 20 5 FFBDLP CC(C)C[N@@H+](C)CCCN[C@H](c1[nH+]ccn1C)c1cccc([N+](=O)[O-])c1 ZINC000593646940 521129002 /nfs/dbraw/zinc/12/90/02/521129002.db2.gz UFWNLTZNZIQAEB-SFHVURJKSA-N 2 2 359.474 2.985 20 5 FFBDLP Cn1cc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)CC2(C)C)c([N+](=O)[O-])n1 ZINC000602825405 521555452 /nfs/dbraw/zinc/55/54/52/521555452.db2.gz SLOQMIALZQBOAL-KRWDZBQOSA-N 2 2 357.458 2.719 20 5 FFBDLP Cn1cc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)c([N+](=O)[O-])n1 ZINC000602825405 521555453 /nfs/dbraw/zinc/55/54/53/521555453.db2.gz SLOQMIALZQBOAL-KRWDZBQOSA-N 2 2 357.458 2.719 20 5 FFBDLP C[NH+]1CCC([N@@H+]2CC[C@@H](Nc3nc4ccc([N+](=O)[O-])cc4s3)C2)CC1 ZINC000732804731 734766654 /nfs/dbraw/zinc/76/66/54/734766654.db2.gz DLOMMKCXDSOQNH-GFCCVEGCSA-N 2 2 361.471 2.785 20 5 FFBDLP C[NH+]1CCC([N@H+]2CC[C@@H](Nc3nc4ccc([N+](=O)[O-])cc4s3)C2)CC1 ZINC000732804731 734766656 /nfs/dbraw/zinc/76/66/56/734766656.db2.gz DLOMMKCXDSOQNH-GFCCVEGCSA-N 2 2 361.471 2.785 20 5 FFBDLP CN(CC[N@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1)C1CC[NH+](C)CC1 ZINC000809734942 741337918 /nfs/dbraw/zinc/33/79/18/741337918.db2.gz UCHAKRYLKIYCFT-UHFFFAOYSA-N 2 2 354.882 2.706 20 5 FFBDLP CN(CC[N@@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1)C1CC[NH+](C)CC1 ZINC000809734942 741337921 /nfs/dbraw/zinc/33/79/21/741337921.db2.gz UCHAKRYLKIYCFT-UHFFFAOYSA-N 2 2 354.882 2.706 20 5 FFBDLP CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)C1([NH+](C)C)CC1 ZINC001182597924 1001957502 /nfs/dbraw/zinc/95/75/02/1001957502.db2.gz WUPFXHKPGPWMDT-UHFFFAOYSA-N 2 2 364.449 2.989 20 5 FFBDLP C[C@@H]1CC[N@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H]1n1cc[nH+]c1 ZINC000121676781 1011068644 /nfs/dbraw/zinc/06/86/44/1011068644.db2.gz OOZXQPLWAAWOJO-PBHICJAKSA-N 2 2 367.413 2.590 20 5 FFBDLP C[C@@H]1CC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H]1n1cc[nH+]c1 ZINC000121676781 1011068646 /nfs/dbraw/zinc/06/86/46/1011068646.db2.gz OOZXQPLWAAWOJO-PBHICJAKSA-N 2 2 367.413 2.590 20 5 FFBDLP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCn2cc(C[NH+]3CCCC3)nc2C1 ZINC001173223738 1012354688 /nfs/dbraw/zinc/35/46/88/1012354688.db2.gz HDSVCCXAJYNDJI-MRXNPFEDSA-N 2 2 369.469 2.834 20 5 FFBDLP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCn2cc(C[NH+]3CCCC3)nc2C1 ZINC001173223738 1012354699 /nfs/dbraw/zinc/35/46/99/1012354699.db2.gz HDSVCCXAJYNDJI-MRXNPFEDSA-N 2 2 369.469 2.834 20 5 FFBDLP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCc2onc(Cn3cc[nH+]c3)c2C1 ZINC001173224144 1012358144 /nfs/dbraw/zinc/35/81/44/1012358144.db2.gz IPAXCWSIORWSAB-AWEZNQCLSA-N 2 2 367.409 2.817 20 5 FFBDLP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2onc(Cn3cc[nH+]c3)c2C1 ZINC001173224144 1012358161 /nfs/dbraw/zinc/35/81/61/1012358161.db2.gz IPAXCWSIORWSAB-AWEZNQCLSA-N 2 2 367.409 2.817 20 5 FFBDLP O=[N+]([O-])c1ccc(OCCC[NH+]2CCC([N@@H+]3CCCOCC3)CC2)cc1 ZINC000931284288 1020402468 /nfs/dbraw/zinc/40/24/68/1020402468.db2.gz RBJXWAQQZRZLDR-UHFFFAOYSA-N 2 2 363.458 2.550 20 5 FFBDLP O=[N+]([O-])c1ccc(OCCC[NH+]2CCC([N@H+]3CCCOCC3)CC2)cc1 ZINC000931284288 1020402475 /nfs/dbraw/zinc/40/24/75/1020402475.db2.gz RBJXWAQQZRZLDR-UHFFFAOYSA-N 2 2 363.458 2.550 20 5 FFBDLP Cc1cccc(NC[C@H]2CCC[N@@H+]2C[C@H](O)c2cccc([N+](=O)[O-])c2)[nH+]1 ZINC001116351686 1021175904 /nfs/dbraw/zinc/17/59/04/1021175904.db2.gz ISHFVUOFCWVLBW-MSOLQXFVSA-N 2 2 356.426 2.908 20 5 FFBDLP Cc1cccc(NC[C@H]2CCC[N@H+]2C[C@H](O)c2cccc([N+](=O)[O-])c2)[nH+]1 ZINC001116351686 1021175912 /nfs/dbraw/zinc/17/59/12/1021175912.db2.gz ISHFVUOFCWVLBW-MSOLQXFVSA-N 2 2 356.426 2.908 20 5 FFBDLP Cn1cc[nH+]c1[C@H]1CC[N@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000755790731 1023636568 /nfs/dbraw/zinc/63/65/68/1023636568.db2.gz QJFPWWIXWGQSPI-HNNXBMFYSA-N 2 2 352.398 2.639 20 5 FFBDLP Cn1cc[nH+]c1[C@H]1CC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000755790731 1023636571 /nfs/dbraw/zinc/63/65/71/1023636571.db2.gz QJFPWWIXWGQSPI-HNNXBMFYSA-N 2 2 352.398 2.639 20 5 FFBDLP COc1cc(N2CCC([NH2+][C@@H]3CC[N@@H+](C(C)C)C3)CC2)ccc1[N+](=O)[O-] ZINC001256087033 1038371380 /nfs/dbraw/zinc/37/13/80/1038371380.db2.gz MQXMRZRLNPCFQF-MRXNPFEDSA-N 2 2 362.474 2.645 20 5 FFBDLP COc1cc(N2CCC([NH2+][C@@H]3CC[N@H+](C(C)C)C3)CC2)ccc1[N+](=O)[O-] ZINC001256087033 1038371392 /nfs/dbraw/zinc/37/13/92/1038371392.db2.gz MQXMRZRLNPCFQF-MRXNPFEDSA-N 2 2 362.474 2.645 20 5 FFBDLP CC[N@H+]([C@@H]1CCOC1)C1CC[NH+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254603066 1040832136 /nfs/dbraw/zinc/83/21/36/1040832136.db2.gz LGPRKSNSKSWTQX-UXHICEINSA-N 2 2 359.470 2.637 20 5 FFBDLP CC[N@@H+]([C@@H]1CCOC1)C1CC[NH+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254603066 1040832144 /nfs/dbraw/zinc/83/21/44/1040832144.db2.gz LGPRKSNSKSWTQX-UXHICEINSA-N 2 2 359.470 2.637 20 5 FFBDLP Cc1cc(NCC2([NH+](C)C)CCOCC2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000072947686 507875376 /nfs/dbraw/zinc/87/53/76/507875376.db2.gz IHUHAHIQBZDGLD-UHFFFAOYSA-N 2 2 371.441 2.883 20 5 FFBDLP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000072974869 507879696 /nfs/dbraw/zinc/87/96/96/507879696.db2.gz FQRADVQSLVZYJP-JKSUJKDBSA-N 2 2 374.485 2.780 20 5 FFBDLP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000072974869 507879699 /nfs/dbraw/zinc/87/96/99/507879699.db2.gz FQRADVQSLVZYJP-JKSUJKDBSA-N 2 2 374.485 2.780 20 5 FFBDLP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000072974869 507879700 /nfs/dbraw/zinc/87/97/00/507879700.db2.gz FQRADVQSLVZYJP-JKSUJKDBSA-N 2 2 374.485 2.780 20 5 FFBDLP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000072974869 507879703 /nfs/dbraw/zinc/87/97/03/507879703.db2.gz FQRADVQSLVZYJP-JKSUJKDBSA-N 2 2 374.485 2.780 20 5 FFBDLP C[C@@H]([NH2+]Cc1cccnc1N1CC[NH+](C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000158515933 508715547 /nfs/dbraw/zinc/71/55/47/508715547.db2.gz YEPGEUYQRXCUSN-OAHLLOKOSA-N 2 2 355.442 2.592 20 5 FFBDLP C[N@@H+]1CCC[C@H]2C[NH+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)CC[C@@H]21 ZINC000140052961 508799233 /nfs/dbraw/zinc/79/92/33/508799233.db2.gz AQULGWWXIFFQHG-HOCLYGCPSA-N 2 2 357.414 2.561 20 5 FFBDLP C[N@H+]1CCC[C@H]2C[NH+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)CC[C@@H]21 ZINC000140052961 508799236 /nfs/dbraw/zinc/79/92/36/508799236.db2.gz AQULGWWXIFFQHG-HOCLYGCPSA-N 2 2 357.414 2.561 20 5 FFBDLP C[NH+]1CCC[C@H]2C[N@H+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)CC[C@@H]21 ZINC000140052961 508799239 /nfs/dbraw/zinc/79/92/39/508799239.db2.gz AQULGWWXIFFQHG-HOCLYGCPSA-N 2 2 357.414 2.561 20 5 FFBDLP C[NH+]1CCC[C@H]2C[N@@H+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)CC[C@@H]21 ZINC000140052961 508799242 /nfs/dbraw/zinc/79/92/42/508799242.db2.gz AQULGWWXIFFQHG-HOCLYGCPSA-N 2 2 357.414 2.561 20 5 FFBDLP C[NH+]1CCC([N@H+](CCO)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000155507626 509016430 /nfs/dbraw/zinc/01/64/30/509016430.db2.gz ATCOYIIZAKEAHQ-UHFFFAOYSA-N 2 2 359.426 2.743 20 5 FFBDLP C[NH+]1CCC([N@@H+](CCO)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000155507626 509016432 /nfs/dbraw/zinc/01/64/32/509016432.db2.gz ATCOYIIZAKEAHQ-UHFFFAOYSA-N 2 2 359.426 2.743 20 5 FFBDLP COc1cc(C[N@@H+]2CC[C@H](C[NH+](C)C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000156309009 509157684 /nfs/dbraw/zinc/15/76/84/509157684.db2.gz PRBAWDLGHYZKAM-GFCCVEGCSA-N 2 2 373.400 2.631 20 5 FFBDLP COc1cc(C[N@H+]2CC[C@H](C[NH+](C)C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000156309009 509157687 /nfs/dbraw/zinc/15/76/87/509157687.db2.gz PRBAWDLGHYZKAM-GFCCVEGCSA-N 2 2 373.400 2.631 20 5 FFBDLP C[NH+]1CCC([NH+]2CCC(Nc3ncc([N+](=O)[O-])cc3Cl)CC2)CC1 ZINC000265562860 510117679 /nfs/dbraw/zinc/11/76/79/510117679.db2.gz SREBEHRGSVRCDE-UHFFFAOYSA-N 2 2 353.854 2.614 20 5 FFBDLP COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+]1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000363562304 511629312 /nfs/dbraw/zinc/62/93/12/511629312.db2.gz LLLIARJLBOAOFQ-OLZOCXBDSA-N 2 2 373.413 2.533 20 5 FFBDLP COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+]1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000363562304 511629317 /nfs/dbraw/zinc/62/93/17/511629317.db2.gz LLLIARJLBOAOFQ-OLZOCXBDSA-N 2 2 373.413 2.533 20 5 FFBDLP C[C@@H]1C[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC[C@@H]1N1CC[NH+](C)CC1 ZINC000376636958 512912184 /nfs/dbraw/zinc/91/21/84/512912184.db2.gz NCJFKCGVOAYZBC-PBHICJAKSA-N 2 2 366.893 2.706 20 5 FFBDLP C[C@@H]1C[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC[C@@H]1N1CC[NH+](C)CC1 ZINC000376636958 512912186 /nfs/dbraw/zinc/91/21/86/512912186.db2.gz NCJFKCGVOAYZBC-PBHICJAKSA-N 2 2 366.893 2.706 20 5 FFBDLP Cc1ccc(C[N@@H+](Cc2nccn2C)[C@H]2CC23CC[NH2+]CC3)cc1[N+](=O)[O-] ZINC000435431768 513584324 /nfs/dbraw/zinc/58/43/24/513584324.db2.gz FTNPNHAGNZPXPP-SFHVURJKSA-N 2 2 369.469 2.781 20 5 FFBDLP Cc1ccc(C[N@H+](Cc2nccn2C)[C@H]2CC23CC[NH2+]CC3)cc1[N+](=O)[O-] ZINC000435431768 513584331 /nfs/dbraw/zinc/58/43/31/513584331.db2.gz FTNPNHAGNZPXPP-SFHVURJKSA-N 2 2 369.469 2.781 20 5 FFBDLP Cc1ccc(CN(Cc2[nH+]ccn2C)[C@H]2CC23CC[NH2+]CC3)cc1[N+](=O)[O-] ZINC000435431768 513584339 /nfs/dbraw/zinc/58/43/39/513584339.db2.gz FTNPNHAGNZPXPP-SFHVURJKSA-N 2 2 369.469 2.781 20 5 FFBDLP C[C@H](CNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)[N@@H+]1CCC[C@@H](C)C1 ZINC000448706584 513857170 /nfs/dbraw/zinc/85/71/70/513857170.db2.gz ZIGMNKISNLXKOM-HUUCEWRRSA-N 2 2 371.441 2.631 20 5 FFBDLP C[C@H](CNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)[N@H+]1CCC[C@@H](C)C1 ZINC000448706584 513857179 /nfs/dbraw/zinc/85/71/79/513857179.db2.gz ZIGMNKISNLXKOM-HUUCEWRRSA-N 2 2 371.441 2.631 20 5 FFBDLP Cc1cc(N2CCC[C@@]3(CC[NH2+]C3)C2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000420258205 514063344 /nfs/dbraw/zinc/06/33/44/514063344.db2.gz XOFJEBARMMGGGA-IBGZPJMESA-N 2 2 353.426 2.940 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1C[NH2+]CC1([NH3+])CC[NH+](Cc2ccccc2)CC1 ZINC000415135247 514461962 /nfs/dbraw/zinc/46/19/62/514461962.db2.gz PZHYDLCTVNIZPN-UHFFFAOYSA-N 3 2 368.481 2.986 20 5 FFBDLP O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]CCc2cn3ccccc3[nH+]2)n1 ZINC000472604618 515334289 /nfs/dbraw/zinc/33/42/89/515334289.db2.gz WEQGFHYQUJTJLB-CVEARBPZSA-N 2 2 354.414 2.755 20 5 FFBDLP O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC(CC[NH+]2CCOCC2)CC1 ZINC000506585284 515923490 /nfs/dbraw/zinc/92/34/90/515923490.db2.gz QVFOWSGSDOUUSS-UHFFFAOYSA-N 2 2 351.422 2.668 20 5 FFBDLP COc1cc(C[NH2+]C[C@H]2CCC[N@H+](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000543705692 516380187 /nfs/dbraw/zinc/38/01/87/516380187.db2.gz USQIYJDINMMJMV-GFCCVEGCSA-N 2 2 373.400 2.679 20 5 FFBDLP COc1cc(C[NH2+]C[C@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000543705692 516380195 /nfs/dbraw/zinc/38/01/95/516380195.db2.gz USQIYJDINMMJMV-GFCCVEGCSA-N 2 2 373.400 2.679 20 5 FFBDLP O=C(CC[NH2+]C1CCN(c2cccc[nH+]2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000548761166 517196246 /nfs/dbraw/zinc/19/62/46/517196246.db2.gz KXZQQDHAUUWODG-UHFFFAOYSA-N 2 2 369.425 2.577 20 5 FFBDLP Cn1ccnc1[C@H]([NH2+]CCCCn1cc[nH+]c1)c1cccc([N+](=O)[O-])c1 ZINC000560516480 517867019 /nfs/dbraw/zinc/86/70/19/517867019.db2.gz KBVNVQFAAKKGRV-QGZVFWFLSA-N 2 2 354.414 2.684 20 5 FFBDLP O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C[C@@]1(O)CC[N@H+](Cc2ccccc2)C1 ZINC000579376484 518651009 /nfs/dbraw/zinc/65/10/09/518651009.db2.gz SPDCCAOKOPDTNM-FPOVZHCZSA-N 2 2 367.449 2.809 20 5 FFBDLP O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000579376484 518651013 /nfs/dbraw/zinc/65/10/13/518651013.db2.gz SPDCCAOKOPDTNM-FPOVZHCZSA-N 2 2 367.449 2.809 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCc2ccccc2[C@@H]1C[NH3+] ZINC000569246109 519452859 /nfs/dbraw/zinc/45/28/59/519452859.db2.gz UUXHTTQCNSRXCB-IBGZPJMESA-N 2 2 368.437 2.790 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCc2ccccc2[C@@H]1C[NH3+] ZINC000569246109 519452863 /nfs/dbraw/zinc/45/28/63/519452863.db2.gz UUXHTTQCNSRXCB-IBGZPJMESA-N 2 2 368.437 2.790 20 5 FFBDLP C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@@H]1CCC[N@@H+]2CCCC[C@H]12 ZINC000594517962 520011660 /nfs/dbraw/zinc/01/16/60/520011660.db2.gz FFJYSNMECBNILU-ZTFGCOKTSA-N 2 2 360.458 2.918 20 5 FFBDLP C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594517962 520011665 /nfs/dbraw/zinc/01/16/65/520011665.db2.gz FFJYSNMECBNILU-ZTFGCOKTSA-N 2 2 360.458 2.918 20 5 FFBDLP CC[C@H]1C[N@H+](Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])CC[C@@H]1[NH3+] ZINC000592427615 520387572 /nfs/dbraw/zinc/38/75/72/520387572.db2.gz HWYPGLPDMPHNLI-AAEUAGOBSA-N 2 2 373.400 2.807 20 5 FFBDLP CC[C@H]1C[N@@H+](Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])CC[C@@H]1[NH3+] ZINC000592427615 520387573 /nfs/dbraw/zinc/38/75/73/520387573.db2.gz HWYPGLPDMPHNLI-AAEUAGOBSA-N 2 2 373.400 2.807 20 5 FFBDLP C[C@H](C[NH+]1CCC(C)CC1)NC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000598261414 520525228 /nfs/dbraw/zinc/52/52/28/520525228.db2.gz FFLOQQKCXAPKAV-OAHLLOKOSA-N 2 2 371.441 2.631 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccc(OCC[NH+]2CCOCC2)cc1 ZINC000601100675 520633979 /nfs/dbraw/zinc/63/39/79/520633979.db2.gz DYEWAUUSTVZRES-UHFFFAOYSA-N 2 2 371.437 2.596 20 5 FFBDLP C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@H]1CC[N@@H+]1C1CCCC1 ZINC000599072881 521016431 /nfs/dbraw/zinc/01/64/31/521016431.db2.gz BDTXCARKOZXVRH-RDTXWAMCSA-N 2 2 360.458 2.918 20 5 FFBDLP C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@H]1CC[N@H+]1C1CCCC1 ZINC000599072881 521016439 /nfs/dbraw/zinc/01/64/39/521016439.db2.gz BDTXCARKOZXVRH-RDTXWAMCSA-N 2 2 360.458 2.918 20 5 FFBDLP CC(C)C[N@H+](C)CCCN[C@H](c1[nH+]ccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000593647371 521130100 /nfs/dbraw/zinc/13/01/00/521130100.db2.gz YOHJCAHMCWTMIW-SFHVURJKSA-N 2 2 359.474 2.985 20 5 FFBDLP CC(C)C[N@@H+](C)CCCN[C@H](c1[nH+]ccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000593647371 521130110 /nfs/dbraw/zinc/13/01/10/521130110.db2.gz YOHJCAHMCWTMIW-SFHVURJKSA-N 2 2 359.474 2.985 20 5 FFBDLP Cc1ncc([N+](=O)[O-])n1CC[N@@H+](C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000602755153 521515574 /nfs/dbraw/zinc/51/55/74/521515574.db2.gz WXVDIYJMGOLUHP-UHFFFAOYSA-N 2 2 357.458 2.696 20 5 FFBDLP Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000602755153 521515579 /nfs/dbraw/zinc/51/55/79/521515579.db2.gz WXVDIYJMGOLUHP-UHFFFAOYSA-N 2 2 357.458 2.696 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH2+]C2CC[NH+](C[C@H]3CCCO3)CC2)cc1Cl ZINC000783628807 738821236 /nfs/dbraw/zinc/82/12/36/738821236.db2.gz MFNFCUWWQRNSSE-OAHLLOKOSA-N 2 2 353.850 2.981 20 5 FFBDLP [NH3+]C[C@H]([NH2+]CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])C1CCCCC1 ZINC000842476240 747613230 /nfs/dbraw/zinc/61/32/30/747613230.db2.gz JZYMULIIEUYMBE-AWEZNQCLSA-N 2 2 354.838 2.684 20 5 FFBDLP O=[N+]([O-])c1cnn(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)c1 ZINC000814223368 1006213142 /nfs/dbraw/zinc/21/31/42/1006213142.db2.gz GXTYPPAHIURXBJ-UHFFFAOYSA-N 2 2 355.442 2.737 20 5 FFBDLP O=[N+]([O-])c1cnn(C[N@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)c1 ZINC000814223368 1006213151 /nfs/dbraw/zinc/21/31/51/1006213151.db2.gz GXTYPPAHIURXBJ-UHFFFAOYSA-N 2 2 355.442 2.737 20 5 FFBDLP C[NH+](C)C1(C[NH2+]CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)CCC1 ZINC001180953631 1009911825 /nfs/dbraw/zinc/91/18/25/1009911825.db2.gz RGXPNOBRGFLXEX-UHFFFAOYSA-N 3 2 374.529 2.923 20 5 FFBDLP CC[N@H+](CCn1cc[nH+]c1)[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173192153 1012333770 /nfs/dbraw/zinc/33/37/70/1012333770.db2.gz IXTZMXLWYSKHCJ-ZDUSSCGKSA-N 2 2 350.394 2.892 20 5 FFBDLP CC[N@@H+](CCn1cc[nH+]c1)[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173192153 1012333790 /nfs/dbraw/zinc/33/37/90/1012333790.db2.gz IXTZMXLWYSKHCJ-ZDUSSCGKSA-N 2 2 350.394 2.892 20 5 FFBDLP Cc1nn(C[N@H+]2CC[C@@H](C)[C@@H](n3cc[nH+]c3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000245847793 1025560638 /nfs/dbraw/zinc/56/06/38/1025560638.db2.gz ISXOBDSLDZCVEF-ACJLOTCBSA-N 2 2 354.414 2.990 20 5 FFBDLP Cc1nn(C[N@@H+]2CC[C@@H](C)[C@@H](n3cc[nH+]c3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000245847793 1025560649 /nfs/dbraw/zinc/56/06/49/1025560649.db2.gz ISXOBDSLDZCVEF-ACJLOTCBSA-N 2 2 354.414 2.990 20 5 FFBDLP O=[N+]([O-])c1cnc(Cl)c(C(F)(F)n2c[nH+]cc2C2CC[NH2+]CC2)c1 ZINC001155057676 1028562449 /nfs/dbraw/zinc/56/24/49/1028562449.db2.gz MJFWOFCIWLMCGK-UHFFFAOYSA-N 2 2 357.748 2.904 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CC[C@H]3[NH2+]CCC[C@@H]3C2)c1F ZINC001247006817 1039575154 /nfs/dbraw/zinc/57/51/54/1039575154.db2.gz AZBBGNLDDHBLJE-GZBFAFLISA-N 2 2 351.422 2.747 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CC[C@H]3[NH2+]CCC[C@@H]3C2)c1F ZINC001247006817 1039575167 /nfs/dbraw/zinc/57/51/67/1039575167.db2.gz AZBBGNLDDHBLJE-GZBFAFLISA-N 2 2 351.422 2.747 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH+]1C[C@H]3C[NH+](Cc4cccnc4)C[C@@H]3C1)C2 ZINC001254599384 1040829089 /nfs/dbraw/zinc/82/90/89/1040829089.db2.gz YNFPGGMGPPABAK-SFHLNBCPSA-N 2 2 364.449 2.521 20 5 FFBDLP C[NH+]1CCN(c2ccc3[nH]c(Cc4cccc([N+](=O)[O-])c4)[nH+]c3c2)CC1 ZINC001250594156 1041262771 /nfs/dbraw/zinc/26/27/71/1041262771.db2.gz AHJWWWZHHMUAJK-UHFFFAOYSA-N 2 2 351.410 2.814 20 5 FFBDLP O=[N+]([O-])c1cccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2CO)c1 ZINC001308283581 1052441367 /nfs/dbraw/zinc/44/13/67/1052441367.db2.gz ZIFKFDVGXSQFAR-QUCCMNQESA-N 2 2 355.438 2.567 20 5 FFBDLP O=[N+]([O-])c1cccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2CO)c1 ZINC001308283581 1052441371 /nfs/dbraw/zinc/44/13/71/1052441371.db2.gz ZIFKFDVGXSQFAR-QUCCMNQESA-N 2 2 355.438 2.567 20 5 FFBDLP C[C@H]1C[C@@H]([NH+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[N@@H+]1C ZINC000093643728 250038158 /nfs/dbraw/zinc/03/81/58/250038158.db2.gz HMVXHNNZSXELAV-KSSFIOAISA-N 2 2 357.458 2.910 20 5 FFBDLP C[C@H]1C[C@@H]([NH+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000093643728 250038162 /nfs/dbraw/zinc/03/81/62/250038162.db2.gz HMVXHNNZSXELAV-KSSFIOAISA-N 2 2 357.458 2.910 20 5 FFBDLP C[C@H]1C[C@@H]([N@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[NH+]1C ZINC000093643728 250038165 /nfs/dbraw/zinc/03/81/65/250038165.db2.gz HMVXHNNZSXELAV-KSSFIOAISA-N 2 2 357.458 2.910 20 5 FFBDLP C[C@H]1C[C@@H]([N@@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[NH+]1C ZINC000093643728 250038169 /nfs/dbraw/zinc/03/81/69/250038169.db2.gz HMVXHNNZSXELAV-KSSFIOAISA-N 2 2 357.458 2.910 20 5 FFBDLP CC(C)[N@@H+]1CCC[C@H](CNC(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)C1 ZINC000063693666 507759589 /nfs/dbraw/zinc/75/95/89/507759589.db2.gz CJJCACFLQBULCC-OAHLLOKOSA-N 2 2 371.441 2.631 20 5 FFBDLP CC(C)[N@H+]1CCC[C@H](CNC(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)C1 ZINC000063693666 507759593 /nfs/dbraw/zinc/75/95/93/507759593.db2.gz CJJCACFLQBULCC-OAHLLOKOSA-N 2 2 371.441 2.631 20 5 FFBDLP C[C@H]1CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H]1n1cc[nH+]c1 ZINC000156455191 508423453 /nfs/dbraw/zinc/42/34/53/508423453.db2.gz DFRWGSJKLRESGA-BBRMVZONSA-N 2 2 368.397 2.924 20 5 FFBDLP C[C@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H]1n1cc[nH+]c1 ZINC000156455191 508423456 /nfs/dbraw/zinc/42/34/56/508423456.db2.gz DFRWGSJKLRESGA-BBRMVZONSA-N 2 2 368.397 2.924 20 5 FFBDLP C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000156462860 508424413 /nfs/dbraw/zinc/42/44/13/508424413.db2.gz HWBXALBKSWUOEL-ZQIUZPCESA-N 2 2 357.414 2.701 20 5 FFBDLP C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000156462860 508424416 /nfs/dbraw/zinc/42/44/16/508424416.db2.gz HWBXALBKSWUOEL-ZQIUZPCESA-N 2 2 357.414 2.701 20 5 FFBDLP COCC[N@H+](C)CCCNc1cc(C)[nH+]c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000126918585 509147054 /nfs/dbraw/zinc/14/70/54/509147054.db2.gz HLAIXPBGBUYRIK-UHFFFAOYSA-N 2 2 359.430 2.740 20 5 FFBDLP COCC[N@@H+](C)CCCNc1cc(C)[nH+]c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000126918585 509147055 /nfs/dbraw/zinc/14/70/55/509147055.db2.gz HLAIXPBGBUYRIK-UHFFFAOYSA-N 2 2 359.430 2.740 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261643138 510011254 /nfs/dbraw/zinc/01/12/54/510011254.db2.gz FUNSPMWZETVHCD-AEFFLSMTSA-N 2 2 368.437 2.516 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261643138 510011259 /nfs/dbraw/zinc/01/12/59/510011259.db2.gz FUNSPMWZETVHCD-AEFFLSMTSA-N 2 2 368.437 2.516 20 5 FFBDLP COc1ccc(NC(=O)CC[NH+]2CCC(c3[nH]cc[nH+]3)CC2)c([N+](=O)[O-])c1 ZINC000265548791 510110805 /nfs/dbraw/zinc/11/08/05/510110805.db2.gz YEOPMLAHTAWBAU-UHFFFAOYSA-N 2 2 373.413 2.535 20 5 FFBDLP CC[N@@H+]1CC[C@@H](N(C)C(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000247511426 510863879 /nfs/dbraw/zinc/86/38/79/510863879.db2.gz VSCBCKWICVFMOP-GOEBONIOSA-N 2 2 371.441 2.583 20 5 FFBDLP CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000247511426 510863880 /nfs/dbraw/zinc/86/38/80/510863880.db2.gz VSCBCKWICVFMOP-GOEBONIOSA-N 2 2 371.441 2.583 20 5 FFBDLP Cc1ccc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC(=O)N(C)C)cc1[N+](=O)[O-] ZINC000285609655 510977423 /nfs/dbraw/zinc/97/74/23/510977423.db2.gz JCXHKPJEAFWULZ-CCNLRDMRSA-N 2 2 374.485 2.637 20 5 FFBDLP Cc1ccc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC(=O)N(C)C)cc1[N+](=O)[O-] ZINC000285609655 510977425 /nfs/dbraw/zinc/97/74/25/510977425.db2.gz JCXHKPJEAFWULZ-CCNLRDMRSA-N 2 2 374.485 2.637 20 5 FFBDLP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCOCC2)c1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000284067022 511594250 /nfs/dbraw/zinc/59/42/50/511594250.db2.gz LDPLCPILNPHMBN-HNNXBMFYSA-N 2 2 370.453 2.860 20 5 FFBDLP COc1cc(C[N@@H+]2CCC[C@H](c3[nH+]ccn3C)C2)c([N+](=O)[O-])cc1OC ZINC000365818832 511667017 /nfs/dbraw/zinc/66/70/17/511667017.db2.gz HGVLLZSYIQRJHD-ZDUSSCGKSA-N 2 2 360.414 2.725 20 5 FFBDLP COc1cc(C[N@H+]2CCC[C@H](c3[nH+]ccn3C)C2)c([N+](=O)[O-])cc1OC ZINC000365818832 511667023 /nfs/dbraw/zinc/66/70/23/511667023.db2.gz HGVLLZSYIQRJHD-ZDUSSCGKSA-N 2 2 360.414 2.725 20 5 FFBDLP C[NH+]1CCC([N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])c(OC(F)F)c3)C2)CC1 ZINC000367518177 512538895 /nfs/dbraw/zinc/53/88/95/512538895.db2.gz MIPNRYWVKZOYNF-CYBMUJFWSA-N 2 2 370.400 2.777 20 5 FFBDLP C[NH+]1CCC([N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])c(OC(F)F)c3)C2)CC1 ZINC000367518177 512538899 /nfs/dbraw/zinc/53/88/99/512538899.db2.gz MIPNRYWVKZOYNF-CYBMUJFWSA-N 2 2 370.400 2.777 20 5 FFBDLP CN(Cc1cc([N+](=O)[O-])ccc1Cl)[C@H]1CC[N@@H+](C2CC[NH+](C)CC2)C1 ZINC000378427748 512754166 /nfs/dbraw/zinc/75/41/66/512754166.db2.gz JLPRGVZVFWMQOG-KRWDZBQOSA-N 2 2 366.893 2.849 20 5 FFBDLP CN(Cc1cc([N+](=O)[O-])ccc1Cl)[C@H]1CC[N@H+](C2CC[NH+](C)CC2)C1 ZINC000378427748 512754173 /nfs/dbraw/zinc/75/41/73/512754173.db2.gz JLPRGVZVFWMQOG-KRWDZBQOSA-N 2 2 366.893 2.849 20 5 FFBDLP CC(C)[NH+](CCN(C)C(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)C(C)C ZINC000450511066 513226985 /nfs/dbraw/zinc/22/69/85/513226985.db2.gz PRPQYCRGFFSBBU-UHFFFAOYSA-N 2 2 373.457 2.971 20 5 FFBDLP CC[NH+]1CCC([N@@H+]2CCCN(Cc3ccc(C)c([N+](=O)[O-])c3)CC2)CC1 ZINC000421366621 513238446 /nfs/dbraw/zinc/23/84/46/513238446.db2.gz CUVLLFROOYPXJB-UHFFFAOYSA-N 2 2 360.502 2.895 20 5 FFBDLP CC[NH+]1CCC([N@H+]2CCCN(Cc3ccc(C)c([N+](=O)[O-])c3)CC2)CC1 ZINC000421366621 513238451 /nfs/dbraw/zinc/23/84/51/513238451.db2.gz CUVLLFROOYPXJB-UHFFFAOYSA-N 2 2 360.502 2.895 20 5 FFBDLP COc1cc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH2+]3)c([N+](=O)[O-])cc1OC(F)F ZINC000435393914 513573730 /nfs/dbraw/zinc/57/37/30/513573730.db2.gz IRYKCXVPZZFPIT-FUNVUKJBSA-N 2 2 371.384 2.920 20 5 FFBDLP COc1cc(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH2+]3)c([N+](=O)[O-])cc1OC(F)F ZINC000435393914 513573736 /nfs/dbraw/zinc/57/37/36/513573736.db2.gz IRYKCXVPZZFPIT-FUNVUKJBSA-N 2 2 371.384 2.920 20 5 FFBDLP CC(C)[NH+]1CCC(Nc2cc(C[NH+]3CCOCC3)ccc2[N+](=O)[O-])CC1 ZINC000447804300 513574961 /nfs/dbraw/zinc/57/49/61/513574961.db2.gz XWDDIFVSUWUGRT-UHFFFAOYSA-N 2 2 362.474 2.712 20 5 FFBDLP CC[NH+]1CCC([N@@H+]2CCCN(Cc3ccc([N+](=O)[O-])cc3F)CC2)CC1 ZINC000420982117 514420987 /nfs/dbraw/zinc/42/09/87/514420987.db2.gz ORKXSLUAHZSFTQ-UHFFFAOYSA-N 2 2 364.465 2.726 20 5 FFBDLP CC[NH+]1CCC([N@H+]2CCCN(Cc3ccc([N+](=O)[O-])cc3F)CC2)CC1 ZINC000420982117 514420988 /nfs/dbraw/zinc/42/09/88/514420988.db2.gz ORKXSLUAHZSFTQ-UHFFFAOYSA-N 2 2 364.465 2.726 20 5 FFBDLP CC[NH+]1CCC(N2CCC[N@H+](Cc3ccc([N+](=O)[O-])cc3F)CC2)CC1 ZINC000420982117 514420990 /nfs/dbraw/zinc/42/09/90/514420990.db2.gz ORKXSLUAHZSFTQ-UHFFFAOYSA-N 2 2 364.465 2.726 20 5 FFBDLP CC[NH+]1CCC(N2CCC[N@@H+](Cc3ccc([N+](=O)[O-])cc3F)CC2)CC1 ZINC000420982117 514421000 /nfs/dbraw/zinc/42/10/00/514421000.db2.gz ORKXSLUAHZSFTQ-UHFFFAOYSA-N 2 2 364.465 2.726 20 5 FFBDLP CC[N@@H+]1CC[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)C[C@H]1C ZINC000449971134 514447639 /nfs/dbraw/zinc/44/76/39/514447639.db2.gz JSYSWFMKGGLGER-GDBMZVCRSA-N 2 2 371.441 2.725 20 5 FFBDLP CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)C[C@H]1C ZINC000449971134 514447643 /nfs/dbraw/zinc/44/76/43/514447643.db2.gz JSYSWFMKGGLGER-GDBMZVCRSA-N 2 2 371.441 2.725 20 5 FFBDLP Cc1cc(N2CC[N@H+](C3CC[NH+](C)CC3)[C@@H](C)C2)c(F)cc1[N+](=O)[O-] ZINC000461937930 514796999 /nfs/dbraw/zinc/79/69/99/514796999.db2.gz WFKPXBHKUOHDFM-AWEZNQCLSA-N 2 2 350.438 2.647 20 5 FFBDLP Cc1cc(N2CC[N@@H+](C3CC[NH+](C)CC3)[C@@H](C)C2)c(F)cc1[N+](=O)[O-] ZINC000461937930 514797008 /nfs/dbraw/zinc/79/70/08/514797008.db2.gz WFKPXBHKUOHDFM-AWEZNQCLSA-N 2 2 350.438 2.647 20 5 FFBDLP C[N@@H+]1CCCC(C)(C)[C@@H]1CNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000468483329 515380162 /nfs/dbraw/zinc/38/01/62/515380162.db2.gz JWKGTNNGYXWMLT-KRWDZBQOSA-N 2 2 371.441 2.631 20 5 FFBDLP C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000468483329 515380171 /nfs/dbraw/zinc/38/01/71/515380171.db2.gz JWKGTNNGYXWMLT-KRWDZBQOSA-N 2 2 371.441 2.631 20 5 FFBDLP C[C@H](CNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)[N@@H+]1CCCC[C@H]1C ZINC000478591620 515884329 /nfs/dbraw/zinc/88/43/29/515884329.db2.gz ONRVRCBUKKZGNW-HUUCEWRRSA-N 2 2 371.441 2.773 20 5 FFBDLP C[C@H](CNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)[N@H+]1CCCC[C@H]1C ZINC000478591620 515884341 /nfs/dbraw/zinc/88/43/41/515884341.db2.gz ONRVRCBUKKZGNW-HUUCEWRRSA-N 2 2 371.441 2.773 20 5 FFBDLP C[C@H](CNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)[N@@H+]1CCCC[C@@H]1C ZINC000478591621 515884806 /nfs/dbraw/zinc/88/48/06/515884806.db2.gz ONRVRCBUKKZGNW-LSDHHAIUSA-N 2 2 371.441 2.773 20 5 FFBDLP C[C@H](CNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)[N@H+]1CCCC[C@@H]1C ZINC000478591621 515884815 /nfs/dbraw/zinc/88/48/15/515884815.db2.gz ONRVRCBUKKZGNW-LSDHHAIUSA-N 2 2 371.441 2.773 20 5 FFBDLP COc1ccc(OCC[NH+]2CCN(c3c[nH+]ccc3C)CC2)c([N+](=O)[O-])c1 ZINC000534241584 517801011 /nfs/dbraw/zinc/80/10/11/517801011.db2.gz GQRDKSSFQNNNPM-UHFFFAOYSA-N 2 2 372.425 2.508 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000557331406 517960924 /nfs/dbraw/zinc/96/09/24/517960924.db2.gz WCSPHHGKIUKBIN-FUHWJXTLSA-N 2 2 360.458 2.838 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000557331406 517960925 /nfs/dbraw/zinc/96/09/25/517960925.db2.gz WCSPHHGKIUKBIN-FUHWJXTLSA-N 2 2 360.458 2.838 20 5 FFBDLP O=C(C[NH+]1CCC([C@H]2CC[NH2+]C2)CC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000580075541 518997092 /nfs/dbraw/zinc/99/70/92/518997092.db2.gz JOUMXQQKFLNSBP-ZDUSSCGKSA-N 2 2 366.849 2.508 20 5 FFBDLP CC(C)[N@@H+](C)C[C@H](C)Nc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000574128387 518998238 /nfs/dbraw/zinc/99/82/38/518998238.db2.gz RFIJTMXFKGGKBD-HNNXBMFYSA-N 2 2 350.463 2.568 20 5 FFBDLP CC(C)[N@H+](C)C[C@H](C)Nc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000574128387 518998242 /nfs/dbraw/zinc/99/82/42/518998242.db2.gz RFIJTMXFKGGKBD-HNNXBMFYSA-N 2 2 350.463 2.568 20 5 FFBDLP C[NH+]1CCN(c2ncccc2C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])CC1 ZINC000565844567 519160167 /nfs/dbraw/zinc/16/01/67/519160167.db2.gz XUOGPHWZDCLTGN-GOSISDBHSA-N 2 2 367.453 2.519 20 5 FFBDLP CC(C)C[NH2+]C1(CO)CCN(c2ccc3c[nH+]ccc3c2[N+](=O)[O-])CC1 ZINC000599083436 521023550 /nfs/dbraw/zinc/02/35/50/521023550.db2.gz MBBPCERUFCGIJN-UHFFFAOYSA-N 2 2 358.442 2.720 20 5 FFBDLP C[NH+](C)CCC1CC[NH+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000121636204 728633874 /nfs/dbraw/zinc/63/38/74/728633874.db2.gz RPZRWQCVSJLWTM-UHFFFAOYSA-N 2 2 368.865 2.850 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@H]2CC[N@H+](CC3CC3)C2)c1F ZINC001173177799 1012319470 /nfs/dbraw/zinc/31/94/70/1012319470.db2.gz DQPGCPGBGLDPJG-JSGCOSHPSA-N 2 2 351.422 2.747 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@H]2CC[N@@H+](CC3CC3)C2)c1F ZINC001173177799 1012319484 /nfs/dbraw/zinc/31/94/84/1012319484.db2.gz DQPGCPGBGLDPJG-JSGCOSHPSA-N 2 2 351.422 2.747 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2CC[C@@]3(CC[NH+](C)C3)C2)c1F ZINC001173192454 1012334949 /nfs/dbraw/zinc/33/49/49/1012334949.db2.gz LDFMQNNHLZSCTN-FZKQIMNGSA-N 2 2 351.422 2.701 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CC[C@@]3(CC[NH+](C)C3)C2)c1F ZINC001173192454 1012334964 /nfs/dbraw/zinc/33/49/64/1012334964.db2.gz LDFMQNNHLZSCTN-FZKQIMNGSA-N 2 2 351.422 2.701 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH+]2CC[C@@]3(CC[N@H+](C)C3)C2)c1F ZINC001173192454 1012334978 /nfs/dbraw/zinc/33/49/78/1012334978.db2.gz LDFMQNNHLZSCTN-FZKQIMNGSA-N 2 2 351.422 2.701 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH+]2CC[C@@]3(CC[N@@H+](C)C3)C2)c1F ZINC001173192454 1012335001 /nfs/dbraw/zinc/33/50/01/1012335001.db2.gz LDFMQNNHLZSCTN-FZKQIMNGSA-N 2 2 351.422 2.701 20 5 FFBDLP COc1cc([C@@H](C)[NH2+]C2CC[NH+](C[C@H]3CCCO3)CC2)cc([N+](=O)[O-])c1 ZINC000903096362 1020674499 /nfs/dbraw/zinc/67/44/99/1020674499.db2.gz BSSKFJZWTWLEJT-RDTXWAMCSA-N 2 2 363.458 2.897 20 5 FFBDLP CC[N@H+]([C@H]1CCOC1)C1CC[NH+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254603067 1040832816 /nfs/dbraw/zinc/83/28/16/1040832816.db2.gz LGPRKSNSKSWTQX-VQTJNVASSA-N 2 2 359.470 2.637 20 5 FFBDLP CC[N@@H+]([C@H]1CCOC1)C1CC[NH+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254603067 1040832828 /nfs/dbraw/zinc/83/28/28/1040832828.db2.gz LGPRKSNSKSWTQX-VQTJNVASSA-N 2 2 359.470 2.637 20 5 FFBDLP CC(C)C[C@@H](C[NH+](C)C)[NH2+][C@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001308970030 1052528712 /nfs/dbraw/zinc/52/87/12/1052528712.db2.gz ADFLKMRGGOXVLX-ZBFHGGJFSA-N 2 2 350.463 2.878 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]CCC[NH+]3CCC(O)CC3)o2)c1 ZINC001473957384 1065427460 /nfs/dbraw/zinc/42/74/60/1065427460.db2.gz IHNDGZWHSPQDRY-UHFFFAOYSA-N 2 2 359.426 2.791 20 5 FFBDLP O=[N+]([O-])c1ccc2[nH]c(C[NH2+]C3CC[NH+](CCC(F)(F)F)CC3)nc2c1 ZINC000278772554 256346458 /nfs/dbraw/zinc/34/64/58/256346458.db2.gz UVEXGHIWEDRWMB-UHFFFAOYSA-N 2 2 371.363 2.978 20 5 FFBDLP Cc1cc(NC[C@@H](C)C[NH+]2CCOCC2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000077995479 507825233 /nfs/dbraw/zinc/82/52/33/507825233.db2.gz UHSSZQOLBYHSJU-CQSZACIVSA-N 2 2 371.441 2.740 20 5 FFBDLP O=C(C[NH+]1CCC(n2cc[nH+]c2)CC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000109792458 507987259 /nfs/dbraw/zinc/98/72/59/507987259.db2.gz DNUIHQUUHMIYOW-UHFFFAOYSA-N 2 2 363.805 2.720 20 5 FFBDLP CC(C)c1ccc(C(=O)N[C@H]2CC[N@@H+](C3CC[NH+](C)CC3)C2)cc1[N+](=O)[O-] ZINC000375534634 512381288 /nfs/dbraw/zinc/38/12/88/512381288.db2.gz QEGZIPKHAJGOGD-INIZCTEOSA-N 2 2 374.485 2.617 20 5 FFBDLP CC(C)c1ccc(C(=O)N[C@H]2CC[N@H+](C3CC[NH+](C)CC3)C2)cc1[N+](=O)[O-] ZINC000375534634 512381293 /nfs/dbraw/zinc/38/12/93/512381293.db2.gz QEGZIPKHAJGOGD-INIZCTEOSA-N 2 2 374.485 2.617 20 5 FFBDLP NC(=O)c1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)c([N+](=O)[O-])c1 ZINC000118834184 508681451 /nfs/dbraw/zinc/68/14/51/508681451.db2.gz BHXCVONCIWMBBQ-INIZCTEOSA-N 2 2 374.485 2.782 20 5 FFBDLP NC(=O)c1ccc(C[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)c([N+](=O)[O-])c1 ZINC000118834184 508681452 /nfs/dbraw/zinc/68/14/52/508681452.db2.gz BHXCVONCIWMBBQ-INIZCTEOSA-N 2 2 374.485 2.782 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000129618788 508746834 /nfs/dbraw/zinc/74/68/34/508746834.db2.gz XSOBULNJHPURNJ-CXAGYDPISA-N 2 2 357.414 2.621 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000129618788 508746837 /nfs/dbraw/zinc/74/68/37/508746837.db2.gz XSOBULNJHPURNJ-CXAGYDPISA-N 2 2 357.414 2.621 20 5 FFBDLP Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000129815546 508768889 /nfs/dbraw/zinc/76/88/89/508768889.db2.gz ZZKGGFRVCDNWEX-CZUORRHYSA-N 2 2 357.414 2.621 20 5 FFBDLP Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000129815546 508768896 /nfs/dbraw/zinc/76/88/96/508768896.db2.gz ZZKGGFRVCDNWEX-CZUORRHYSA-N 2 2 357.414 2.621 20 5 FFBDLP C[C@H]1C[C@@H]([NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[N@@H+]1C1CC1 ZINC000151102586 508956814 /nfs/dbraw/zinc/95/68/14/508956814.db2.gz XPMHSOLAZYVRFZ-XJKSGUPXSA-N 2 2 355.442 2.710 20 5 FFBDLP C[C@H]1C[C@@H]([NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[N@H+]1C1CC1 ZINC000151102586 508956816 /nfs/dbraw/zinc/95/68/16/508956816.db2.gz XPMHSOLAZYVRFZ-XJKSGUPXSA-N 2 2 355.442 2.710 20 5 FFBDLP Cc1ccc([C@H](C)[NH2+]C[C@@H](O)C[N@@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000151782666 509082352 /nfs/dbraw/zinc/08/23/52/509082352.db2.gz OAUBAUOTASBPRK-OXJNMPFZSA-N 2 2 369.465 2.973 20 5 FFBDLP Cc1ccc([C@H](C)[NH2+]C[C@@H](O)C[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000151782666 509082354 /nfs/dbraw/zinc/08/23/54/509082354.db2.gz OAUBAUOTASBPRK-OXJNMPFZSA-N 2 2 369.465 2.973 20 5 FFBDLP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2c(F)cccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000249473470 509689031 /nfs/dbraw/zinc/68/90/31/509689031.db2.gz UWWDTJVYHQMCFH-WMLDXEAASA-N 2 2 353.438 2.961 20 5 FFBDLP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2c(F)cccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000249473470 509689034 /nfs/dbraw/zinc/68/90/34/509689034.db2.gz UWWDTJVYHQMCFH-WMLDXEAASA-N 2 2 353.438 2.961 20 5 FFBDLP COc1ccc(OCC[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c([N+](=O)[O-])c1 ZINC000173880970 509832232 /nfs/dbraw/zinc/83/22/32/509832232.db2.gz KKQPCZJORCGLAT-MRXNPFEDSA-N 2 2 363.458 2.790 20 5 FFBDLP COc1ccc(OCC[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c([N+](=O)[O-])c1 ZINC000173880970 509832237 /nfs/dbraw/zinc/83/22/37/509832237.db2.gz KKQPCZJORCGLAT-MRXNPFEDSA-N 2 2 363.458 2.790 20 5 FFBDLP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2c(F)cccc2[N+](=O)[O-])[C@H](C)C1 ZINC000187015573 510006870 /nfs/dbraw/zinc/00/68/70/510006870.db2.gz UWWDTJVYHQMCFH-RHSMWYFYSA-N 2 2 353.438 2.961 20 5 FFBDLP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2c(F)cccc2[N+](=O)[O-])[C@H](C)C1 ZINC000187015573 510006875 /nfs/dbraw/zinc/00/68/75/510006875.db2.gz UWWDTJVYHQMCFH-RHSMWYFYSA-N 2 2 353.438 2.961 20 5 FFBDLP Cc1c(NC(=O)CC[NH+]2CCC(c3[nH]cc[nH+]3)CC2)cccc1[N+](=O)[O-] ZINC000265531710 510101925 /nfs/dbraw/zinc/10/19/25/510101925.db2.gz VMCYREKMZYFYCC-UHFFFAOYSA-N 2 2 357.414 2.835 20 5 FFBDLP O=C(C[NH+]1CCC(c2[nH]cc[nH+]2)CC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000265555148 510113260 /nfs/dbraw/zinc/11/32/60/510113260.db2.gz ZIKGPRVPPBBUPO-UHFFFAOYSA-N 2 2 363.805 2.789 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246487536 510514883 /nfs/dbraw/zinc/51/48/83/510514883.db2.gz GYGPZIODBMOILR-ZRGWGRIASA-N 2 2 372.469 2.871 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246487536 510514892 /nfs/dbraw/zinc/51/48/92/510514892.db2.gz GYGPZIODBMOILR-ZRGWGRIASA-N 2 2 372.469 2.871 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246487536 510514901 /nfs/dbraw/zinc/51/49/01/510514901.db2.gz GYGPZIODBMOILR-ZRGWGRIASA-N 2 2 372.469 2.871 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246487536 510514905 /nfs/dbraw/zinc/51/49/05/510514905.db2.gz GYGPZIODBMOILR-ZRGWGRIASA-N 2 2 372.469 2.871 20 5 FFBDLP O=[N+]([O-])c1cc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c2c(c1)COCO2 ZINC000246909323 510739357 /nfs/dbraw/zinc/73/93/57/510739357.db2.gz RWUUKLLOYOKVMT-LIRRHRJNSA-N 2 2 373.453 2.910 20 5 FFBDLP O=[N+]([O-])c1cc(C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c2c(c1)COCO2 ZINC000246909323 510739364 /nfs/dbraw/zinc/73/93/64/510739364.db2.gz RWUUKLLOYOKVMT-LIRRHRJNSA-N 2 2 373.453 2.910 20 5 FFBDLP O=[N+]([O-])c1cc(C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c2c(c1)COCO2 ZINC000246909323 510739370 /nfs/dbraw/zinc/73/93/70/510739370.db2.gz RWUUKLLOYOKVMT-LIRRHRJNSA-N 2 2 373.453 2.910 20 5 FFBDLP O=[N+]([O-])c1cc(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c2c(c1)COCO2 ZINC000246909323 510739377 /nfs/dbraw/zinc/73/93/77/510739377.db2.gz RWUUKLLOYOKVMT-LIRRHRJNSA-N 2 2 373.453 2.910 20 5 FFBDLP CN(c1nc2ccccc2cc1[N+](=O)[O-])[C@H]1CC[N@@H+](C2CC[NH+](C)CC2)C1 ZINC000372754512 513029296 /nfs/dbraw/zinc/02/92/96/513029296.db2.gz YLYJYOKYCRTFNI-KRWDZBQOSA-N 2 2 369.469 2.748 20 5 FFBDLP CN(c1nc2ccccc2cc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CC[NH+](C)CC2)C1 ZINC000372754512 513029300 /nfs/dbraw/zinc/02/93/00/513029300.db2.gz YLYJYOKYCRTFNI-KRWDZBQOSA-N 2 2 369.469 2.748 20 5 FFBDLP CN(c1nc2ccccc2cc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C2CC[NH+](C)CC2)C1 ZINC000372754513 513029551 /nfs/dbraw/zinc/02/95/51/513029551.db2.gz YLYJYOKYCRTFNI-QGZVFWFLSA-N 2 2 369.469 2.748 20 5 FFBDLP CN(c1nc2ccccc2cc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CC[NH+](C)CC2)C1 ZINC000372754513 513029556 /nfs/dbraw/zinc/02/95/56/513029556.db2.gz YLYJYOKYCRTFNI-QGZVFWFLSA-N 2 2 369.469 2.748 20 5 FFBDLP C[C@@H]1CN(c2nccc3cc([N+](=O)[O-])ccc32)CC[N@@H+]1C1CC[NH+](C)CC1 ZINC000450423265 513188219 /nfs/dbraw/zinc/18/82/19/513188219.db2.gz WZPMYUZVYPRDRF-OAHLLOKOSA-N 2 2 369.469 2.748 20 5 FFBDLP C[C@@H]1CN(c2nccc3cc([N+](=O)[O-])ccc32)CC[N@H+]1C1CC[NH+](C)CC1 ZINC000450423265 513188222 /nfs/dbraw/zinc/18/82/22/513188222.db2.gz WZPMYUZVYPRDRF-OAHLLOKOSA-N 2 2 369.469 2.748 20 5 FFBDLP CC[NH+]1CCC([N@@H+]2CCCN(C(=O)c3cccc(C)c3[N+](=O)[O-])CC2)CC1 ZINC000422003771 513514641 /nfs/dbraw/zinc/51/46/41/513514641.db2.gz DWYAAHVMRXCEGM-UHFFFAOYSA-N 2 2 374.485 2.535 20 5 FFBDLP CC[NH+]1CCC([N@H+]2CCCN(C(=O)c3cccc(C)c3[N+](=O)[O-])CC2)CC1 ZINC000422003771 513514645 /nfs/dbraw/zinc/51/46/45/513514645.db2.gz DWYAAHVMRXCEGM-UHFFFAOYSA-N 2 2 374.485 2.535 20 5 FFBDLP O=C(NC1CC([NH+]2CCCCC2)C1)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000451355609 513697221 /nfs/dbraw/zinc/69/72/21/513697221.db2.gz BSZBMZHSCZQQBB-UHFFFAOYSA-N 2 2 369.425 2.527 20 5 FFBDLP CNc1cc(N2CCC[C@H]2C[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])nc[nH+]1 ZINC000449125363 514082422 /nfs/dbraw/zinc/08/24/22/514082422.db2.gz RWOPJXHIJQSLMM-HOCLYGCPSA-N 2 2 370.457 2.616 20 5 FFBDLP CCC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CC[NH2+]CC1 ZINC000420314040 514088760 /nfs/dbraw/zinc/08/87/60/514088760.db2.gz JRFPEROTHPNIIY-UHFFFAOYSA-N 2 2 354.838 2.651 20 5 FFBDLP CCC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CC[NH2+]CC1 ZINC000420314040 514088766 /nfs/dbraw/zinc/08/87/66/514088766.db2.gz JRFPEROTHPNIIY-UHFFFAOYSA-N 2 2 354.838 2.651 20 5 FFBDLP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]C[C@@H]2[NH2+]CCc3ccccc32)n1 ZINC000423415026 514134907 /nfs/dbraw/zinc/13/49/07/514134907.db2.gz DDFBFZZFPWSOAA-FGTMMUONSA-N 2 2 355.442 2.752 20 5 FFBDLP CCCN(CC[NH+](CC)CC)C(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000461143190 514523044 /nfs/dbraw/zinc/52/30/44/514523044.db2.gz MTONVJSCTKXKFH-UHFFFAOYSA-N 2 2 373.457 2.975 20 5 FFBDLP Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](CCC[NH3+])Cc1ccccc1 ZINC000479786767 514723669 /nfs/dbraw/zinc/72/36/69/514723669.db2.gz XLDYASXRWARJDJ-UHFFFAOYSA-N 2 2 356.426 2.693 20 5 FFBDLP Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](CCC[NH3+])Cc1ccccc1 ZINC000479786767 514723677 /nfs/dbraw/zinc/72/36/77/514723677.db2.gz XLDYASXRWARJDJ-UHFFFAOYSA-N 2 2 356.426 2.693 20 5 FFBDLP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cc(O)ccc2[N+](=O)[O-])[C@H](C)C1 ZINC000549553455 517615079 /nfs/dbraw/zinc/61/50/79/517615079.db2.gz BDTFBUOTBGYNOP-PBHICJAKSA-N 2 2 351.447 2.527 20 5 FFBDLP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2cc(O)ccc2[N+](=O)[O-])[C@H](C)C1 ZINC000549553455 517615089 /nfs/dbraw/zinc/61/50/89/517615089.db2.gz BDTFBUOTBGYNOP-PBHICJAKSA-N 2 2 351.447 2.527 20 5 FFBDLP Cn1cc[nH+]c1[C@H](N[C@H]1CCC[C@@H]([NH+](C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000560531849 517876263 /nfs/dbraw/zinc/87/62/63/517876263.db2.gz ZYPDRTHMLLVQKR-LZLYRXPVSA-N 2 2 357.458 2.880 20 5 FFBDLP O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]C2CCN(c3cccc[nH+]3)CC2)n1 ZINC000585794123 518602794 /nfs/dbraw/zinc/60/27/94/518602794.db2.gz FTMDPYXHQXSCMY-SJORKVTESA-N 2 2 370.457 2.929 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CCOCC2)cc1N[C@@H]1CCC[N@@H+]2CCCC[C@@H]12 ZINC000594604058 520050473 /nfs/dbraw/zinc/05/04/73/520050473.db2.gz XRPKZDRUBPUBKI-MJGOQNOKSA-N 2 2 374.485 2.856 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CCOCC2)cc1N[C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594604058 520050481 /nfs/dbraw/zinc/05/04/81/520050481.db2.gz XRPKZDRUBPUBKI-MJGOQNOKSA-N 2 2 374.485 2.856 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000609157511 520213964 /nfs/dbraw/zinc/21/39/64/520213964.db2.gz ZZEHTUJUMJMONH-MRXNPFEDSA-N 2 2 357.414 2.765 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000609157511 520213967 /nfs/dbraw/zinc/21/39/67/520213967.db2.gz ZZEHTUJUMJMONH-MRXNPFEDSA-N 2 2 357.414 2.765 20 5 FFBDLP O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+]C2CC[NH+]([C@@H]3CCOC3)CC2)c1 ZINC000594994389 520248249 /nfs/dbraw/zinc/24/82/49/520248249.db2.gz UMPXEEXPMVLGKM-OAHLLOKOSA-N 2 2 371.384 2.539 20 5 FFBDLP C[C@@H]1C[N@@H+](C2CCOCC2)CCN1c1cc[nH+]c2ccc([N+](=O)[O-])cc21 ZINC000601154310 520663969 /nfs/dbraw/zinc/66/39/69/520663969.db2.gz GKTYRAYOMXVWAU-CQSZACIVSA-N 2 2 356.426 2.833 20 5 FFBDLP C[C@@H]1C[N@H+](C2CCOCC2)CCN1c1cc[nH+]c2ccc([N+](=O)[O-])cc21 ZINC000601154310 520663973 /nfs/dbraw/zinc/66/39/73/520663973.db2.gz GKTYRAYOMXVWAU-CQSZACIVSA-N 2 2 356.426 2.833 20 5 FFBDLP C[C@H]1CC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@@H]1n1cc[nH+]c1 ZINC000611286000 521081258 /nfs/dbraw/zinc/08/12/58/521081258.db2.gz QJANZDUEWRHXPM-BBRMVZONSA-N 2 2 358.398 2.646 20 5 FFBDLP C[C@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@@H]1n1cc[nH+]c1 ZINC000611286000 521081263 /nfs/dbraw/zinc/08/12/63/521081263.db2.gz QJANZDUEWRHXPM-BBRMVZONSA-N 2 2 358.398 2.646 20 5 FFBDLP O=C(N[C@@H]1CCC[N@@H+]2CCCC[C@@H]12)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000594200281 521466053 /nfs/dbraw/zinc/46/60/53/521466053.db2.gz KMSQHOWGEBEMOB-CVEARBPZSA-N 2 2 369.425 2.527 20 5 FFBDLP O=C(N[C@@H]1CCC[N@H+]2CCCC[C@@H]12)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000594200281 521466071 /nfs/dbraw/zinc/46/60/71/521466071.db2.gz KMSQHOWGEBEMOB-CVEARBPZSA-N 2 2 369.425 2.527 20 5 FFBDLP O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]C1CC[NH+]([C@H]2CCOC2)CC1 ZINC000602717880 521493489 /nfs/dbraw/zinc/49/34/89/521493489.db2.gz JPIOXBWLOMFLQG-HNNXBMFYSA-N 2 2 373.375 2.957 20 5 FFBDLP C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1CC[NH+]([C@H]2CCOC2)CC1 ZINC000866393735 731054738 /nfs/dbraw/zinc/05/47/38/731054738.db2.gz QESMVWSQBXULHW-DYVFJYSZSA-N 2 2 351.422 2.508 20 5 FFBDLP O=C(C[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000842472292 747612492 /nfs/dbraw/zinc/61/24/92/747612492.db2.gz BXZYRNTVGWMGLD-AWEZNQCLSA-N 2 2 366.849 2.651 20 5 FFBDLP Cc1[nH+]ccn1-c1cc[nH+]cc1NC(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC001136818742 996783469 /nfs/dbraw/zinc/78/34/69/996783469.db2.gz HSIOUHSVOQAWSW-UHFFFAOYSA-N 2 2 355.329 2.804 20 5 FFBDLP C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777963459 1020332793 /nfs/dbraw/zinc/33/27/93/1020332793.db2.gz LRKRULMXVJTOFP-VQIMIIECSA-N 2 2 355.442 2.832 20 5 FFBDLP C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777963459 1020332802 /nfs/dbraw/zinc/33/28/02/1020332802.db2.gz LRKRULMXVJTOFP-VQIMIIECSA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777963459 1020332809 /nfs/dbraw/zinc/33/28/09/1020332809.db2.gz LRKRULMXVJTOFP-VQIMIIECSA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777963459 1020332817 /nfs/dbraw/zinc/33/28/17/1020332817.db2.gz LRKRULMXVJTOFP-VQIMIIECSA-N 2 2 355.442 2.832 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CCC[C@]3(CC[NH2+]C3)C2)c1F ZINC001246626658 1039420536 /nfs/dbraw/zinc/42/05/36/1039420536.db2.gz HGPSFURMHCPGSW-SCLBCKFNSA-N 2 2 351.422 2.749 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC[C@]3(CC[NH2+]C3)C2)c1F ZINC001246626658 1039420543 /nfs/dbraw/zinc/42/05/43/1039420543.db2.gz HGPSFURMHCPGSW-SCLBCKFNSA-N 2 2 351.422 2.749 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@H](Cc3[nH+]ccn3C)C2)c1 ZINC001326387972 1046911443 /nfs/dbraw/zinc/91/14/43/1046911443.db2.gz NHFVHWKWTPTFLO-CQSZACIVSA-N 2 2 372.425 2.570 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@H](Cc3[nH+]ccn3C)C2)c1 ZINC001326387972 1046911453 /nfs/dbraw/zinc/91/14/53/1046911453.db2.gz NHFVHWKWTPTFLO-CQSZACIVSA-N 2 2 372.425 2.570 20 5 FFBDLP Cn1cc[nH+]c1[C@@H]1CC[N@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848482204 1060117091 /nfs/dbraw/zinc/11/70/91/1060117091.db2.gz KBBQSRDLRVQGPB-CQSZACIVSA-N 2 2 352.398 2.639 20 5 FFBDLP Cn1cc[nH+]c1[C@@H]1CC[N@@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848482204 1060117104 /nfs/dbraw/zinc/11/71/04/1060117104.db2.gz KBBQSRDLRVQGPB-CQSZACIVSA-N 2 2 352.398 2.639 20 5 FFBDLP C[C@@](CO)([NH2+]Cc1ccc(-n2cc[nH+]c2)cc1)c1cccc([N+](=O)[O-])c1 ZINC001473714117 1065327310 /nfs/dbraw/zinc/32/73/10/1065327310.db2.gz LKYXGNHEPAUSQL-IBGZPJMESA-N 2 2 352.394 2.778 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@@H+]2Cc1cc([N+](=O)[O-])ccc1Cl ZINC000371294771 512312075 /nfs/dbraw/zinc/31/20/75/512312075.db2.gz MZJTZDINJUBACJ-COXVUDFISA-N 2 2 353.850 2.932 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@H+]2Cc1cc([N+](=O)[O-])ccc1Cl ZINC000371294771 512312076 /nfs/dbraw/zinc/31/20/76/512312076.db2.gz MZJTZDINJUBACJ-COXVUDFISA-N 2 2 353.850 2.932 20 5 FFBDLP Cn1cc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000092043075 508036857 /nfs/dbraw/zinc/03/68/57/508036857.db2.gz XPECEGDJMIGYJN-APWZRJJASA-N 2 2 369.469 2.911 20 5 FFBDLP Cn1cc(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000092043075 508036858 /nfs/dbraw/zinc/03/68/58/508036858.db2.gz XPECEGDJMIGYJN-APWZRJJASA-N 2 2 369.469 2.911 20 5 FFBDLP Cn1cc(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000092043075 508036860 /nfs/dbraw/zinc/03/68/60/508036860.db2.gz XPECEGDJMIGYJN-APWZRJJASA-N 2 2 369.469 2.911 20 5 FFBDLP Cn1cc(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000092043075 508036862 /nfs/dbraw/zinc/03/68/62/508036862.db2.gz XPECEGDJMIGYJN-APWZRJJASA-N 2 2 369.469 2.911 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000080959061 508117246 /nfs/dbraw/zinc/11/72/46/508117246.db2.gz MEHFGGDUIYGDQQ-AWEZNQCLSA-N 2 2 357.414 2.835 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000080959061 508117250 /nfs/dbraw/zinc/11/72/50/508117250.db2.gz MEHFGGDUIYGDQQ-AWEZNQCLSA-N 2 2 357.414 2.835 20 5 FFBDLP CC[NH+](CC)C[C@@H]1CCN(C(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)C1 ZINC000081330144 508163073 /nfs/dbraw/zinc/16/30/73/508163073.db2.gz REMPEPWQVFAOKE-HNNXBMFYSA-N 2 2 371.441 2.584 20 5 FFBDLP C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000156442258 508421550 /nfs/dbraw/zinc/42/15/50/508421550.db2.gz CBMLPFOHMIGJCE-ZQIUZPCESA-N 2 2 357.414 2.701 20 5 FFBDLP C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000156442258 508421553 /nfs/dbraw/zinc/42/15/53/508421553.db2.gz CBMLPFOHMIGJCE-ZQIUZPCESA-N 2 2 357.414 2.701 20 5 FFBDLP Cc1c(C[NH+]2CCN(CC[NH+]3[C@@H](C)CC[C@@H]3C)CC2)cccc1[N+](=O)[O-] ZINC000153920317 508677259 /nfs/dbraw/zinc/67/72/59/508677259.db2.gz XXDQTAZVUJBSKR-IRXDYDNUSA-N 2 2 360.502 2.894 20 5 FFBDLP CC(C)C[N@@H+]1CCO[C@@H](C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000248035722 509220177 /nfs/dbraw/zinc/22/01/77/509220177.db2.gz RNYAJKLQHSFFLD-RBUKOAKNSA-N 2 2 361.486 2.862 20 5 FFBDLP CC(C)C[N@H+]1CCO[C@@H](C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000248035722 509220181 /nfs/dbraw/zinc/22/01/81/509220181.db2.gz RNYAJKLQHSFFLD-RBUKOAKNSA-N 2 2 361.486 2.862 20 5 FFBDLP C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261634034 510007538 /nfs/dbraw/zinc/00/75/38/510007538.db2.gz FCILXLGQGXERAA-GMBSWORKSA-N 2 2 368.437 2.596 20 5 FFBDLP C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261634034 510007547 /nfs/dbraw/zinc/00/75/47/510007547.db2.gz FCILXLGQGXERAA-GMBSWORKSA-N 2 2 368.437 2.596 20 5 FFBDLP C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000246192175 510352415 /nfs/dbraw/zinc/35/24/15/510352415.db2.gz UIOHIAQFRDTFHP-STQMWFEESA-N 2 2 368.865 2.849 20 5 FFBDLP C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000246192175 510352424 /nfs/dbraw/zinc/35/24/24/510352424.db2.gz UIOHIAQFRDTFHP-STQMWFEESA-N 2 2 368.865 2.849 20 5 FFBDLP C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[NH+](C)C[C@H]1CCC[N@H+](C)C1 ZINC000246192175 510352435 /nfs/dbraw/zinc/35/24/35/510352435.db2.gz UIOHIAQFRDTFHP-STQMWFEESA-N 2 2 368.865 2.849 20 5 FFBDLP C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[NH+](C)C[C@H]1CCC[N@@H+](C)C1 ZINC000246192175 510352444 /nfs/dbraw/zinc/35/24/44/510352444.db2.gz UIOHIAQFRDTFHP-STQMWFEESA-N 2 2 368.865 2.849 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C)C2)cccc1[N+](=O)[O-] ZINC000246710724 510629323 /nfs/dbraw/zinc/62/93/23/510629323.db2.gz FFFILKRZSWGHFJ-RLFYNMQTSA-N 2 2 360.458 2.646 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C)C2)cccc1[N+](=O)[O-] ZINC000246710724 510629330 /nfs/dbraw/zinc/62/93/30/510629330.db2.gz FFFILKRZSWGHFJ-RLFYNMQTSA-N 2 2 360.458 2.646 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)cccc1[N+](=O)[O-] ZINC000246710724 510629339 /nfs/dbraw/zinc/62/93/39/510629339.db2.gz FFFILKRZSWGHFJ-RLFYNMQTSA-N 2 2 360.458 2.646 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)cccc1[N+](=O)[O-] ZINC000246710724 510629345 /nfs/dbraw/zinc/62/93/45/510629345.db2.gz FFFILKRZSWGHFJ-RLFYNMQTSA-N 2 2 360.458 2.646 20 5 FFBDLP Cc1[nH+]c2ccccc2n1C[C@@H]1CCC[N@@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000270126147 510685441 /nfs/dbraw/zinc/68/54/41/510685441.db2.gz GJKQUNLTFUEBGZ-HNNXBMFYSA-N 2 2 354.414 2.614 20 5 FFBDLP Cc1[nH+]c2ccccc2n1C[C@@H]1CCC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000270126147 510685448 /nfs/dbraw/zinc/68/54/48/510685448.db2.gz GJKQUNLTFUEBGZ-HNNXBMFYSA-N 2 2 354.414 2.614 20 5 FFBDLP C[C@@H]1CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1n1cc[nH+]c1 ZINC000246907321 510738923 /nfs/dbraw/zinc/73/89/23/510738923.db2.gz BLEBKEBRXYASDH-CZUORRHYSA-N 2 2 368.397 2.924 20 5 FFBDLP C[C@@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1n1cc[nH+]c1 ZINC000246907321 510738928 /nfs/dbraw/zinc/73/89/28/510738928.db2.gz BLEBKEBRXYASDH-CZUORRHYSA-N 2 2 368.397 2.924 20 5 FFBDLP COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CC[N@H+](Cc2ccccn2)C[C@H]1C ZINC000246935940 510754712 /nfs/dbraw/zinc/75/47/12/510754712.db2.gz HIGNNOBBQDMSSD-DNVCBOLYSA-N 2 2 370.453 2.999 20 5 FFBDLP COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccn2)C[C@H]1C ZINC000246935940 510754714 /nfs/dbraw/zinc/75/47/14/510754714.db2.gz HIGNNOBBQDMSSD-DNVCBOLYSA-N 2 2 370.453 2.999 20 5 FFBDLP O=C(C[NH+]1CCC(c2c[nH]c[nH+]2)CC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000374209933 512708894 /nfs/dbraw/zinc/70/88/94/512708894.db2.gz RYMUWPUKEOKWAK-UHFFFAOYSA-N 2 2 363.805 2.789 20 5 FFBDLP Cn1cc[nH+]c1[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000368137234 512817715 /nfs/dbraw/zinc/81/77/15/512817715.db2.gz YKUHLSSWYYGSMP-NSHDSACASA-N 2 2 352.341 2.919 20 5 FFBDLP Cn1cc[nH+]c1[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000368137234 512817719 /nfs/dbraw/zinc/81/77/19/512817719.db2.gz YKUHLSSWYYGSMP-NSHDSACASA-N 2 2 352.341 2.919 20 5 FFBDLP C[C@@H](Nc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-])C(C)(C)C[NH+](C)C ZINC000447813299 513577813 /nfs/dbraw/zinc/57/78/13/513577813.db2.gz VGHQLWNZZOHFTI-OAHLLOKOSA-N 2 2 364.490 2.815 20 5 FFBDLP CCn1cc[nH+]c1CN(Cc1cccc([N+](=O)[O-])c1)[C@@H]1CC12CC[NH2+]CC2 ZINC000435428138 513581414 /nfs/dbraw/zinc/58/14/14/513581414.db2.gz QQUOKMTYFMUUAI-GOSISDBHSA-N 2 2 369.469 2.956 20 5 FFBDLP CCn1ccnc1C[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1CC12CC[NH2+]CC2 ZINC000435428138 513581420 /nfs/dbraw/zinc/58/14/20/513581420.db2.gz QQUOKMTYFMUUAI-GOSISDBHSA-N 2 2 369.469 2.956 20 5 FFBDLP CCn1ccnc1C[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1CC12CC[NH2+]CC2 ZINC000435428138 513581425 /nfs/dbraw/zinc/58/14/25/513581425.db2.gz QQUOKMTYFMUUAI-GOSISDBHSA-N 2 2 369.469 2.956 20 5 FFBDLP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CC[NH+](C2CC[NH+](C)CC2)CC1 ZINC000449108424 514075615 /nfs/dbraw/zinc/07/56/15/514075615.db2.gz QPBQUUITQLMQGZ-INIZCTEOSA-N 3 2 360.502 2.674 20 5 FFBDLP CC[NH+]1CCC([N@@H+]2CCCN(Cc3c(F)cccc3[N+](=O)[O-])CC2)CC1 ZINC000420982042 514420589 /nfs/dbraw/zinc/42/05/89/514420589.db2.gz OKDMCDLRHUWICW-UHFFFAOYSA-N 2 2 364.465 2.726 20 5 FFBDLP CC[NH+]1CCC([N@H+]2CCCN(Cc3c(F)cccc3[N+](=O)[O-])CC2)CC1 ZINC000420982042 514420594 /nfs/dbraw/zinc/42/05/94/514420594.db2.gz OKDMCDLRHUWICW-UHFFFAOYSA-N 2 2 364.465 2.726 20 5 FFBDLP CC[NH+]1CCC(N2CCC[N@H+](Cc3c(F)cccc3[N+](=O)[O-])CC2)CC1 ZINC000420982042 514420598 /nfs/dbraw/zinc/42/05/98/514420598.db2.gz OKDMCDLRHUWICW-UHFFFAOYSA-N 2 2 364.465 2.726 20 5 FFBDLP CC[NH+]1CCC(N2CCC[N@@H+](Cc3c(F)cccc3[N+](=O)[O-])CC2)CC1 ZINC000420982042 514420602 /nfs/dbraw/zinc/42/06/02/514420602.db2.gz OKDMCDLRHUWICW-UHFFFAOYSA-N 2 2 364.465 2.726 20 5 FFBDLP CC[NH+]1CCC([N@@H+]2CCCN(Cc3csc([N+](=O)[O-])c3)CC2)CC1 ZINC000420986769 514425633 /nfs/dbraw/zinc/42/56/33/514425633.db2.gz YWFMZECFVPZGRF-UHFFFAOYSA-N 2 2 352.504 2.648 20 5 FFBDLP CC[NH+]1CCC([N@H+]2CCCN(Cc3csc([N+](=O)[O-])c3)CC2)CC1 ZINC000420986769 514425641 /nfs/dbraw/zinc/42/56/41/514425641.db2.gz YWFMZECFVPZGRF-UHFFFAOYSA-N 2 2 352.504 2.648 20 5 FFBDLP CC[NH+]1CCC(N2CCC[N@H+](Cc3csc([N+](=O)[O-])c3)CC2)CC1 ZINC000420986769 514425646 /nfs/dbraw/zinc/42/56/46/514425646.db2.gz YWFMZECFVPZGRF-UHFFFAOYSA-N 2 2 352.504 2.648 20 5 FFBDLP CC[NH+]1CCC(N2CCC[N@@H+](Cc3csc([N+](=O)[O-])c3)CC2)CC1 ZINC000420986769 514425652 /nfs/dbraw/zinc/42/56/52/514425652.db2.gz YWFMZECFVPZGRF-UHFFFAOYSA-N 2 2 352.504 2.648 20 5 FFBDLP COc1ccc(OCC[N@@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)c([N+](=O)[O-])c1 ZINC000472488141 515289447 /nfs/dbraw/zinc/28/94/47/515289447.db2.gz WPIPMWNMYMCHDW-INIZCTEOSA-N 2 2 363.458 2.646 20 5 FFBDLP COc1ccc(OCC[N@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)c([N+](=O)[O-])c1 ZINC000472488141 515289456 /nfs/dbraw/zinc/28/94/56/515289456.db2.gz WPIPMWNMYMCHDW-INIZCTEOSA-N 2 2 363.458 2.646 20 5 FFBDLP COc1ccc(OCC[NH+]2CC[C@@H](C[N@H+](C)CC3CC3)C2)c([N+](=O)[O-])c1 ZINC000472488141 515289466 /nfs/dbraw/zinc/28/94/66/515289466.db2.gz WPIPMWNMYMCHDW-INIZCTEOSA-N 2 2 363.458 2.646 20 5 FFBDLP COc1ccc(OCC[NH+]2CC[C@@H](C[N@@H+](C)CC3CC3)C2)c([N+](=O)[O-])c1 ZINC000472488141 515289477 /nfs/dbraw/zinc/28/94/77/515289477.db2.gz WPIPMWNMYMCHDW-INIZCTEOSA-N 2 2 363.458 2.646 20 5 FFBDLP O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]CCc2cn3ccccc3[nH+]2)n1 ZINC000472604619 515334307 /nfs/dbraw/zinc/33/43/07/515334307.db2.gz WEQGFHYQUJTJLB-HOTGVXAUSA-N 2 2 354.414 2.755 20 5 FFBDLP C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@H](c2[nH+]ccn2C)C1 ZINC000536068649 516618439 /nfs/dbraw/zinc/61/84/39/516618439.db2.gz JUBXDXLFSWZBIR-OCCSQVGLSA-N 2 2 368.397 2.929 20 5 FFBDLP C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H](c2[nH+]ccn2C)C1 ZINC000536068649 516618449 /nfs/dbraw/zinc/61/84/49/516618449.db2.gz JUBXDXLFSWZBIR-OCCSQVGLSA-N 2 2 368.397 2.929 20 5 FFBDLP C[C@H]1C[N@@H+](C2CC2)C[C@H]1[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000540625407 516645253 /nfs/dbraw/zinc/64/52/53/516645253.db2.gz FDZXUHYMWHJCHS-SCLBCKFNSA-N 2 2 355.442 2.568 20 5 FFBDLP C[C@H]1C[N@H+](C2CC2)C[C@H]1[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000540625407 516645257 /nfs/dbraw/zinc/64/52/57/516645257.db2.gz FDZXUHYMWHJCHS-SCLBCKFNSA-N 2 2 355.442 2.568 20 5 FFBDLP CC[N@@H+]1CC[C@@H](N(C)C(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)C[C@H]1C ZINC000524879798 516857116 /nfs/dbraw/zinc/85/71/16/516857116.db2.gz UGVOEKONXGITFT-GDBMZVCRSA-N 2 2 371.441 2.725 20 5 FFBDLP CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)C[C@H]1C ZINC000524879798 516857125 /nfs/dbraw/zinc/85/71/25/516857125.db2.gz UGVOEKONXGITFT-GDBMZVCRSA-N 2 2 371.441 2.725 20 5 FFBDLP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cc(O)ccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000549553457 517614551 /nfs/dbraw/zinc/61/45/51/517614551.db2.gz BDTFBUOTBGYNOP-WMLDXEAASA-N 2 2 351.447 2.527 20 5 FFBDLP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2cc(O)ccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000549553457 517614558 /nfs/dbraw/zinc/61/45/58/517614558.db2.gz BDTFBUOTBGYNOP-WMLDXEAASA-N 2 2 351.447 2.527 20 5 FFBDLP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]C2CCN(c3cccc[nH+]3)CC2)n1 ZINC000585794120 518602138 /nfs/dbraw/zinc/60/21/38/518602138.db2.gz FTMDPYXHQXSCMY-DLBZAZTESA-N 2 2 370.457 2.929 20 5 FFBDLP CN(C/C=C\c1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](C2CC[NH+](C)CC2)C1 ZINC000589195500 518947868 /nfs/dbraw/zinc/94/78/68/518947868.db2.gz APUHAJUTOSPKKB-WPGJWXSHSA-N 2 2 358.486 2.708 20 5 FFBDLP CN(C/C=C\c1ccccc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CC[NH+](C)CC2)C1 ZINC000589195500 518947871 /nfs/dbraw/zinc/94/78/71/518947871.db2.gz APUHAJUTOSPKKB-WPGJWXSHSA-N 2 2 358.486 2.708 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000589505979 519020156 /nfs/dbraw/zinc/02/01/56/519020156.db2.gz SVUPVLKBWIWCPX-MAUKXSAKSA-N 2 2 373.453 2.830 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000589505979 519020163 /nfs/dbraw/zinc/02/01/63/519020163.db2.gz SVUPVLKBWIWCPX-MAUKXSAKSA-N 2 2 373.453 2.830 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000589505979 519020167 /nfs/dbraw/zinc/02/01/67/519020167.db2.gz SVUPVLKBWIWCPX-MAUKXSAKSA-N 2 2 373.453 2.830 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCC[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000595003043 520250810 /nfs/dbraw/zinc/25/08/10/520250810.db2.gz BMEQGJBVWQLXHP-KKUMJFAQSA-N 2 2 351.447 2.753 20 5 FFBDLP [NH3+]CCC[N@H+](Cc1ccccc1)Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000592432441 520387692 /nfs/dbraw/zinc/38/76/92/520387692.db2.gz JCKJWAULZGMNCZ-UHFFFAOYSA-N 2 2 357.410 2.717 20 5 FFBDLP [NH3+]CCC[N@@H+](Cc1ccccc1)Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000592432441 520387696 /nfs/dbraw/zinc/38/76/96/520387696.db2.gz JCKJWAULZGMNCZ-UHFFFAOYSA-N 2 2 357.410 2.717 20 5 FFBDLP Cc1cc(N[C@@H](C)C2CC[NH+](C)CC2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000611132485 521002379 /nfs/dbraw/zinc/00/23/79/521002379.db2.gz VEQHIHDVDLOZFE-AWEZNQCLSA-N 2 2 355.442 2.924 20 5 FFBDLP C[C@@H]1CC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@H]1n1cc[nH+]c1 ZINC000611286002 521082028 /nfs/dbraw/zinc/08/20/28/521082028.db2.gz QJANZDUEWRHXPM-CZUORRHYSA-N 2 2 358.398 2.646 20 5 FFBDLP C[C@@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@H]1n1cc[nH+]c1 ZINC000611286002 521082033 /nfs/dbraw/zinc/08/20/33/521082033.db2.gz QJANZDUEWRHXPM-CZUORRHYSA-N 2 2 358.398 2.646 20 5 FFBDLP CC(C)C[N@H+](C)CCCN[C@@H](c1[nH+]ccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000593647370 521129976 /nfs/dbraw/zinc/12/99/76/521129976.db2.gz YOHJCAHMCWTMIW-GOSISDBHSA-N 2 2 359.474 2.985 20 5 FFBDLP CC(C)C[N@@H+](C)CCCN[C@@H](c1[nH+]ccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000593647370 521129982 /nfs/dbraw/zinc/12/99/82/521129982.db2.gz YOHJCAHMCWTMIW-GOSISDBHSA-N 2 2 359.474 2.985 20 5 FFBDLP C[N@H+](CCCN1CC[NH+](C)CC1)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602656763 521463345 /nfs/dbraw/zinc/46/33/45/521463345.db2.gz MZEQSLZLTHRHHH-UHFFFAOYSA-N 2 2 374.407 2.683 20 5 FFBDLP C[N@@H+](CCCN1CC[NH+](C)CC1)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602656763 521463362 /nfs/dbraw/zinc/46/33/62/521463362.db2.gz MZEQSLZLTHRHHH-UHFFFAOYSA-N 2 2 374.407 2.683 20 5 FFBDLP C[NH2+]CCC1CC[NH+]([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000262000539 729657305 /nfs/dbraw/zinc/65/73/05/729657305.db2.gz PPTIKHUZDYGRRV-LBPRGKRZSA-N 2 2 368.865 2.897 20 5 FFBDLP C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1CC[NH+]([C@@H]2CCOC2)CC1 ZINC000866393737 731054638 /nfs/dbraw/zinc/05/46/38/731054638.db2.gz QESMVWSQBXULHW-SUMWQHHRSA-N 2 2 351.422 2.508 20 5 FFBDLP C[C@H]([NH3+])C1CC[NH+]([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000843348372 747814507 /nfs/dbraw/zinc/81/45/07/747814507.db2.gz DWXAWPKTGQQVST-QWRGUYRKSA-N 2 2 354.838 2.634 20 5 FFBDLP O=[N+]([O-])c1cnn(C2CC([NH2+][C@H](Cn3cc[nH+]c3)c3ccccc3)C2)c1 ZINC000895705470 970862802 /nfs/dbraw/zinc/86/28/02/970862802.db2.gz BUBOIRQLLCMYIM-LEOMRAHMSA-N 2 2 352.398 2.722 20 5 FFBDLP C[C@@H]1C[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CCN1c1cc[nH+]cc1 ZINC000880263397 1015793251 /nfs/dbraw/zinc/79/32/51/1015793251.db2.gz XLAGUNHLIPWJEX-CYBMUJFWSA-N 2 2 353.382 2.842 20 5 FFBDLP C[C@@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CCN1c1cc[nH+]cc1 ZINC000880263397 1015793256 /nfs/dbraw/zinc/79/32/56/1015793256.db2.gz XLAGUNHLIPWJEX-CYBMUJFWSA-N 2 2 353.382 2.842 20 5 FFBDLP O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@H](Cn2cc[nH+]c2)c2ccccc2)c1 ZINC001197265476 1004147590 /nfs/dbraw/zinc/14/75/90/1004147590.db2.gz SJEKDHVXCOSTDL-RTBURBONSA-N 2 2 352.394 2.856 20 5 FFBDLP C[NH+](C)Cc1ccc(C[N@H+](C)CC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000859214268 1008488548 /nfs/dbraw/zinc/48/85/48/1008488548.db2.gz HMVMMAAQMCKOMS-UHFFFAOYSA-N 2 2 356.426 2.727 20 5 FFBDLP C[NH+](C)Cc1ccc(C[N@@H+](C)CC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000859214268 1008488552 /nfs/dbraw/zinc/48/85/52/1008488552.db2.gz HMVMMAAQMCKOMS-UHFFFAOYSA-N 2 2 356.426 2.727 20 5 FFBDLP CC[NH+](CC)CC1CC[NH+](Cn2c(=O)oc3cccc([N+](=O)[O-])c32)CC1 ZINC000794633600 1010447625 /nfs/dbraw/zinc/44/76/25/1010447625.db2.gz VRCIOPIGJHUAKG-UHFFFAOYSA-N 2 2 362.430 2.514 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2CC[C@]3(CC[NH+](C)C3)C2)c1F ZINC001173192452 1012334479 /nfs/dbraw/zinc/33/44/79/1012334479.db2.gz LDFMQNNHLZSCTN-ACJLOTCBSA-N 2 2 351.422 2.701 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CC[C@]3(CC[NH+](C)C3)C2)c1F ZINC001173192452 1012334500 /nfs/dbraw/zinc/33/45/00/1012334500.db2.gz LDFMQNNHLZSCTN-ACJLOTCBSA-N 2 2 351.422 2.701 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH+]2CC[C@]3(CC[N@H+](C)C3)C2)c1F ZINC001173192452 1012334513 /nfs/dbraw/zinc/33/45/13/1012334513.db2.gz LDFMQNNHLZSCTN-ACJLOTCBSA-N 2 2 351.422 2.701 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH+]2CC[C@]3(CC[N@@H+](C)C3)C2)c1F ZINC001173192452 1012334524 /nfs/dbraw/zinc/33/45/24/1012334524.db2.gz LDFMQNNHLZSCTN-ACJLOTCBSA-N 2 2 351.422 2.701 20 5 FFBDLP COc1cc[nH+]c(N2CC[NH+]([C@@H](C)Cc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC001173237744 1012386437 /nfs/dbraw/zinc/38/64/37/1012386437.db2.gz LULHKVFJUKVXKU-HNNXBMFYSA-N 2 2 356.426 2.752 20 5 FFBDLP Cn1cc[nH+]c1CCNC(=O)[C@@H]([NH3+])Cc1c2ccccc2cc2ccccc21 ZINC001157420861 1029580853 /nfs/dbraw/zinc/58/08/53/1029580853.db2.gz BMNZVFRMYCAQCC-NRFANRHFSA-N 2 2 372.472 2.955 20 5 FFBDLP O=C(CC[N@@H+]1CCCC[C@@H]1[C@@H]1CCC[NH2+]1)Nc1cc([N+](=O)[O-])ccc1F ZINC000842473106 1030748332 /nfs/dbraw/zinc/74/83/32/1030748332.db2.gz PSORPNPXYLGNQQ-DOTOQJQBSA-N 2 2 364.421 2.669 20 5 FFBDLP O=C(CC[N@H+]1CCCC[C@@H]1[C@@H]1CCC[NH2+]1)Nc1cc([N+](=O)[O-])ccc1F ZINC000842473106 1030748339 /nfs/dbraw/zinc/74/83/39/1030748339.db2.gz PSORPNPXYLGNQQ-DOTOQJQBSA-N 2 2 364.421 2.669 20 5 FFBDLP C[N@H+](C1CCOCC1)C1CC[NH+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254603812 1040831549 /nfs/dbraw/zinc/83/15/49/1040831549.db2.gz QXPRMFBWBFWLLB-HXUWFJFHSA-N 2 2 359.470 2.637 20 5 FFBDLP C[N@@H+](C1CCOCC1)C1CC[NH+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254603812 1040831566 /nfs/dbraw/zinc/83/15/66/1040831566.db2.gz QXPRMFBWBFWLLB-HXUWFJFHSA-N 2 2 359.470 2.637 20 5 FFBDLP Cn1cc[nH+]c1C[C@@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC001336704073 1054151240 /nfs/dbraw/zinc/15/12/40/1054151240.db2.gz NTLLCVDYTYMQRJ-RTBURBONSA-N 2 2 366.421 2.935 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH+]1CCC(n2cc[nH+]c2)CC1 ZINC000109795566 507988014 /nfs/dbraw/zinc/98/80/14/507988014.db2.gz RRPONGGKYLLOEI-UHFFFAOYSA-N 2 2 357.414 2.765 20 5 FFBDLP C[C@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000116396641 508506157 /nfs/dbraw/zinc/50/61/57/508506157.db2.gz GNYSRCXXHFZIAQ-XJKSGUPXSA-N 2 2 350.463 2.878 20 5 FFBDLP C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCN(C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1 ZINC000119744789 508854902 /nfs/dbraw/zinc/85/49/02/508854902.db2.gz RWBKDWQAKXAOCG-RYVRDWITSA-N 2 2 358.486 2.899 20 5 FFBDLP C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCN(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)CC1 ZINC000119744789 508854906 /nfs/dbraw/zinc/85/49/06/508854906.db2.gz RWBKDWQAKXAOCG-RYVRDWITSA-N 2 2 358.486 2.899 20 5 FFBDLP C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[NH+](C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1 ZINC000119744789 508854908 /nfs/dbraw/zinc/85/49/08/508854908.db2.gz RWBKDWQAKXAOCG-RYVRDWITSA-N 2 2 358.486 2.899 20 5 FFBDLP C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[NH+](C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)CC1 ZINC000119744789 508854912 /nfs/dbraw/zinc/85/49/12/508854912.db2.gz RWBKDWQAKXAOCG-RYVRDWITSA-N 2 2 358.486 2.899 20 5 FFBDLP O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c([N+](=O)[O-])c1 ZINC000249035609 509578149 /nfs/dbraw/zinc/57/81/49/509578149.db2.gz SNHQXWXIHBPPGF-SUMWQHHRSA-N 2 2 360.414 2.952 20 5 FFBDLP O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c([N+](=O)[O-])c1 ZINC000249035609 509578157 /nfs/dbraw/zinc/57/81/57/509578157.db2.gz SNHQXWXIHBPPGF-SUMWQHHRSA-N 2 2 360.414 2.952 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c([N+](=O)[O-])c1 ZINC000249035609 509578164 /nfs/dbraw/zinc/57/81/64/509578164.db2.gz SNHQXWXIHBPPGF-SUMWQHHRSA-N 2 2 360.414 2.952 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c([N+](=O)[O-])c1 ZINC000249035609 509578171 /nfs/dbraw/zinc/57/81/71/509578171.db2.gz SNHQXWXIHBPPGF-SUMWQHHRSA-N 2 2 360.414 2.952 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCN(CC[NH+]2[C@H](C)CC[C@H]2C)CC1 ZINC000183308967 509708992 /nfs/dbraw/zinc/70/89/92/509708992.db2.gz LVLOGTMOOASPDW-QZTJIDSGSA-N 2 2 360.502 2.894 20 5 FFBDLP C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000246172481 510338816 /nfs/dbraw/zinc/33/88/16/510338816.db2.gz PVZGBFMRTKXPRU-KBPBESRZSA-N 2 2 359.430 2.979 20 5 FFBDLP C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000246172481 510338823 /nfs/dbraw/zinc/33/88/23/510338823.db2.gz PVZGBFMRTKXPRU-KBPBESRZSA-N 2 2 359.430 2.979 20 5 FFBDLP C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+](C)C[C@H]1CCC[N@H+](C)C1 ZINC000246172481 510338829 /nfs/dbraw/zinc/33/88/29/510338829.db2.gz PVZGBFMRTKXPRU-KBPBESRZSA-N 2 2 359.430 2.979 20 5 FFBDLP C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+](C)C[C@H]1CCC[N@@H+](C)C1 ZINC000246172481 510338834 /nfs/dbraw/zinc/33/88/34/510338834.db2.gz PVZGBFMRTKXPRU-KBPBESRZSA-N 2 2 359.430 2.979 20 5 FFBDLP C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246985627 510782172 /nfs/dbraw/zinc/78/21/72/510782172.db2.gz WCDXYMFMJJEDRK-RVKKMQEKSA-N 2 2 372.469 2.871 20 5 FFBDLP C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246985627 510782178 /nfs/dbraw/zinc/78/21/78/510782178.db2.gz WCDXYMFMJJEDRK-RVKKMQEKSA-N 2 2 372.469 2.871 20 5 FFBDLP C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246985627 510782182 /nfs/dbraw/zinc/78/21/82/510782182.db2.gz WCDXYMFMJJEDRK-RVKKMQEKSA-N 2 2 372.469 2.871 20 5 FFBDLP C[N@@H+]1CC[C@H]([NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000283662566 511453210 /nfs/dbraw/zinc/45/32/10/511453210.db2.gz BZZAAGJLLMQGIK-PXNSSMCTSA-N 2 2 368.437 2.958 20 5 FFBDLP C[N@H+]1CC[C@H]([NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000283662566 511453214 /nfs/dbraw/zinc/45/32/14/511453214.db2.gz BZZAAGJLLMQGIK-PXNSSMCTSA-N 2 2 368.437 2.958 20 5 FFBDLP COc1cc(C[N@H+](C)CC(C)(C)C[NH3+])c([N+](=O)[O-])cc1OCC(F)F ZINC000435369877 513567885 /nfs/dbraw/zinc/56/78/85/513567885.db2.gz GHTLWACJYWULCV-UHFFFAOYSA-N 2 2 361.389 2.664 20 5 FFBDLP COc1cc(C[N@@H+](C)CC(C)(C)C[NH3+])c([N+](=O)[O-])cc1OCC(F)F ZINC000435369877 513567892 /nfs/dbraw/zinc/56/78/92/513567892.db2.gz GHTLWACJYWULCV-UHFFFAOYSA-N 2 2 361.389 2.664 20 5 FFBDLP C[C@@H](CNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-])C[NH+]1CCCC1 ZINC000447814606 513580341 /nfs/dbraw/zinc/58/03/41/513580341.db2.gz ZRRVFDXDJGRCOC-INIZCTEOSA-N 2 2 362.474 2.571 20 5 FFBDLP CN(C)c1[nH+]cc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)n1C ZINC000419731792 513900051 /nfs/dbraw/zinc/90/00/51/513900051.db2.gz RMBGDMBIJNFFPV-UHFFFAOYSA-N 2 2 357.336 2.703 20 5 FFBDLP CCC[N@H+](CC)C[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000451859746 514026760 /nfs/dbraw/zinc/02/67/60/514026760.db2.gz AKTHWIBGIMYSPT-CQSZACIVSA-N 2 2 359.430 2.631 20 5 FFBDLP CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000451859746 514026768 /nfs/dbraw/zinc/02/67/68/514026768.db2.gz AKTHWIBGIMYSPT-CQSZACIVSA-N 2 2 359.430 2.631 20 5 FFBDLP C[C@@H](Cc1ccccc1[N+](=O)[O-])Nc1ccc(N2CC[NH+](C)CC2)c[nH+]1 ZINC000449086717 514066607 /nfs/dbraw/zinc/06/66/07/514066607.db2.gz SMZLOPURXAQVNA-HNNXBMFYSA-N 2 2 355.442 2.785 20 5 FFBDLP CC[NH2+]CC1CC[NH+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000420286163 514072858 /nfs/dbraw/zinc/07/28/58/514072858.db2.gz FSFNJZJUBQXXHA-UHFFFAOYSA-N 2 2 354.838 2.508 20 5 FFBDLP CN(c1ccccc1)c1ccc(C[NH2+]C[C@@H]2C[NH2+]CCCO2)cc1[N+](=O)[O-] ZINC000415046226 514414053 /nfs/dbraw/zinc/41/40/53/514414053.db2.gz UQTGWKKRDKGROT-SFHVURJKSA-N 2 2 370.453 2.831 20 5 FFBDLP COc1cc(C[N@H+](CCC[NH3+])Cc2ccccc2)c([N+](=O)[O-])cc1OC ZINC000479960779 514790984 /nfs/dbraw/zinc/79/09/84/514790984.db2.gz TYXZADMINNDGLC-UHFFFAOYSA-N 2 2 359.426 2.963 20 5 FFBDLP COc1cc(C[N@@H+](CCC[NH3+])Cc2ccccc2)c([N+](=O)[O-])cc1OC ZINC000479960779 514790990 /nfs/dbraw/zinc/79/09/90/514790990.db2.gz TYXZADMINNDGLC-UHFFFAOYSA-N 2 2 359.426 2.963 20 5 FFBDLP COc1cc(CNc2ccc(Cn3cc[nH+]c3)c[nH+]2)cc([N+](=O)[O-])c1O ZINC000508474745 514791416 /nfs/dbraw/zinc/79/14/16/514791416.db2.gz QURUUDCSMXWHEY-UHFFFAOYSA-N 2 2 355.354 2.561 20 5 FFBDLP Cc1cc(NCC2(C)CC[NH+](C)CC2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000503302464 514994220 /nfs/dbraw/zinc/99/42/20/514994220.db2.gz NAORYXUDWGBIHG-UHFFFAOYSA-N 2 2 355.442 2.926 20 5 FFBDLP C[C@@H]([NH2+]C[C@@]1(O)CC[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000484135246 516302724 /nfs/dbraw/zinc/30/27/24/516302724.db2.gz QXUMMAZSEFIAAK-UZLBHIALSA-N 2 2 355.438 2.882 20 5 FFBDLP C[C@@H]([NH2+]C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000484135246 516302728 /nfs/dbraw/zinc/30/27/28/516302728.db2.gz QXUMMAZSEFIAAK-UZLBHIALSA-N 2 2 355.438 2.882 20 5 FFBDLP C[C@H]([NH2+]C[C@]1(O)CC[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000484135244 516302788 /nfs/dbraw/zinc/30/27/88/516302788.db2.gz QXUMMAZSEFIAAK-OXJNMPFZSA-N 2 2 355.438 2.882 20 5 FFBDLP C[C@H]([NH2+]C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000484135244 516302790 /nfs/dbraw/zinc/30/27/90/516302790.db2.gz QXUMMAZSEFIAAK-OXJNMPFZSA-N 2 2 355.438 2.882 20 5 FFBDLP Cc1cc(NC[C@@H]2CC[N@@H+](C(C)C)C2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000548764971 517199295 /nfs/dbraw/zinc/19/92/95/517199295.db2.gz LRYIDFRUHPKQKN-HNNXBMFYSA-N 2 2 355.442 2.924 20 5 FFBDLP Cc1cc(NC[C@@H]2CC[N@H+](C(C)C)C2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000548764971 517199305 /nfs/dbraw/zinc/19/93/05/517199305.db2.gz LRYIDFRUHPKQKN-HNNXBMFYSA-N 2 2 355.442 2.924 20 5 FFBDLP COc1ccc(OCC[NH+]2CCC(Nc3cccc[nH+]3)CC2)c([N+](=O)[O-])c1 ZINC000534129638 517754287 /nfs/dbraw/zinc/75/42/87/517754287.db2.gz YBNWKTBSCKLMIT-UHFFFAOYSA-N 2 2 372.425 2.954 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@H](n2cc[nH+]c2)C1 ZINC000609157510 520214245 /nfs/dbraw/zinc/21/42/45/520214245.db2.gz ZZEHTUJUMJMONH-INIZCTEOSA-N 2 2 357.414 2.765 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H](n2cc[nH+]c2)C1 ZINC000609157510 520214254 /nfs/dbraw/zinc/21/42/54/520214254.db2.gz ZZEHTUJUMJMONH-INIZCTEOSA-N 2 2 357.414 2.765 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1 ZINC000595007804 520254601 /nfs/dbraw/zinc/25/46/01/520254601.db2.gz KVZIWTZFRXWODD-GJZGRUSLSA-N 2 2 363.458 2.755 20 5 FFBDLP O=[N+]([O-])c1cccc([C@@H](O)C[NH2+][C@@H](Cn2cc[nH+]c2)c2ccccc2)c1 ZINC001197265473 1004147423 /nfs/dbraw/zinc/14/74/23/1004147423.db2.gz SJEKDHVXCOSTDL-OALUTQOASA-N 2 2 352.394 2.856 20 5 FFBDLP O=[N+]([O-])c1ccc2c(cnn2C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000246569819 1026274924 /nfs/dbraw/zinc/27/49/24/1026274924.db2.gz RHZKAPPCNKGVBE-KBXCAEBGSA-N 2 2 355.442 2.851 20 5 FFBDLP O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000246569819 1026274930 /nfs/dbraw/zinc/27/49/30/1026274930.db2.gz RHZKAPPCNKGVBE-KBXCAEBGSA-N 2 2 355.442 2.851 20 5 FFBDLP O=[N+]([O-])c1ccc2c(cnn2C[NH+]2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000246569819 1026274936 /nfs/dbraw/zinc/27/49/36/1026274936.db2.gz RHZKAPPCNKGVBE-KBXCAEBGSA-N 2 2 355.442 2.851 20 5 FFBDLP O=[N+]([O-])c1ccc2c(cnn2C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000246569819 1026274944 /nfs/dbraw/zinc/27/49/44/1026274944.db2.gz RHZKAPPCNKGVBE-KBXCAEBGSA-N 2 2 355.442 2.851 20 5 FFBDLP CN(Cc1c2ccccc2cc2ccccc21)C(=O)[C@@H]1C[C@H]2C[NH2+]C[C@H]2[NH2+]1 ZINC001160739210 1027847829 /nfs/dbraw/zinc/84/78/29/1027847829.db2.gz UHDWDIMTIYFIIX-BULFRSBZSA-N 2 2 359.473 2.901 20 5 FFBDLP C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CCc2onc(Cn3cc[nH+]c3)c2C1 ZINC001254561841 1040799307 /nfs/dbraw/zinc/79/93/07/1040799307.db2.gz MOMVKTSYSWFXAS-AWEZNQCLSA-N 2 2 367.409 2.817 20 5 FFBDLP C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCc2onc(Cn3cc[nH+]c3)c2C1 ZINC001254561841 1040799323 /nfs/dbraw/zinc/79/93/23/1040799323.db2.gz MOMVKTSYSWFXAS-AWEZNQCLSA-N 2 2 367.409 2.817 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH2+]Cc1cccc(C[NH+]3CCOCC3)c1)C2 ZINC001254573050 1040809842 /nfs/dbraw/zinc/80/98/42/1040809842.db2.gz WAMIBVVGMRHASI-FQEVSTJZSA-N 2 2 367.449 2.684 20 5 FFBDLP COc1ccc(CC(=O)Nc2c[nH+]ccc2-n2cc[nH+]c2C)cc1[N+](=O)[O-] ZINC001318605896 1044769590 /nfs/dbraw/zinc/76/95/90/1044769590.db2.gz WFFDPTWHEFUXAP-UHFFFAOYSA-N 2 2 367.365 2.674 20 5 FFBDLP C[C@@H](C[NH2+]Cc1c(Br)cccc1[N+](=O)[O-])Cn1cc[nH+]c1 ZINC001461157721 1061228617 /nfs/dbraw/zinc/22/86/17/1061228617.db2.gz SDOVFJYEALGOSD-NSHDSACASA-N 2 2 353.220 2.980 20 5 FFBDLP C[N@@H+]1CCCC[C@H]1CN1CC[NH+](C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000093146932 250020382 /nfs/dbraw/zinc/02/03/82/250020382.db2.gz AMTNCQZPQKAXQW-FNQPIQQGSA-N 2 2 358.486 2.710 20 5 FFBDLP C[N@H+]1CCCC[C@H]1CN1CC[NH+](C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000093146932 250020388 /nfs/dbraw/zinc/02/03/88/250020388.db2.gz AMTNCQZPQKAXQW-FNQPIQQGSA-N 2 2 358.486 2.710 20 5 FFBDLP CN(C/C=C/c1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C2CC[NH+](C)CC2)C1 ZINC000377617388 512356090 /nfs/dbraw/zinc/35/60/90/512356090.db2.gz APUHAJUTOSPKKB-WSSFADSRSA-N 2 2 358.486 2.708 20 5 FFBDLP CN(C/C=C/c1ccccc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CC[NH+](C)CC2)C1 ZINC000377617388 512356094 /nfs/dbraw/zinc/35/60/94/512356094.db2.gz APUHAJUTOSPKKB-WSSFADSRSA-N 2 2 358.486 2.708 20 5 FFBDLP C[C@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1n1cc[nH+]c1 ZINC000120208606 508950979 /nfs/dbraw/zinc/95/09/79/508950979.db2.gz CUWYJEIZQZVJPM-BBRMVZONSA-N 2 2 368.397 2.924 20 5 FFBDLP C[C@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1n1cc[nH+]c1 ZINC000120208606 508950981 /nfs/dbraw/zinc/95/09/81/508950981.db2.gz CUWYJEIZQZVJPM-BBRMVZONSA-N 2 2 368.397 2.924 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000245751071 510129304 /nfs/dbraw/zinc/12/93/04/510129304.db2.gz YTWTYGHLHOKVEF-PBHICJAKSA-N 2 2 357.414 2.621 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000245751071 510129308 /nfs/dbraw/zinc/12/93/08/510129308.db2.gz YTWTYGHLHOKVEF-PBHICJAKSA-N 2 2 357.414 2.621 20 5 FFBDLP CC[N@@H+]1CC[C@H]([NH+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H](C)C1 ZINC000174773117 510304138 /nfs/dbraw/zinc/30/41/38/510304138.db2.gz RRAUKAZGKSQIFP-CJNGLKHVSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[N@H+]1CC[C@H]([NH+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H](C)C1 ZINC000174773117 510304140 /nfs/dbraw/zinc/30/41/40/510304140.db2.gz RRAUKAZGKSQIFP-CJNGLKHVSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[NH+]1CC[C@H]([N@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H](C)C1 ZINC000174773117 510304143 /nfs/dbraw/zinc/30/41/43/510304143.db2.gz RRAUKAZGKSQIFP-CJNGLKHVSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[NH+]1CC[C@H]([N@@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H](C)C1 ZINC000174773117 510304146 /nfs/dbraw/zinc/30/41/46/510304146.db2.gz RRAUKAZGKSQIFP-CJNGLKHVSA-N 2 2 359.430 2.807 20 5 FFBDLP C[C@@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1n1cc[nH+]c1 ZINC000246656342 510605166 /nfs/dbraw/zinc/60/51/66/510605166.db2.gz CUWYJEIZQZVJPM-CZUORRHYSA-N 2 2 368.397 2.924 20 5 FFBDLP C[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1n1cc[nH+]c1 ZINC000246656342 510605174 /nfs/dbraw/zinc/60/51/74/510605174.db2.gz CUWYJEIZQZVJPM-CZUORRHYSA-N 2 2 368.397 2.924 20 5 FFBDLP O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[NH+](CCn2cc[nH+]c2)CC1 ZINC000178473440 510621865 /nfs/dbraw/zinc/62/18/65/510621865.db2.gz JVAHENBBBDKQDN-UHFFFAOYSA-N 2 2 369.347 2.632 20 5 FFBDLP Cc1cc(NCCC[NH+]2CCC(O)CC2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000270241457 510731829 /nfs/dbraw/zinc/73/18/29/510731829.db2.gz QJWJXSMVPGFCNK-UHFFFAOYSA-N 2 2 371.441 2.619 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000246944459 510760935 /nfs/dbraw/zinc/76/09/35/510760935.db2.gz CBMLPFOHMIGJCE-CPUCHLNUSA-N 2 2 357.414 2.701 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000246944459 510760938 /nfs/dbraw/zinc/76/09/38/510760938.db2.gz CBMLPFOHMIGJCE-CPUCHLNUSA-N 2 2 357.414 2.701 20 5 FFBDLP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCOCC2)c1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000284067026 511593392 /nfs/dbraw/zinc/59/33/92/511593392.db2.gz LDPLCPILNPHMBN-OAHLLOKOSA-N 2 2 370.453 2.860 20 5 FFBDLP C[C@@H]1C[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC[C@H]1N1CC[NH+](C)CC1 ZINC000376636959 512912209 /nfs/dbraw/zinc/91/22/09/512912209.db2.gz NCJFKCGVOAYZBC-RHSMWYFYSA-N 2 2 366.893 2.706 20 5 FFBDLP C[C@@H]1C[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC[C@H]1N1CC[NH+](C)CC1 ZINC000376636959 512912214 /nfs/dbraw/zinc/91/22/14/512912214.db2.gz NCJFKCGVOAYZBC-RHSMWYFYSA-N 2 2 366.893 2.706 20 5 FFBDLP COc1ccc(OCC[NH+]2CCC([NH+]3CCCCC3)CC2)c([N+](=O)[O-])c1 ZINC000441216337 513514548 /nfs/dbraw/zinc/51/45/48/513514548.db2.gz CWYHNOUSBKIFEO-UHFFFAOYSA-N 2 2 363.458 2.933 20 5 FFBDLP C[C@@H]1CN(c2ccc([N+](=O)[O-])c3ncccc23)CC[N@@H+]1C1CC[NH+](C)CC1 ZINC000413219062 513528015 /nfs/dbraw/zinc/52/80/15/513528015.db2.gz KSAYUFNKJSEDKH-OAHLLOKOSA-N 2 2 369.469 2.748 20 5 FFBDLP C[C@@H]1CN(c2ccc([N+](=O)[O-])c3ncccc23)CC[N@H+]1C1CC[NH+](C)CC1 ZINC000413219062 513528023 /nfs/dbraw/zinc/52/80/23/513528023.db2.gz KSAYUFNKJSEDKH-OAHLLOKOSA-N 2 2 369.469 2.748 20 5 FFBDLP CC[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CCC[NH2+]CC1 ZINC000435626610 513642525 /nfs/dbraw/zinc/64/25/25/513642525.db2.gz LCJGMAXRYVDFJD-ZDUSSCGKSA-N 2 2 354.838 2.651 20 5 FFBDLP CC[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CCC[NH2+]CC1 ZINC000435626610 513642532 /nfs/dbraw/zinc/64/25/32/513642532.db2.gz LCJGMAXRYVDFJD-ZDUSSCGKSA-N 2 2 354.838 2.651 20 5 FFBDLP C[C@H](CNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)[N@@H+]1CCCC[C@@H]1C ZINC000448699176 513852737 /nfs/dbraw/zinc/85/27/37/513852737.db2.gz SMHIYWVZXWZRMW-LSDHHAIUSA-N 2 2 371.441 2.773 20 5 FFBDLP C[C@H](CNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)[N@H+]1CCCC[C@@H]1C ZINC000448699176 513852745 /nfs/dbraw/zinc/85/27/45/513852745.db2.gz SMHIYWVZXWZRMW-LSDHHAIUSA-N 2 2 371.441 2.773 20 5 FFBDLP C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)[N@@H+]1CCC[C@@H](C)C1 ZINC000448706582 513856336 /nfs/dbraw/zinc/85/63/36/513856336.db2.gz ZIGMNKISNLXKOM-CABCVRRESA-N 2 2 371.441 2.631 20 5 FFBDLP C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)[N@H+]1CCC[C@@H](C)C1 ZINC000448706582 513856345 /nfs/dbraw/zinc/85/63/45/513856345.db2.gz ZIGMNKISNLXKOM-CABCVRRESA-N 2 2 371.441 2.631 20 5 FFBDLP C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)C[NH+]1CCCCC1 ZINC000448751167 513880352 /nfs/dbraw/zinc/88/03/52/513880352.db2.gz KQKZRCOGWQMOTO-HNNXBMFYSA-N 2 2 371.441 2.632 20 5 FFBDLP CC[NH+](CC)CCCCNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000448975320 514002115 /nfs/dbraw/zinc/00/21/15/514002115.db2.gz OEYOWKPTNZLSSF-UHFFFAOYSA-N 2 2 359.430 2.632 20 5 FFBDLP CC(=Cc1cccc([N+](=O)[O-])c1)CNc1ccc(N2CC[NH+](C)CC2)c[nH+]1 ZINC000468644356 515450522 /nfs/dbraw/zinc/45/05/22/515450522.db2.gz AEEWIISTKOBVFU-VBKFSLOCSA-N 2 2 367.453 2.679 20 5 FFBDLP C[C@@H]1C[N@@H+](C2CC2)C[C@H]1[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000540625406 516644507 /nfs/dbraw/zinc/64/45/07/516644507.db2.gz FDZXUHYMWHJCHS-FZKQIMNGSA-N 2 2 355.442 2.568 20 5 FFBDLP C[C@@H]1C[N@H+](C2CC2)C[C@H]1[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000540625406 516644516 /nfs/dbraw/zinc/64/45/16/516644516.db2.gz FDZXUHYMWHJCHS-FZKQIMNGSA-N 2 2 355.442 2.568 20 5 FFBDLP O=[N+]([O-])c1ccc(C(F)(F)F)c(C[NH+]2CCN(c3[nH]cc[nH+]3)CC2)c1 ZINC000569706379 518249424 /nfs/dbraw/zinc/24/94/24/518249424.db2.gz NPIBWIAZZBADCB-UHFFFAOYSA-N 2 2 355.320 2.659 20 5 FFBDLP Cc1c(NC(=O)CC[N@@H+]2CCCC[C@H]2[C@H]2CCC[NH2+]2)cccc1[N+](=O)[O-] ZINC000573670264 518777981 /nfs/dbraw/zinc/77/79/81/518777981.db2.gz PFBSNDUGAYMIPI-AEFFLSMTSA-N 2 2 360.458 2.838 20 5 FFBDLP Cc1c(NC(=O)CC[N@H+]2CCCC[C@H]2[C@H]2CCC[NH2+]2)cccc1[N+](=O)[O-] ZINC000573670264 518777985 /nfs/dbraw/zinc/77/79/85/518777985.db2.gz PFBSNDUGAYMIPI-AEFFLSMTSA-N 2 2 360.458 2.838 20 5 FFBDLP [NH3+]CCN(Cc1[nH+]ccn1Cc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000582931657 518992659 /nfs/dbraw/zinc/99/26/59/518992659.db2.gz AIKIRVCKJAOSRH-UHFFFAOYSA-N 2 2 351.410 2.805 20 5 FFBDLP C[N@@H+]1CCN(Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)[C@H](C[NH3+])C1 ZINC000571801508 519282493 /nfs/dbraw/zinc/28/24/93/519282493.db2.gz YESALXXQXSQFCH-MRXNPFEDSA-N 2 2 374.416 2.601 20 5 FFBDLP C[N@H+]1CCN(Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)[C@H](C[NH3+])C1 ZINC000571801508 519282502 /nfs/dbraw/zinc/28/25/02/519282502.db2.gz YESALXXQXSQFCH-MRXNPFEDSA-N 2 2 374.416 2.601 20 5 FFBDLP C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCCN(c2cc[nH+]cc2)CC1 ZINC000602847996 519924240 /nfs/dbraw/zinc/92/42/40/519924240.db2.gz XCVOOHGKDIIILA-OAHLLOKOSA-N 2 2 369.425 2.529 20 5 FFBDLP C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCCN(c2cc[nH+]cc2)CC1 ZINC000602847996 519924243 /nfs/dbraw/zinc/92/42/43/519924243.db2.gz XCVOOHGKDIIILA-OAHLLOKOSA-N 2 2 369.425 2.529 20 5 FFBDLP Cn1cc[nH+]c1[C@@H](N[C@H]1CC[NH2+]C2(CCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000591582260 519957621 /nfs/dbraw/zinc/95/76/21/519957621.db2.gz BXHWZJMIMWXRDK-RDJZCZTQSA-N 2 2 355.442 2.682 20 5 FFBDLP C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@H]1CCC[N@@H+]2CCCC[C@@H]12 ZINC000594517960 520012236 /nfs/dbraw/zinc/01/22/36/520012236.db2.gz FFJYSNMECBNILU-JLSDUUJJSA-N 2 2 360.458 2.918 20 5 FFBDLP C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594517960 520012239 /nfs/dbraw/zinc/01/22/39/520012239.db2.gz FFJYSNMECBNILU-JLSDUUJJSA-N 2 2 360.458 2.918 20 5 FFBDLP Cn1c[nH+]cc1CC[N@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592132258 520206682 /nfs/dbraw/zinc/20/66/82/520206682.db2.gz FNFUKSFWSJQSAK-SAABIXHNSA-N 2 2 358.442 2.677 20 5 FFBDLP Cn1c[nH+]cc1CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592132258 520206686 /nfs/dbraw/zinc/20/66/86/520206686.db2.gz FNFUKSFWSJQSAK-SAABIXHNSA-N 2 2 358.442 2.677 20 5 FFBDLP O=C(C[N@@H+]1CCC[C@@H](n2cc[nH+]c2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609157617 520212737 /nfs/dbraw/zinc/21/27/37/520212737.db2.gz KOSPPYYWBTVNDB-CYBMUJFWSA-N 2 2 363.805 2.720 20 5 FFBDLP O=C(C[N@H+]1CCC[C@@H](n2cc[nH+]c2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609157617 520212750 /nfs/dbraw/zinc/21/27/50/520212750.db2.gz KOSPPYYWBTVNDB-CYBMUJFWSA-N 2 2 363.805 2.720 20 5 FFBDLP Cn1cc(C[NH2+]C[C@H]2CC[N@@H+]2C(C)(C)C)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000594962847 520230445 /nfs/dbraw/zinc/23/04/45/520230445.db2.gz LUCQKGPQIIIBCZ-QGZVFWFLSA-N 2 2 357.458 2.958 20 5 FFBDLP Cn1cc(C[NH2+]C[C@H]2CC[N@H+]2C(C)(C)C)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000594962847 520230449 /nfs/dbraw/zinc/23/04/49/520230449.db2.gz LUCQKGPQIIIBCZ-QGZVFWFLSA-N 2 2 357.458 2.958 20 5 FFBDLP C[C@@H](CNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)[NH+]1CCC(C)CC1 ZINC000604472089 520570059 /nfs/dbraw/zinc/57/00/59/520570059.db2.gz AGQHAOIZLWVDBQ-HNNXBMFYSA-N 2 2 371.441 2.631 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(OCC[NH+]3CCOCC3)cc2)cc1 ZINC000601101635 520635906 /nfs/dbraw/zinc/63/59/06/520635906.db2.gz USFDEOMVHMVBRV-UHFFFAOYSA-N 2 2 371.437 2.596 20 5 FFBDLP Cn1cc(C[N@@H+]2CC[C@]3(C2)CCC[NH+](Cc2ccccc2)C3)c([N+](=O)[O-])n1 ZINC000602473066 521365942 /nfs/dbraw/zinc/36/59/42/521365942.db2.gz IMGUYQHWTYVNBS-HXUWFJFHSA-N 2 2 369.469 2.816 20 5 FFBDLP Cn1cc(C[N@H+]2CC[C@]3(C2)CCC[NH+](Cc2ccccc2)C3)c([N+](=O)[O-])n1 ZINC000602473066 521365945 /nfs/dbraw/zinc/36/59/45/521365945.db2.gz IMGUYQHWTYVNBS-HXUWFJFHSA-N 2 2 369.469 2.816 20 5 FFBDLP Cn1cc(C[NH+]2CC[C@]3(C2)CCC[N@H+](Cc2ccccc2)C3)c([N+](=O)[O-])n1 ZINC000602473066 521365953 /nfs/dbraw/zinc/36/59/53/521365953.db2.gz IMGUYQHWTYVNBS-HXUWFJFHSA-N 2 2 369.469 2.816 20 5 FFBDLP Cn1cc(C[NH+]2CC[C@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)c([N+](=O)[O-])n1 ZINC000602473066 521365960 /nfs/dbraw/zinc/36/59/60/521365960.db2.gz IMGUYQHWTYVNBS-HXUWFJFHSA-N 2 2 369.469 2.816 20 5 FFBDLP O=[N+]([O-])c1ccc(N2CCC([NH2+]C[C@H]3CC[N@@H+]3C3CCCCC3)CC2)cn1 ZINC000602719717 521495331 /nfs/dbraw/zinc/49/53/31/521495331.db2.gz FMEJBQAOMCBKDB-LJQANCHMSA-N 2 2 373.501 2.955 20 5 FFBDLP O=[N+]([O-])c1ccc(N2CCC([NH2+]C[C@H]3CC[N@H+]3C3CCCCC3)CC2)cn1 ZINC000602719717 521495336 /nfs/dbraw/zinc/49/53/36/521495336.db2.gz FMEJBQAOMCBKDB-LJQANCHMSA-N 2 2 373.501 2.955 20 5 FFBDLP O=[N+]([O-])c1ccc(N2CCC([NH2+]C[C@H]3CC[N@@H+]3C3CCCC3)CC2)cn1 ZINC000602725249 521497266 /nfs/dbraw/zinc/49/72/66/521497266.db2.gz KOOXWMFEFVREKX-GOSISDBHSA-N 2 2 359.474 2.565 20 5 FFBDLP O=[N+]([O-])c1ccc(N2CCC([NH2+]C[C@H]3CC[N@H+]3C3CCCC3)CC2)cn1 ZINC000602725249 521497273 /nfs/dbraw/zinc/49/72/73/521497273.db2.gz KOOXWMFEFVREKX-GOSISDBHSA-N 2 2 359.474 2.565 20 5 FFBDLP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]Cc1cn(C)nc1[N+](=O)[O-] ZINC000602813414 521548083 /nfs/dbraw/zinc/54/80/83/521548083.db2.gz XKDCFXFFRSKBMC-HWWDLCQESA-N 2 2 357.458 2.575 20 5 FFBDLP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]Cc1cn(C)nc1[N+](=O)[O-] ZINC000602813414 521548090 /nfs/dbraw/zinc/54/80/90/521548090.db2.gz XKDCFXFFRSKBMC-HWWDLCQESA-N 2 2 357.458 2.575 20 5 FFBDLP CC(C)(C)[NH+]1CCC(NC(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)CC1 ZINC000194331051 989209336 /nfs/dbraw/zinc/20/93/36/989209336.db2.gz NLNMGOKVDKIQNK-UHFFFAOYSA-N 2 2 371.441 2.773 20 5 FFBDLP C[C@@H]1C[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CCN1c1cc[nH+]cc1 ZINC000880261997 1015792587 /nfs/dbraw/zinc/79/25/87/1015792587.db2.gz QSUCSINKQCCFMZ-CQSZACIVSA-N 2 2 370.409 2.567 20 5 FFBDLP C[C@@H]1C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CCN1c1cc[nH+]cc1 ZINC000880261997 1015792592 /nfs/dbraw/zinc/79/25/92/1015792592.db2.gz QSUCSINKQCCFMZ-CQSZACIVSA-N 2 2 370.409 2.567 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2cnn(C[N@@H+]3CCC[C@H](n4cc[nH+]c4)C3)c2)cc1 ZINC000738159233 999622185 /nfs/dbraw/zinc/62/21/85/999622185.db2.gz REGVOSDXTUMUKO-SFHVURJKSA-N 2 2 352.398 2.949 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CCC[C@H](n4cc[nH+]c4)C3)c2)cc1 ZINC000738159233 999622187 /nfs/dbraw/zinc/62/21/87/999622187.db2.gz REGVOSDXTUMUKO-SFHVURJKSA-N 2 2 352.398 2.949 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C1CC[NH+](C[C@H]2CCCO2)CC1 ZINC000850434494 1005815470 /nfs/dbraw/zinc/81/54/70/1005815470.db2.gz UKQYXDDELKCIGT-RHSMWYFYSA-N 2 2 363.458 2.897 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@H]2CC[N@H+](CC(C)C)C2)c1F ZINC001173182280 1012327649 /nfs/dbraw/zinc/32/76/49/1012327649.db2.gz REWRUEKEJDIZAL-KGLIPLIRSA-N 2 2 353.438 2.993 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@H]2CC[N@@H+](CC(C)C)C2)c1F ZINC001173182280 1012327659 /nfs/dbraw/zinc/32/76/59/1012327659.db2.gz REWRUEKEJDIZAL-KGLIPLIRSA-N 2 2 353.438 2.993 20 5 FFBDLP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1C[C@@H]2C[NH+](Cc3cccnc3)C[C@H]2C1 ZINC001173220755 1012351471 /nfs/dbraw/zinc/35/14/71/1012351471.db2.gz CDCGTHDLOJNRSX-UXPWSPDFSA-N 2 2 366.465 2.985 20 5 FFBDLP C[NH+](C)C1(C)CCC(NC(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)CC1 ZINC000871357018 1012882941 /nfs/dbraw/zinc/88/29/41/1012882941.db2.gz SXVKBNKYWYBHTO-UHFFFAOYSA-N 2 2 371.441 2.773 20 5 FFBDLP COc1ccc(C(=O)Nc2c[nH+]ccc2-n2cc[nH+]c2C)cc1[N+](=O)[O-] ZINC001251846366 1039321939 /nfs/dbraw/zinc/32/19/39/1039321939.db2.gz CGQAWLFQQDGNKB-UHFFFAOYSA-N 2 2 353.338 2.745 20 5 FFBDLP CC(C)[N@H+](C)Cc1cnc2n1CC[NH+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254595829 1040823974 /nfs/dbraw/zinc/82/39/74/1040823974.db2.gz NKATXSABTHLIGP-GOSISDBHSA-N 2 2 369.469 2.615 20 5 FFBDLP CC(C)[N@@H+](C)Cc1cnc2n1CC[NH+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254595829 1040823987 /nfs/dbraw/zinc/82/39/87/1040823987.db2.gz NKATXSABTHLIGP-GOSISDBHSA-N 2 2 369.469 2.615 20 5 FFBDLP CC(C)[NH+](C)Cc1cnc2n1CC[N@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254595829 1040823997 /nfs/dbraw/zinc/82/39/97/1040823997.db2.gz NKATXSABTHLIGP-GOSISDBHSA-N 2 2 369.469 2.615 20 5 FFBDLP CC(C)[NH+](C)Cc1cnc2n1CC[N@@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254595829 1040824009 /nfs/dbraw/zinc/82/40/09/1040824009.db2.gz NKATXSABTHLIGP-GOSISDBHSA-N 2 2 369.469 2.615 20 5 FFBDLP C[N@@H+]1CCC[C@@H]2C[NH+](Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)CC[C@@H]21 ZINC000848483118 1060121558 /nfs/dbraw/zinc/12/15/58/1060121558.db2.gz YOPUFPMYXUHPKC-QAPCUYQASA-N 2 2 355.442 2.832 20 5 FFBDLP C[N@H+]1CCC[C@@H]2C[NH+](Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)CC[C@@H]21 ZINC000848483118 1060121564 /nfs/dbraw/zinc/12/15/64/1060121564.db2.gz YOPUFPMYXUHPKC-QAPCUYQASA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CCC[C@@H]2C[N@H+](Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)CC[C@@H]21 ZINC000848483118 1060121569 /nfs/dbraw/zinc/12/15/69/1060121569.db2.gz YOPUFPMYXUHPKC-QAPCUYQASA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CCC[C@@H]2C[N@@H+](Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)CC[C@@H]21 ZINC000848483118 1060121573 /nfs/dbraw/zinc/12/15/73/1060121573.db2.gz YOPUFPMYXUHPKC-QAPCUYQASA-N 2 2 355.442 2.832 20 5 FFBDLP C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848483147 1060122188 /nfs/dbraw/zinc/12/21/88/1060122188.db2.gz YUPQNXYUUYPKQJ-YJBOKZPZSA-N 2 2 355.442 2.832 20 5 FFBDLP C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848483147 1060122196 /nfs/dbraw/zinc/12/21/96/1060122196.db2.gz YUPQNXYUUYPKQJ-YJBOKZPZSA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848483147 1060122211 /nfs/dbraw/zinc/12/22/11/1060122211.db2.gz YUPQNXYUUYPKQJ-YJBOKZPZSA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848483147 1060122225 /nfs/dbraw/zinc/12/22/25/1060122225.db2.gz YUPQNXYUUYPKQJ-YJBOKZPZSA-N 2 2 355.442 2.832 20 5 FFBDLP Cn1cc[nH+]c1[C@H](NCC1([NH+](C)C)CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000272531891 252061926 /nfs/dbraw/zinc/06/19/26/252061926.db2.gz NEHUKYYPYVMNOJ-QGZVFWFLSA-N 2 2 357.458 2.882 20 5 FFBDLP CC(C)[NH+](CCNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)C(C)C ZINC000032480550 208027350 /nfs/dbraw/zinc/02/73/50/208027350.db2.gz FHQDSUFDHDRICP-UHFFFAOYSA-N 2 2 359.430 2.629 20 5 FFBDLP Cc1c(NC(=O)CC[N@@H+]2CC[C@@H](Oc3cc[nH+]cc3)C2)cccc1[N+](=O)[O-] ZINC000156394577 508413904 /nfs/dbraw/zinc/41/39/04/508413904.db2.gz AXDHNQJZERCPOJ-MRXNPFEDSA-N 2 2 370.409 2.780 20 5 FFBDLP Cc1c(NC(=O)CC[N@H+]2CC[C@@H](Oc3cc[nH+]cc3)C2)cccc1[N+](=O)[O-] ZINC000156394577 508413907 /nfs/dbraw/zinc/41/39/07/508413907.db2.gz AXDHNQJZERCPOJ-MRXNPFEDSA-N 2 2 370.409 2.780 20 5 FFBDLP CC(C)[NH2+]C1CC[NH+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000179831810 509642214 /nfs/dbraw/zinc/64/22/14/509642214.db2.gz KWQOIUSTLDBEMX-UHFFFAOYSA-N 2 2 357.458 2.958 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2nnc(C[NH+]3CCC(c4[nH]cc[nH+]4)CC3)o2)cc1 ZINC000265514138 510095226 /nfs/dbraw/zinc/09/52/26/510095226.db2.gz RLCQRATXIDGUJQ-UHFFFAOYSA-N 2 2 354.370 2.748 20 5 FFBDLP COC(=O)CCC[NH+]1CCC([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000271785899 511324000 /nfs/dbraw/zinc/32/40/00/511324000.db2.gz HTKRIWWXTAHEFA-UHFFFAOYSA-N 2 2 369.849 2.755 20 5 FFBDLP C[C@H]([NH2+]C1CC[NH+](Cc2ccncc2)CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000284303330 511675156 /nfs/dbraw/zinc/67/51/56/511675156.db2.gz YTZBCURLWCAHTG-AWEZNQCLSA-N 2 2 355.442 2.887 20 5 FFBDLP O=C(CC[N@@H+]1CC[C@@H](Oc2cc[nH+]cc2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000376550495 512868207 /nfs/dbraw/zinc/86/82/07/512868207.db2.gz FJBILPKBLOYAAH-OAHLLOKOSA-N 2 2 374.372 2.611 20 5 FFBDLP C[C@@H]1CN(c2nccc3ccc([N+](=O)[O-])cc32)CC[N@@H+]1C1CC[NH+](C)CC1 ZINC000413219385 513527969 /nfs/dbraw/zinc/52/79/69/513527969.db2.gz MJEKWXZPVSRUAK-OAHLLOKOSA-N 2 2 369.469 2.748 20 5 FFBDLP C[C@@H]1CN(c2nccc3ccc([N+](=O)[O-])cc32)CC[N@H+]1C1CC[NH+](C)CC1 ZINC000413219385 513527973 /nfs/dbraw/zinc/52/79/73/513527973.db2.gz MJEKWXZPVSRUAK-OAHLLOKOSA-N 2 2 369.469 2.748 20 5 FFBDLP CC[NH+]1CCC([N@@H+]2CCCN(C(=O)c3c(C)cccc3[N+](=O)[O-])CC2)CC1 ZINC000422026756 513532198 /nfs/dbraw/zinc/53/21/98/513532198.db2.gz VOOZYSAOJOTDKQ-UHFFFAOYSA-N 2 2 374.485 2.535 20 5 FFBDLP CC[NH+]1CCC([N@H+]2CCCN(C(=O)c3c(C)cccc3[N+](=O)[O-])CC2)CC1 ZINC000422026756 513532204 /nfs/dbraw/zinc/53/22/04/513532204.db2.gz VOOZYSAOJOTDKQ-UHFFFAOYSA-N 2 2 374.485 2.535 20 5 FFBDLP COc1ccc(C[N@@H+]2CCC[NH2+]CC2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000435381620 513571017 /nfs/dbraw/zinc/57/10/17/513571017.db2.gz WZYYEUSRDZZHJH-UHFFFAOYSA-N 2 2 371.437 2.978 20 5 FFBDLP COc1ccc(C[N@H+]2CCC[NH2+]CC2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000435381620 513571019 /nfs/dbraw/zinc/57/10/19/513571019.db2.gz WZYYEUSRDZZHJH-UHFFFAOYSA-N 2 2 371.437 2.978 20 5 FFBDLP CC(C)[NH+](CCNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-])C(C)C ZINC000447803708 513574649 /nfs/dbraw/zinc/57/46/49/513574649.db2.gz BLLHYXJOGUEPSU-UHFFFAOYSA-N 2 2 364.490 2.958 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCC[N@@H+](CCCO)C1 ZINC000449399198 514197745 /nfs/dbraw/zinc/19/77/45/514197745.db2.gz YKOWIARNXXZMSR-UHOSZYNNSA-N 2 2 361.486 2.742 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCC[N@H+](CCCO)C1 ZINC000449399198 514197747 /nfs/dbraw/zinc/19/77/47/514197747.db2.gz YKOWIARNXXZMSR-UHOSZYNNSA-N 2 2 361.486 2.742 20 5 FFBDLP COc1cc(C[NH2+]C[C@H]([NH3+])C(C)C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000414800287 514299736 /nfs/dbraw/zinc/29/97/36/514299736.db2.gz SEFVNOAOFUAMMF-NSHDSACASA-N 2 2 365.352 2.617 20 5 FFBDLP COc1ccc([C@H]2CC[NH2+]C[C@@H]2[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000414884967 514340829 /nfs/dbraw/zinc/34/08/29/514340829.db2.gz OTHCGPRAXODBEB-MSOLQXFVSA-N 2 2 371.437 2.847 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)C[N@@H+](Cc1ccc(C[NH+]3CCOCC3)cc1)CC2 ZINC000420938797 514389211 /nfs/dbraw/zinc/38/92/11/514389211.db2.gz PRSGBLJGNDRWGC-UHFFFAOYSA-N 2 2 367.449 2.985 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)C[N@H+](Cc1ccc(C[NH+]3CCOCC3)cc1)CC2 ZINC000420938797 514389219 /nfs/dbraw/zinc/38/92/19/514389219.db2.gz PRSGBLJGNDRWGC-UHFFFAOYSA-N 2 2 367.449 2.985 20 5 FFBDLP COc1ccc(OCC[N@@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)c([N+](=O)[O-])c1 ZINC000472488142 515289014 /nfs/dbraw/zinc/28/90/14/515289014.db2.gz WPIPMWNMYMCHDW-MRXNPFEDSA-N 2 2 363.458 2.646 20 5 FFBDLP COc1ccc(OCC[N@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)c([N+](=O)[O-])c1 ZINC000472488142 515289023 /nfs/dbraw/zinc/28/90/23/515289023.db2.gz WPIPMWNMYMCHDW-MRXNPFEDSA-N 2 2 363.458 2.646 20 5 FFBDLP COc1ccc(OCC[NH+]2CC[C@H](C[N@H+](C)CC3CC3)C2)c([N+](=O)[O-])c1 ZINC000472488142 515289029 /nfs/dbraw/zinc/28/90/29/515289029.db2.gz WPIPMWNMYMCHDW-MRXNPFEDSA-N 2 2 363.458 2.646 20 5 FFBDLP COc1ccc(OCC[NH+]2CC[C@H](C[N@@H+](C)CC3CC3)C2)c([N+](=O)[O-])c1 ZINC000472488142 515289038 /nfs/dbraw/zinc/28/90/38/515289038.db2.gz WPIPMWNMYMCHDW-MRXNPFEDSA-N 2 2 363.458 2.646 20 5 FFBDLP CC(C)[NH+](CCN(C)C(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)C(C)C ZINC000505396097 515521430 /nfs/dbraw/zinc/52/14/30/515521430.db2.gz NEIIPSAKRXCODS-UHFFFAOYSA-N 2 2 373.457 2.971 20 5 FFBDLP C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1c[nH+]c2n1CCCC2 ZINC000556610197 517517823 /nfs/dbraw/zinc/51/78/23/517517823.db2.gz REFSWWTZCUBHNW-ZDUSSCGKSA-N 2 2 357.414 2.635 20 5 FFBDLP CC[NH+](CC)CCC[N@H+](CC)Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000589197055 518947986 /nfs/dbraw/zinc/94/79/86/518947986.db2.gz ALTHAAOVBOMLQX-UHFFFAOYSA-N 2 2 351.447 2.920 20 5 FFBDLP CC[NH+](CC)CCC[N@@H+](CC)Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000589197055 518947989 /nfs/dbraw/zinc/94/79/89/518947989.db2.gz ALTHAAOVBOMLQX-UHFFFAOYSA-N 2 2 351.447 2.920 20 5 FFBDLP Cc1cc(N2CC[C@]3(C2)CCC[NH2+]C3)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000583555344 519309232 /nfs/dbraw/zinc/30/92/32/519309232.db2.gz XDZLLNIUBOLRHN-LJQANCHMSA-N 2 2 353.426 2.940 20 5 FFBDLP O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)Nc1c[nH+]ccc1-n1cc[nH+]c1 ZINC000581004079 519472713 /nfs/dbraw/zinc/47/27/13/519472713.db2.gz YJSUWEGOQIOETE-UHFFFAOYSA-N 2 2 359.292 2.635 20 5 FFBDLP C[C@H]([NH2+]C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@H](c1ccccc1)[NH+](C)C ZINC000591761299 520026505 /nfs/dbraw/zinc/02/65/05/520026505.db2.gz HKZCLWLZRVQZQO-ZAAXVRCTSA-N 2 2 373.453 2.616 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1 ZINC000595048851 520270699 /nfs/dbraw/zinc/27/06/99/520270699.db2.gz RQAZIEOAYOASLM-GJZGRUSLSA-N 2 2 351.447 2.755 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCC[N@H+]1CCCO[C@@H](C)C1 ZINC000595048851 520270706 /nfs/dbraw/zinc/27/07/06/520270706.db2.gz RQAZIEOAYOASLM-GJZGRUSLSA-N 2 2 351.447 2.755 20 5 FFBDLP C[C@H](C[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)[N@@H+]1CCCC[C@H]1C ZINC000602513217 521387857 /nfs/dbraw/zinc/38/78/57/521387857.db2.gz ARNDWKRDYSJGIZ-HZPDHXFCSA-N 2 2 361.490 2.811 20 5 FFBDLP C[C@H](C[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)[N@H+]1CCCC[C@H]1C ZINC000602513217 521387862 /nfs/dbraw/zinc/38/78/62/521387862.db2.gz ARNDWKRDYSJGIZ-HZPDHXFCSA-N 2 2 361.490 2.811 20 5 FFBDLP CC(C)[C@@H]([NH3+])CC[N@H+](C)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000843354611 747815879 /nfs/dbraw/zinc/81/58/79/747815879.db2.gz LRHARLGTCZZHLT-FZMZJTMJSA-N 2 2 356.854 2.880 20 5 FFBDLP CC(C)[C@@H]([NH3+])CC[N@@H+](C)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000843354611 747815888 /nfs/dbraw/zinc/81/58/88/747815888.db2.gz LRHARLGTCZZHLT-FZMZJTMJSA-N 2 2 356.854 2.880 20 5 FFBDLP C[C@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)[C@H]1CC[NH3+] ZINC000846226685 748434207 /nfs/dbraw/zinc/43/42/07/748434207.db2.gz TWFARLKASMGXEZ-FZMZJTMJSA-N 2 2 354.838 2.636 20 5 FFBDLP C[C@H]1CCC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)[C@H]1CC[NH3+] ZINC000846226685 748434209 /nfs/dbraw/zinc/43/42/09/748434209.db2.gz TWFARLKASMGXEZ-FZMZJTMJSA-N 2 2 354.838 2.636 20 5 FFBDLP Cc1[nH+]ccn1-c1cc[nH+]cc1NC(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC001116065252 1032101467 /nfs/dbraw/zinc/10/14/67/1032101467.db2.gz NHVPBLZLJAFQEQ-UHFFFAOYSA-N 2 2 371.328 2.641 20 5 FFBDLP CC(C)(C)[N@@H+]1CC[C@H]1COC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000845738310 998630214 /nfs/dbraw/zinc/63/02/14/998630214.db2.gz DYAFHDHSTCKROA-AWEZNQCLSA-N 2 2 358.398 2.810 20 5 FFBDLP CC(C)(C)[N@H+]1CC[C@H]1COC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000845738310 998630216 /nfs/dbraw/zinc/63/02/16/998630216.db2.gz DYAFHDHSTCKROA-AWEZNQCLSA-N 2 2 358.398 2.810 20 5 FFBDLP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCn2cc(C[NH+]3CCCC3)nc2C1 ZINC001173223735 1012354335 /nfs/dbraw/zinc/35/43/35/1012354335.db2.gz HDSVCCXAJYNDJI-INIZCTEOSA-N 2 2 369.469 2.834 20 5 FFBDLP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCn2cc(C[NH+]3CCCC3)nc2C1 ZINC001173223735 1012354354 /nfs/dbraw/zinc/35/43/54/1012354354.db2.gz HDSVCCXAJYNDJI-INIZCTEOSA-N 2 2 369.469 2.834 20 5 FFBDLP O=[N+]([O-])c1ccccc1-c1ccc(-n2c[nH+]cc2C2CC[NH2+]CC2)nn1 ZINC001155064593 1028563733 /nfs/dbraw/zinc/56/37/33/1028563733.db2.gz TYHSGEXCZMUGHQ-UHFFFAOYSA-N 2 2 350.382 2.705 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH+]1C[C@@H]3C[NH+](Cc4ccccn4)C[C@H]3C1)C2 ZINC001254596678 1040825085 /nfs/dbraw/zinc/82/50/85/1040825085.db2.gz QETVJCVPVMIFKN-BBTUJRGHSA-N 2 2 364.449 2.521 20 5 FFBDLP C[NH+]1CCN(c2cccc3[nH+]c(Cc4cccc([N+](=O)[O-])c4)[nH]c32)CC1 ZINC001250594170 1041263117 /nfs/dbraw/zinc/26/31/17/1041263117.db2.gz BFKBJYQFZPWABD-UHFFFAOYSA-N 2 2 351.410 2.814 20 5 FFBDLP O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@H](Cn2cc[nH+]c2)c2ccccc2)cc1 ZINC001473748184 1065343757 /nfs/dbraw/zinc/34/37/57/1065343757.db2.gz WLJZDVREEMSSNX-MOPGFXCFSA-N 2 2 352.394 2.856 20 5 FFBDLP C[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)[C@@H]1CCC[NH3+] ZINC001579420833 1078627278 /nfs/dbraw/zinc/62/72/78/1078627278.db2.gz HTSVUWBRHYTQDJ-GDBMZVCRSA-N 2 2 371.441 2.760 20 5 FFBDLP O=C(N[C@H]1CC[N@@H+](C2CCCC2)C1)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000369066565 512210790 /nfs/dbraw/zinc/21/07/90/512210790.db2.gz RUBOLJVQMZJRKS-HNNXBMFYSA-N 2 2 369.425 2.527 20 5 FFBDLP O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000369066565 512210795 /nfs/dbraw/zinc/21/07/95/512210795.db2.gz RUBOLJVQMZJRKS-HNNXBMFYSA-N 2 2 369.425 2.527 20 5 FFBDLP C[NH+]1CCC([N@@H+]2CC[C@H](Nc3ccc4ncccc4c3[N+](=O)[O-])C2)CC1 ZINC000369269018 512321154 /nfs/dbraw/zinc/32/11/54/512321154.db2.gz VCSFWQYZYXFMKC-AWEZNQCLSA-N 2 2 355.442 2.723 20 5 FFBDLP C[NH+]1CCC([N@H+]2CC[C@H](Nc3ccc4ncccc4c3[N+](=O)[O-])C2)CC1 ZINC000369269018 512321157 /nfs/dbraw/zinc/32/11/57/512321157.db2.gz VCSFWQYZYXFMKC-AWEZNQCLSA-N 2 2 355.442 2.723 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[NH+]3CCC(n4cc[nH+]c4)CC3)n2)cc1 ZINC000109796208 507988154 /nfs/dbraw/zinc/98/81/54/507988154.db2.gz YUDXGYOUQBDWME-UHFFFAOYSA-N 2 2 354.370 2.678 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@@H](c4[nH]cc[nH+]4)C3)n2)cc1 ZINC000080961724 508117808 /nfs/dbraw/zinc/11/78/08/508117808.db2.gz MQSDZVDUQVIURO-CYBMUJFWSA-N 2 2 354.370 2.748 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@@H](c4[nH]cc[nH+]4)C3)n2)cc1 ZINC000080961724 508117810 /nfs/dbraw/zinc/11/78/10/508117810.db2.gz MQSDZVDUQVIURO-CYBMUJFWSA-N 2 2 354.370 2.748 20 5 FFBDLP CC[N@@H+]1CC[C@H]([NH+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000081096031 508136531 /nfs/dbraw/zinc/13/65/31/508136531.db2.gz UAPKAZZVTKUAJJ-DOMZBBRYSA-N 2 2 368.865 2.849 20 5 FFBDLP CC[N@H+]1CC[C@H]([NH+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000081096031 508136534 /nfs/dbraw/zinc/13/65/34/508136534.db2.gz UAPKAZZVTKUAJJ-DOMZBBRYSA-N 2 2 368.865 2.849 20 5 FFBDLP CC[NH+]1CC[C@H]([N@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000081096031 508136536 /nfs/dbraw/zinc/13/65/36/508136536.db2.gz UAPKAZZVTKUAJJ-DOMZBBRYSA-N 2 2 368.865 2.849 20 5 FFBDLP CC[NH+]1CC[C@H]([N@@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000081096031 508136538 /nfs/dbraw/zinc/13/65/38/508136538.db2.gz UAPKAZZVTKUAJJ-DOMZBBRYSA-N 2 2 368.865 2.849 20 5 FFBDLP COc1cc(C[N@H+](C)C[C@@H]2CCC[NH+](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000152374110 508433314 /nfs/dbraw/zinc/43/33/14/508433314.db2.gz QZARPZAOMNARQL-GFCCVEGCSA-N 2 2 373.400 2.978 20 5 FFBDLP COc1cc(C[N@@H+](C)C[C@@H]2CCC[NH+](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000152374110 508433319 /nfs/dbraw/zinc/43/33/19/508433319.db2.gz QZARPZAOMNARQL-GFCCVEGCSA-N 2 2 373.400 2.978 20 5 FFBDLP COc1cc(C[NH+](C)C[C@@H]2CCC[N@H+](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000152374110 508433324 /nfs/dbraw/zinc/43/33/24/508433324.db2.gz QZARPZAOMNARQL-GFCCVEGCSA-N 2 2 373.400 2.978 20 5 FFBDLP COc1cc(C[NH+](C)C[C@@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000152374110 508433326 /nfs/dbraw/zinc/43/33/26/508433326.db2.gz QZARPZAOMNARQL-GFCCVEGCSA-N 2 2 373.400 2.978 20 5 FFBDLP O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c2c(c1)COCO2 ZINC000157319132 508552083 /nfs/dbraw/zinc/55/20/83/508552083.db2.gz OANYIXOQFVQYMP-KRWDZBQOSA-N 2 2 361.442 2.912 20 5 FFBDLP O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c2c(c1)COCO2 ZINC000157319132 508552090 /nfs/dbraw/zinc/55/20/90/508552090.db2.gz OANYIXOQFVQYMP-KRWDZBQOSA-N 2 2 361.442 2.912 20 5 FFBDLP CCOc1ccc([C@@H](C)[NH2+]C[C@@H](O)C[NH+]2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000153702775 508630096 /nfs/dbraw/zinc/63/00/96/508630096.db2.gz BUAAZTKKEPMLAV-NVXWUHKLSA-N 2 2 365.474 2.737 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000129618550 508747001 /nfs/dbraw/zinc/74/70/01/508747001.db2.gz XSOBULNJHPURNJ-SUMWQHHRSA-N 2 2 357.414 2.621 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000129618550 508747004 /nfs/dbraw/zinc/74/70/04/508747004.db2.gz XSOBULNJHPURNJ-SUMWQHHRSA-N 2 2 357.414 2.621 20 5 FFBDLP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000130501861 508823586 /nfs/dbraw/zinc/82/35/86/508823586.db2.gz SOJZFMMWDUYNEH-UHFFFAOYSA-N 2 2 356.386 2.672 20 5 FFBDLP Cc1[nH+]ccn1CCC[N@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000130501861 508823593 /nfs/dbraw/zinc/82/35/93/508823593.db2.gz SOJZFMMWDUYNEH-UHFFFAOYSA-N 2 2 356.386 2.672 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CC[C@@H](Oc4cc[nH+]cc4)C3)n2)cc1 ZINC000156337102 509161890 /nfs/dbraw/zinc/16/18/90/509161890.db2.gz DZUPIINUKDMRQI-MRXNPFEDSA-N 2 2 367.365 2.693 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CC[C@@H](Oc4cc[nH+]cc4)C3)n2)cc1 ZINC000156337102 509161895 /nfs/dbraw/zinc/16/18/95/509161895.db2.gz DZUPIINUKDMRQI-MRXNPFEDSA-N 2 2 367.365 2.693 20 5 FFBDLP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)C1 ZINC000245446098 509940687 /nfs/dbraw/zinc/94/06/87/509940687.db2.gz ZMQCLQMABAHUAS-XJKSGUPXSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[N@H+]1CC[C@@H]([NH+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)C1 ZINC000245446098 509940693 /nfs/dbraw/zinc/94/06/93/509940693.db2.gz ZMQCLQMABAHUAS-XJKSGUPXSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[NH+]1CC[C@@H]([N@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)C1 ZINC000245446098 509940697 /nfs/dbraw/zinc/94/06/97/509940697.db2.gz ZMQCLQMABAHUAS-XJKSGUPXSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)C1 ZINC000245446098 509940704 /nfs/dbraw/zinc/94/07/04/509940704.db2.gz ZMQCLQMABAHUAS-XJKSGUPXSA-N 2 2 359.430 2.807 20 5 FFBDLP C[C@@H]1C[C@@H]([NH+](C)CCn2cc([N+](=O)[O-])cn2)CC[N@@H+]1Cc1ccccc1 ZINC000174870565 510356287 /nfs/dbraw/zinc/35/62/87/510356287.db2.gz PNJOUZXSNYLMQL-AEFFLSMTSA-N 2 2 357.458 2.776 20 5 FFBDLP C[C@@H]1C[C@@H]([NH+](C)CCn2cc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1 ZINC000174870565 510356291 /nfs/dbraw/zinc/35/62/91/510356291.db2.gz PNJOUZXSNYLMQL-AEFFLSMTSA-N 2 2 357.458 2.776 20 5 FFBDLP C[C@@H]1C[C@@H]([N@H+](C)CCn2cc([N+](=O)[O-])cn2)CC[NH+]1Cc1ccccc1 ZINC000174870565 510356295 /nfs/dbraw/zinc/35/62/95/510356295.db2.gz PNJOUZXSNYLMQL-AEFFLSMTSA-N 2 2 357.458 2.776 20 5 FFBDLP C[C@@H]1C[C@@H]([N@@H+](C)CCn2cc([N+](=O)[O-])cn2)CC[NH+]1Cc1ccccc1 ZINC000174870565 510356297 /nfs/dbraw/zinc/35/62/97/510356297.db2.gz PNJOUZXSNYLMQL-AEFFLSMTSA-N 2 2 357.458 2.776 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C)C2)cccc1[N+](=O)[O-] ZINC000246710713 510628273 /nfs/dbraw/zinc/62/82/73/510628273.db2.gz FFFILKRZSWGHFJ-DAYGRLMNSA-N 2 2 360.458 2.646 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C)C2)cccc1[N+](=O)[O-] ZINC000246710713 510628282 /nfs/dbraw/zinc/62/82/82/510628282.db2.gz FFFILKRZSWGHFJ-DAYGRLMNSA-N 2 2 360.458 2.646 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)cccc1[N+](=O)[O-] ZINC000246710713 510628293 /nfs/dbraw/zinc/62/82/93/510628293.db2.gz FFFILKRZSWGHFJ-DAYGRLMNSA-N 2 2 360.458 2.646 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C)C2)cccc1[N+](=O)[O-] ZINC000246710713 510628298 /nfs/dbraw/zinc/62/82/98/510628298.db2.gz FFFILKRZSWGHFJ-DAYGRLMNSA-N 2 2 360.458 2.646 20 5 FFBDLP C[N@H+](CCc1ccc([N+](=O)[O-])cc1)C[C@@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC000188294627 510694330 /nfs/dbraw/zinc/69/43/30/510694330.db2.gz VWAKRLKPMDSNCZ-NRFANRHFSA-N 2 2 369.465 2.706 20 5 FFBDLP C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C[C@@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC000188294627 510694341 /nfs/dbraw/zinc/69/43/41/510694341.db2.gz VWAKRLKPMDSNCZ-NRFANRHFSA-N 2 2 369.465 2.706 20 5 FFBDLP C[NH+](CCc1ccc([N+](=O)[O-])cc1)C[C@@]1(O)CC[N@H+](Cc2ccccc2)C1 ZINC000188294627 510694351 /nfs/dbraw/zinc/69/43/51/510694351.db2.gz VWAKRLKPMDSNCZ-NRFANRHFSA-N 2 2 369.465 2.706 20 5 FFBDLP C[NH+](CCc1ccc([N+](=O)[O-])cc1)C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000188294627 510694358 /nfs/dbraw/zinc/69/43/58/510694358.db2.gz VWAKRLKPMDSNCZ-NRFANRHFSA-N 2 2 369.465 2.706 20 5 FFBDLP CN(C(=O)C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000246993765 510788729 /nfs/dbraw/zinc/78/87/29/510788729.db2.gz WNZXZSBSQSZGGJ-KXBFYZLASA-N 2 2 372.469 2.506 20 5 FFBDLP CN(C(=O)C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000246993765 510788736 /nfs/dbraw/zinc/78/87/36/510788736.db2.gz WNZXZSBSQSZGGJ-KXBFYZLASA-N 2 2 372.469 2.506 20 5 FFBDLP CN(C(=O)C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000246993765 510788742 /nfs/dbraw/zinc/78/87/42/510788742.db2.gz WNZXZSBSQSZGGJ-KXBFYZLASA-N 2 2 372.469 2.506 20 5 FFBDLP CN(C(=O)C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000246993765 510788747 /nfs/dbraw/zinc/78/87/47/510788747.db2.gz WNZXZSBSQSZGGJ-KXBFYZLASA-N 2 2 372.469 2.506 20 5 FFBDLP C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000292212273 511508443 /nfs/dbraw/zinc/50/84/43/511508443.db2.gz UESHDRGNVAKQTG-SCLBCKFNSA-N 2 2 357.414 2.733 20 5 FFBDLP C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000292212273 511508446 /nfs/dbraw/zinc/50/84/46/511508446.db2.gz UESHDRGNVAKQTG-SCLBCKFNSA-N 2 2 357.414 2.733 20 5 FFBDLP C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CC[C@@]2(CC[N@H+](C)C2)C1 ZINC000292212273 511508451 /nfs/dbraw/zinc/50/84/51/511508451.db2.gz UESHDRGNVAKQTG-SCLBCKFNSA-N 2 2 357.414 2.733 20 5 FFBDLP C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000292212273 511508454 /nfs/dbraw/zinc/50/84/54/511508454.db2.gz UESHDRGNVAKQTG-SCLBCKFNSA-N 2 2 357.414 2.733 20 5 FFBDLP O=[N+]([O-])c1ccn(C2CC[NH+](Cc3ccc(-n4cc[nH+]c4)cc3)CC2)n1 ZINC000365820921 511668620 /nfs/dbraw/zinc/66/86/20/511668620.db2.gz OTIAMOHNWYXSCB-UHFFFAOYSA-N 2 2 352.398 2.814 20 5 FFBDLP CC(C)[NH+]1CCN([C@@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C2)CC1 ZINC000367768265 512654397 /nfs/dbraw/zinc/65/43/97/512654397.db2.gz IDJDPLWJDCQROP-QGZVFWFLSA-N 2 2 366.893 2.849 20 5 FFBDLP CC(C)[NH+]1CCN([C@@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C2)CC1 ZINC000367768265 512654400 /nfs/dbraw/zinc/65/44/00/512654400.db2.gz IDJDPLWJDCQROP-QGZVFWFLSA-N 2 2 366.893 2.849 20 5 FFBDLP COc1ccc(NC(=O)CC[NH+]2CCC(c3c[nH]c[nH+]3)CC2)c([N+](=O)[O-])c1 ZINC000374199825 512704119 /nfs/dbraw/zinc/70/41/19/512704119.db2.gz LLINPQBTFVUYQG-UHFFFAOYSA-N 2 2 373.413 2.535 20 5 FFBDLP Cn1cnc([N+](=O)[O-])c1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C ZINC000374533414 512878128 /nfs/dbraw/zinc/87/81/28/512878128.db2.gz BHMNPKBLGNPNCS-QGZVFWFLSA-N 2 2 357.458 2.719 20 5 FFBDLP Cn1cnc([N+](=O)[O-])c1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000374533414 512878133 /nfs/dbraw/zinc/87/81/33/512878133.db2.gz BHMNPKBLGNPNCS-QGZVFWFLSA-N 2 2 357.458 2.719 20 5 FFBDLP Cc1cn2c([nH+]1)[C@H](C[NH2+][C@@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1)CCC2 ZINC000370682476 513050916 /nfs/dbraw/zinc/05/09/16/513050916.db2.gz NYULXZCHNKKASJ-ZFWWWQNUSA-N 2 2 371.441 2.984 20 5 FFBDLP CC[NH+]1CCC([N@@H+]2CCCN(C(=O)c3cc(C)cc([N+](=O)[O-])c3)CC2)CC1 ZINC000422014427 513524302 /nfs/dbraw/zinc/52/43/02/513524302.db2.gz YXDJVNWZFQEDNI-UHFFFAOYSA-N 2 2 374.485 2.535 20 5 FFBDLP CC[NH+]1CCC([N@H+]2CCCN(C(=O)c3cc(C)cc([N+](=O)[O-])c3)CC2)CC1 ZINC000422014427 513524308 /nfs/dbraw/zinc/52/43/08/513524308.db2.gz YXDJVNWZFQEDNI-UHFFFAOYSA-N 2 2 374.485 2.535 20 5 FFBDLP COc1cc(C[N@@H+]2CCC[NH2+]CC2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000435377446 513568571 /nfs/dbraw/zinc/56/85/71/513568571.db2.gz BNOOMLMKVXPQIG-UHFFFAOYSA-N 2 2 371.437 2.978 20 5 FFBDLP COc1cc(C[N@H+]2CCC[NH2+]CC2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000435377446 513568579 /nfs/dbraw/zinc/56/85/79/513568579.db2.gz BNOOMLMKVXPQIG-UHFFFAOYSA-N 2 2 371.437 2.978 20 5 FFBDLP CC(C)C[C@@H](CNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-])[NH+](C)C ZINC000447815703 513580225 /nfs/dbraw/zinc/58/02/25/513580225.db2.gz FZPBNOWPFLDRRT-KRWDZBQOSA-N 2 2 364.490 2.815 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1C[N@@H+](Cc1nccn1C)[C@@H]1CC12CC[NH2+]CC2 ZINC000435434289 513585855 /nfs/dbraw/zinc/58/58/55/513585855.db2.gz XFKAATDBMYWFOC-GOSISDBHSA-N 2 2 369.469 2.781 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1C[N@H+](Cc1nccn1C)[C@@H]1CC12CC[NH2+]CC2 ZINC000435434289 513585860 /nfs/dbraw/zinc/58/58/60/513585860.db2.gz XFKAATDBMYWFOC-GOSISDBHSA-N 2 2 369.469 2.781 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1CN(Cc1[nH+]ccn1C)[C@@H]1CC12CC[NH2+]CC2 ZINC000435434289 513585864 /nfs/dbraw/zinc/58/58/64/513585864.db2.gz XFKAATDBMYWFOC-GOSISDBHSA-N 2 2 369.469 2.781 20 5 FFBDLP Cc1c(C[N@@H+](Cc2nccn2C)[C@H]2CC23CC[NH2+]CC3)cccc1[N+](=O)[O-] ZINC000435695929 513660638 /nfs/dbraw/zinc/66/06/38/513660638.db2.gz OQQHCSZYOPTVIN-SFHVURJKSA-N 2 2 369.469 2.781 20 5 FFBDLP Cc1c(C[N@H+](Cc2nccn2C)[C@H]2CC23CC[NH2+]CC3)cccc1[N+](=O)[O-] ZINC000435695929 513660644 /nfs/dbraw/zinc/66/06/44/513660644.db2.gz OQQHCSZYOPTVIN-SFHVURJKSA-N 2 2 369.469 2.781 20 5 FFBDLP Cc1c(CN(Cc2[nH+]ccn2C)[C@H]2CC23CC[NH2+]CC3)cccc1[N+](=O)[O-] ZINC000435695929 513660648 /nfs/dbraw/zinc/66/06/48/513660648.db2.gz OQQHCSZYOPTVIN-SFHVURJKSA-N 2 2 369.469 2.781 20 5 FFBDLP COc1cc(C[N@@H+]2CCC[C@H]([C@H](C)[NH3+])C2)c([N+](=O)[O-])cc1OC(F)F ZINC000430598570 513700933 /nfs/dbraw/zinc/70/09/33/513700933.db2.gz TVYVIVWFUQZRIC-QWRGUYRKSA-N 2 2 359.373 2.764 20 5 FFBDLP COc1cc(C[N@H+]2CCC[C@H]([C@H](C)[NH3+])C2)c([N+](=O)[O-])cc1OC(F)F ZINC000430598570 513700942 /nfs/dbraw/zinc/70/09/42/513700942.db2.gz TVYVIVWFUQZRIC-QWRGUYRKSA-N 2 2 359.373 2.764 20 5 FFBDLP O=[N+]([O-])c1cc(C[NH2+]C[C@@H]2C[NH2+]CCO2)ccc1Oc1ccc(F)cc1 ZINC000415095370 514440803 /nfs/dbraw/zinc/44/08/03/514440803.db2.gz MJQSLJCNJGPCSF-INIZCTEOSA-N 2 2 361.373 2.604 20 5 FFBDLP CC[N@@H+]1CC[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)[C@H](C)C1 ZINC000449990730 514456140 /nfs/dbraw/zinc/45/61/40/514456140.db2.gz XCZKLNOJLSTKLW-ZBFHGGJFSA-N 2 2 371.441 2.583 20 5 FFBDLP CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)[C@H](C)C1 ZINC000449990730 514456148 /nfs/dbraw/zinc/45/61/48/514456148.db2.gz XCZKLNOJLSTKLW-ZBFHGGJFSA-N 2 2 371.441 2.583 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH+]1CCC(Nc2cccc[nH+]2)CC1 ZINC000535573696 516407215 /nfs/dbraw/zinc/40/72/15/516407215.db2.gz FWUQXFRNEVHWCI-UHFFFAOYSA-N 2 2 369.425 2.813 20 5 FFBDLP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000513656236 516709649 /nfs/dbraw/zinc/70/96/49/516709649.db2.gz QVBYEZRUHQTCAT-KDOFPFPSSA-N 2 2 368.441 2.849 20 5 FFBDLP CS[C@H]1CN(c2cc(C)[nH+]c(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H]1[NH+](C)C ZINC000533928434 517672708 /nfs/dbraw/zinc/67/27/08/517672708.db2.gz QQUMIOFKPNGYRY-HOTGVXAUSA-N 2 2 373.482 2.842 20 5 FFBDLP C[NH+]1CCC(CCO)([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000516490646 517707984 /nfs/dbraw/zinc/70/79/84/517707984.db2.gz LPIFYVBOLYGFGY-UHFFFAOYSA-N 2 2 359.426 2.791 20 5 FFBDLP CN(c1ccccc1)c1ccc(C[NH2+]C[C@]2(O)CC[N@H+](C)C2)cc1[N+](=O)[O-] ZINC000546563320 517726741 /nfs/dbraw/zinc/72/67/41/517726741.db2.gz JQUCDZQFCWBJIV-HXUWFJFHSA-N 2 2 370.453 2.519 20 5 FFBDLP CN(c1ccccc1)c1ccc(C[NH2+]C[C@]2(O)CC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC000546563320 517726747 /nfs/dbraw/zinc/72/67/47/517726747.db2.gz JQUCDZQFCWBJIV-HXUWFJFHSA-N 2 2 370.453 2.519 20 5 FFBDLP Cn1cc[nH+]c1[C@H](N[C@H]1CC[NH2+]C2(CCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000591582258 519958285 /nfs/dbraw/zinc/95/82/85/519958285.db2.gz BXHWZJMIMWXRDK-DOTOQJQBSA-N 2 2 355.442 2.682 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CCOCC2)cc1N[C@H]1CCC[N@@H+]2CCCC[C@H]12 ZINC000594604059 520049935 /nfs/dbraw/zinc/04/99/35/520049935.db2.gz XRPKZDRUBPUBKI-PKOBYXMFSA-N 2 2 374.485 2.856 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CCOCC2)cc1N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594604059 520049940 /nfs/dbraw/zinc/04/99/40/520049940.db2.gz XRPKZDRUBPUBKI-PKOBYXMFSA-N 2 2 374.485 2.856 20 5 FFBDLP COCCC[NH+]1CCC([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)CC1 ZINC000595035367 520263138 /nfs/dbraw/zinc/26/31/38/520263138.db2.gz IMYFYTIJZYAXBN-AWEZNQCLSA-N 2 2 351.447 2.755 20 5 FFBDLP CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](C(F)(F)F)[C@@H](C[NH3+])C1 ZINC000600729384 520427974 /nfs/dbraw/zinc/42/79/74/520427974.db2.gz YLLWWWFHWFOAGT-GXTWGEPZSA-N 2 2 361.364 2.953 20 5 FFBDLP CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](C(F)(F)F)[C@@H](C[NH3+])C1 ZINC000600729384 520427982 /nfs/dbraw/zinc/42/79/82/520427982.db2.gz YLLWWWFHWFOAGT-GXTWGEPZSA-N 2 2 361.364 2.953 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CCOCC2)cc1N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000615996190 521597732 /nfs/dbraw/zinc/59/77/32/521597732.db2.gz VNDCHFCVFPHSTQ-UHFFFAOYSA-N 2 2 371.441 2.534 20 5 FFBDLP COCC[N@@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)CC1CC[NH+](C)CC1 ZINC000879127045 732651567 /nfs/dbraw/zinc/65/15/67/732651567.db2.gz QEMFNPCBDMAAJR-UHFFFAOYSA-N 2 2 357.401 2.663 20 5 FFBDLP COCC[N@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)CC1CC[NH+](C)CC1 ZINC000879127045 732651569 /nfs/dbraw/zinc/65/15/69/732651569.db2.gz QEMFNPCBDMAAJR-UHFFFAOYSA-N 2 2 357.401 2.663 20 5 FFBDLP O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1 ZINC000893011533 734637498 /nfs/dbraw/zinc/63/74/98/734637498.db2.gz KRRHZGMXSREWGY-ZDUSSCGKSA-N 2 2 353.850 2.839 20 5 FFBDLP COc1cc([C@@H](C)[NH2+]CCC[N@@H+]2CCCO[C@@H](C)C2)cc([N+](=O)[O-])c1 ZINC000903160469 736044790 /nfs/dbraw/zinc/04/47/90/736044790.db2.gz MMOYSLOTQZGUPN-LSDHHAIUSA-N 2 2 351.447 2.755 20 5 FFBDLP COc1cc([C@@H](C)[NH2+]CCC[N@H+]2CCCO[C@@H](C)C2)cc([N+](=O)[O-])c1 ZINC000903160469 736044795 /nfs/dbraw/zinc/04/47/95/736044795.db2.gz MMOYSLOTQZGUPN-LSDHHAIUSA-N 2 2 351.447 2.755 20 5 FFBDLP O=[N+]([O-])c1cnn(C2CC([NH2+]C[C@H]3CCC[N@@H+]3Cc3ccccc3)C2)c1 ZINC000877046278 1014460387 /nfs/dbraw/zinc/46/03/87/1014460387.db2.gz KTRGXVPCRWBTJN-LXPRWKDFSA-N 2 2 355.442 2.749 20 5 FFBDLP O=[N+]([O-])c1cnn(C2CC([NH2+]C[C@H]3CCC[N@H+]3Cc3ccccc3)C2)c1 ZINC000877046278 1014460395 /nfs/dbraw/zinc/46/03/95/1014460395.db2.gz KTRGXVPCRWBTJN-LXPRWKDFSA-N 2 2 355.442 2.749 20 5 FFBDLP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H]2C[NH+](Cc3ccccn3)C[C@H]2C1 ZINC001173228530 1012363769 /nfs/dbraw/zinc/36/37/69/1012363769.db2.gz YVFYSBMWCUNEOL-YTQUADARSA-N 2 2 366.465 2.985 20 5 FFBDLP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H]2C[NH+](Cc3ccccn3)C[C@H]2C1 ZINC001173228530 1012363781 /nfs/dbraw/zinc/36/37/81/1012363781.db2.gz YVFYSBMWCUNEOL-YTQUADARSA-N 2 2 366.465 2.985 20 5 FFBDLP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1C[C@H]2C[N@@H+](Cc3ccccn3)C[C@H]2C1 ZINC001173228530 1012363788 /nfs/dbraw/zinc/36/37/88/1012363788.db2.gz YVFYSBMWCUNEOL-YTQUADARSA-N 2 2 366.465 2.985 20 5 FFBDLP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1C[C@H]2C[N@H+](Cc3ccccn3)C[C@H]2C1 ZINC001173228530 1012363794 /nfs/dbraw/zinc/36/37/94/1012363794.db2.gz YVFYSBMWCUNEOL-YTQUADARSA-N 2 2 366.465 2.985 20 5 FFBDLP C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848483140 1060121373 /nfs/dbraw/zinc/12/13/73/1060121373.db2.gz YUPQNXYUUYPKQJ-CRAIPNDOSA-N 2 2 355.442 2.832 20 5 FFBDLP C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848483140 1060121375 /nfs/dbraw/zinc/12/13/75/1060121375.db2.gz YUPQNXYUUYPKQJ-CRAIPNDOSA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848483140 1060121378 /nfs/dbraw/zinc/12/13/78/1060121378.db2.gz YUPQNXYUUYPKQJ-CRAIPNDOSA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848483140 1060121382 /nfs/dbraw/zinc/12/13/82/1060121382.db2.gz YUPQNXYUUYPKQJ-CRAIPNDOSA-N 2 2 355.442 2.832 20 5 FFBDLP C[C@@H]1C[C@@H]([NH+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[N@@H+]1C ZINC000093643727 250037977 /nfs/dbraw/zinc/03/79/77/250037977.db2.gz HMVXHNNZSXELAV-KDOFPFPSSA-N 2 2 357.458 2.910 20 5 FFBDLP C[C@@H]1C[C@@H]([NH+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000093643727 250037981 /nfs/dbraw/zinc/03/79/81/250037981.db2.gz HMVXHNNZSXELAV-KDOFPFPSSA-N 2 2 357.458 2.910 20 5 FFBDLP C[C@@H]1C[C@@H]([N@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[NH+]1C ZINC000093643727 250037984 /nfs/dbraw/zinc/03/79/84/250037984.db2.gz HMVXHNNZSXELAV-KDOFPFPSSA-N 2 2 357.458 2.910 20 5 FFBDLP C[C@@H]1C[C@@H]([N@@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[NH+]1C ZINC000093643727 250037988 /nfs/dbraw/zinc/03/79/88/250037988.db2.gz HMVXHNNZSXELAV-KDOFPFPSSA-N 2 2 357.458 2.910 20 5 FFBDLP C[C@H](C[N@@H+]1CCC[C@@H](C)C1)NC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000055402216 506743923 /nfs/dbraw/zinc/74/39/23/506743923.db2.gz XWTVORWYCAUNKQ-HUUCEWRRSA-N 2 2 371.441 2.631 20 5 FFBDLP C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000055402216 506743925 /nfs/dbraw/zinc/74/39/25/506743925.db2.gz XWTVORWYCAUNKQ-HUUCEWRRSA-N 2 2 371.441 2.631 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@@H+]2Cc1cc([N+](=O)[O-])ccc1Cl ZINC000371294774 512312193 /nfs/dbraw/zinc/31/21/93/512312193.db2.gz MZJTZDINJUBACJ-XYPHTWIQSA-N 2 2 353.850 2.932 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCC[N@H+]2Cc1cc([N+](=O)[O-])ccc1Cl ZINC000371294774 512312195 /nfs/dbraw/zinc/31/21/95/512312195.db2.gz MZJTZDINJUBACJ-XYPHTWIQSA-N 2 2 353.850 2.932 20 5 FFBDLP O=[N+]([O-])c1cnn(CC[NH2+]C2CC[NH+](Cc3ccccc3Cl)CC2)c1 ZINC000090539796 507926110 /nfs/dbraw/zinc/92/61/10/507926110.db2.gz DWWILZNFETYAPW-UHFFFAOYSA-N 2 2 363.849 2.699 20 5 FFBDLP C[C@H]1CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H]1n1cc[nH+]c1 ZINC000156454912 508423552 /nfs/dbraw/zinc/42/35/52/508423552.db2.gz BLEBKEBRXYASDH-BBRMVZONSA-N 2 2 368.397 2.924 20 5 FFBDLP C[C@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H]1n1cc[nH+]c1 ZINC000156454912 508423557 /nfs/dbraw/zinc/42/35/57/508423557.db2.gz BLEBKEBRXYASDH-BBRMVZONSA-N 2 2 368.397 2.924 20 5 FFBDLP CCOc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+]2CCOC)cc1[N+](=O)[O-] ZINC000153554002 508596391 /nfs/dbraw/zinc/59/63/91/508596391.db2.gz YVEAPJWMEWWIOJ-GOEBONIOSA-N 2 2 351.447 2.755 20 5 FFBDLP CCOc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+]2CCOC)cc1[N+](=O)[O-] ZINC000153554002 508596392 /nfs/dbraw/zinc/59/63/92/508596392.db2.gz YVEAPJWMEWWIOJ-GOEBONIOSA-N 2 2 351.447 2.755 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@H](Oc3cc[nH+]cc3)C2)cccc1[N+](=O)[O-] ZINC000154073958 508711734 /nfs/dbraw/zinc/71/17/34/508711734.db2.gz WNVPWLPUKDIDCY-HOCLYGCPSA-N 2 2 370.409 2.779 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@H](Oc3cc[nH+]cc3)C2)cccc1[N+](=O)[O-] ZINC000154073958 508711739 /nfs/dbraw/zinc/71/17/39/508711739.db2.gz WNVPWLPUKDIDCY-HOCLYGCPSA-N 2 2 370.409 2.779 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000129365671 508719009 /nfs/dbraw/zinc/71/90/09/508719009.db2.gz YTWTYGHLHOKVEF-WMLDXEAASA-N 2 2 357.414 2.621 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000129365671 508719013 /nfs/dbraw/zinc/71/90/13/508719013.db2.gz YTWTYGHLHOKVEF-WMLDXEAASA-N 2 2 357.414 2.621 20 5 FFBDLP CC[N@@H+]1CC[C@H]2CC[C@@H](C1)[NH+]2CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000177304975 509988346 /nfs/dbraw/zinc/98/83/46/509988346.db2.gz KKPKQSJJZVNNPL-WBVHZDCISA-N 2 2 360.458 2.790 20 5 FFBDLP CC[N@H+]1CC[C@H]2CC[C@@H](C1)[NH+]2CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000177304975 509988357 /nfs/dbraw/zinc/98/83/57/509988357.db2.gz KKPKQSJJZVNNPL-WBVHZDCISA-N 2 2 360.458 2.790 20 5 FFBDLP CC[NH+]1CC[C@H]2CC[C@@H](C1)[N@@H+]2CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000177304975 509988364 /nfs/dbraw/zinc/98/83/64/509988364.db2.gz KKPKQSJJZVNNPL-WBVHZDCISA-N 2 2 360.458 2.790 20 5 FFBDLP CC[NH+]1CC[C@H]2CC[C@@H](C1)[N@H+]2CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000177304975 509988371 /nfs/dbraw/zinc/98/83/71/509988371.db2.gz KKPKQSJJZVNNPL-WBVHZDCISA-N 2 2 360.458 2.790 20 5 FFBDLP CC[NH+](CC)C[C@@H]1CC[N@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000174226169 510013564 /nfs/dbraw/zinc/01/35/64/510013564.db2.gz WFDKFPIWLVMMKZ-HNNXBMFYSA-N 2 2 351.447 2.646 20 5 FFBDLP CC[NH+](CC)C[C@@H]1CC[N@@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000174226169 510013569 /nfs/dbraw/zinc/01/35/69/510013569.db2.gz WFDKFPIWLVMMKZ-HNNXBMFYSA-N 2 2 351.447 2.646 20 5 FFBDLP CN(CC[N@H+](C)C1CC[NH+](C)CC1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000180936724 510192798 /nfs/dbraw/zinc/19/27/98/510192798.db2.gz IICKVJNNDDVAIH-UHFFFAOYSA-N 2 2 354.882 2.706 20 5 FFBDLP CN(CC[N@@H+](C)C1CC[NH+](C)CC1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000180936724 510192802 /nfs/dbraw/zinc/19/28/02/510192802.db2.gz IICKVJNNDDVAIH-UHFFFAOYSA-N 2 2 354.882 2.706 20 5 FFBDLP CN(CC[N@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-])C1CC[NH+](C)CC1 ZINC000180936724 510192808 /nfs/dbraw/zinc/19/28/08/510192808.db2.gz IICKVJNNDDVAIH-UHFFFAOYSA-N 2 2 354.882 2.706 20 5 FFBDLP CN(CC[N@@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-])C1CC[NH+](C)CC1 ZINC000180936724 510192811 /nfs/dbraw/zinc/19/28/11/510192811.db2.gz IICKVJNNDDVAIH-UHFFFAOYSA-N 2 2 354.882 2.706 20 5 FFBDLP C[C@H]1C[C@@H]([NH+](C)CCn2cc([N+](=O)[O-])cn2)CC[N@@H+]1Cc1ccccc1 ZINC000174870579 510356243 /nfs/dbraw/zinc/35/62/43/510356243.db2.gz PNJOUZXSNYLMQL-WMZOPIPTSA-N 2 2 357.458 2.776 20 5 FFBDLP C[C@H]1C[C@@H]([NH+](C)CCn2cc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1 ZINC000174870579 510356247 /nfs/dbraw/zinc/35/62/47/510356247.db2.gz PNJOUZXSNYLMQL-WMZOPIPTSA-N 2 2 357.458 2.776 20 5 FFBDLP C[C@H]1C[C@@H]([N@H+](C)CCn2cc([N+](=O)[O-])cn2)CC[NH+]1Cc1ccccc1 ZINC000174870579 510356253 /nfs/dbraw/zinc/35/62/53/510356253.db2.gz PNJOUZXSNYLMQL-WMZOPIPTSA-N 2 2 357.458 2.776 20 5 FFBDLP C[C@H]1C[C@@H]([N@@H+](C)CCn2cc([N+](=O)[O-])cn2)CC[NH+]1Cc1ccccc1 ZINC000174870579 510356258 /nfs/dbraw/zinc/35/62/58/510356258.db2.gz PNJOUZXSNYLMQL-WMZOPIPTSA-N 2 2 357.458 2.776 20 5 FFBDLP C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000247121262 510840114 /nfs/dbraw/zinc/84/01/14/510840114.db2.gz MQOHHRHEPCOFNP-GJZGRUSLSA-N 2 2 371.441 2.610 20 5 FFBDLP C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000247121262 510840115 /nfs/dbraw/zinc/84/01/15/510840115.db2.gz MQOHHRHEPCOFNP-GJZGRUSLSA-N 2 2 371.441 2.610 20 5 FFBDLP CC(C)[NH+]1CCN(C2CC[NH+](Cc3ccc([N+](=O)[O-])c(F)c3)CC2)CC1 ZINC000283148427 511254941 /nfs/dbraw/zinc/25/49/41/511254941.db2.gz OJUWCSHXOWPILB-UHFFFAOYSA-N 2 2 364.465 2.724 20 5 FFBDLP CC(C)[NH+]1CCC([NH+]2CCN(c3c4c(ccc3[N+](=O)[O-])NCC4)CC2)CC1 ZINC000436400077 513845419 /nfs/dbraw/zinc/84/54/19/513845419.db2.gz LFJIXOWNCWGPKK-UHFFFAOYSA-N 2 2 373.501 2.558 20 5 FFBDLP C[C@H](C[N@@H+]1CCC[C@@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000448780393 513894120 /nfs/dbraw/zinc/89/41/20/513894120.db2.gz JTEABVRVSHWLKH-HUUCEWRRSA-N 2 2 371.441 2.631 20 5 FFBDLP C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000448780393 513894125 /nfs/dbraw/zinc/89/41/25/513894125.db2.gz JTEABVRVSHWLKH-HUUCEWRRSA-N 2 2 371.441 2.631 20 5 FFBDLP C[C@@H]([NH2+]C[C@]1(O)CC[N@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000467849781 515146670 /nfs/dbraw/zinc/14/66/70/515146670.db2.gz IRKZSXCAQWFDJD-OXQOHEQNSA-N 2 2 355.438 2.882 20 5 FFBDLP C[C@@H]([NH2+]C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000467849781 515146674 /nfs/dbraw/zinc/14/66/74/515146674.db2.gz IRKZSXCAQWFDJD-OXQOHEQNSA-N 2 2 355.438 2.882 20 5 FFBDLP CC[N@@H+]1CCCC[C@@H]1CNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000472340590 515234700 /nfs/dbraw/zinc/23/47/00/515234700.db2.gz NMGIIXQONJYFML-QGZVFWFLSA-N 2 2 362.474 2.713 20 5 FFBDLP CC[N@H+]1CCCC[C@@H]1CNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000472340590 515234706 /nfs/dbraw/zinc/23/47/06/515234706.db2.gz NMGIIXQONJYFML-QGZVFWFLSA-N 2 2 362.474 2.713 20 5 FFBDLP O=C(CC[NH+]1CCC(Nc2cccc[nH+]2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000535574583 516406200 /nfs/dbraw/zinc/40/62/00/516406200.db2.gz HRPROVBHDPVERO-UHFFFAOYSA-N 2 2 369.425 2.895 20 5 FFBDLP NC(=O)c1ccc(C[NH+]2CCC(CCCn3cc[nH+]c3)CC2)c([N+](=O)[O-])c1 ZINC000543988405 516526452 /nfs/dbraw/zinc/52/64/52/516526452.db2.gz NSVORYMUOSRMHH-UHFFFAOYSA-N 2 2 371.441 2.583 20 5 FFBDLP Cc1cn2c([nH+]1)[C@H](C[NH2+][C@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000531988147 516744737 /nfs/dbraw/zinc/74/47/37/516744737.db2.gz DNKZNUGFDDFGKY-HIFRSBDPSA-N 2 2 371.441 2.984 20 5 FFBDLP CC[C@H](C)[N@H+](C)CCNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000562234657 516971682 /nfs/dbraw/zinc/97/16/82/516971682.db2.gz XYWDZGPBJIBBDW-HNNXBMFYSA-N 2 2 350.463 2.569 20 5 FFBDLP CC[C@H](C)[N@@H+](C)CCNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000562234657 516971690 /nfs/dbraw/zinc/97/16/90/516971690.db2.gz XYWDZGPBJIBBDW-HNNXBMFYSA-N 2 2 350.463 2.569 20 5 FFBDLP O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C[C@]1(O)CC[N@H+](Cc2ccccc2)C1 ZINC000579376485 518651439 /nfs/dbraw/zinc/65/14/39/518651439.db2.gz SPDCCAOKOPDTNM-PZJWPPBQSA-N 2 2 367.449 2.809 20 5 FFBDLP O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000579376485 518651445 /nfs/dbraw/zinc/65/14/45/518651445.db2.gz SPDCCAOKOPDTNM-PZJWPPBQSA-N 2 2 367.449 2.809 20 5 FFBDLP Cc1cn2c([nH+]1)[C@H](C[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])CCC2 ZINC000564851853 518653361 /nfs/dbraw/zinc/65/33/61/518653361.db2.gz GQDHTBCWSVPXMB-AWEZNQCLSA-N 2 2 357.414 2.596 20 5 FFBDLP C[N@@H+]1CC[C@@H]([NH2+]CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000589267644 518968545 /nfs/dbraw/zinc/96/85/45/518968545.db2.gz CMDHYZBUXSCCDU-QUCCMNQESA-N 2 2 368.437 2.958 20 5 FFBDLP C[N@H+]1CC[C@@H]([NH2+]CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000589267644 518968553 /nfs/dbraw/zinc/96/85/53/518968553.db2.gz CMDHYZBUXSCCDU-QUCCMNQESA-N 2 2 368.437 2.958 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000589505983 519020311 /nfs/dbraw/zinc/02/03/11/519020311.db2.gz SVUPVLKBWIWCPX-QAPCUYQASA-N 2 2 373.453 2.830 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000589505983 519020316 /nfs/dbraw/zinc/02/03/16/519020316.db2.gz SVUPVLKBWIWCPX-QAPCUYQASA-N 2 2 373.453 2.830 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000589505983 519020323 /nfs/dbraw/zinc/02/03/23/519020323.db2.gz SVUPVLKBWIWCPX-QAPCUYQASA-N 2 2 373.453 2.830 20 5 FFBDLP Cc1cn2c([nH+]1)[C@H](C[NH2+][C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)CCC2 ZINC000575206888 519554482 /nfs/dbraw/zinc/55/44/82/519554482.db2.gz IZWCHFSOKIWCGK-JYJNAYRXSA-N 2 2 358.446 2.947 20 5 FFBDLP Cn1cc(C[NH+]2CCC(Cc3[nH]c4ccccc4[nH+]3)CC2)c([N+](=O)[O-])n1 ZINC000602847869 519924224 /nfs/dbraw/zinc/92/42/24/519924224.db2.gz UREAUKHRXATJJG-UHFFFAOYSA-N 2 2 354.414 2.659 20 5 FFBDLP C[N@@H+](Cc1ccccc1)C[C@H](O)Cn1cc[nH+]c1-c1ccc([N+](=O)[O-])cc1 ZINC000608860478 520147042 /nfs/dbraw/zinc/14/70/42/520147042.db2.gz PNHMDNWEESLRBG-IBGZPJMESA-N 2 2 366.421 2.951 20 5 FFBDLP C[N@H+](Cc1ccccc1)C[C@H](O)Cn1cc[nH+]c1-c1ccc([N+](=O)[O-])cc1 ZINC000608860478 520147054 /nfs/dbraw/zinc/14/70/54/520147054.db2.gz PNHMDNWEESLRBG-IBGZPJMESA-N 2 2 366.421 2.951 20 5 FFBDLP O=C(C[N@@H+]1CCC[C@@H](n2cc[nH+]c2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000609157396 520213897 /nfs/dbraw/zinc/21/38/97/520213897.db2.gz IUJAGZLZYXYMKG-CYBMUJFWSA-N 2 2 363.805 2.720 20 5 FFBDLP O=C(C[N@H+]1CCC[C@@H](n2cc[nH+]c2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000609157396 520213903 /nfs/dbraw/zinc/21/39/03/520213903.db2.gz IUJAGZLZYXYMKG-CYBMUJFWSA-N 2 2 363.805 2.720 20 5 FFBDLP C[N@@H+]1CCN(Cc2ccccc2)[C@@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000594993104 520245525 /nfs/dbraw/zinc/24/55/25/520245525.db2.gz BKXMMJCUIKBBKA-FQEVSTJZSA-N 2 2 354.454 2.501 20 5 FFBDLP C[N@H+]1CCN(Cc2ccccc2)[C@@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000594993104 520245529 /nfs/dbraw/zinc/24/55/29/520245529.db2.gz BKXMMJCUIKBBKA-FQEVSTJZSA-N 2 2 354.454 2.501 20 5 FFBDLP O=[N+]([O-])c1ccc(CC[NH2+][C@@]2(CO)CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000609620441 520383284 /nfs/dbraw/zinc/38/32/84/520383284.db2.gz YXESOCGEVBUHAD-NRFANRHFSA-N 2 2 369.465 2.754 20 5 FFBDLP O=[N+]([O-])c1ccc(CC[NH2+][C@@]2(CO)CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000609620441 520383290 /nfs/dbraw/zinc/38/32/90/520383290.db2.gz YXESOCGEVBUHAD-NRFANRHFSA-N 2 2 369.465 2.754 20 5 FFBDLP CC[C@@H]1C[N@H+](Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])CC[C@H]1[NH3+] ZINC000592427616 520387061 /nfs/dbraw/zinc/38/70/61/520387061.db2.gz HWYPGLPDMPHNLI-DGCLKSJQSA-N 2 2 373.400 2.807 20 5 FFBDLP CC[C@@H]1C[N@@H+](Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])CC[C@H]1[NH3+] ZINC000592427616 520387068 /nfs/dbraw/zinc/38/70/68/520387068.db2.gz HWYPGLPDMPHNLI-DGCLKSJQSA-N 2 2 373.400 2.807 20 5 FFBDLP CC[C@@H]1C[N@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])CC[C@H]1[NH3+] ZINC000592427654 520387568 /nfs/dbraw/zinc/38/75/68/520387568.db2.gz NJUMTADJDFZLPM-ZYHUDNBSSA-N 2 2 359.373 2.764 20 5 FFBDLP CC[C@@H]1C[N@@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])CC[C@H]1[NH3+] ZINC000592427654 520387570 /nfs/dbraw/zinc/38/75/70/520387570.db2.gz NJUMTADJDFZLPM-ZYHUDNBSSA-N 2 2 359.373 2.764 20 5 FFBDLP Cc1cc(N2CCC[C@H]3C[NH2+]CC[C@H]32)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000601982643 521057032 /nfs/dbraw/zinc/05/70/32/521057032.db2.gz KKUDHJDXJXRKCQ-DOTOQJQBSA-N 2 2 353.426 2.939 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2ccc(C[NH+]3CCC([N@@H+]4CC[C@H](O)C4)CC3)o2)c1 ZINC000597234861 521588304 /nfs/dbraw/zinc/58/83/04/521588304.db2.gz CEJIGTOWIVWPOV-SFHVURJKSA-N 2 2 371.437 2.886 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2ccc(C[NH+]3CCC([N@H+]4CC[C@H](O)C4)CC3)o2)c1 ZINC000597234861 521588309 /nfs/dbraw/zinc/58/83/09/521588309.db2.gz CEJIGTOWIVWPOV-SFHVURJKSA-N 2 2 371.437 2.886 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1C[C@H]2CC[C@@H](C1)N2C1CC[NH2+]CC1 ZINC000903507407 1015943651 /nfs/dbraw/zinc/94/36/51/1015943651.db2.gz YKMLJTATZSLLNT-LZQZEXGQSA-N 2 2 358.486 2.865 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1C[C@H]2CC[C@@H](C1)N2C1CC[NH2+]CC1 ZINC000903507407 1015943658 /nfs/dbraw/zinc/94/36/58/1015943658.db2.gz YKMLJTATZSLLNT-LZQZEXGQSA-N 2 2 358.486 2.865 20 5 FFBDLP C[NH+](C)CCCC1CC[NH+](Cn2c3cc([N+](=O)[O-])ccc3oc2=O)CC1 ZINC000159993119 1022864878 /nfs/dbraw/zinc/86/48/78/1022864878.db2.gz PMSOAICMEJLYKG-UHFFFAOYSA-N 2 2 362.430 2.514 20 5 FFBDLP O=C(CC[N@@H+]1CCCC[C@@H]1[C@H]1CCC[NH2+]1)Nc1cc([N+](=O)[O-])ccc1F ZINC000842473108 1030748382 /nfs/dbraw/zinc/74/83/82/1030748382.db2.gz PSORPNPXYLGNQQ-NVXWUHKLSA-N 2 2 364.421 2.669 20 5 FFBDLP O=C(CC[N@H+]1CCCC[C@@H]1[C@H]1CCC[NH2+]1)Nc1cc([N+](=O)[O-])ccc1F ZINC000842473108 1030748396 /nfs/dbraw/zinc/74/83/96/1030748396.db2.gz PSORPNPXYLGNQQ-NVXWUHKLSA-N 2 2 364.421 2.669 20 5 FFBDLP COc1cc(N2CCC([NH2+]CCOc3cc[nH+]cc3)CC2)ccc1[N+](=O)[O-] ZINC001256094562 1038380298 /nfs/dbraw/zinc/38/02/98/1038380298.db2.gz KYFMFYVIBHUMPP-UHFFFAOYSA-N 2 2 372.425 2.636 20 5 FFBDLP COc1cc(N2CCC([N@@H+]3C[C@H]4CCC[NH+](C)[C@@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256101344 1038386569 /nfs/dbraw/zinc/38/65/69/1038386569.db2.gz FMPGJPWTXYBQDE-DNVCBOLYSA-N 2 2 374.485 2.598 20 5 FFBDLP COc1cc(N2CCC([N@H+]3C[C@H]4CCC[NH+](C)[C@@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256101344 1038386583 /nfs/dbraw/zinc/38/65/83/1038386583.db2.gz FMPGJPWTXYBQDE-DNVCBOLYSA-N 2 2 374.485 2.598 20 5 FFBDLP COc1cc(N2CCC([NH+]3C[C@H]4CCC[N@H+](C)[C@@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256101344 1038386597 /nfs/dbraw/zinc/38/65/97/1038386597.db2.gz FMPGJPWTXYBQDE-DNVCBOLYSA-N 2 2 374.485 2.598 20 5 FFBDLP COc1cc(N2CCC([NH+]3C[C@H]4CCC[N@@H+](C)[C@@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256101344 1038386613 /nfs/dbraw/zinc/38/66/13/1038386613.db2.gz FMPGJPWTXYBQDE-DNVCBOLYSA-N 2 2 374.485 2.598 20 5 FFBDLP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1 ZINC000093742184 250044265 /nfs/dbraw/zinc/04/42/65/250044265.db2.gz LSRJPHJNDSSDIB-CQSZACIVSA-N 2 2 351.447 2.776 20 5 FFBDLP CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1 ZINC000093742184 250044270 /nfs/dbraw/zinc/04/42/70/250044270.db2.gz LSRJPHJNDSSDIB-CQSZACIVSA-N 2 2 351.447 2.776 20 5 FFBDLP CCC[NH+](C)C[C@H]1CC[N@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1 ZINC000093742184 250044275 /nfs/dbraw/zinc/04/42/75/250044275.db2.gz LSRJPHJNDSSDIB-CQSZACIVSA-N 2 2 351.447 2.776 20 5 FFBDLP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1 ZINC000093742184 250044278 /nfs/dbraw/zinc/04/42/78/250044278.db2.gz LSRJPHJNDSSDIB-CQSZACIVSA-N 2 2 351.447 2.776 20 5 FFBDLP Cn1cc[nH+]c1[C@H](NCC[N@H+](C)C1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000272475876 252047058 /nfs/dbraw/zinc/04/70/58/252047058.db2.gz BEZDINIIJMEIEW-GOSISDBHSA-N 2 2 357.458 2.882 20 5 FFBDLP Cn1cc[nH+]c1[C@H](NCC[N@@H+](C)C1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000272475876 252047061 /nfs/dbraw/zinc/04/70/61/252047061.db2.gz BEZDINIIJMEIEW-GOSISDBHSA-N 2 2 357.458 2.882 20 5 FFBDLP CCCn1cc[nH+]c1CCC[N@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000277171039 256168098 /nfs/dbraw/zinc/16/80/98/256168098.db2.gz KRJUZOBQSXITAD-UHFFFAOYSA-N 2 2 373.457 2.729 20 5 FFBDLP CCCn1cc[nH+]c1CCC[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000277171039 256168099 /nfs/dbraw/zinc/16/80/99/256168099.db2.gz KRJUZOBQSXITAD-UHFFFAOYSA-N 2 2 373.457 2.729 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H](c2[nH+]ccn2C)C1 ZINC000373100471 512171553 /nfs/dbraw/zinc/17/15/53/512171553.db2.gz RYONZTFONJYHKN-HNNXBMFYSA-N 2 2 371.441 2.845 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@H](c2[nH+]ccn2C)C1 ZINC000373100471 512171554 /nfs/dbraw/zinc/17/15/54/512171554.db2.gz RYONZTFONJYHKN-HNNXBMFYSA-N 2 2 371.441 2.845 20 5 FFBDLP CC[N@@H+]1CC[C@@H](N(C)C(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000076486607 508212868 /nfs/dbraw/zinc/21/28/68/508212868.db2.gz VSCBCKWICVFMOP-GDBMZVCRSA-N 2 2 371.441 2.583 20 5 FFBDLP CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000076486607 508212869 /nfs/dbraw/zinc/21/28/69/508212869.db2.gz VSCBCKWICVFMOP-GDBMZVCRSA-N 2 2 371.441 2.583 20 5 FFBDLP C[NH+]1CCC([NH+]2CCC(Nc3ncc(Cl)cc3[N+](=O)[O-])CC2)CC1 ZINC000153652351 508617191 /nfs/dbraw/zinc/61/71/91/508617191.db2.gz TUSLIFPWNGQVLY-UHFFFAOYSA-N 2 2 353.854 2.614 20 5 FFBDLP C[NH+]1CCC([N@H+](CCO)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000155505872 509015574 /nfs/dbraw/zinc/01/55/74/509015574.db2.gz KGNAJVROJUBYDH-UHFFFAOYSA-N 2 2 359.426 2.743 20 5 FFBDLP C[NH+]1CCC([N@@H+](CCO)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000155505872 509015578 /nfs/dbraw/zinc/01/55/78/509015578.db2.gz KGNAJVROJUBYDH-UHFFFAOYSA-N 2 2 359.426 2.743 20 5 FFBDLP C[C@@H]([NH2+]C[C@@H](O)C[N@@H+]1CCc2ccccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000173315896 509527059 /nfs/dbraw/zinc/52/70/59/509527059.db2.gz ONUBAVLLWQOWCN-FOIQADDNSA-N 2 2 355.438 2.665 20 5 FFBDLP C[C@@H]([NH2+]C[C@@H](O)C[N@H+]1CCc2ccccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000173315896 509527066 /nfs/dbraw/zinc/52/70/66/509527066.db2.gz ONUBAVLLWQOWCN-FOIQADDNSA-N 2 2 355.438 2.665 20 5 FFBDLP C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000247781863 510870526 /nfs/dbraw/zinc/87/05/26/510870526.db2.gz XTBUISOICGAPIQ-JKIFEVAISA-N 2 2 357.414 2.701 20 5 FFBDLP C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000247781863 510870527 /nfs/dbraw/zinc/87/05/27/510870527.db2.gz XTBUISOICGAPIQ-JKIFEVAISA-N 2 2 357.414 2.701 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH+]1CCC(c2c[nH]c[nH+]2)CC1 ZINC000374210100 512708024 /nfs/dbraw/zinc/70/80/24/512708024.db2.gz FDSZNGCIYJYBHE-UHFFFAOYSA-N 2 2 357.414 2.835 20 5 FFBDLP COc1cc(C[N@@H+]2CCC[C@@H]([C@H](C)[NH3+])C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000435372742 513567480 /nfs/dbraw/zinc/56/74/80/513567480.db2.gz CDEAVCXIKUJYMR-NWDGAFQWSA-N 2 2 373.400 2.807 20 5 FFBDLP COc1cc(C[N@H+]2CCC[C@@H]([C@H](C)[NH3+])C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000435372742 513567483 /nfs/dbraw/zinc/56/74/83/513567483.db2.gz CDEAVCXIKUJYMR-NWDGAFQWSA-N 2 2 373.400 2.807 20 5 FFBDLP C[C@@H](C[NH+]1CCCCC1)Nc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000447807175 513576436 /nfs/dbraw/zinc/57/64/36/513576436.db2.gz QHCFQLMAPRQVRJ-INIZCTEOSA-N 2 2 362.474 2.713 20 5 FFBDLP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](O)C[N@@H+]1CCc2ccccc2C1 ZINC000449071327 514059562 /nfs/dbraw/zinc/05/95/62/514059562.db2.gz AZEKDWPYHWUQOF-OXJNMPFZSA-N 2 2 369.465 2.535 20 5 FFBDLP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000449071327 514059568 /nfs/dbraw/zinc/05/95/68/514059568.db2.gz AZEKDWPYHWUQOF-OXJNMPFZSA-N 2 2 369.465 2.535 20 5 FFBDLP C[C@@H]1CN(c2ccnc3c2cccc3[N+](=O)[O-])CC[N@@H+]1C1CC[NH+](C)CC1 ZINC000432138359 514104765 /nfs/dbraw/zinc/10/47/65/514104765.db2.gz LBZFVSZTYOSWPT-OAHLLOKOSA-N 2 2 369.469 2.748 20 5 FFBDLP C[C@@H]1CN(c2ccnc3c2cccc3[N+](=O)[O-])CC[N@H+]1C1CC[NH+](C)CC1 ZINC000432138359 514104767 /nfs/dbraw/zinc/10/47/67/514104767.db2.gz LBZFVSZTYOSWPT-OAHLLOKOSA-N 2 2 369.469 2.748 20 5 FFBDLP CN1CC[NH2+]C[C@@H]1C[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000414966835 514379645 /nfs/dbraw/zinc/37/96/45/514379645.db2.gz ANGWDKUAPJGLKT-MRXNPFEDSA-N 2 2 374.416 2.519 20 5 FFBDLP CCc1ccccc1[C@H]([NH3+])C[NH2+]Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000415063437 514422827 /nfs/dbraw/zinc/42/28/27/514422827.db2.gz IALDYGYZRGTPOJ-MRXNPFEDSA-N 2 2 359.426 2.964 20 5 FFBDLP COc1cc(C[N@@H+]2CC[C@H](C)[C@H](C[NH3+])C2)c([N+](=O)[O-])cc1OC(F)F ZINC000415103285 514445236 /nfs/dbraw/zinc/44/52/36/514445236.db2.gz DAZFSFZHEJADGZ-CMPLNLGQSA-N 2 2 359.373 2.622 20 5 FFBDLP COc1cc(C[N@H+]2CC[C@H](C)[C@H](C[NH3+])C2)c([N+](=O)[O-])cc1OC(F)F ZINC000415103285 514445244 /nfs/dbraw/zinc/44/52/44/514445244.db2.gz DAZFSFZHEJADGZ-CMPLNLGQSA-N 2 2 359.373 2.622 20 5 FFBDLP [NH3+]C[C@H](C[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1)c1ccc(F)cc1 ZINC000424301767 514449953 /nfs/dbraw/zinc/44/99/53/514449953.db2.gz LHEIPRQQYLCHSY-MRXNPFEDSA-N 2 2 358.417 2.598 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCN(c2cc[nH+]c(N(C)C)n2)CC1 ZINC000490035497 515077877 /nfs/dbraw/zinc/07/78/77/515077877.db2.gz CSDDXUVKHXMCKN-HNNXBMFYSA-N 2 2 370.457 2.642 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CCOCC2)cc1NC1CC([NH+]2CCCCC2)C1 ZINC000480842826 515104030 /nfs/dbraw/zinc/10/40/30/515104030.db2.gz OYHDHKVUOGFLID-UHFFFAOYSA-N 2 2 374.485 2.856 20 5 FFBDLP C[C@H]([NH2+]C[C@@]1(O)CC[N@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000467849779 515146650 /nfs/dbraw/zinc/14/66/50/515146650.db2.gz IRKZSXCAQWFDJD-JXFKEZNVSA-N 2 2 355.438 2.882 20 5 FFBDLP C[C@H]([NH2+]C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000467849779 515146654 /nfs/dbraw/zinc/14/66/54/515146654.db2.gz IRKZSXCAQWFDJD-JXFKEZNVSA-N 2 2 355.438 2.882 20 5 FFBDLP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCN(c2cc[nH+]c(C)n2)CC1 ZINC000470208594 516172391 /nfs/dbraw/zinc/17/23/91/516172391.db2.gz ZSXHOYRJELQYAE-NTCAYCPXSA-N 2 2 353.426 2.919 20 5 FFBDLP C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@H](c2[nH+]ccn2C)C1 ZINC000536068648 516617157 /nfs/dbraw/zinc/61/71/57/516617157.db2.gz JUBXDXLFSWZBIR-JSGCOSHPSA-N 2 2 368.397 2.929 20 5 FFBDLP C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H](c2[nH+]ccn2C)C1 ZINC000536068648 516617169 /nfs/dbraw/zinc/61/71/69/516617169.db2.gz JUBXDXLFSWZBIR-JSGCOSHPSA-N 2 2 368.397 2.929 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CCOCC2)cc1NCc1c[nH+]c2n1CCCC2 ZINC000570749914 518760047 /nfs/dbraw/zinc/76/00/47/518760047.db2.gz YJHOJHVWZFMLOD-UHFFFAOYSA-N 2 2 371.441 2.572 20 5 FFBDLP COc1cc(C[N@H+](C)CCC[NH3+])c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000566225817 519379585 /nfs/dbraw/zinc/37/95/85/519379585.db2.gz OLYGPMNFQBHAFE-UHFFFAOYSA-N 2 2 359.426 2.963 20 5 FFBDLP COc1cc(C[N@@H+](C)CCC[NH3+])c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000566225817 519379591 /nfs/dbraw/zinc/37/95/91/519379591.db2.gz OLYGPMNFQBHAFE-UHFFFAOYSA-N 2 2 359.426 2.963 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CCOCC2)cc1N[C@H]1CCC[N@@H+]2CCCC[C@@H]12 ZINC000594604056 520048031 /nfs/dbraw/zinc/04/80/31/520048031.db2.gz XRPKZDRUBPUBKI-HKUYNNGSSA-N 2 2 374.485 2.856 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CCOCC2)cc1N[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594604056 520048037 /nfs/dbraw/zinc/04/80/37/520048037.db2.gz XRPKZDRUBPUBKI-HKUYNNGSSA-N 2 2 374.485 2.856 20 5 FFBDLP C[N@@H+]1CCN(Cc2ccccc2)[C@@H](C[NH2+]Cc2cccc([N+](=O)[O-])c2)C1 ZINC000594995026 520247401 /nfs/dbraw/zinc/24/74/01/520247401.db2.gz NBKVUGYDWYGVDZ-FQEVSTJZSA-N 2 2 354.454 2.501 20 5 FFBDLP C[N@H+]1CCN(Cc2ccccc2)[C@@H](C[NH2+]Cc2cccc([N+](=O)[O-])c2)C1 ZINC000594995026 520247404 /nfs/dbraw/zinc/24/74/04/520247404.db2.gz NBKVUGYDWYGVDZ-FQEVSTJZSA-N 2 2 354.454 2.501 20 5 FFBDLP CCOc1ccc([C@@H](C)[NH2+]C2CC[NH+]([C@H]3CCOC3)CC2)cc1[N+](=O)[O-] ZINC000595106579 520297238 /nfs/dbraw/zinc/29/72/38/520297238.db2.gz VKZIXAQCNATUIO-PBHICJAKSA-N 2 2 363.458 2.897 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@H]([C@H]4CCC[NH2+]4)C3)n2)cc1 ZINC000592478412 520406851 /nfs/dbraw/zinc/40/68/51/520406851.db2.gz APRVUNOHHGYVIQ-GOEBONIOSA-N 2 2 357.414 2.609 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@H]([C@H]4CCC[NH2+]4)C3)n2)cc1 ZINC000592478412 520406859 /nfs/dbraw/zinc/40/68/59/520406859.db2.gz APRVUNOHHGYVIQ-GOEBONIOSA-N 2 2 357.414 2.609 20 5 FFBDLP C[C@H](CNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)C[NH+]1CCCCC1 ZINC000604439044 520563215 /nfs/dbraw/zinc/56/32/15/520563215.db2.gz WQUAHISHPUACAI-OAHLLOKOSA-N 2 2 371.441 2.632 20 5 FFBDLP Cn1cc[nH+]c1[C@@H](N[C@H]1CC[NH2+]CC(C)(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000602023516 521084238 /nfs/dbraw/zinc/08/42/38/521084238.db2.gz YVCWCIGIOUADBV-RDJZCZTQSA-N 2 2 357.458 2.786 20 5 FFBDLP CC(C)[C@@H]([NH3+])CC[N@H+](C)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000843354613 747815950 /nfs/dbraw/zinc/81/59/50/747815950.db2.gz LRHARLGTCZZHLT-RISCZKNCSA-N 2 2 356.854 2.880 20 5 FFBDLP CC(C)[C@@H]([NH3+])CC[N@@H+](C)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000843354613 747815956 /nfs/dbraw/zinc/81/59/56/747815956.db2.gz LRHARLGTCZZHLT-RISCZKNCSA-N 2 2 356.854 2.880 20 5 FFBDLP C[NH+](C)CC[C@H]([NH2+][C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1cccnc1 ZINC000903381661 1020815126 /nfs/dbraw/zinc/81/51/26/1020815126.db2.gz YJILUSYDGYZVSW-BZSNNMDCSA-N 2 2 372.473 2.953 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CCC[NH3+])C(=O)OC(C)(C)C ZINC001246206078 1039280418 /nfs/dbraw/zinc/28/04/18/1039280418.db2.gz CTWAOLFAFPIHTH-HIFRSBDPSA-N 2 2 351.447 2.565 20 5 FFBDLP COc1cc(N2CCC([NH2+][C@H](C[NH3+])c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC001246505544 1039375025 /nfs/dbraw/zinc/37/50/25/1039375025.db2.gz DGOVKJQDGOUCBN-GOSISDBHSA-N 2 2 370.453 2.862 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CCc2onc(Cn3cc[nH+]c3)c2C1 ZINC001254561842 1040799090 /nfs/dbraw/zinc/79/90/90/1040799090.db2.gz MOMVKTSYSWFXAS-CQSZACIVSA-N 2 2 367.409 2.817 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCc2onc(Cn3cc[nH+]c3)c2C1 ZINC001254561842 1040799105 /nfs/dbraw/zinc/79/91/05/1040799105.db2.gz MOMVKTSYSWFXAS-CQSZACIVSA-N 2 2 367.409 2.817 20 5 FFBDLP O=C(c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)N1CCCC[C@]12CCC[NH2+]C2 ZINC001343677326 1052369982 /nfs/dbraw/zinc/36/99/82/1052369982.db2.gz USPDYJGAOURKPP-LJQANCHMSA-N 2 2 369.425 2.529 20 5 FFBDLP CC(C)C[NH+]1CCC(NC(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)CC1 ZINC000067265187 506807746 /nfs/dbraw/zinc/80/77/46/506807746.db2.gz GOSXJQLCTJEUNP-UHFFFAOYSA-N 2 2 371.441 2.631 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@@H+]2Cc1cc([N+](=O)[O-])ccc1Cl ZINC000371294772 512312082 /nfs/dbraw/zinc/31/20/82/512312082.db2.gz MZJTZDINJUBACJ-KBRIMQKVSA-N 2 2 353.850 2.932 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@H+]2Cc1cc([N+](=O)[O-])ccc1Cl ZINC000371294772 512312084 /nfs/dbraw/zinc/31/20/84/512312084.db2.gz MZJTZDINJUBACJ-KBRIMQKVSA-N 2 2 353.850 2.932 20 5 FFBDLP Cc1c(NC(=O)CC[NH+]2CCC(n3cc[nH+]c3)CC2)cccc1[N+](=O)[O-] ZINC000109795570 507987758 /nfs/dbraw/zinc/98/77/58/507987758.db2.gz WTCVTGZEXMJMDO-UHFFFAOYSA-N 2 2 357.414 2.765 20 5 FFBDLP COc1cc(C[N@@H+]2CC[C@H](C)[C@@H](n3cc[nH+]c3)C2)c([N+](=O)[O-])cc1OC ZINC000091960396 508027379 /nfs/dbraw/zinc/02/73/79/508027379.db2.gz AJYAHHVFNQUKTA-BBRMVZONSA-N 2 2 360.414 2.892 20 5 FFBDLP COc1cc(C[N@H+]2CC[C@H](C)[C@@H](n3cc[nH+]c3)C2)c([N+](=O)[O-])cc1OC ZINC000091960396 508027382 /nfs/dbraw/zinc/02/73/82/508027382.db2.gz AJYAHHVFNQUKTA-BBRMVZONSA-N 2 2 360.414 2.892 20 5 FFBDLP CCC[NH+]1CCC([N@H+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])CC1 ZINC000092165571 508047347 /nfs/dbraw/zinc/04/73/47/508047347.db2.gz INXIUSNLPHBUGS-UHFFFAOYSA-N 2 2 351.447 2.918 20 5 FFBDLP CCC[NH+]1CCC([N@@H+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])CC1 ZINC000092165571 508047350 /nfs/dbraw/zinc/04/73/50/508047350.db2.gz INXIUSNLPHBUGS-UHFFFAOYSA-N 2 2 351.447 2.918 20 5 FFBDLP C[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H]1n1cc[nH+]c1 ZINC000136090519 508669221 /nfs/dbraw/zinc/66/92/21/508669221.db2.gz JXYLTASMCOKQSE-GUYCJALGSA-N 2 2 358.398 2.741 20 5 FFBDLP C[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H]1n1cc[nH+]c1 ZINC000136090519 508669222 /nfs/dbraw/zinc/66/92/22/508669222.db2.gz JXYLTASMCOKQSE-GUYCJALGSA-N 2 2 358.398 2.741 20 5 FFBDLP C[NH+](C)CCC1CC[NH+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000118868674 508688540 /nfs/dbraw/zinc/68/85/40/508688540.db2.gz OQAGLXBDLKWUEL-UHFFFAOYSA-N 2 2 368.865 2.850 20 5 FFBDLP Cc1c([C@@H](C)[NH2+]Cc2cccnc2N2CC[NH+](C)CC2)cccc1[N+](=O)[O-] ZINC000158482679 508710959 /nfs/dbraw/zinc/71/09/59/508710959.db2.gz BIYFVRHCDVXSTL-MRXNPFEDSA-N 2 2 369.469 2.901 20 5 FFBDLP CCOc1ccc(NC(=O)C[NH+]2CCC(c3[nH]cc[nH+]3)CC2)c([N+](=O)[O-])c1 ZINC000266777366 509188855 /nfs/dbraw/zinc/18/88/55/509188855.db2.gz UKDGHQHNXPMRGZ-UHFFFAOYSA-N 2 2 373.413 2.535 20 5 FFBDLP Cc1ccc(C(=O)NCC2([NH+]3CCCCC3)CC[NH+](C)CC2)cc1[N+](=O)[O-] ZINC000172749534 509210839 /nfs/dbraw/zinc/21/08/39/509210839.db2.gz MFXHJSZCUXIRCE-UHFFFAOYSA-N 2 2 374.485 2.583 20 5 FFBDLP CC[N@@H+]1CC[C@@H]([NH+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000245439944 509936904 /nfs/dbraw/zinc/93/69/04/509936904.db2.gz UAPKAZZVTKUAJJ-SWLSCSKDSA-N 2 2 368.865 2.849 20 5 FFBDLP CC[N@H+]1CC[C@@H]([NH+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000245439944 509936908 /nfs/dbraw/zinc/93/69/08/509936908.db2.gz UAPKAZZVTKUAJJ-SWLSCSKDSA-N 2 2 368.865 2.849 20 5 FFBDLP CC[NH+]1CC[C@@H]([N@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000245439944 509936911 /nfs/dbraw/zinc/93/69/11/509936911.db2.gz UAPKAZZVTKUAJJ-SWLSCSKDSA-N 2 2 368.865 2.849 20 5 FFBDLP CC[NH+]1CC[C@@H]([N@@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000245439944 509936914 /nfs/dbraw/zinc/93/69/14/509936914.db2.gz UAPKAZZVTKUAJJ-SWLSCSKDSA-N 2 2 368.865 2.849 20 5 FFBDLP COc1cc(C[N@@H+]2CC[C@@H](C)[C@H](n3cc[nH+]c3)C2)c([N+](=O)[O-])cc1OC ZINC000245687233 510086238 /nfs/dbraw/zinc/08/62/38/510086238.db2.gz AJYAHHVFNQUKTA-CZUORRHYSA-N 2 2 360.414 2.892 20 5 FFBDLP COc1cc(C[N@H+]2CC[C@@H](C)[C@H](n3cc[nH+]c3)C2)c([N+](=O)[O-])cc1OC ZINC000245687233 510086243 /nfs/dbraw/zinc/08/62/43/510086243.db2.gz AJYAHHVFNQUKTA-CZUORRHYSA-N 2 2 360.414 2.892 20 5 FFBDLP Cc1[nH+]c2ccccc2n1C1CC[NH+](Cc2c([N+](=O)[O-])ncn2C)CC1 ZINC000370040243 512738642 /nfs/dbraw/zinc/73/86/42/512738642.db2.gz IWTUPNSTFPEKFZ-UHFFFAOYSA-N 2 2 354.414 2.824 20 5 FFBDLP CC[NH+]1CCC([N@@H+]2CCCN(C(=O)c3ccc(C)c([N+](=O)[O-])c3)CC2)CC1 ZINC000422006567 513516756 /nfs/dbraw/zinc/51/67/56/513516756.db2.gz LYKKSAZHAAUHBV-UHFFFAOYSA-N 2 2 374.485 2.535 20 5 FFBDLP CC[NH+]1CCC([N@H+]2CCCN(C(=O)c3ccc(C)c([N+](=O)[O-])c3)CC2)CC1 ZINC000422006567 513516761 /nfs/dbraw/zinc/51/67/61/513516761.db2.gz LYKKSAZHAAUHBV-UHFFFAOYSA-N 2 2 374.485 2.535 20 5 FFBDLP C[NH+](C)[C@H]1CCC[C@@H](Nc2cc(C[NH+]3CCOCC3)ccc2[N+](=O)[O-])C1 ZINC000447817337 513581424 /nfs/dbraw/zinc/58/14/24/513581424.db2.gz NNCPNWMIHCKYEQ-SJORKVTESA-N 2 2 362.474 2.712 20 5 FFBDLP C[C@H](CNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)[N@@H+]1CCC[C@H](C)C1 ZINC000448706585 513857383 /nfs/dbraw/zinc/85/73/83/513857383.db2.gz ZIGMNKISNLXKOM-LSDHHAIUSA-N 2 2 371.441 2.631 20 5 FFBDLP C[C@H](CNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)[N@H+]1CCC[C@H](C)C1 ZINC000448706585 513857389 /nfs/dbraw/zinc/85/73/89/513857389.db2.gz ZIGMNKISNLXKOM-LSDHHAIUSA-N 2 2 371.441 2.631 20 5 FFBDLP CCCN(CC[NH+]1CCCC1)C(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000451694137 513915615 /nfs/dbraw/zinc/91/56/15/513915615.db2.gz LWUOPJJLCWTUIS-UHFFFAOYSA-N 2 2 371.441 2.729 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](O)C[N@@H+]1CCc2ccccc2C1 ZINC000449071328 514059657 /nfs/dbraw/zinc/05/96/57/514059657.db2.gz AZEKDWPYHWUQOF-OXQOHEQNSA-N 2 2 369.465 2.535 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000449071328 514059662 /nfs/dbraw/zinc/05/96/62/514059662.db2.gz AZEKDWPYHWUQOF-OXQOHEQNSA-N 2 2 369.465 2.535 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCC(c2nnc3n2CC[NH2+]C3)CC1 ZINC000420360480 514109726 /nfs/dbraw/zinc/10/97/26/514109726.db2.gz WSZSKMDNGOVESR-CQSZACIVSA-N 2 2 370.457 2.539 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCCC[C@H]3[C@H]3CC[NH2+]C3)n2)c1 ZINC000420413083 514138892 /nfs/dbraw/zinc/13/88/92/514138892.db2.gz ZPFVPAUHDQNXPO-HOCLYGCPSA-N 2 2 357.414 2.609 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCCC[C@H]3[C@H]3CC[NH2+]C3)n2)c1 ZINC000420413083 514138899 /nfs/dbraw/zinc/13/88/99/514138899.db2.gz ZPFVPAUHDQNXPO-HOCLYGCPSA-N 2 2 357.414 2.609 20 5 FFBDLP CN1CC[NH2+]C[C@H]1C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414978830 514385100 /nfs/dbraw/zinc/38/51/00/514385100.db2.gz SOSNIKNHCWXCOA-ZDUSSCGKSA-N 2 2 364.833 2.501 20 5 FFBDLP CC1CC[NH+](C[C@@H](O)C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000433181192 514407139 /nfs/dbraw/zinc/40/71/39/514407139.db2.gz XGKJKDZNBQVWKG-LPHOPBHVSA-N 2 2 361.486 3.000 20 5 FFBDLP COC(=O)C(C)(C)[NH+]1CCN(c2cc(C)[nH+]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000489942940 515040625 /nfs/dbraw/zinc/04/06/25/515040625.db2.gz GJXZFXKVZFUFHT-UHFFFAOYSA-N 2 2 372.425 2.525 20 5 FFBDLP C[N@H+](CCN1CC[NH+](Cc2ccc([N+](=O)[O-])cc2)CC1)Cc1ccccc1 ZINC000513446028 516626696 /nfs/dbraw/zinc/62/66/96/516626696.db2.gz BMCZZCYYBUXEOX-UHFFFAOYSA-N 2 2 368.481 2.844 20 5 FFBDLP C[N@@H+](CCN1CC[NH+](Cc2ccc([N+](=O)[O-])cc2)CC1)Cc1ccccc1 ZINC000513446028 516626704 /nfs/dbraw/zinc/62/67/04/516626704.db2.gz BMCZZCYYBUXEOX-UHFFFAOYSA-N 2 2 368.481 2.844 20 5 FFBDLP C[NH+](C)C[C@H](Cc1ccccc1)[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000548761611 517197157 /nfs/dbraw/zinc/19/71/57/517197157.db2.gz YNDFRTHAIZACST-KRWDZBQOSA-N 2 2 370.453 2.686 20 5 FFBDLP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cc(O)ccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000549553458 517615500 /nfs/dbraw/zinc/61/55/00/517615500.db2.gz BDTFBUOTBGYNOP-YOEHRIQHSA-N 2 2 351.447 2.527 20 5 FFBDLP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2cc(O)ccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000549553458 517615506 /nfs/dbraw/zinc/61/55/06/517615506.db2.gz BDTFBUOTBGYNOP-YOEHRIQHSA-N 2 2 351.447 2.527 20 5 FFBDLP C[NH+](C)CCOC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000539832282 518169778 /nfs/dbraw/zinc/16/97/78/518169778.db2.gz NZGDQCAVUCUQKS-UHFFFAOYSA-N 2 2 373.400 2.739 20 5 FFBDLP O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C[C@@H](O)C[N@@H+]1CCc2ccccc2C1 ZINC000568663994 519154521 /nfs/dbraw/zinc/15/45/21/519154521.db2.gz JPVSIIUWPWZNPC-YLJYHZDGSA-N 2 2 367.449 2.591 20 5 FFBDLP O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000568663994 519154528 /nfs/dbraw/zinc/15/45/28/519154528.db2.gz JPVSIIUWPWZNPC-YLJYHZDGSA-N 2 2 367.449 2.591 20 5 FFBDLP Cn1cc[nH+]c1[C@H](N[C@H]1CC[NH2+]C2(CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000591582648 519958410 /nfs/dbraw/zinc/95/84/10/519958410.db2.gz RSVXBLFLDZWXGF-DOTOQJQBSA-N 2 2 355.442 2.682 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCC[N@@H+]1CCCO[C@H](C)C1 ZINC000595048850 520270041 /nfs/dbraw/zinc/27/00/41/520270041.db2.gz RQAZIEOAYOASLM-CABCVRRESA-N 2 2 351.447 2.755 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCC[N@H+]1CCCO[C@H](C)C1 ZINC000595048850 520270050 /nfs/dbraw/zinc/27/00/50/520270050.db2.gz RQAZIEOAYOASLM-CABCVRRESA-N 2 2 351.447 2.755 20 5 FFBDLP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(F)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000595439690 520471959 /nfs/dbraw/zinc/47/19/59/520471959.db2.gz KCMCNHWRIFMGTP-WMLDXEAASA-N 2 2 353.438 2.961 20 5 FFBDLP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(F)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000595439690 520471969 /nfs/dbraw/zinc/47/19/69/520471969.db2.gz KCMCNHWRIFMGTP-WMLDXEAASA-N 2 2 353.438 2.961 20 5 FFBDLP C[C@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@@H]1CC[NH3+] ZINC000593735708 521181342 /nfs/dbraw/zinc/18/13/42/521181342.db2.gz ZHELPGDCRUUCHJ-SMDDNHRTSA-N 2 2 354.838 2.636 20 5 FFBDLP C[C@H]1CCC[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@@H]1CC[NH3+] ZINC000593735708 521181351 /nfs/dbraw/zinc/18/13/51/521181351.db2.gz ZHELPGDCRUUCHJ-SMDDNHRTSA-N 2 2 354.838 2.636 20 5 FFBDLP [NH3+]Cc1nc2c(s1)CC[N@@H+]([C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)C2 ZINC000925746956 738526377 /nfs/dbraw/zinc/52/63/77/738526377.db2.gz DQAUWOOMXZNSCD-INIZCTEOSA-N 2 2 358.467 2.889 20 5 FFBDLP [NH3+]Cc1nc2c(s1)CC[N@H+]([C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)C2 ZINC000925746956 738526381 /nfs/dbraw/zinc/52/63/81/738526381.db2.gz DQAUWOOMXZNSCD-INIZCTEOSA-N 2 2 358.467 2.889 20 5 FFBDLP C[NH2+]CCC1CC[NH+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000843363411 747817593 /nfs/dbraw/zinc/81/75/93/747817593.db2.gz CWLHDPOJABIILO-UHFFFAOYSA-N 2 2 354.838 2.508 20 5 FFBDLP C[N@@H+]1CCC[C@@H]1C[NH2+]CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001206694851 1032391962 /nfs/dbraw/zinc/39/19/62/1032391962.db2.gz PCNIRUPCMBWCCC-HXUWFJFHSA-N 3 2 360.502 2.533 20 5 FFBDLP C[N@H+]1CCC[C@@H]1C[NH2+]CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001206694851 1032391972 /nfs/dbraw/zinc/39/19/72/1032391972.db2.gz PCNIRUPCMBWCCC-HXUWFJFHSA-N 3 2 360.502 2.533 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH+]2CCN(c3cc[nH+]cc3)CC2)c1F ZINC001173187331 1012329808 /nfs/dbraw/zinc/32/98/08/1012329808.db2.gz ZFNUFMLGOVOFAR-AWEZNQCLSA-N 2 2 374.416 2.891 20 5 FFBDLP C[NH+](C)CC[C@H]([NH2+][C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1cccnc1 ZINC000903381663 1020815913 /nfs/dbraw/zinc/81/59/13/1020815913.db2.gz YJILUSYDGYZVSW-OKZBNKHCSA-N 2 2 372.473 2.953 20 5 FFBDLP CCCC[N@H+](C)CC[NH2+]C1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC001256084751 1038369074 /nfs/dbraw/zinc/36/90/74/1038369074.db2.gz HIMHLUYCKBWMHK-UHFFFAOYSA-N 2 2 364.490 2.894 20 5 FFBDLP CCCC[N@@H+](C)CC[NH2+]C1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC001256084751 1038369080 /nfs/dbraw/zinc/36/90/80/1038369080.db2.gz HIMHLUYCKBWMHK-UHFFFAOYSA-N 2 2 364.490 2.894 20 5 FFBDLP O=[N+]([O-])c1ccc(N2CCC([NH2+]CC[NH2+]Cc3ccccc3)CC2)cc1 ZINC001246166106 1039264988 /nfs/dbraw/zinc/26/49/88/1039264988.db2.gz NOOUONOWWYHVDB-UHFFFAOYSA-N 2 2 354.454 2.943 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2CCC[C@@]3(CC[NH2+]C3)C2)c1F ZINC001246626642 1039420174 /nfs/dbraw/zinc/42/01/74/1039420174.db2.gz HGPSFURMHCPGSW-ACJLOTCBSA-N 2 2 351.422 2.749 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCC[C@@]3(CC[NH2+]C3)C2)c1F ZINC001246626642 1039420179 /nfs/dbraw/zinc/42/01/79/1039420179.db2.gz HGPSFURMHCPGSW-ACJLOTCBSA-N 2 2 351.422 2.749 20 5 FFBDLP CC(C)[N@@H+]1CCC[C@@H](CNC(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)C1 ZINC000069036120 507385474 /nfs/dbraw/zinc/38/54/74/507385474.db2.gz CJJCACFLQBULCC-HNNXBMFYSA-N 2 2 371.441 2.631 20 5 FFBDLP CC(C)[N@H+]1CCC[C@@H](CNC(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)C1 ZINC000069036120 507385479 /nfs/dbraw/zinc/38/54/79/507385479.db2.gz CJJCACFLQBULCC-HNNXBMFYSA-N 2 2 371.441 2.631 20 5 FFBDLP COc1ccc(OCC[N@@H+]2CCC[C@@H](Cc3[nH+]ccn3C)C2)c([N+](=O)[O-])c1 ZINC000090004205 507900091 /nfs/dbraw/zinc/90/00/91/507900091.db2.gz NZCVAFPRVALXHZ-HNNXBMFYSA-N 2 2 374.441 2.670 20 5 FFBDLP COc1ccc(OCC[N@H+]2CCC[C@@H](Cc3[nH+]ccn3C)C2)c([N+](=O)[O-])c1 ZINC000090004205 507900094 /nfs/dbraw/zinc/90/00/94/507900094.db2.gz NZCVAFPRVALXHZ-HNNXBMFYSA-N 2 2 374.441 2.670 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2nnc(C[NH+]3CCC(n4cc[nH+]c4)CC3)o2)cc1 ZINC000109794077 507987244 /nfs/dbraw/zinc/98/72/44/507987244.db2.gz ZOJYFMNESTUHPF-UHFFFAOYSA-N 2 2 354.370 2.678 20 5 FFBDLP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)C1 ZINC000081095402 508136553 /nfs/dbraw/zinc/13/65/53/508136553.db2.gz ZMQCLQMABAHUAS-CZUORRHYSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[N@H+]1CC[C@@H]([NH+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)C1 ZINC000081095402 508136556 /nfs/dbraw/zinc/13/65/56/508136556.db2.gz ZMQCLQMABAHUAS-CZUORRHYSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[NH+]1CC[C@@H]([N@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)C1 ZINC000081095402 508136557 /nfs/dbraw/zinc/13/65/57/508136557.db2.gz ZMQCLQMABAHUAS-CZUORRHYSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)C1 ZINC000081095402 508136560 /nfs/dbraw/zinc/13/65/60/508136560.db2.gz ZMQCLQMABAHUAS-CZUORRHYSA-N 2 2 359.430 2.807 20 5 FFBDLP CCOc1ccc([C@@H](C)[NH2+]C[C@@H](C)C[NH+]2CCOCC2)cc1[N+](=O)[O-] ZINC000153901946 508673440 /nfs/dbraw/zinc/67/34/40/508673440.db2.gz FLSQBSSYHZZVNM-HUUCEWRRSA-N 2 2 351.447 2.612 20 5 FFBDLP Cc1[nH+]ccn1CCC[N@@H+](C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000130936975 508867872 /nfs/dbraw/zinc/86/78/72/508867872.db2.gz ANUFJSPQIUUMAW-UHFFFAOYSA-N 2 2 365.821 2.714 20 5 FFBDLP Cc1[nH+]ccn1CCC[N@H+](C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000130936975 508867874 /nfs/dbraw/zinc/86/78/74/508867874.db2.gz ANUFJSPQIUUMAW-UHFFFAOYSA-N 2 2 365.821 2.714 20 5 FFBDLP O=[N+]([O-])c1ccc(N2CC[NH+](CCn3cc[nH+]c3)CC2)c(C(F)(F)F)c1 ZINC000131062163 508882518 /nfs/dbraw/zinc/88/25/18/508882518.db2.gz WYCSBJKAXPSICU-UHFFFAOYSA-N 2 2 369.347 2.632 20 5 FFBDLP Cc1c(C(=O)NCC2([NH+]3CCCCC3)CC[NH+](C)CC2)cccc1[N+](=O)[O-] ZINC000172755286 509214540 /nfs/dbraw/zinc/21/45/40/509214540.db2.gz UDKRQIYYCBPWOA-UHFFFAOYSA-N 2 2 374.485 2.583 20 5 FFBDLP CC[N@@H+]1CC[C@@H]([NH+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@@H](C)C1 ZINC000245432935 509929006 /nfs/dbraw/zinc/92/90/06/509929006.db2.gz OYJZDIHMMSOEPM-BLLLJJGKSA-N 2 2 368.865 2.849 20 5 FFBDLP CC[N@H+]1CC[C@@H]([NH+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@@H](C)C1 ZINC000245432935 509929010 /nfs/dbraw/zinc/92/90/10/509929010.db2.gz OYJZDIHMMSOEPM-BLLLJJGKSA-N 2 2 368.865 2.849 20 5 FFBDLP CC[NH+]1CC[C@@H]([N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@@H](C)C1 ZINC000245432935 509929014 /nfs/dbraw/zinc/92/90/14/509929014.db2.gz OYJZDIHMMSOEPM-BLLLJJGKSA-N 2 2 368.865 2.849 20 5 FFBDLP CC[NH+]1CC[C@@H]([N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@@H](C)C1 ZINC000245432935 509929018 /nfs/dbraw/zinc/92/90/18/509929018.db2.gz OYJZDIHMMSOEPM-BLLLJJGKSA-N 2 2 368.865 2.849 20 5 FFBDLP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H](C)C1 ZINC000245438038 509932804 /nfs/dbraw/zinc/93/28/04/509932804.db2.gz RYRGAODWMDIWLJ-XJKSGUPXSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[N@H+]1CC[C@@H]([NH+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H](C)C1 ZINC000245438038 509932811 /nfs/dbraw/zinc/93/28/11/509932811.db2.gz RYRGAODWMDIWLJ-XJKSGUPXSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[NH+]1CC[C@@H]([N@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H](C)C1 ZINC000245438038 509932817 /nfs/dbraw/zinc/93/28/17/509932817.db2.gz RYRGAODWMDIWLJ-XJKSGUPXSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H](C)C1 ZINC000245438038 509932825 /nfs/dbraw/zinc/93/28/25/509932825.db2.gz RYRGAODWMDIWLJ-XJKSGUPXSA-N 2 2 359.430 2.807 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C[C@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC000190310364 510055186 /nfs/dbraw/zinc/05/51/86/510055186.db2.gz UAVBDTDWEAHHRR-OAQYLSRUSA-N 2 2 369.465 2.972 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)C[C@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC000190310364 510055191 /nfs/dbraw/zinc/05/51/91/510055191.db2.gz UAVBDTDWEAHHRR-OAQYLSRUSA-N 2 2 369.465 2.972 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1C[NH+](C)C[C@]1(O)CC[N@H+](Cc2ccccc2)C1 ZINC000190310364 510055197 /nfs/dbraw/zinc/05/51/97/510055197.db2.gz UAVBDTDWEAHHRR-OAQYLSRUSA-N 2 2 369.465 2.972 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1C[NH+](C)C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000190310364 510055202 /nfs/dbraw/zinc/05/52/02/510055202.db2.gz UAVBDTDWEAHHRR-OAQYLSRUSA-N 2 2 369.465 2.972 20 5 FFBDLP C[C@H]1C[C@H]([NH+](C)CCn2cc([N+](=O)[O-])cn2)CC[N@@H+]1Cc1ccccc1 ZINC000174870556 510356637 /nfs/dbraw/zinc/35/66/37/510356637.db2.gz PNJOUZXSNYLMQL-FUHWJXTLSA-N 2 2 357.458 2.776 20 5 FFBDLP C[C@H]1C[C@H]([NH+](C)CCn2cc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1 ZINC000174870556 510356641 /nfs/dbraw/zinc/35/66/41/510356641.db2.gz PNJOUZXSNYLMQL-FUHWJXTLSA-N 2 2 357.458 2.776 20 5 FFBDLP C[C@H]1C[C@H]([N@H+](C)CCn2cc([N+](=O)[O-])cn2)CC[NH+]1Cc1ccccc1 ZINC000174870556 510356644 /nfs/dbraw/zinc/35/66/44/510356644.db2.gz PNJOUZXSNYLMQL-FUHWJXTLSA-N 2 2 357.458 2.776 20 5 FFBDLP C[C@H]1C[C@H]([N@@H+](C)CCn2cc([N+](=O)[O-])cn2)CC[NH+]1Cc1ccccc1 ZINC000174870556 510356646 /nfs/dbraw/zinc/35/66/46/510356646.db2.gz PNJOUZXSNYLMQL-FUHWJXTLSA-N 2 2 357.458 2.776 20 5 FFBDLP C[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@H]1n1cc[nH+]c1 ZINC000246254822 510391574 /nfs/dbraw/zinc/39/15/74/510391574.db2.gz JXYLTASMCOKQSE-SUMWQHHRSA-N 2 2 358.398 2.741 20 5 FFBDLP C[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@H]1n1cc[nH+]c1 ZINC000246254822 510391581 /nfs/dbraw/zinc/39/15/81/510391581.db2.gz JXYLTASMCOKQSE-SUMWQHHRSA-N 2 2 358.398 2.741 20 5 FFBDLP C[C@@H]1CC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1n1cc[nH+]c1 ZINC000247643339 510867642 /nfs/dbraw/zinc/86/76/42/510867642.db2.gz OQFHSYQTYHQBBW-RHSMWYFYSA-N 2 2 357.414 2.703 20 5 FFBDLP C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1n1cc[nH+]c1 ZINC000247643339 510867643 /nfs/dbraw/zinc/86/76/43/510867643.db2.gz OQFHSYQTYHQBBW-RHSMWYFYSA-N 2 2 357.414 2.703 20 5 FFBDLP C[C@@H]1C[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC[C@H]1N1CC[NH+](C)CC1 ZINC000362077898 511128435 /nfs/dbraw/zinc/12/84/35/511128435.db2.gz KMUVLQZHZQQRQZ-RHSMWYFYSA-N 2 2 366.893 2.706 20 5 FFBDLP C[C@@H]1C[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC[C@H]1N1CC[NH+](C)CC1 ZINC000362077898 511128438 /nfs/dbraw/zinc/12/84/38/511128438.db2.gz KMUVLQZHZQQRQZ-RHSMWYFYSA-N 2 2 366.893 2.706 20 5 FFBDLP COc1cc(C[N@@H+]2CCC[C@@H](c3[nH+]ccn3C)C2)c([N+](=O)[O-])cc1OC ZINC000365818824 511667440 /nfs/dbraw/zinc/66/74/40/511667440.db2.gz HGVLLZSYIQRJHD-CYBMUJFWSA-N 2 2 360.414 2.725 20 5 FFBDLP COc1cc(C[N@H+]2CCC[C@@H](c3[nH+]ccn3C)C2)c([N+](=O)[O-])cc1OC ZINC000365818824 511667442 /nfs/dbraw/zinc/66/74/42/511667442.db2.gz HGVLLZSYIQRJHD-CYBMUJFWSA-N 2 2 360.414 2.725 20 5 FFBDLP CN(Cc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CC[N@@H+](C2CC[NH+](C)CC2)C1 ZINC000371702596 512535428 /nfs/dbraw/zinc/53/54/28/512535428.db2.gz FQGACNRXFBCRIS-QGZVFWFLSA-N 2 2 366.893 2.849 20 5 FFBDLP CN(Cc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CC[N@H+](C2CC[NH+](C)CC2)C1 ZINC000371702596 512535430 /nfs/dbraw/zinc/53/54/30/512535430.db2.gz FQGACNRXFBCRIS-QGZVFWFLSA-N 2 2 366.893 2.849 20 5 FFBDLP CC(C)[NH+]1CCC([NH+]2CCN(Cc3c(F)cccc3[N+](=O)[O-])CC2)CC1 ZINC000441060063 513471292 /nfs/dbraw/zinc/47/12/92/513471292.db2.gz JOHXNOGFYKNJMX-UHFFFAOYSA-N 2 2 364.465 2.724 20 5 FFBDLP C[C@@H]1C[NH+](CCCCNc2[nH+]ccc3ccc([N+](=O)[O-])cc32)C[C@@H](C)O1 ZINC000413179978 513502104 /nfs/dbraw/zinc/50/21/04/513502104.db2.gz DCFCCUFNSSXUCN-HUUCEWRRSA-N 2 2 358.442 2.866 20 5 FFBDLP C[C@H](CNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-])C[NH+]1CCCC1 ZINC000447814607 513579875 /nfs/dbraw/zinc/57/98/75/513579875.db2.gz ZRRVFDXDJGRCOC-MRXNPFEDSA-N 2 2 362.474 2.571 20 5 FFBDLP CC[C@@H]1CCCC[N@@H+]1CCNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000448984991 514007928 /nfs/dbraw/zinc/00/79/28/514007928.db2.gz VKHNQVXHFSAYDY-MRXNPFEDSA-N 2 2 371.441 2.775 20 5 FFBDLP CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000448984991 514007936 /nfs/dbraw/zinc/00/79/36/514007936.db2.gz VKHNQVXHFSAYDY-MRXNPFEDSA-N 2 2 371.441 2.775 20 5 FFBDLP C[C@H]([NH2+]C[C@]1(O)CC[N@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000467849780 515146767 /nfs/dbraw/zinc/14/67/67/515146767.db2.gz IRKZSXCAQWFDJD-OXJNMPFZSA-N 2 2 355.438 2.882 20 5 FFBDLP C[C@H]([NH2+]C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000467849780 515146772 /nfs/dbraw/zinc/14/67/72/515146772.db2.gz IRKZSXCAQWFDJD-OXJNMPFZSA-N 2 2 355.438 2.882 20 5 FFBDLP C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC[NH+](CCO)CC1 ZINC000513567228 516673733 /nfs/dbraw/zinc/67/37/33/516673733.db2.gz DUSJDMVEQHEGFF-UHFFFAOYSA-N 2 2 359.426 2.743 20 5 FFBDLP C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC[NH+](CCO)CC1 ZINC000513567228 516673743 /nfs/dbraw/zinc/67/37/43/516673743.db2.gz DUSJDMVEQHEGFF-UHFFFAOYSA-N 2 2 359.426 2.743 20 5 FFBDLP Cc1cc(NCCCCn2cc[nH+]c2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000540905552 516764614 /nfs/dbraw/zinc/76/46/14/516764614.db2.gz PVGQNRKSCOBSHW-UHFFFAOYSA-N 2 2 352.398 2.871 20 5 FFBDLP Cc1[nH+]c2ccccc2n1CC[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000558579893 516818659 /nfs/dbraw/zinc/81/86/59/516818659.db2.gz AGWBYHMAHCIRHA-UHFFFAOYSA-N 2 2 367.409 2.871 20 5 FFBDLP Cn1cc[nH+]c1[C@H](NCC[N@H+](C)C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000552249643 517162597 /nfs/dbraw/zinc/16/25/97/517162597.db2.gz GUCOCHMWSQSCCZ-GOSISDBHSA-N 2 2 357.458 2.882 20 5 FFBDLP Cn1cc[nH+]c1[C@H](NCC[N@@H+](C)C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000552249643 517162608 /nfs/dbraw/zinc/16/26/08/517162608.db2.gz GUCOCHMWSQSCCZ-GOSISDBHSA-N 2 2 357.458 2.882 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(Nc2cccc[nH+]2)CC1 ZINC000534861857 518060050 /nfs/dbraw/zinc/06/00/50/518060050.db2.gz BYNNNZVBQRPEST-CQSZACIVSA-N 2 2 369.425 2.893 20 5 FFBDLP Cc1ccc([N+](=O)[O-])c(OCCC(=O)Nc2c[nH+]ccc2-n2cc[nH+]c2)c1 ZINC000539526293 518089334 /nfs/dbraw/zinc/08/93/34/518089334.db2.gz PBCHNXBASYHXOQ-UHFFFAOYSA-N 2 2 367.365 2.892 20 5 FFBDLP Cn1c[nH+]cc1[C@@H]1C[C@H]([NH2+][C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)CCO1 ZINC000575941678 518354227 /nfs/dbraw/zinc/35/42/27/518354227.db2.gz GSIKUJVZNTWDKO-ANQUJSFKSA-N 2 2 374.445 2.518 20 5 FFBDLP CC(C)C[C@H](CN[C@H](c1[nH+]ccn1C)c1ccc([N+](=O)[O-])cc1)[NH+](C)C ZINC000582137954 518606236 /nfs/dbraw/zinc/60/62/36/518606236.db2.gz NDABLOJDKGMBLD-MSOLQXFVSA-N 2 2 359.474 2.984 20 5 FFBDLP CCCC[N@H+](C)C[C@H](C)Nc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000588866103 518852368 /nfs/dbraw/zinc/85/23/68/518852368.db2.gz MDCZMRYOZOWBSC-INIZCTEOSA-N 2 2 364.490 2.959 20 5 FFBDLP CCCC[N@@H+](C)C[C@H](C)Nc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000588866103 518852372 /nfs/dbraw/zinc/85/23/72/518852372.db2.gz MDCZMRYOZOWBSC-INIZCTEOSA-N 2 2 364.490 2.959 20 5 FFBDLP C[C@H]([NH2+]C[C@@H](O)COc1ccccc1[N+](=O)[O-])[C@@H](c1ccccc1)[NH+](C)C ZINC000574686175 519281721 /nfs/dbraw/zinc/28/17/21/519281721.db2.gz KLRZEZRBFBWTDP-VPWXQRGCSA-N 2 2 373.453 2.616 20 5 FFBDLP C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCC[N@@H+]2CCCC[C@H]12 ZINC000594519479 520011975 /nfs/dbraw/zinc/01/19/75/520011975.db2.gz LCTQOTRKDXYKMO-FHLIZLRMSA-N 2 2 360.458 2.918 20 5 FFBDLP C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594519479 520011983 /nfs/dbraw/zinc/01/19/83/520011983.db2.gz LCTQOTRKDXYKMO-FHLIZLRMSA-N 2 2 360.458 2.918 20 5 FFBDLP O=C(NC[C@@H]1CC[N@@H+]1C1CCCC1)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000600469787 520279971 /nfs/dbraw/zinc/27/99/71/520279971.db2.gz KFQSEJDOZJAHIA-INIZCTEOSA-N 2 2 369.425 2.527 20 5 FFBDLP O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000600469787 520279981 /nfs/dbraw/zinc/27/99/81/520279981.db2.gz KFQSEJDOZJAHIA-INIZCTEOSA-N 2 2 369.425 2.527 20 5 FFBDLP COC(=O)C1CC[NH+](CCCNc2ccc3c[nH+]ccc3c2[N+](=O)[O-])CC1 ZINC000599019420 520984207 /nfs/dbraw/zinc/98/42/07/520984207.db2.gz JYFUKCARPDGQNV-UHFFFAOYSA-N 2 2 372.425 2.830 20 5 FFBDLP COc1c[nH+]ccc1N1CCN(c2ccc3c[nH+]ccc3c2[N+](=O)[O-])CC1 ZINC000599071600 521014383 /nfs/dbraw/zinc/01/43/83/521014383.db2.gz ZKMJLIUOJQWZEC-UHFFFAOYSA-N 2 2 365.393 2.873 20 5 FFBDLP Cn1cc[nH+]c1[C@@H](N[C@H]1CC[NH2+]CC(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000602019707 521080826 /nfs/dbraw/zinc/08/08/26/521080826.db2.gz GGGXVWHLYIFEHT-RDJZCZTQSA-N 2 2 357.458 2.786 20 5 FFBDLP O=C(N[C@H]1CCC[N@@H+]2CCCC[C@H]12)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000594198702 521464725 /nfs/dbraw/zinc/46/47/25/521464725.db2.gz VCPGVBPGRAHVAS-JKSUJKDBSA-N 2 2 369.425 2.527 20 5 FFBDLP O=C(N[C@H]1CCC[N@H+]2CCCC[C@H]12)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000594198702 521464733 /nfs/dbraw/zinc/46/47/33/521464733.db2.gz VCPGVBPGRAHVAS-JKSUJKDBSA-N 2 2 369.425 2.527 20 5 FFBDLP C[NH+](Cc1ccccc1)C[C@H](O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000619785176 521872314 /nfs/dbraw/zinc/87/23/14/521872314.db2.gz KINPGUSMGVLRKO-HXUWFJFHSA-N 2 2 357.454 2.562 20 5 FFBDLP C[NH+](Cc1ccccc1)C[C@H](O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000619785176 521872323 /nfs/dbraw/zinc/87/23/23/521872323.db2.gz KINPGUSMGVLRKO-HXUWFJFHSA-N 2 2 357.454 2.562 20 5 FFBDLP C[NH+](CCc1cccc([N+](=O)[O-])c1)C[C@@H](O)C[N@H+](C)Cc1ccccc1 ZINC000619785176 521872332 /nfs/dbraw/zinc/87/23/32/521872332.db2.gz KINPGUSMGVLRKO-HXUWFJFHSA-N 2 2 357.454 2.562 20 5 FFBDLP C[NH+](CCc1cccc([N+](=O)[O-])c1)C[C@@H](O)C[N@@H+](C)Cc1ccccc1 ZINC000619785176 521872339 /nfs/dbraw/zinc/87/23/39/521872339.db2.gz KINPGUSMGVLRKO-HXUWFJFHSA-N 2 2 357.454 2.562 20 5 FFBDLP O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000174844171 729081068 /nfs/dbraw/zinc/08/10/68/729081068.db2.gz POXLZQZKUGPVPF-UHFFFAOYSA-N 2 2 353.850 2.792 20 5 FFBDLP CN1CC[NH+](CC2CC[NH+](Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)CC1 ZINC000894458153 734861853 /nfs/dbraw/zinc/86/18/53/734861853.db2.gz MUOIWELQFJUBGB-UHFFFAOYSA-N 2 2 366.893 2.708 20 5 FFBDLP C[NH+](C)CC1(O)CC[NH+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000931480906 739272580 /nfs/dbraw/zinc/27/25/80/739272580.db2.gz LSTRDPDVVZGKRI-UHFFFAOYSA-N 2 2 362.257 2.790 20 5 FFBDLP O=[N+]([O-])c1ccc([C@@H](O)C[NH+]2CCC([NH2+]Cc3ccccc3)CC2)cc1 ZINC000852117343 1005942673 /nfs/dbraw/zinc/94/26/73/1005942673.db2.gz YWVGLHMQERUHMX-FQEVSTJZSA-N 2 2 355.438 2.882 20 5 FFBDLP O=[N+]([O-])c1ccn(CC[NH+]2CCC(c3ccccc3)([NH+]3CCCC3)CC2)n1 ZINC000933546699 1021029000 /nfs/dbraw/zinc/02/90/00/1021029000.db2.gz GDSNPKUHMGYZQE-UHFFFAOYSA-N 2 2 369.469 2.878 20 5 FFBDLP C[NH+](C)C1(CNc2ccc3cc(F)cc([N+](=O)[O-])c3n2)CC[NH+](C)CC1 ZINC001164211762 1029205376 /nfs/dbraw/zinc/20/53/76/1029205376.db2.gz SIHQIZNASVDRQU-UHFFFAOYSA-N 2 2 361.421 2.720 20 5 FFBDLP Cc1[nH+]ccn1-c1cc[nH+]cc1NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC001251846277 1039320744 /nfs/dbraw/zinc/32/07/44/1039320744.db2.gz AKTMOYXMTBWBGM-UHFFFAOYSA-N 2 2 353.338 2.501 20 5 FFBDLP Cc1[nH+]ccn1-c1cc[nH+]cc1NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC001322846528 1046246838 /nfs/dbraw/zinc/24/68/38/1046246838.db2.gz OMAITSORTRQFNN-UHFFFAOYSA-N 2 2 353.338 2.501 20 5 FFBDLP C[C@H]1C[C@H]([NH+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[N@@H+]1C ZINC000093643726 250039038 /nfs/dbraw/zinc/03/90/38/250039038.db2.gz HMVXHNNZSXELAV-KBXCAEBGSA-N 2 2 357.458 2.910 20 5 FFBDLP C[C@H]1C[C@H]([NH+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000093643726 250039041 /nfs/dbraw/zinc/03/90/41/250039041.db2.gz HMVXHNNZSXELAV-KBXCAEBGSA-N 2 2 357.458 2.910 20 5 FFBDLP C[C@H]1C[C@H]([N@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[NH+]1C ZINC000093643726 250039043 /nfs/dbraw/zinc/03/90/43/250039043.db2.gz HMVXHNNZSXELAV-KBXCAEBGSA-N 2 2 357.458 2.910 20 5 FFBDLP C[C@H]1C[C@H]([N@@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[NH+]1C ZINC000093643726 250039046 /nfs/dbraw/zinc/03/90/46/250039046.db2.gz HMVXHNNZSXELAV-KBXCAEBGSA-N 2 2 357.458 2.910 20 5 FFBDLP Cn1cc[nH+]c1C[C@@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000090003543 507899218 /nfs/dbraw/zinc/89/92/18/507899218.db2.gz MCQFXCCAJKFLAQ-ZDUSSCGKSA-N 2 2 355.398 2.924 20 5 FFBDLP Cn1cc[nH+]c1C[C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000090003543 507899221 /nfs/dbraw/zinc/89/92/21/507899221.db2.gz MCQFXCCAJKFLAQ-ZDUSSCGKSA-N 2 2 355.398 2.924 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000090003641 507900037 /nfs/dbraw/zinc/90/00/37/507900037.db2.gz IZNZOSVYVQTKMC-OAHLLOKOSA-N 2 2 371.441 2.530 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000090003641 507900039 /nfs/dbraw/zinc/90/00/39/507900039.db2.gz IZNZOSVYVQTKMC-OAHLLOKOSA-N 2 2 371.441 2.530 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000123849103 508747669 /nfs/dbraw/zinc/74/76/69/508747669.db2.gz BQPBFFUWVFHFRU-HUUCEWRRSA-N 2 2 371.441 2.610 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000123849103 508747671 /nfs/dbraw/zinc/74/76/71/508747671.db2.gz BQPBFFUWVFHFRU-HUUCEWRRSA-N 2 2 371.441 2.610 20 5 FFBDLP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000130890212 508860569 /nfs/dbraw/zinc/86/05/69/508860569.db2.gz XIWIHTNAEVJQTG-UHFFFAOYSA-N 2 2 356.386 2.672 20 5 FFBDLP Cc1[nH+]ccn1CCC[N@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000130890212 508860574 /nfs/dbraw/zinc/86/05/74/508860574.db2.gz XIWIHTNAEVJQTG-UHFFFAOYSA-N 2 2 356.386 2.672 20 5 FFBDLP CN(c1ccccc1)c1ccc(C[NH2+]C[C@@](C)(O)C[NH+](C)C)cc1[N+](=O)[O-] ZINC000131456616 508933946 /nfs/dbraw/zinc/93/39/46/508933946.db2.gz QSXCCDAUCIDPIV-HXUWFJFHSA-N 2 2 372.469 2.765 20 5 FFBDLP Cc1c(NC(=O)[C@@H](C)[NH+]2CCC(c3[nH]cc[nH+]3)CC2)cccc1[N+](=O)[O-] ZINC000266785911 509192599 /nfs/dbraw/zinc/19/25/99/509192599.db2.gz WBMOZTNVRAPIHV-CYBMUJFWSA-N 2 2 357.414 2.833 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[NH+]3CCC(C[NH+]4CCCC4)CC3)n2)cc1 ZINC000171386682 510123522 /nfs/dbraw/zinc/12/35/22/510123522.db2.gz TWAHJGUWRDFZTB-UHFFFAOYSA-N 2 2 371.441 2.953 20 5 FFBDLP C[N@@H+]1CCC[C@H]2C[NH+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)CC[C@H]21 ZINC000246541533 510545697 /nfs/dbraw/zinc/54/56/97/510545697.db2.gz AQULGWWXIFFQHG-GOEBONIOSA-N 2 2 357.414 2.561 20 5 FFBDLP C[N@H+]1CCC[C@H]2C[NH+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)CC[C@H]21 ZINC000246541533 510545704 /nfs/dbraw/zinc/54/57/04/510545704.db2.gz AQULGWWXIFFQHG-GOEBONIOSA-N 2 2 357.414 2.561 20 5 FFBDLP C[NH+]1CCC[C@H]2C[N@H+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)CC[C@H]21 ZINC000246541533 510545710 /nfs/dbraw/zinc/54/57/10/510545710.db2.gz AQULGWWXIFFQHG-GOEBONIOSA-N 2 2 357.414 2.561 20 5 FFBDLP C[NH+]1CCC[C@H]2C[N@@H+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)CC[C@H]21 ZINC000246541533 510545716 /nfs/dbraw/zinc/54/57/16/510545716.db2.gz AQULGWWXIFFQHG-GOEBONIOSA-N 2 2 357.414 2.561 20 5 FFBDLP C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000246571794 510562613 /nfs/dbraw/zinc/56/26/13/510562613.db2.gz BQPBFFUWVFHFRU-GJZGRUSLSA-N 2 2 371.441 2.610 20 5 FFBDLP C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000246571794 510562616 /nfs/dbraw/zinc/56/26/16/510562616.db2.gz BQPBFFUWVFHFRU-GJZGRUSLSA-N 2 2 371.441 2.610 20 5 FFBDLP C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000247376571 510859135 /nfs/dbraw/zinc/85/91/35/510859135.db2.gz HWBXALBKSWUOEL-JKIFEVAISA-N 2 2 357.414 2.701 20 5 FFBDLP C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000247376571 510859136 /nfs/dbraw/zinc/85/91/36/510859136.db2.gz HWBXALBKSWUOEL-JKIFEVAISA-N 2 2 357.414 2.701 20 5 FFBDLP C[C@@H]([NH2+]C1CC[NH+](Cc2ccccn2)CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000293579545 512016046 /nfs/dbraw/zinc/01/60/46/512016046.db2.gz DVANZPUDSBYOOG-CQSZACIVSA-N 2 2 355.442 2.887 20 5 FFBDLP O=C(NCCCCC[NH+]1CCCC1)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000293786482 512084876 /nfs/dbraw/zinc/08/48/76/512084876.db2.gz ADDSEXTWFZZKIV-UHFFFAOYSA-N 2 2 371.441 2.776 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@@H+]2Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000374426292 512828200 /nfs/dbraw/zinc/82/82/00/512828200.db2.gz DCFVKCCDCGNGLO-HLLBOEOZSA-N 2 2 353.850 2.932 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@H+]2Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000374426292 512828205 /nfs/dbraw/zinc/82/82/05/512828205.db2.gz DCFVKCCDCGNGLO-HLLBOEOZSA-N 2 2 353.850 2.932 20 5 FFBDLP CC[NH+]1CCC([N@@H+]2CCCN(C(=O)c3cc(C)ccc3[N+](=O)[O-])CC2)CC1 ZINC000422014056 513522127 /nfs/dbraw/zinc/52/21/27/513522127.db2.gz FSUFHQMFHHEOLV-UHFFFAOYSA-N 2 2 374.485 2.535 20 5 FFBDLP CC[NH+]1CCC([N@H+]2CCCN(C(=O)c3cc(C)ccc3[N+](=O)[O-])CC2)CC1 ZINC000422014056 513522133 /nfs/dbraw/zinc/52/21/33/513522133.db2.gz FSUFHQMFHHEOLV-UHFFFAOYSA-N 2 2 374.485 2.535 20 5 FFBDLP CCn1ccnc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CC12CC[NH2+]CC2 ZINC000435422887 513578632 /nfs/dbraw/zinc/57/86/32/513578632.db2.gz QITVOUJSJXRDTD-GOSISDBHSA-N 2 2 369.469 2.956 20 5 FFBDLP CCn1ccnc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CC12CC[NH2+]CC2 ZINC000435422887 513578636 /nfs/dbraw/zinc/57/86/36/513578636.db2.gz QITVOUJSJXRDTD-GOSISDBHSA-N 2 2 369.469 2.956 20 5 FFBDLP CCn1cc[nH+]c1CN(Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CC12CC[NH2+]CC2 ZINC000435422887 513578643 /nfs/dbraw/zinc/57/86/43/513578643.db2.gz QITVOUJSJXRDTD-GOSISDBHSA-N 2 2 369.469 2.956 20 5 FFBDLP C[NH+](C)[C@H]1CCC[C@H](Nc2cc(C[NH+]3CCOCC3)ccc2[N+](=O)[O-])C1 ZINC000447817336 513581920 /nfs/dbraw/zinc/58/19/20/513581920.db2.gz NNCPNWMIHCKYEQ-IRXDYDNUSA-N 2 2 362.474 2.712 20 5 FFBDLP C[NH+](C)C1(CNC(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)CCCCC1 ZINC000448574331 513788802 /nfs/dbraw/zinc/78/88/02/513788802.db2.gz RHPSSIUAAHJAPS-UHFFFAOYSA-N 2 2 371.441 2.775 20 5 FFBDLP COc1ccc(-c2ccc(C[N@H+]3C[C@H]4C[NH+](C)C[C@H]4C3)o2)c([N+](=O)[O-])c1 ZINC000425995750 513820454 /nfs/dbraw/zinc/82/04/54/513820454.db2.gz MQTWDRJRBOQEJE-OKILXGFUSA-N 2 2 357.410 2.857 20 5 FFBDLP COc1ccc(-c2ccc(C[N@@H+]3C[C@H]4C[NH+](C)C[C@H]4C3)o2)c([N+](=O)[O-])c1 ZINC000425995750 513820457 /nfs/dbraw/zinc/82/04/57/513820457.db2.gz MQTWDRJRBOQEJE-OKILXGFUSA-N 2 2 357.410 2.857 20 5 FFBDLP COc1ccc(-c2ccc(C[NH+]3C[C@H]4C[N@@H+](C)C[C@H]4C3)o2)c([N+](=O)[O-])c1 ZINC000425995750 513820459 /nfs/dbraw/zinc/82/04/59/513820459.db2.gz MQTWDRJRBOQEJE-OKILXGFUSA-N 2 2 357.410 2.857 20 5 FFBDLP COc1ccc(-c2ccc(C[NH+]3C[C@H]4C[N@H+](C)C[C@H]4C3)o2)c([N+](=O)[O-])c1 ZINC000425995750 513820461 /nfs/dbraw/zinc/82/04/61/513820461.db2.gz MQTWDRJRBOQEJE-OKILXGFUSA-N 2 2 357.410 2.857 20 5 FFBDLP Cn1cc[nH+]c1[C@@H](NC[C@@H]1[NH2+]CCCC1(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000423392855 514126827 /nfs/dbraw/zinc/12/68/27/514126827.db2.gz QUWJQURYWVHMJK-IRXDYDNUSA-N 2 2 357.458 2.786 20 5 FFBDLP C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@@H]1[NH2+]CCc2ccccc21 ZINC000423431316 514140529 /nfs/dbraw/zinc/14/05/29/514140529.db2.gz QJRMJGWVOOYDCS-KUHUBIRLSA-N 2 2 368.437 2.789 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCCC[N@H+]1CCO ZINC000449394588 514192619 /nfs/dbraw/zinc/19/26/19/514192619.db2.gz NXYYHNYBBXEHBK-UHOSZYNNSA-N 2 2 361.486 2.742 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCCC[N@@H+]1CCO ZINC000449394588 514192622 /nfs/dbraw/zinc/19/26/22/514192622.db2.gz NXYYHNYBBXEHBK-UHOSZYNNSA-N 2 2 361.486 2.742 20 5 FFBDLP C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C[C@H]1[NH2+]CCc2ccccc21 ZINC000414941912 514366240 /nfs/dbraw/zinc/36/62/40/514366240.db2.gz BGYNRQHGHMRWPQ-AUUYWEPGSA-N 2 2 368.437 2.789 20 5 FFBDLP C[NH+](C)CC[C@H](NC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)C(C)(C)C ZINC000449879729 514405170 /nfs/dbraw/zinc/40/51/70/514405170.db2.gz JJHTUMGPHHWZEW-KRWDZBQOSA-N 2 2 373.457 2.877 20 5 FFBDLP COC(=O)CCC[NH+]1CCC([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000462895856 515287692 /nfs/dbraw/zinc/28/76/92/515287692.db2.gz NLOAEVQZKWZDFI-UHFFFAOYSA-N 2 2 369.849 2.755 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@H](Oc2cc[nH+]cc2)C1 ZINC000469741240 515948076 /nfs/dbraw/zinc/94/80/76/515948076.db2.gz GAMFGJHQTPRDTC-KRWDZBQOSA-N 2 2 370.409 2.780 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](Oc2cc[nH+]cc2)C1 ZINC000469741240 515948089 /nfs/dbraw/zinc/94/80/89/515948089.db2.gz GAMFGJHQTPRDTC-KRWDZBQOSA-N 2 2 370.409 2.780 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH+]1CCC(Nc2cccc[nH+]2)CC1 ZINC000535573736 516407926 /nfs/dbraw/zinc/40/79/26/516407926.db2.gz CKVHXHILPCLZOM-UHFFFAOYSA-N 2 2 369.425 2.813 20 5 FFBDLP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000531340096 516415517 /nfs/dbraw/zinc/41/55/17/516415517.db2.gz YKFRFJUBDVQKPX-HNNXBMFYSA-N 2 2 361.442 2.625 20 5 FFBDLP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000531340096 516415522 /nfs/dbraw/zinc/41/55/22/516415522.db2.gz YKFRFJUBDVQKPX-HNNXBMFYSA-N 2 2 361.442 2.625 20 5 FFBDLP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000531340096 516415525 /nfs/dbraw/zinc/41/55/25/516415525.db2.gz YKFRFJUBDVQKPX-HNNXBMFYSA-N 2 2 361.442 2.625 20 5 FFBDLP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000531340096 516415527 /nfs/dbraw/zinc/41/55/27/516415527.db2.gz YKFRFJUBDVQKPX-HNNXBMFYSA-N 2 2 361.442 2.625 20 5 FFBDLP CC[C@@H]([NH2+][C@H]1CCCN(Cc2[nH+]ccn2C)C1=O)c1cccc([N+](=O)[O-])c1 ZINC000544017197 516541219 /nfs/dbraw/zinc/54/12/19/516541219.db2.gz TWVNPONNMILBJW-SJORKVTESA-N 2 2 371.441 2.560 20 5 FFBDLP C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@@H](c2[nH+]ccn2C)C1 ZINC000536068650 516617377 /nfs/dbraw/zinc/61/73/77/516617377.db2.gz JUBXDXLFSWZBIR-TZMCWYRMSA-N 2 2 368.397 2.929 20 5 FFBDLP C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](c2[nH+]ccn2C)C1 ZINC000536068650 516617387 /nfs/dbraw/zinc/61/73/87/516617387.db2.gz JUBXDXLFSWZBIR-TZMCWYRMSA-N 2 2 368.397 2.929 20 5 FFBDLP C[C@H]1C[N@@H+](C2CC2)C[C@@H]1[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000540625408 516644758 /nfs/dbraw/zinc/64/47/58/516644758.db2.gz FDZXUHYMWHJCHS-UGSOOPFHSA-N 2 2 355.442 2.568 20 5 FFBDLP C[C@H]1C[N@H+](C2CC2)C[C@@H]1[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000540625408 516644765 /nfs/dbraw/zinc/64/47/65/516644765.db2.gz FDZXUHYMWHJCHS-UGSOOPFHSA-N 2 2 355.442 2.568 20 5 FFBDLP Cc1cc(N2CC[NH+](Cc3cnn(C)c3)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000541172557 516912115 /nfs/dbraw/zinc/91/21/15/516912115.db2.gz FARJOGJMSBQUMA-UHFFFAOYSA-N 2 2 366.425 2.507 20 5 FFBDLP C[NH+]1CCN(c2ncccc2C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])CC1 ZINC000565844568 519160402 /nfs/dbraw/zinc/16/04/02/519160402.db2.gz XUOGPHWZDCLTGN-SFHVURJKSA-N 2 2 367.453 2.519 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1 ZINC000595023347 520260151 /nfs/dbraw/zinc/26/01/51/520260151.db2.gz VZVWJHHNSDJOPR-VHSSKADRSA-N 2 2 363.458 2.632 20 5 FFBDLP C[C@@H]1CCCN(C(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)[C@@H]1CCC[NH3+] ZINC000595257890 520377283 /nfs/dbraw/zinc/37/72/83/520377283.db2.gz BNVVIZPIMLHQLA-GDBMZVCRSA-N 2 2 371.441 2.760 20 5 FFBDLP CC[C@@H]1C[N@H+](Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])CC[C@@H]1[NH3+] ZINC000592427618 520388379 /nfs/dbraw/zinc/38/83/79/520388379.db2.gz HWYPGLPDMPHNLI-YPMHNXCESA-N 2 2 373.400 2.807 20 5 FFBDLP CC[C@@H]1C[N@@H+](Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])CC[C@@H]1[NH3+] ZINC000592427618 520388385 /nfs/dbraw/zinc/38/83/85/520388385.db2.gz HWYPGLPDMPHNLI-YPMHNXCESA-N 2 2 373.400 2.807 20 5 FFBDLP Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@H+](C)CCC[NH3+])c([N+](=O)[O-])c1 ZINC000592473846 520402702 /nfs/dbraw/zinc/40/27/02/520402702.db2.gz QUWOIYFGWTXRAL-SFHVURJKSA-N 2 2 356.426 2.864 20 5 FFBDLP Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@@H+](C)CCC[NH3+])c([N+](=O)[O-])c1 ZINC000592473846 520402710 /nfs/dbraw/zinc/40/27/10/520402710.db2.gz QUWOIYFGWTXRAL-SFHVURJKSA-N 2 2 356.426 2.864 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]3)C2)cccc1[N+](=O)[O-] ZINC000592479177 520406726 /nfs/dbraw/zinc/40/67/26/520406726.db2.gz UELHPKXRGZVSIC-UXLLHSPISA-N 2 2 360.458 2.694 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]3)C2)cccc1[N+](=O)[O-] ZINC000592479177 520406735 /nfs/dbraw/zinc/40/67/35/520406735.db2.gz UELHPKXRGZVSIC-UXLLHSPISA-N 2 2 360.458 2.694 20 5 FFBDLP CC[NH+]1CCC([N@@H+]2CCCN(Cc3ccc(F)cc3[N+](=O)[O-])CC2)CC1 ZINC000595545836 520543520 /nfs/dbraw/zinc/54/35/20/520543520.db2.gz KEWNYJAIVIMOSF-UHFFFAOYSA-N 2 2 364.465 2.726 20 5 FFBDLP CC[NH+]1CCC([N@H+]2CCCN(Cc3ccc(F)cc3[N+](=O)[O-])CC2)CC1 ZINC000595545836 520543528 /nfs/dbraw/zinc/54/35/28/520543528.db2.gz KEWNYJAIVIMOSF-UHFFFAOYSA-N 2 2 364.465 2.726 20 5 FFBDLP CC[NH+]1CCC(N2CCC[N@H+](Cc3ccc(F)cc3[N+](=O)[O-])CC2)CC1 ZINC000595545836 520543537 /nfs/dbraw/zinc/54/35/37/520543537.db2.gz KEWNYJAIVIMOSF-UHFFFAOYSA-N 2 2 364.465 2.726 20 5 FFBDLP CC[NH+]1CCC(N2CCC[N@@H+](Cc3ccc(F)cc3[N+](=O)[O-])CC2)CC1 ZINC000595545836 520543548 /nfs/dbraw/zinc/54/35/48/520543548.db2.gz KEWNYJAIVIMOSF-UHFFFAOYSA-N 2 2 364.465 2.726 20 5 FFBDLP Cc1ccc(C[NH2+]C[C@]2(O)CC[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000610162186 520564282 /nfs/dbraw/zinc/56/42/82/520564282.db2.gz FWMAWSFKENIJMA-HXUWFJFHSA-N 2 2 355.438 2.630 20 5 FFBDLP Cc1ccc(C[NH2+]C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000610162186 520564288 /nfs/dbraw/zinc/56/42/88/520564288.db2.gz FWMAWSFKENIJMA-HXUWFJFHSA-N 2 2 355.438 2.630 20 5 FFBDLP Cc1cc(N[C@H](C)C2CC[NH+](C)CC2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000611132486 521002271 /nfs/dbraw/zinc/00/22/71/521002271.db2.gz VEQHIHDVDLOZFE-CQSZACIVSA-N 2 2 355.442 2.924 20 5 FFBDLP C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C[C@@H]1CC[N@@H+]1C1CCCC1 ZINC000599072934 521016850 /nfs/dbraw/zinc/01/68/50/521016850.db2.gz COPJPJUHKBHUCF-KDOFPFPSSA-N 2 2 360.458 2.918 20 5 FFBDLP C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C[C@@H]1CC[N@H+]1C1CCCC1 ZINC000599072934 521016856 /nfs/dbraw/zinc/01/68/56/521016856.db2.gz COPJPJUHKBHUCF-KDOFPFPSSA-N 2 2 360.458 2.918 20 5 FFBDLP C[C@@H]1C[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])CC[C@H]1N1CC[NH+](C)CC1 ZINC000611275113 521076529 /nfs/dbraw/zinc/07/65/29/521076529.db2.gz DZXSOFJFPAQGJB-OLVPKOTESA-N 2 2 358.486 2.566 20 5 FFBDLP C[C@@H]1C[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])CC[C@H]1N1CC[NH+](C)CC1 ZINC000611275113 521076536 /nfs/dbraw/zinc/07/65/36/521076536.db2.gz DZXSOFJFPAQGJB-OLVPKOTESA-N 2 2 358.486 2.566 20 5 FFBDLP O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C1)OCCO2 ZINC000611287365 521080704 /nfs/dbraw/zinc/08/07/04/521080704.db2.gz ZUDJVJXEWWGKGD-RHSMWYFYSA-N 2 2 373.453 2.815 20 5 FFBDLP O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C1)OCCO2 ZINC000611287365 521080709 /nfs/dbraw/zinc/08/07/09/521080709.db2.gz ZUDJVJXEWWGKGD-RHSMWYFYSA-N 2 2 373.453 2.815 20 5 FFBDLP O=[N+]([O-])c1cc2c(cc1C[NH+]1CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C1)OCCO2 ZINC000611287365 521080717 /nfs/dbraw/zinc/08/07/17/521080717.db2.gz ZUDJVJXEWWGKGD-RHSMWYFYSA-N 2 2 373.453 2.815 20 5 FFBDLP O=[N+]([O-])c1cc2c(cc1C[NH+]1CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C1)OCCO2 ZINC000611287365 521080722 /nfs/dbraw/zinc/08/07/22/521080722.db2.gz ZUDJVJXEWWGKGD-RHSMWYFYSA-N 2 2 373.453 2.815 20 5 FFBDLP Cn1cc[nH+]c1[C@@H](N[C@@H]1CC[NH2+]CC(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000602019708 521081315 /nfs/dbraw/zinc/08/13/15/521081315.db2.gz GGGXVWHLYIFEHT-WBVHZDCISA-N 2 2 357.458 2.786 20 5 FFBDLP C[NH+]1CCC2(CC1)C[N@H+](Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])CCO2 ZINC000602701990 521485904 /nfs/dbraw/zinc/48/59/04/521485904.db2.gz GZGYZZNPCKLXNR-UHFFFAOYSA-N 2 2 373.375 2.910 20 5 FFBDLP C[NH+]1CCC2(CC1)C[N@@H+](Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])CCO2 ZINC000602701990 521485909 /nfs/dbraw/zinc/48/59/09/521485909.db2.gz GZGYZZNPCKLXNR-UHFFFAOYSA-N 2 2 373.375 2.910 20 5 FFBDLP O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CCC[NH+]1CCC(O)CC1 ZINC000811476302 741527513 /nfs/dbraw/zinc/52/75/13/741527513.db2.gz RTEHFMAUICIKKR-UHFFFAOYSA-N 2 2 362.257 2.838 20 5 FFBDLP O=C(C[NH+]1CCC([C@H]2CCC[NH2+]2)CC1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000842472295 747612467 /nfs/dbraw/zinc/61/24/67/747612467.db2.gz BXZYRNTVGWMGLD-CQSZACIVSA-N 2 2 366.849 2.651 20 5 FFBDLP CC[NH2+]CC1CC[NH+]([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000843352087 747815337 /nfs/dbraw/zinc/81/53/37/747815337.db2.gz DHJKWMGZFKQBNG-GFCCVEGCSA-N 2 2 368.865 2.897 20 5 FFBDLP O=C(C[NH+]1CCC([C@H]2CC[NH2+]C2)CC1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000843385831 747821518 /nfs/dbraw/zinc/82/15/18/747821518.db2.gz ADGGABOVAVHDER-ZDUSSCGKSA-N 2 2 366.849 2.508 20 5 FFBDLP COc1c(O)ccc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000894135132 977942611 /nfs/dbraw/zinc/94/26/11/977942611.db2.gz RJCGGJWPMZIVKW-MRXNPFEDSA-N 2 2 371.437 2.921 20 5 FFBDLP COc1c(O)ccc(C[NH2+]C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000894135132 977942617 /nfs/dbraw/zinc/94/26/17/977942617.db2.gz RJCGGJWPMZIVKW-MRXNPFEDSA-N 2 2 371.437 2.921 20 5 FFBDLP O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[N@@H+]3CCc4cn[nH]c4C3)CC2)cc1 ZINC001180147703 1009580728 /nfs/dbraw/zinc/58/07/28/1009580728.db2.gz LKZLDKJLJYCUCV-UHFFFAOYSA-N 2 2 369.469 2.631 20 5 FFBDLP O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[N@H+]3CCc4cn[nH]c4C3)CC2)cc1 ZINC001180147703 1009580740 /nfs/dbraw/zinc/58/07/40/1009580740.db2.gz LKZLDKJLJYCUCV-UHFFFAOYSA-N 2 2 369.469 2.631 20 5 FFBDLP COCC[N@H+](C1CC[NH+](C)CC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172912304 1012126223 /nfs/dbraw/zinc/12/62/23/1012126223.db2.gz ZAEBFWGDDLWPED-GOSISDBHSA-N 2 2 361.486 2.885 20 5 FFBDLP COCC[N@@H+](C1CC[NH+](C)CC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172912304 1012126235 /nfs/dbraw/zinc/12/62/35/1012126235.db2.gz ZAEBFWGDDLWPED-GOSISDBHSA-N 2 2 361.486 2.885 20 5 FFBDLP C[N@@H+]1CCC[C@H]2C[NH+](Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)CC[C@H]21 ZINC000777963012 1020356975 /nfs/dbraw/zinc/35/69/75/1020356975.db2.gz FORBQYITJLOWBY-QFBILLFUSA-N 2 2 355.442 2.832 20 5 FFBDLP C[N@H+]1CCC[C@H]2C[NH+](Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)CC[C@H]21 ZINC000777963012 1020356987 /nfs/dbraw/zinc/35/69/87/1020356987.db2.gz FORBQYITJLOWBY-QFBILLFUSA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CCC[C@H]2C[N@H+](Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)CC[C@H]21 ZINC000777963012 1020357000 /nfs/dbraw/zinc/35/70/00/1020357000.db2.gz FORBQYITJLOWBY-QFBILLFUSA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CCC[C@H]2C[N@@H+](Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)CC[C@H]21 ZINC000777963012 1020357010 /nfs/dbraw/zinc/35/70/10/1020357010.db2.gz FORBQYITJLOWBY-QFBILLFUSA-N 2 2 355.442 2.832 20 5 FFBDLP O=[N+]([O-])c1ccc2c(cnn2C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000158003347 1022470757 /nfs/dbraw/zinc/47/07/57/1022470757.db2.gz RHZKAPPCNKGVBE-RDTXWAMCSA-N 2 2 355.442 2.851 20 5 FFBDLP O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000158003347 1022470762 /nfs/dbraw/zinc/47/07/62/1022470762.db2.gz RHZKAPPCNKGVBE-RDTXWAMCSA-N 2 2 355.442 2.851 20 5 FFBDLP O=[N+]([O-])c1ccc2c(cnn2C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000158003347 1022470768 /nfs/dbraw/zinc/47/07/68/1022470768.db2.gz RHZKAPPCNKGVBE-RDTXWAMCSA-N 2 2 355.442 2.851 20 5 FFBDLP O=[N+]([O-])c1ccc2c(cnn2C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000158003347 1022470776 /nfs/dbraw/zinc/47/07/76/1022470776.db2.gz RHZKAPPCNKGVBE-RDTXWAMCSA-N 2 2 355.442 2.851 20 5 FFBDLP O=C(OCCC[NH+]1CCCCC1)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000838102422 1026210111 /nfs/dbraw/zinc/21/01/11/1026210111.db2.gz QRQJEHSBKKHPQW-UHFFFAOYSA-N 2 2 358.398 2.813 20 5 FFBDLP O=[N+]([O-])c1ccc(C(F)(F)n2c[nH+]cc2C2CC[NH2+]CC2)nc1Cl ZINC001155052407 1028558377 /nfs/dbraw/zinc/55/83/77/1028558377.db2.gz BOISSKGCWICBGJ-UHFFFAOYSA-N 2 2 357.748 2.904 20 5 FFBDLP [NH3+]C[C@H]([NH3+])c1ccc(C(=O)Nc2cc3cccnc3c3ncccc23)cc1 ZINC001218980021 1033441723 /nfs/dbraw/zinc/44/17/23/1033441723.db2.gz PQJPJZQCRGFMGZ-KRWDZBQOSA-N 2 2 357.417 2.994 20 5 FFBDLP Cn1c[nH+]c(CCNC(=O)[C@@H]([NH3+])Cc2c3ccccc3cc3ccccc32)c1 ZINC001219633783 1033724021 /nfs/dbraw/zinc/72/40/21/1033724021.db2.gz DXBUHVPXTAVKEU-QFIPXVFZSA-N 2 2 372.472 2.955 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2CC[C@@]3(C2)CCC[NH2+]C3)c1F ZINC001246600006 1039411296 /nfs/dbraw/zinc/41/12/96/1039411296.db2.gz CNTAXULRMWHZGN-ACJLOTCBSA-N 2 2 351.422 2.749 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CC[C@@]3(C2)CCC[NH2+]C3)c1F ZINC001246600006 1039411303 /nfs/dbraw/zinc/41/13/03/1039411303.db2.gz CNTAXULRMWHZGN-ACJLOTCBSA-N 2 2 351.422 2.749 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH2+]CC1CCN(c3cccc[nH+]3)CC1)C2 ZINC001254578377 1040812194 /nfs/dbraw/zinc/81/21/94/1040812194.db2.gz KPCLXYBODQWPDV-GOSISDBHSA-N 2 2 352.438 2.963 20 5 FFBDLP C[C@@H](C[NH3+])[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC001579395910 1078625639 /nfs/dbraw/zinc/62/56/39/1078625639.db2.gz SHEJCIPNICPPMG-AWEZNQCLSA-N 2 2 351.410 2.884 20 5 FFBDLP CC[NH+]1CCN([C@H]2CC[N@H+](Cc3ccc(C(C)C)c([N+](=O)[O-])c3)C2)CC1 ZINC000093133041 250018431 /nfs/dbraw/zinc/01/84/31/250018431.db2.gz PZNRGSPIXHETMF-SFHVURJKSA-N 2 2 360.502 2.930 20 5 FFBDLP CC[NH+]1CCN([C@H]2CC[N@@H+](Cc3ccc(C(C)C)c([N+](=O)[O-])c3)C2)CC1 ZINC000093133041 250018436 /nfs/dbraw/zinc/01/84/36/250018436.db2.gz PZNRGSPIXHETMF-SFHVURJKSA-N 2 2 360.502 2.930 20 5 FFBDLP COc1ccc(OCC[N@@H+]2CCC[C@H](c3[nH+]ccn3C)C2)c([N+](=O)[O-])c1 ZINC000377261354 512190752 /nfs/dbraw/zinc/19/07/52/512190752.db2.gz INWAVLJILUPPLD-AWEZNQCLSA-N 2 2 360.414 2.595 20 5 FFBDLP COc1ccc(OCC[N@H+]2CCC[C@H](c3[nH+]ccn3C)C2)c([N+](=O)[O-])c1 ZINC000377261354 512190756 /nfs/dbraw/zinc/19/07/56/512190756.db2.gz INWAVLJILUPPLD-AWEZNQCLSA-N 2 2 360.414 2.595 20 5 FFBDLP CC(C)(C)[N@@H+]1CCCN(C(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)CC1 ZINC000063723343 507764666 /nfs/dbraw/zinc/76/46/66/507764666.db2.gz UQUNXGBPASXUKE-UHFFFAOYSA-N 2 2 371.441 2.727 20 5 FFBDLP CC(C)(C)[N@H+]1CCCN(C(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)CC1 ZINC000063723343 507764669 /nfs/dbraw/zinc/76/46/69/507764669.db2.gz UQUNXGBPASXUKE-UHFFFAOYSA-N 2 2 371.441 2.727 20 5 FFBDLP COc1cc(C[N@@H+]2CC[C@@H](Oc3cc[nH+]cc3)C2)c([N+](=O)[O-])cc1OC ZINC000093865961 508157845 /nfs/dbraw/zinc/15/78/45/508157845.db2.gz XKCFEZAWOVTSDA-OAHLLOKOSA-N 2 2 359.382 2.660 20 5 FFBDLP COc1cc(C[N@H+]2CC[C@@H](Oc3cc[nH+]cc3)C2)c([N+](=O)[O-])cc1OC ZINC000093865961 508157849 /nfs/dbraw/zinc/15/78/49/508157849.db2.gz XKCFEZAWOVTSDA-OAHLLOKOSA-N 2 2 359.382 2.660 20 5 FFBDLP CC[NH+](CC)C[C@H]1CCN(C(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)C1 ZINC000081330146 508163297 /nfs/dbraw/zinc/16/32/97/508163297.db2.gz REMPEPWQVFAOKE-OAHLLOKOSA-N 2 2 371.441 2.584 20 5 FFBDLP CC(C)[NH+]1CCC(NC(=O)C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)CC1 ZINC000153283173 508567526 /nfs/dbraw/zinc/56/75/26/508567526.db2.gz ATPMDPAECVOPHS-UHFFFAOYSA-N 2 2 374.485 2.548 20 5 FFBDLP CC(C)[NH+]1CCC(NC(=O)C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)CC1 ZINC000153283173 508567530 /nfs/dbraw/zinc/56/75/30/508567530.db2.gz ATPMDPAECVOPHS-UHFFFAOYSA-N 2 2 374.485 2.548 20 5 FFBDLP C[C@H]1CC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H]1n1cc[nH+]c1 ZINC000129676859 508753286 /nfs/dbraw/zinc/75/32/86/508753286.db2.gz STPCRHRMIOFILM-YOEHRIQHSA-N 2 2 357.414 2.703 20 5 FFBDLP C[C@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H]1n1cc[nH+]c1 ZINC000129676859 508753288 /nfs/dbraw/zinc/75/32/88/508753288.db2.gz STPCRHRMIOFILM-YOEHRIQHSA-N 2 2 357.414 2.703 20 5 FFBDLP COCCC[N@H+](C)CCNc1cc(C)[nH+]c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000161128782 509074865 /nfs/dbraw/zinc/07/48/65/509074865.db2.gz FGPRXUVGZGULRJ-UHFFFAOYSA-N 2 2 359.430 2.740 20 5 FFBDLP COCCC[N@@H+](C)CCNc1cc(C)[nH+]c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000161128782 509074867 /nfs/dbraw/zinc/07/48/67/509074867.db2.gz FGPRXUVGZGULRJ-UHFFFAOYSA-N 2 2 359.430 2.740 20 5 FFBDLP COc1ccc(OCC[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC000173781961 509774138 /nfs/dbraw/zinc/77/41/38/509774138.db2.gz NBJOYZSBYMDOEB-MRXNPFEDSA-N 2 2 363.458 2.933 20 5 FFBDLP COc1ccc(OCC[N@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC000173781961 509774143 /nfs/dbraw/zinc/77/41/43/509774143.db2.gz NBJOYZSBYMDOEB-MRXNPFEDSA-N 2 2 363.458 2.933 20 5 FFBDLP COc1ccc(OCC[N@@H+]2CC[C@H](C)[C@H](n3cc[nH+]c3)C2)c([N+](=O)[O-])c1 ZINC000245526789 509984279 /nfs/dbraw/zinc/98/42/79/509984279.db2.gz FLCKJRJFCIFRML-WMLDXEAASA-N 2 2 360.414 2.762 20 5 FFBDLP COc1ccc(OCC[N@H+]2CC[C@H](C)[C@H](n3cc[nH+]c3)C2)c([N+](=O)[O-])c1 ZINC000245526789 509984284 /nfs/dbraw/zinc/98/42/84/509984284.db2.gz FLCKJRJFCIFRML-WMLDXEAASA-N 2 2 360.414 2.762 20 5 FFBDLP CC[N@@H+]1CC[C@@H]([NH+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@H](C)C1 ZINC000174773862 510304328 /nfs/dbraw/zinc/30/43/28/510304328.db2.gz OYJZDIHMMSOEPM-MLGOLLRUSA-N 2 2 368.865 2.849 20 5 FFBDLP CC[N@H+]1CC[C@@H]([NH+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@H](C)C1 ZINC000174773862 510304335 /nfs/dbraw/zinc/30/43/35/510304335.db2.gz OYJZDIHMMSOEPM-MLGOLLRUSA-N 2 2 368.865 2.849 20 5 FFBDLP CC[NH+]1CC[C@@H]([N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@H](C)C1 ZINC000174773862 510304344 /nfs/dbraw/zinc/30/43/44/510304344.db2.gz OYJZDIHMMSOEPM-MLGOLLRUSA-N 2 2 368.865 2.849 20 5 FFBDLP CC[NH+]1CC[C@@H]([N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@H](C)C1 ZINC000174773862 510304347 /nfs/dbraw/zinc/30/43/47/510304347.db2.gz OYJZDIHMMSOEPM-MLGOLLRUSA-N 2 2 368.865 2.849 20 5 FFBDLP Cc1[nH+]ccn1CC[N@@H+]1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000284352687 511693774 /nfs/dbraw/zinc/69/37/74/511693774.db2.gz CYKBYRCTFAGJBA-UHFFFAOYSA-N 2 2 365.231 2.921 20 5 FFBDLP Cc1[nH+]ccn1CC[N@H+]1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000284352687 511693785 /nfs/dbraw/zinc/69/37/85/511693785.db2.gz CYKBYRCTFAGJBA-UHFFFAOYSA-N 2 2 365.231 2.921 20 5 FFBDLP O=C(NC[C@H]1CCCC[N@@H+]1C1CC1)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000434419755 513318783 /nfs/dbraw/zinc/31/87/83/513318783.db2.gz BJIRCDDVNLOVKX-MRXNPFEDSA-N 2 2 369.425 2.527 20 5 FFBDLP O=C(NC[C@H]1CCCC[N@H+]1C1CC1)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000434419755 513318790 /nfs/dbraw/zinc/31/87/90/513318790.db2.gz BJIRCDDVNLOVKX-MRXNPFEDSA-N 2 2 369.425 2.527 20 5 FFBDLP C[C@H]1CN(c2ccnc3c2cccc3[N+](=O)[O-])CC[N@@H+]1C1CC[NH+](C)CC1 ZINC000432138358 514105161 /nfs/dbraw/zinc/10/51/61/514105161.db2.gz LBZFVSZTYOSWPT-HNNXBMFYSA-N 2 2 369.469 2.748 20 5 FFBDLP C[C@H]1CN(c2ccnc3c2cccc3[N+](=O)[O-])CC[N@H+]1C1CC[NH+](C)CC1 ZINC000432138358 514105168 /nfs/dbraw/zinc/10/51/68/514105168.db2.gz LBZFVSZTYOSWPT-HNNXBMFYSA-N 2 2 369.469 2.748 20 5 FFBDLP CN(c1ccccc1)c1ccc(C[N@@H+]2CCCO[C@@H](C[NH3+])C2)cc1[N+](=O)[O-] ZINC000415107001 514447357 /nfs/dbraw/zinc/44/73/57/514447357.db2.gz KHGVXKPCKNJVSG-SFHVURJKSA-N 2 2 370.453 2.912 20 5 FFBDLP CN(c1ccccc1)c1ccc(C[N@H+]2CCCO[C@@H](C[NH3+])C2)cc1[N+](=O)[O-] ZINC000415107001 514447363 /nfs/dbraw/zinc/44/73/63/514447363.db2.gz KHGVXKPCKNJVSG-SFHVURJKSA-N 2 2 370.453 2.912 20 5 FFBDLP Cc1ccc(C[NH2+]CC2([NH3+])CC[NH+](Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000415140308 514465225 /nfs/dbraw/zinc/46/52/25/514465225.db2.gz YPELZPBOLQFVSP-UHFFFAOYSA-N 3 2 368.481 2.986 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CCOCC2)cc1NCC[NH+]1CCCCCC1 ZINC000472345552 515236419 /nfs/dbraw/zinc/23/64/19/515236419.db2.gz FMLQHMFBMXDALA-UHFFFAOYSA-N 2 2 362.474 2.715 20 5 FFBDLP CC[NH+]1CCC([NH2+]Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])CC1 ZINC000491056498 515367063 /nfs/dbraw/zinc/36/70/63/515367063.db2.gz BKHYJEWUQJVDEQ-UHFFFAOYSA-N 2 2 373.400 2.821 20 5 FFBDLP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]Cc1c([N+](=O)[O-])ncn1C ZINC000469764073 515955958 /nfs/dbraw/zinc/95/59/58/515955958.db2.gz NDDBUGOJRHNKQJ-HWWDLCQESA-N 2 2 357.458 2.575 20 5 FFBDLP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]Cc1c([N+](=O)[O-])ncn1C ZINC000469764073 515955966 /nfs/dbraw/zinc/95/59/66/515955966.db2.gz NDDBUGOJRHNKQJ-HWWDLCQESA-N 2 2 357.458 2.575 20 5 FFBDLP CCOc1ccc(C(=O)Nc2c[nH+]ccc2-n2cc[nH+]c2)cc1[N+](=O)[O-] ZINC000566342203 519442496 /nfs/dbraw/zinc/44/24/96/519442496.db2.gz ALZLEHXWDZPNLQ-UHFFFAOYSA-N 2 2 353.338 2.827 20 5 FFBDLP Cc1c(NC(=O)CC[N@@H+]2CCC[C@@H](n3cc[nH+]c3)C2)cccc1[N+](=O)[O-] ZINC000609157387 520212883 /nfs/dbraw/zinc/21/28/83/520212883.db2.gz HSWIFQRRJYJSOE-OAHLLOKOSA-N 2 2 357.414 2.765 20 5 FFBDLP Cc1c(NC(=O)CC[N@H+]2CCC[C@@H](n3cc[nH+]c3)C2)cccc1[N+](=O)[O-] ZINC000609157387 520212890 /nfs/dbraw/zinc/21/28/90/520212890.db2.gz HSWIFQRRJYJSOE-OAHLLOKOSA-N 2 2 357.414 2.765 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[C@H]([NH2+]C1CC[NH+]([C@H]2CCOC2)CC1)C1CC1 ZINC000595102181 520294732 /nfs/dbraw/zinc/29/47/32/520294732.db2.gz LANXIYSWSPOQIF-OALUTQOASA-N 2 2 359.470 2.759 20 5 FFBDLP COc1cc(C[N@@H+]2C[C@@H]3CCC[C@]3(C[NH3+])C2)c([N+](=O)[O-])cc1OC(F)F ZINC000593315965 520902930 /nfs/dbraw/zinc/90/29/30/520902930.db2.gz NFIJEMKTVRDONM-SJCJKPOMSA-N 2 2 371.384 2.766 20 5 FFBDLP COc1cc(C[N@H+]2C[C@@H]3CCC[C@]3(C[NH3+])C2)c([N+](=O)[O-])cc1OC(F)F ZINC000593315965 520902940 /nfs/dbraw/zinc/90/29/40/520902940.db2.gz NFIJEMKTVRDONM-SJCJKPOMSA-N 2 2 371.384 2.766 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2ccc(C[NH+]3CCC([N@@H+]4CC[C@@H](O)C4)CC3)o2)c1 ZINC000597234858 521588416 /nfs/dbraw/zinc/58/84/16/521588416.db2.gz CEJIGTOWIVWPOV-GOSISDBHSA-N 2 2 371.437 2.886 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2ccc(C[NH+]3CCC([N@H+]4CC[C@@H](O)C4)CC3)o2)c1 ZINC000597234858 521588426 /nfs/dbraw/zinc/58/84/26/521588426.db2.gz CEJIGTOWIVWPOV-GOSISDBHSA-N 2 2 371.437 2.886 20 5 FFBDLP COc1c(O)ccc(C[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)c1[N+](=O)[O-] ZINC000893200030 734667209 /nfs/dbraw/zinc/66/72/09/734667209.db2.gz LISATHOMXTZGEM-CQSZACIVSA-N 2 2 351.447 2.767 20 5 FFBDLP COc1c(O)ccc(C[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)c1[N+](=O)[O-] ZINC000893200030 734667211 /nfs/dbraw/zinc/66/72/11/734667211.db2.gz LISATHOMXTZGEM-CQSZACIVSA-N 2 2 351.447 2.767 20 5 FFBDLP COc1cc([C@@H](C)[NH2+]CCC[N@@H+]2CCCO[C@H](C)C2)cc([N+](=O)[O-])c1 ZINC000903160468 736044883 /nfs/dbraw/zinc/04/48/83/736044883.db2.gz MMOYSLOTQZGUPN-HUUCEWRRSA-N 2 2 351.447 2.755 20 5 FFBDLP COc1cc([C@@H](C)[NH2+]CCC[N@H+]2CCCO[C@H](C)C2)cc([N+](=O)[O-])c1 ZINC000903160468 736044885 /nfs/dbraw/zinc/04/48/85/736044885.db2.gz MMOYSLOTQZGUPN-HUUCEWRRSA-N 2 2 351.447 2.755 20 5 FFBDLP O=[N+]([O-])c1cc(C(F)(F)n2c[nH+]cc2C2CC[NH2+]CC2)cnc1Cl ZINC001155054401 1028560736 /nfs/dbraw/zinc/56/07/36/1028560736.db2.gz XOVZWSQJSROOBA-UHFFFAOYSA-N 2 2 357.748 2.904 20 5 FFBDLP Cc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2CO)cc1[N+](=O)[O-] ZINC001200704259 1059151127 /nfs/dbraw/zinc/15/11/27/1059151127.db2.gz SCUNSGSORUPPDI-UXHICEINSA-N 2 2 369.465 2.876 20 5 FFBDLP Cc1ccc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2CO)cc1[N+](=O)[O-] ZINC001200704259 1059151138 /nfs/dbraw/zinc/15/11/38/1059151138.db2.gz SCUNSGSORUPPDI-UXHICEINSA-N 2 2 369.465 2.876 20 5 FFBDLP O=C(CC[NH+]1CCC(c2[nH]cc[nH+]2)CC1)Nc1cc([N+](=O)[O-])ccc1F ZINC000273205985 252250882 /nfs/dbraw/zinc/25/08/82/252250882.db2.gz UAXGFZVUPKYAEM-UHFFFAOYSA-N 2 2 361.377 2.665 20 5 FFBDLP Cc1cc(N2CCN(Cc3[nH+]ccn3C)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302167187 258092092 /nfs/dbraw/zinc/09/20/92/258092092.db2.gz LCXHRKSFHAIUOT-UHFFFAOYSA-N 2 2 366.425 2.507 20 5 FFBDLP Cc1c(NC(=O)[C@@H](C)[NH+]2CCC(n3cc[nH+]c3)CC2)cccc1[N+](=O)[O-] ZINC000111243939 508081681 /nfs/dbraw/zinc/08/16/81/508081681.db2.gz WCWSZLXLCWMESX-CQSZACIVSA-N 2 2 357.414 2.764 20 5 FFBDLP C[C@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000116396984 508507147 /nfs/dbraw/zinc/50/71/47/508507147.db2.gz CEYMVSGNBIKPLM-BBRMVZONSA-N 2 2 350.463 2.878 20 5 FFBDLP CC[N@@H+]1CC[C@H]2CC[C@@H](C1)[NH+]2CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000128860028 508652541 /nfs/dbraw/zinc/65/25/41/508652541.db2.gz FHFWNCXIAVBRGP-HIFRSBDPSA-N 2 2 364.421 2.621 20 5 FFBDLP CC[N@H+]1CC[C@H]2CC[C@@H](C1)[NH+]2CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000128860028 508652544 /nfs/dbraw/zinc/65/25/44/508652544.db2.gz FHFWNCXIAVBRGP-HIFRSBDPSA-N 2 2 364.421 2.621 20 5 FFBDLP CC[NH+]1CC[C@H]2CC[C@@H](C1)[N@@H+]2CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000128860028 508652549 /nfs/dbraw/zinc/65/25/49/508652549.db2.gz FHFWNCXIAVBRGP-HIFRSBDPSA-N 2 2 364.421 2.621 20 5 FFBDLP CC[NH+]1CC[C@H]2CC[C@@H](C1)[N@H+]2CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000128860028 508652553 /nfs/dbraw/zinc/65/25/53/508652553.db2.gz FHFWNCXIAVBRGP-HIFRSBDPSA-N 2 2 364.421 2.621 20 5 FFBDLP CCOc1ccc(NC(=O)C[N@@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)c([N+](=O)[O-])c1 ZINC000267416859 509469751 /nfs/dbraw/zinc/46/97/51/509469751.db2.gz JMZOGFBMTQZZRT-ZDUSSCGKSA-N 2 2 373.413 2.535 20 5 FFBDLP CCOc1ccc(NC(=O)C[N@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)c([N+](=O)[O-])c1 ZINC000267416859 509469756 /nfs/dbraw/zinc/46/97/56/509469756.db2.gz JMZOGFBMTQZZRT-ZDUSSCGKSA-N 2 2 373.413 2.535 20 5 FFBDLP CN1CC[N@H+](C)C[C@@H]1C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000264767519 509692309 /nfs/dbraw/zinc/69/23/09/509692309.db2.gz QETRGTNZSGRSPD-INIZCTEOSA-N 2 2 360.483 2.659 20 5 FFBDLP CN1CC[N@@H+](C)C[C@@H]1C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000264767519 509692321 /nfs/dbraw/zinc/69/23/21/509692321.db2.gz QETRGTNZSGRSPD-INIZCTEOSA-N 2 2 360.483 2.659 20 5 FFBDLP CCOc1cc(C[N@@H+]2CCO[C@@H]3C[C@H]([NH+](C)C)CC[C@H]32)ccc1[N+](=O)[O-] ZINC000365188765 511308100 /nfs/dbraw/zinc/30/81/00/511308100.db2.gz GAIIPLKMWKIBAR-GPMSIDNRSA-N 2 2 363.458 2.677 20 5 FFBDLP CCOc1cc(C[N@H+]2CCO[C@@H]3C[C@H]([NH+](C)C)CC[C@H]32)ccc1[N+](=O)[O-] ZINC000365188765 511308103 /nfs/dbraw/zinc/30/81/03/511308103.db2.gz GAIIPLKMWKIBAR-GPMSIDNRSA-N 2 2 363.458 2.677 20 5 FFBDLP C[C@H]1C[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC[C@H]1N1CC[NH+](C)CC1 ZINC000376636960 512912171 /nfs/dbraw/zinc/91/21/71/512912171.db2.gz NCJFKCGVOAYZBC-WMLDXEAASA-N 2 2 366.893 2.706 20 5 FFBDLP C[C@H]1C[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC[C@H]1N1CC[NH+](C)CC1 ZINC000376636960 512912174 /nfs/dbraw/zinc/91/21/74/512912174.db2.gz NCJFKCGVOAYZBC-WMLDXEAASA-N 2 2 366.893 2.706 20 5 FFBDLP Cc1cn2c([nH+]1)[C@@H](C[NH2+][C@@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1)CCC2 ZINC000370682473 513051062 /nfs/dbraw/zinc/05/10/62/513051062.db2.gz NYULXZCHNKKASJ-DZGCQCFKSA-N 2 2 371.441 2.984 20 5 FFBDLP CC1(C)CCC[N@H+](CCNC(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)C1 ZINC000451221734 513604533 /nfs/dbraw/zinc/60/45/33/513604533.db2.gz ZZPFNIHDEKXIGY-UHFFFAOYSA-N 2 2 371.441 2.632 20 5 FFBDLP CC1(C)CCC[N@@H+](CCNC(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)C1 ZINC000451221734 513604537 /nfs/dbraw/zinc/60/45/37/513604537.db2.gz ZZPFNIHDEKXIGY-UHFFFAOYSA-N 2 2 371.441 2.632 20 5 FFBDLP COc1cc(C[N@@H+]2CCC[C@@H]([C@@H](C)[NH3+])C2)c([N+](=O)[O-])cc1OC(F)F ZINC000430598568 513700297 /nfs/dbraw/zinc/70/02/97/513700297.db2.gz TVYVIVWFUQZRIC-GHMZBOCLSA-N 2 2 359.373 2.764 20 5 FFBDLP COc1cc(C[N@H+]2CCC[C@@H]([C@@H](C)[NH3+])C2)c([N+](=O)[O-])cc1OC(F)F ZINC000430598568 513700302 /nfs/dbraw/zinc/70/03/02/513700302.db2.gz TVYVIVWFUQZRIC-GHMZBOCLSA-N 2 2 359.373 2.764 20 5 FFBDLP C[NH+](C)CCN(C(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)C1CCCC1 ZINC000448976968 514002646 /nfs/dbraw/zinc/00/26/46/514002646.db2.gz WOINKKAKTXFEPL-UHFFFAOYSA-N 2 2 371.441 2.727 20 5 FFBDLP CN1CC[NH2+]C[C@H]1C[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000414966834 514379823 /nfs/dbraw/zinc/37/98/23/514379823.db2.gz ANGWDKUAPJGLKT-INIZCTEOSA-N 2 2 374.416 2.519 20 5 FFBDLP COc1cc(C[N@@H+]2CC[C@H](C)[C@H](C[NH3+])C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000415132390 514459239 /nfs/dbraw/zinc/45/92/39/514459239.db2.gz UCNCEBFSJDLQEB-WCQYABFASA-N 2 2 373.400 2.664 20 5 FFBDLP COc1cc(C[N@H+]2CC[C@H](C)[C@H](C[NH3+])C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000415132390 514459240 /nfs/dbraw/zinc/45/92/40/514459240.db2.gz UCNCEBFSJDLQEB-WCQYABFASA-N 2 2 373.400 2.664 20 5 FFBDLP C[C@H]1CCC[N@H+](CCNc2cc(C[NH+]3CCOCC3)ccc2[N+](=O)[O-])C1 ZINC000472371487 515247930 /nfs/dbraw/zinc/24/79/30/515247930.db2.gz ZQMSLZGREYVVQE-INIZCTEOSA-N 2 2 362.474 2.571 20 5 FFBDLP C[C@H]1CCC[N@@H+](CCNc2cc(C[NH+]3CCOCC3)ccc2[N+](=O)[O-])C1 ZINC000472371487 515247934 /nfs/dbraw/zinc/24/79/34/515247934.db2.gz ZQMSLZGREYVVQE-INIZCTEOSA-N 2 2 362.474 2.571 20 5 FFBDLP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1[NH2+]Cc1c([N+](=O)[O-])ncn1C ZINC000469764071 515956439 /nfs/dbraw/zinc/95/64/39/515956439.db2.gz NDDBUGOJRHNKQJ-GJZGRUSLSA-N 2 2 357.458 2.575 20 5 FFBDLP CC(C)[NH+]1CCN([C@@H]2CC[N@H+](Cc3c(Cl)cccc3[N+](=O)[O-])C2)CC1 ZINC000547968080 516664336 /nfs/dbraw/zinc/66/43/36/516664336.db2.gz BZUUDBIOGIWUCK-OAHLLOKOSA-N 2 2 366.893 2.849 20 5 FFBDLP CC(C)[NH+]1CCN([C@@H]2CC[N@@H+](Cc3c(Cl)cccc3[N+](=O)[O-])C2)CC1 ZINC000547968080 516664350 /nfs/dbraw/zinc/66/43/50/516664350.db2.gz BZUUDBIOGIWUCK-OAHLLOKOSA-N 2 2 366.893 2.849 20 5 FFBDLP Cc1ccc([C@@H](C[NH2+]C[C@@H](O)COc2ccccc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000579111163 518526859 /nfs/dbraw/zinc/52/68/59/518526859.db2.gz VGLGRIOTDIYSBP-IEBWSBKVSA-N 2 2 373.453 2.535 20 5 FFBDLP Cc1cc2[nH+]cn(C[C@H](O)C[NH2+]Cc3cccc([N+](=O)[O-])c3)c2cc1C ZINC000582020523 518549258 /nfs/dbraw/zinc/54/92/58/518549258.db2.gz QBEFMBDFSMJMGV-QGZVFWFLSA-N 2 2 354.410 2.712 20 5 FFBDLP C[NH+](C)CCCOc1cnccc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000588932316 518873824 /nfs/dbraw/zinc/87/38/24/518873824.db2.gz BPVWMXMSNXVDER-UHFFFAOYSA-N 2 2 362.405 2.749 20 5 FFBDLP Cc1cc2[nH+]cn(C[C@H](O)C[NH2+]CCc3ccccc3[N+](=O)[O-])c2cc1C ZINC000574150683 519012289 /nfs/dbraw/zinc/01/22/89/519012289.db2.gz FCTARFPICDPTJJ-QGZVFWFLSA-N 2 2 368.437 2.755 20 5 FFBDLP Cc1cc(N(C)[C@H]2CC[N@@H+](C3CC[NH+](C)CC3)C2)c(F)cc1[N+](=O)[O-] ZINC000589687924 519064641 /nfs/dbraw/zinc/06/46/41/519064641.db2.gz RPIYNPNLXPOFRY-HNNXBMFYSA-N 2 2 350.438 2.647 20 5 FFBDLP Cc1cc(N(C)[C@H]2CC[N@H+](C3CC[NH+](C)CC3)C2)c(F)cc1[N+](=O)[O-] ZINC000589687924 519064645 /nfs/dbraw/zinc/06/46/45/519064645.db2.gz RPIYNPNLXPOFRY-HNNXBMFYSA-N 2 2 350.438 2.647 20 5 FFBDLP CC(C)(C)[N@@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)CC1 ZINC000590626636 519294213 /nfs/dbraw/zinc/29/42/13/519294213.db2.gz LVAPWAJSQYEJMQ-UHFFFAOYSA-N 2 2 371.441 2.727 20 5 FFBDLP CC(C)(C)[N@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)CC1 ZINC000590626636 519294219 /nfs/dbraw/zinc/29/42/19/519294219.db2.gz LVAPWAJSQYEJMQ-UHFFFAOYSA-N 2 2 371.441 2.727 20 5 FFBDLP C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCC[N@@H+]2CCCC[C@@H]12 ZINC000594519481 520012580 /nfs/dbraw/zinc/01/25/80/520012580.db2.gz LCTQOTRKDXYKMO-OLMNPRSZSA-N 2 2 360.458 2.918 20 5 FFBDLP C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594519481 520012582 /nfs/dbraw/zinc/01/25/82/520012582.db2.gz LCTQOTRKDXYKMO-OLMNPRSZSA-N 2 2 360.458 2.918 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1 ZINC000595007803 520254547 /nfs/dbraw/zinc/25/45/47/520254547.db2.gz KVZIWTZFRXWODD-CABCVRRESA-N 2 2 363.458 2.755 20 5 FFBDLP Cc1nc(N2CCN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)CC2)cc[nH+]1 ZINC000601142602 520658033 /nfs/dbraw/zinc/65/80/33/520658033.db2.gz VZQVSNJLVFRJJM-UHFFFAOYSA-N 2 2 350.382 2.568 20 5 FFBDLP C[C@@H]([NH2+]C[C@@]1(O)CC[N@H+](Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000610422076 520675415 /nfs/dbraw/zinc/67/54/15/520675415.db2.gz UQBGJHKCKVKUQR-UZLBHIALSA-N 2 2 355.438 2.882 20 5 FFBDLP C[C@@H]([NH2+]C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000610422076 520675422 /nfs/dbraw/zinc/67/54/22/520675422.db2.gz UQBGJHKCKVKUQR-UZLBHIALSA-N 2 2 355.438 2.882 20 5 FFBDLP CN(Cc1ccc([N+](=O)[O-])c(Cl)c1)[C@H]1CC[N@@H+](C2CC[NH+](C)CC2)C1 ZINC000809741413 741338925 /nfs/dbraw/zinc/33/89/25/741338925.db2.gz OKNSKTODEVTERV-INIZCTEOSA-N 2 2 366.893 2.849 20 5 FFBDLP CN(Cc1ccc([N+](=O)[O-])c(Cl)c1)[C@H]1CC[N@H+](C2CC[NH+](C)CC2)C1 ZINC000809741413 741338929 /nfs/dbraw/zinc/33/89/29/741338929.db2.gz OKNSKTODEVTERV-INIZCTEOSA-N 2 2 366.893 2.849 20 5 FFBDLP CC(C)[C@H]([NH3+])CC[N@H+](C)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000843354609 747815680 /nfs/dbraw/zinc/81/56/80/747815680.db2.gz LRHARLGTCZZHLT-BXUZGUMPSA-N 2 2 356.854 2.880 20 5 FFBDLP CC(C)[C@H]([NH3+])CC[N@@H+](C)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000843354609 747815690 /nfs/dbraw/zinc/81/56/90/747815690.db2.gz LRHARLGTCZZHLT-BXUZGUMPSA-N 2 2 356.854 2.880 20 5 FFBDLP O=[N+]([O-])c1cnn(C2CC([NH2+][C@@H](Cn3cc[nH+]c3)c3ccccc3)C2)c1 ZINC000895705469 970863835 /nfs/dbraw/zinc/86/38/35/970863835.db2.gz BUBOIRQLLCMYIM-HTWSVDAQSA-N 2 2 352.398 2.722 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH+]1CCC(c2c[nH+]cn2C)CC1 ZINC001198768318 1004734056 /nfs/dbraw/zinc/73/40/56/1004734056.db2.gz GKKFHFCWNZRIQF-UHFFFAOYSA-N 2 2 371.441 2.845 20 5 FFBDLP C[N@@H+]1CCC[C@H]1C[NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173011871 1012181263 /nfs/dbraw/zinc/18/12/63/1012181263.db2.gz MQLMVFSFBJDBPD-ZDUSSCGKSA-N 2 2 354.401 2.526 20 5 FFBDLP C[N@H+]1CCC[C@H]1C[NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173011871 1012181266 /nfs/dbraw/zinc/18/12/66/1012181266.db2.gz MQLMVFSFBJDBPD-ZDUSSCGKSA-N 2 2 354.401 2.526 20 5 FFBDLP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1C[C@@H]2C[NH+](Cc3ccccn3)C[C@H]2C1 ZINC001173228528 1012364907 /nfs/dbraw/zinc/36/49/07/1012364907.db2.gz YVFYSBMWCUNEOL-NEWSRXKRSA-N 2 2 366.465 2.985 20 5 FFBDLP C[NH+](C)C1(C)CCC(NC(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)CC1 ZINC000871362231 1012884311 /nfs/dbraw/zinc/88/43/11/1012884311.db2.gz OHUJTHLSQLMHME-UHFFFAOYSA-N 2 2 371.441 2.773 20 5 FFBDLP Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)NCC[N@@H+](C)CCC[NH+](C)C ZINC001310801984 1043744208 /nfs/dbraw/zinc/74/42/08/1043744208.db2.gz SFLMWLNIHPUALS-UHFFFAOYSA-N 2 2 371.869 2.562 20 5 FFBDLP Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)NCC[N@H+](C)CCC[NH+](C)C ZINC001310801984 1043744220 /nfs/dbraw/zinc/74/42/20/1043744220.db2.gz SFLMWLNIHPUALS-UHFFFAOYSA-N 2 2 371.869 2.562 20 5 FFBDLP O=[N+]([O-])c1cc(-c2nc([C@H]3C[NH+]4CCC3CC4)no2)ccc1-n1cc[nH+]c1 ZINC001342547521 1051150513 /nfs/dbraw/zinc/15/05/13/1051150513.db2.gz YXBGRFQQPXTSFG-AWEZNQCLSA-N 2 2 366.381 2.640 20 5 FFBDLP Cn1cc([N+](=O)[O-])c(Nc2ccc([NH+]3CCC(C[NH+](C)C)CC3)cc2)n1 ZINC001458186721 1060536620 /nfs/dbraw/zinc/53/66/20/1060536620.db2.gz DZQCCRCAVVZMRI-UHFFFAOYSA-N 2 2 358.446 2.850 20 5 FFBDLP C[N@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC001473416819 1065258451 /nfs/dbraw/zinc/25/84/51/1065258451.db2.gz VIOLRXNMFWDQAT-NRFANRHFSA-N 2 2 369.465 2.706 20 5 FFBDLP C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC001473416819 1065258466 /nfs/dbraw/zinc/25/84/66/1065258466.db2.gz VIOLRXNMFWDQAT-NRFANRHFSA-N 2 2 369.465 2.706 20 5 FFBDLP C[NH+](CCc1cccc([N+](=O)[O-])c1)C[C@@]1(O)CC[N@H+](Cc2ccccc2)C1 ZINC001473416819 1065258476 /nfs/dbraw/zinc/25/84/76/1065258476.db2.gz VIOLRXNMFWDQAT-NRFANRHFSA-N 2 2 369.465 2.706 20 5 FFBDLP C[NH+](CCc1cccc([N+](=O)[O-])c1)C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC001473416819 1065258488 /nfs/dbraw/zinc/25/84/88/1065258488.db2.gz VIOLRXNMFWDQAT-NRFANRHFSA-N 2 2 369.465 2.706 20 5 FFBDLP Cn1cc[nH+]c1[C@@H](N[C@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000272564010 252069318 /nfs/dbraw/zinc/06/93/18/252069318.db2.gz UQNWXNLBPVUSOZ-JQHSSLGASA-N 2 2 357.458 2.880 20 5 FFBDLP Cn1cc[nH+]c1[C@H](N[C@@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000272564015 252069867 /nfs/dbraw/zinc/06/98/67/252069867.db2.gz UQNWXNLBPVUSOZ-KBAYOESNSA-N 2 2 357.458 2.880 20 5 FFBDLP Cn1cc[nH+]c1[C@@H]1CCC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000377262654 512190575 /nfs/dbraw/zinc/19/05/75/512190575.db2.gz QGMFMQPBXYAPGZ-CQSZACIVSA-N 2 2 368.397 2.758 20 5 FFBDLP Cn1cc[nH+]c1[C@@H]1CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000377262654 512190583 /nfs/dbraw/zinc/19/05/83/512190583.db2.gz QGMFMQPBXYAPGZ-CQSZACIVSA-N 2 2 368.397 2.758 20 5 FFBDLP C[C@H](C[N@@H+]1CCC[C@H](C)C1)NC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000055402220 506742814 /nfs/dbraw/zinc/74/28/14/506742814.db2.gz XWTVORWYCAUNKQ-LSDHHAIUSA-N 2 2 371.441 2.631 20 5 FFBDLP C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000055402220 506742820 /nfs/dbraw/zinc/74/28/20/506742820.db2.gz XWTVORWYCAUNKQ-LSDHHAIUSA-N 2 2 371.441 2.631 20 5 FFBDLP C[N@H+](CC[C@H]1CCCC[NH+]1C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000072758951 507849927 /nfs/dbraw/zinc/84/99/27/507849927.db2.gz ROSABGVFFJKBRH-CRAIPNDOSA-N 2 2 360.458 2.506 20 5 FFBDLP C[N@@H+](CC[C@H]1CCCC[NH+]1C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000072758951 507849928 /nfs/dbraw/zinc/84/99/28/507849928.db2.gz ROSABGVFFJKBRH-CRAIPNDOSA-N 2 2 360.458 2.506 20 5 FFBDLP C[NH+](CC[C@H]1CCCC[N@@H+]1C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000072758951 507849930 /nfs/dbraw/zinc/84/99/30/507849930.db2.gz ROSABGVFFJKBRH-CRAIPNDOSA-N 2 2 360.458 2.506 20 5 FFBDLP C[NH+](CC[C@H]1CCCC[N@H+]1C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000072758951 507849933 /nfs/dbraw/zinc/84/99/33/507849933.db2.gz ROSABGVFFJKBRH-CRAIPNDOSA-N 2 2 360.458 2.506 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[NH+]2CCC(n3cc[nH+]c3)CC2)cccc1[N+](=O)[O-] ZINC000111243940 508081686 /nfs/dbraw/zinc/08/16/86/508081686.db2.gz WCWSZLXLCWMESX-AWEZNQCLSA-N 2 2 357.414 2.764 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cccnc1N1CC[NH+](C)CC1 ZINC000158482079 508710924 /nfs/dbraw/zinc/71/09/24/508710924.db2.gz RSLXCLSVSPARSI-MRXNPFEDSA-N 2 2 369.469 2.901 20 5 FFBDLP COc1cc(N2CC[NH+](C3CC[NH+](C(C)C)CC3)CC2)ccc1[N+](=O)[O-] ZINC000269298587 510329404 /nfs/dbraw/zinc/32/94/04/510329404.db2.gz BHTXTYFUQVPZNN-UHFFFAOYSA-N 2 2 362.474 2.598 20 5 FFBDLP C[C@@H]1C[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000362077897 511128224 /nfs/dbraw/zinc/12/82/24/511128224.db2.gz KMUVLQZHZQQRQZ-PBHICJAKSA-N 2 2 366.893 2.706 20 5 FFBDLP C[C@@H]1C[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000362077897 511128227 /nfs/dbraw/zinc/12/82/27/511128227.db2.gz KMUVLQZHZQQRQZ-PBHICJAKSA-N 2 2 366.893 2.706 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000363582747 511640258 /nfs/dbraw/zinc/64/02/58/511640258.db2.gz KFJDCFBVTZACGN-CYBMUJFWSA-N 2 2 373.413 2.535 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000363582747 511640264 /nfs/dbraw/zinc/64/02/64/511640264.db2.gz KFJDCFBVTZACGN-CYBMUJFWSA-N 2 2 373.413 2.535 20 5 FFBDLP COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[NH+]1CCC(c2c[nH]c[nH+]2)CC1 ZINC000374199714 512704301 /nfs/dbraw/zinc/70/43/01/512704301.db2.gz KYHPEUWKNWGTTA-GFCCVEGCSA-N 2 2 373.413 2.533 20 5 FFBDLP C[C@@H]1C[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])CC[C@H]1N1CC[NH+](C)CC1 ZINC000370705134 513061765 /nfs/dbraw/zinc/06/17/65/513061765.db2.gz DZXSOFJFPAQGJB-YVNZRUEQSA-N 2 2 358.486 2.566 20 5 FFBDLP C[C@@H]1C[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])CC[C@H]1N1CC[NH+](C)CC1 ZINC000370705134 513061769 /nfs/dbraw/zinc/06/17/69/513061769.db2.gz DZXSOFJFPAQGJB-YVNZRUEQSA-N 2 2 358.486 2.566 20 5 FFBDLP C[C@@H](CCc1ccccc1[N+](=O)[O-])Nc1ccc(N2CC[NH2+]CC2)c[nH+]1 ZINC000423242624 514091158 /nfs/dbraw/zinc/09/11/58/514091158.db2.gz ZCEWCRQNEKDODX-HNNXBMFYSA-N 2 2 355.442 2.833 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)C[N@@H+](Cc1cccc(C[NH+]3CCOCC3)c1)CC2 ZINC000420943400 514391737 /nfs/dbraw/zinc/39/17/37/514391737.db2.gz WIZBGBJKALZRSZ-UHFFFAOYSA-N 2 2 367.449 2.985 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)C[N@H+](Cc1cccc(C[NH+]3CCOCC3)c1)CC2 ZINC000420943400 514391742 /nfs/dbraw/zinc/39/17/42/514391742.db2.gz WIZBGBJKALZRSZ-UHFFFAOYSA-N 2 2 367.449 2.985 20 5 FFBDLP CCN(CCC[NH+](CC)CC)C(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000508181744 514696628 /nfs/dbraw/zinc/69/66/28/514696628.db2.gz LTUSXBXJOHZWLK-UHFFFAOYSA-N 2 2 373.457 2.975 20 5 FFBDLP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]CCc2cn3ccccc3[nH+]2)n1 ZINC000472604620 515334594 /nfs/dbraw/zinc/33/45/94/515334594.db2.gz WEQGFHYQUJTJLB-HZPDHXFCSA-N 2 2 354.414 2.755 20 5 FFBDLP C[C@@H]1CN(Cc2c(Cl)cccc2[N+](=O)[O-])CC[N@@H+]1C1CC[NH+](C)CC1 ZINC000492175429 515510290 /nfs/dbraw/zinc/51/02/90/515510290.db2.gz JGDXMRNZDPNPHQ-CQSZACIVSA-N 2 2 366.893 2.849 20 5 FFBDLP C[C@@H]1CN(Cc2c(Cl)cccc2[N+](=O)[O-])CC[N@H+]1C1CC[NH+](C)CC1 ZINC000492175429 515510296 /nfs/dbraw/zinc/51/02/96/515510296.db2.gz JGDXMRNZDPNPHQ-CQSZACIVSA-N 2 2 366.893 2.849 20 5 FFBDLP C[N@H+](CCN1CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1)Cc1ccccc1 ZINC000513460619 516633811 /nfs/dbraw/zinc/63/38/11/516633811.db2.gz GVTFEGLRUFMKSM-UHFFFAOYSA-N 2 2 368.481 2.844 20 5 FFBDLP C[N@@H+](CCN1CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1)Cc1ccccc1 ZINC000513460619 516633819 /nfs/dbraw/zinc/63/38/19/516633819.db2.gz GVTFEGLRUFMKSM-UHFFFAOYSA-N 2 2 368.481 2.844 20 5 FFBDLP CCN(C[C@@H]1CCC[N@@H+]1CC)C(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000577578151 519147614 /nfs/dbraw/zinc/14/76/14/519147614.db2.gz XIPZSBRWXGJKGQ-INIZCTEOSA-N 2 2 371.441 2.727 20 5 FFBDLP CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000577578151 519147622 /nfs/dbraw/zinc/14/76/22/519147622.db2.gz XIPZSBRWXGJKGQ-INIZCTEOSA-N 2 2 371.441 2.727 20 5 FFBDLP CCC(C)(C)[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)CC1 ZINC000594389855 519935998 /nfs/dbraw/zinc/93/59/98/519935998.db2.gz OTXRXCYNUSCXLX-UHFFFAOYSA-N 2 2 371.441 2.727 20 5 FFBDLP Cc1noc(C[NH+]2CCN(c3cc[nH+]c4ccccc43)CC2)c1[N+](=O)[O-] ZINC000595483304 520500081 /nfs/dbraw/zinc/50/00/81/520500081.db2.gz FYMODBLCSJGPPO-UHFFFAOYSA-N 2 2 353.382 2.762 20 5 FFBDLP C[C@H]([NH2+]C[C@@]1(O)CC[N@H+](Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000610422073 520676728 /nfs/dbraw/zinc/67/67/28/520676728.db2.gz UQBGJHKCKVKUQR-JXFKEZNVSA-N 2 2 355.438 2.882 20 5 FFBDLP C[C@H]([NH2+]C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000610422073 520676737 /nfs/dbraw/zinc/67/67/37/520676737.db2.gz UQBGJHKCKVKUQR-JXFKEZNVSA-N 2 2 355.438 2.882 20 5 FFBDLP COc1cc(C[N@@H+]2CCC[C@H]3C[NH2+]CC[C@@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000601335855 520746219 /nfs/dbraw/zinc/74/62/19/520746219.db2.gz YWTNCMCIJFYJQL-AAEUAGOBSA-N 2 2 371.384 2.779 20 5 FFBDLP COc1cc(C[N@H+]2CCC[C@H]3C[NH2+]CC[C@@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000601335855 520746225 /nfs/dbraw/zinc/74/62/25/520746225.db2.gz YWTNCMCIJFYJQL-AAEUAGOBSA-N 2 2 371.384 2.779 20 5 FFBDLP COc1cc(N[C@H]2CC[N@H+](C3CC[NH+](C)CC3)C2)c(Cl)cc1[N+](=O)[O-] ZINC000596124312 520926503 /nfs/dbraw/zinc/92/65/03/520926503.db2.gz VHDOUZRMXUIRQV-LBPRGKRZSA-N 2 2 368.865 2.837 20 5 FFBDLP CC(C)(C[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)[NH+]1CCCCC1 ZINC000602501662 521381638 /nfs/dbraw/zinc/38/16/38/521381638.db2.gz DYYMTSAGXKSWFC-UHFFFAOYSA-N 2 2 361.490 2.813 20 5 FFBDLP O=[N+]([O-])c1sc(C[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc1Br ZINC000602508694 521386987 /nfs/dbraw/zinc/38/69/87/521386987.db2.gz DNGNTHITBGZJCE-SECBINFHSA-N 2 2 360.277 2.993 20 5 FFBDLP O=[N+]([O-])c1sc(C[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)cc1Br ZINC000602508694 521386989 /nfs/dbraw/zinc/38/69/89/521386989.db2.gz DNGNTHITBGZJCE-SECBINFHSA-N 2 2 360.277 2.993 20 5 FFBDLP O=[N+]([O-])c1sc(C[NH2+][C@@H]2CCn3cc[nH+]c3C2)cc1Br ZINC000602624231 521441106 /nfs/dbraw/zinc/44/11/06/521441106.db2.gz SVCVMCXYEZYQRO-MRVPVSSYSA-N 2 2 357.233 2.720 20 5 FFBDLP Cc1[nH+]c2ccccc2n1C1CC[NH+](Cc2cn(C)nc2[N+](=O)[O-])CC1 ZINC000602638560 521451212 /nfs/dbraw/zinc/45/12/12/521451212.db2.gz PJNPWNJJLYYXKT-UHFFFAOYSA-N 2 2 354.414 2.824 20 5 FFBDLP C[NH2+]CCC1CC[NH+]([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000262000537 729656963 /nfs/dbraw/zinc/65/69/63/729656963.db2.gz PPTIKHUZDYGRRV-GFCCVEGCSA-N 2 2 368.865 2.897 20 5 FFBDLP [NH3+]C[C@@H]([NH2+]CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])C1CCCCC1 ZINC000842476241 747612811 /nfs/dbraw/zinc/61/28/11/747612811.db2.gz JZYMULIIEUYMBE-CQSZACIVSA-N 2 2 354.838 2.684 20 5 FFBDLP CC(C)(C)[N@@H+]1CC[C@@H]1COC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000845738312 998629365 /nfs/dbraw/zinc/62/93/65/998629365.db2.gz DYAFHDHSTCKROA-CQSZACIVSA-N 2 2 358.398 2.810 20 5 FFBDLP CC(C)(C)[N@H+]1CC[C@@H]1COC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000845738312 998629367 /nfs/dbraw/zinc/62/93/67/998629367.db2.gz DYAFHDHSTCKROA-CQSZACIVSA-N 2 2 358.398 2.810 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]CC[NH+]2CCC(C)CC2)c1F ZINC001173174801 1012318932 /nfs/dbraw/zinc/31/89/32/1012318932.db2.gz CEUQRVFYLOVQJD-AWEZNQCLSA-N 2 2 353.438 2.995 20 5 FFBDLP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCc2onc(Cn3cc[nH+]c3)c2C1 ZINC001173224151 1012359317 /nfs/dbraw/zinc/35/93/17/1012359317.db2.gz IPAXCWSIORWSAB-CQSZACIVSA-N 2 2 367.409 2.817 20 5 FFBDLP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2onc(Cn3cc[nH+]c3)c2C1 ZINC001173224151 1012359328 /nfs/dbraw/zinc/35/93/28/1012359328.db2.gz IPAXCWSIORWSAB-CQSZACIVSA-N 2 2 367.409 2.817 20 5 FFBDLP C[C@H](COC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)[NH+]1CCCCC1 ZINC000847958186 1058519252 /nfs/dbraw/zinc/51/92/52/1058519252.db2.gz FJDMNUPLNVFWDI-CQSZACIVSA-N 2 2 358.398 2.812 20 5 FFBDLP O=[N+]([O-])c1cc(F)c(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)c(F)c1 ZINC000286542074 257042185 /nfs/dbraw/zinc/04/21/85/257042185.db2.gz UIYJFLADJNYQOH-UHFFFAOYSA-N 2 2 369.412 2.950 20 5 FFBDLP COCC[NH+]1CCC(Nc2cc(C)[nH+]c(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000301130655 258028017 /nfs/dbraw/zinc/02/80/17/258028017.db2.gz YAJVIZMYDOVUJZ-UHFFFAOYSA-N 2 2 371.441 2.883 20 5 FFBDLP Cn1cc[nH+]c1[C@H]1CCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000373095164 512169096 /nfs/dbraw/zinc/16/90/96/512169096.db2.gz OIUFOFCQCNLMJI-AWEZNQCLSA-N 2 2 368.397 2.758 20 5 FFBDLP Cn1cc[nH+]c1[C@H]1CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000373095164 512169101 /nfs/dbraw/zinc/16/91/01/512169101.db2.gz OIUFOFCQCNLMJI-AWEZNQCLSA-N 2 2 368.397 2.758 20 5 FFBDLP CN(C/C=C/c1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](C2CC[NH+](C)CC2)C1 ZINC000377617389 512356167 /nfs/dbraw/zinc/35/61/67/512356167.db2.gz APUHAJUTOSPKKB-XZXOBPBMSA-N 2 2 358.486 2.708 20 5 FFBDLP CN(C/C=C/c1ccccc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CC[NH+](C)CC2)C1 ZINC000377617389 512356171 /nfs/dbraw/zinc/35/61/71/512356171.db2.gz APUHAJUTOSPKKB-XZXOBPBMSA-N 2 2 358.486 2.708 20 5 FFBDLP Cc1c(NC(=O)CC[N@@H+]2CC[C@H](Oc3cc[nH+]cc3)C2)cccc1[N+](=O)[O-] ZINC000156394437 508414122 /nfs/dbraw/zinc/41/41/22/508414122.db2.gz AXDHNQJZERCPOJ-INIZCTEOSA-N 2 2 370.409 2.780 20 5 FFBDLP Cc1c(NC(=O)CC[N@H+]2CC[C@H](Oc3cc[nH+]cc3)C2)cccc1[N+](=O)[O-] ZINC000156394437 508414125 /nfs/dbraw/zinc/41/41/25/508414125.db2.gz AXDHNQJZERCPOJ-INIZCTEOSA-N 2 2 370.409 2.780 20 5 FFBDLP C[C@@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000116395852 508506202 /nfs/dbraw/zinc/50/62/02/508506202.db2.gz IQPWOBUXDHCCFB-CJNGLKHVSA-N 2 2 350.463 2.878 20 5 FFBDLP CCOc1ccc([C@@H](C)[NH2+]C[C@H](O)C[NH+]2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000153702548 508629562 /nfs/dbraw/zinc/62/95/62/508629562.db2.gz BUAAZTKKEPMLAV-WBVHZDCISA-N 2 2 365.474 2.737 20 5 FFBDLP CC[N@@H+]1CC[C@H]([NH+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)C1 ZINC000245446096 509940369 /nfs/dbraw/zinc/94/03/69/509940369.db2.gz ZMQCLQMABAHUAS-BBRMVZONSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[N@H+]1CC[C@H]([NH+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)C1 ZINC000245446096 509940370 /nfs/dbraw/zinc/94/03/70/509940370.db2.gz ZMQCLQMABAHUAS-BBRMVZONSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[NH+]1CC[C@H]([N@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)C1 ZINC000245446096 509940372 /nfs/dbraw/zinc/94/03/72/509940372.db2.gz ZMQCLQMABAHUAS-BBRMVZONSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[NH+]1CC[C@H]([N@@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)C1 ZINC000245446096 509940374 /nfs/dbraw/zinc/94/03/74/509940374.db2.gz ZMQCLQMABAHUAS-BBRMVZONSA-N 2 2 359.430 2.807 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C[C@@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC000190310382 510054855 /nfs/dbraw/zinc/05/48/55/510054855.db2.gz UAVBDTDWEAHHRR-NRFANRHFSA-N 2 2 369.465 2.972 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)C[C@@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC000190310382 510054860 /nfs/dbraw/zinc/05/48/60/510054860.db2.gz UAVBDTDWEAHHRR-NRFANRHFSA-N 2 2 369.465 2.972 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1C[NH+](C)C[C@@]1(O)CC[N@H+](Cc2ccccc2)C1 ZINC000190310382 510054868 /nfs/dbraw/zinc/05/48/68/510054868.db2.gz UAVBDTDWEAHHRR-NRFANRHFSA-N 2 2 369.465 2.972 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1C[NH+](C)C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000190310382 510054876 /nfs/dbraw/zinc/05/48/76/510054876.db2.gz UAVBDTDWEAHHRR-NRFANRHFSA-N 2 2 369.465 2.972 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@@H+]2Cc1ccc([N+](=O)[O-])cc1Cl ZINC000374695358 512959927 /nfs/dbraw/zinc/95/99/27/512959927.db2.gz FKVAHQZXROFEJP-KBRIMQKVSA-N 2 2 353.850 2.932 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@H+]2Cc1ccc([N+](=O)[O-])cc1Cl ZINC000374695358 512959929 /nfs/dbraw/zinc/95/99/29/512959929.db2.gz FKVAHQZXROFEJP-KBRIMQKVSA-N 2 2 353.850 2.932 20 5 FFBDLP COc1cc(C[N@@H+]2CC[C@@H](C[NH3+])C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000435392169 513573819 /nfs/dbraw/zinc/57/38/19/513573819.db2.gz VNKQAEWIDRPDTN-INIZCTEOSA-N 2 2 371.437 2.963 20 5 FFBDLP COc1cc(C[N@H+]2CC[C@@H](C[NH3+])C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000435392169 513573828 /nfs/dbraw/zinc/57/38/28/513573828.db2.gz VNKQAEWIDRPDTN-INIZCTEOSA-N 2 2 371.437 2.963 20 5 FFBDLP CC[NH+](CC)CCCNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000447806097 513575265 /nfs/dbraw/zinc/57/52/65/513575265.db2.gz LXXTYYCKUBXMQR-UHFFFAOYSA-N 2 2 350.463 2.571 20 5 FFBDLP COc1cc(C[N@@H+]2CCC[C@@H]([C@H](C)[NH3+])C2)c([N+](=O)[O-])cc1OC(F)F ZINC000430598571 513701450 /nfs/dbraw/zinc/70/14/50/513701450.db2.gz TVYVIVWFUQZRIC-WDEREUQCSA-N 2 2 359.373 2.764 20 5 FFBDLP COc1cc(C[N@H+]2CCC[C@@H]([C@H](C)[NH3+])C2)c([N+](=O)[O-])cc1OC(F)F ZINC000430598571 513701457 /nfs/dbraw/zinc/70/14/57/513701457.db2.gz TVYVIVWFUQZRIC-WDEREUQCSA-N 2 2 359.373 2.764 20 5 FFBDLP CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCC[NH2+]CC1 ZINC000420306029 514081855 /nfs/dbraw/zinc/08/18/55/514081855.db2.gz HFHNHEXSFHCONP-LBPRGKRZSA-N 2 2 354.838 2.651 20 5 FFBDLP CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCC[NH2+]CC1 ZINC000420306029 514081862 /nfs/dbraw/zinc/08/18/62/514081862.db2.gz HFHNHEXSFHCONP-LBPRGKRZSA-N 2 2 354.838 2.651 20 5 FFBDLP Cn1cc[nH+]c1[C@@H](NC[C@@H]1[NH2+]CCCC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000423403171 514130959 /nfs/dbraw/zinc/13/09/59/514130959.db2.gz ZAGDFUXJWYGIRM-IRXDYDNUSA-N 2 2 357.458 2.786 20 5 FFBDLP CN(CC[C@H]1CCCC[N@@H+]1C)C(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000449963540 514443542 /nfs/dbraw/zinc/44/35/42/514443542.db2.gz AOULBHQHLBLTQM-MRXNPFEDSA-N 2 2 371.441 2.727 20 5 FFBDLP CN(CC[C@H]1CCCC[N@H+]1C)C(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000449963540 514443548 /nfs/dbraw/zinc/44/35/48/514443548.db2.gz AOULBHQHLBLTQM-MRXNPFEDSA-N 2 2 371.441 2.727 20 5 FFBDLP C[NH+](C)CCCC(C)(C)NC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000456199310 515018164 /nfs/dbraw/zinc/01/81/64/515018164.db2.gz SSBDLFISFVDFEX-UHFFFAOYSA-N 2 2 359.430 2.631 20 5 FFBDLP Cc1cn2c([nH+]1)[C@@H](C[NH2+][C@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000531988148 516744422 /nfs/dbraw/zinc/74/44/22/516744422.db2.gz DNKZNUGFDDFGKY-UKRRQHHQSA-N 2 2 371.441 2.984 20 5 FFBDLP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C[C@H]1C ZINC000537618194 517263749 /nfs/dbraw/zinc/26/37/49/517263749.db2.gz PSLKXCJVJROUFU-HIFRSBDPSA-N 2 2 351.447 2.917 20 5 FFBDLP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C[C@H]1C ZINC000537618194 517263755 /nfs/dbraw/zinc/26/37/55/517263755.db2.gz PSLKXCJVJROUFU-HIFRSBDPSA-N 2 2 351.447 2.917 20 5 FFBDLP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C[C@H]1C ZINC000537618194 517263761 /nfs/dbraw/zinc/26/37/61/517263761.db2.gz PSLKXCJVJROUFU-HIFRSBDPSA-N 2 2 351.447 2.917 20 5 FFBDLP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C[C@H]1C ZINC000537618194 517263769 /nfs/dbraw/zinc/26/37/69/517263769.db2.gz PSLKXCJVJROUFU-HIFRSBDPSA-N 2 2 351.447 2.917 20 5 FFBDLP Cc1[nH+]c2ccccc2n1C[C@H]1CCC[N@H+]1Cc1c([N+](=O)[O-])ncn1C ZINC000533760472 517601414 /nfs/dbraw/zinc/60/14/14/517601414.db2.gz BPBMHDHOTFOOSL-CQSZACIVSA-N 2 2 354.414 2.651 20 5 FFBDLP Cc1[nH+]c2ccccc2n1C[C@H]1CCC[N@@H+]1Cc1c([N+](=O)[O-])ncn1C ZINC000533760472 517601424 /nfs/dbraw/zinc/60/14/24/517601424.db2.gz BPBMHDHOTFOOSL-CQSZACIVSA-N 2 2 354.414 2.651 20 5 FFBDLP CC(C)C[C@@H](CN[C@H](c1[nH+]ccn1C)c1ccc([N+](=O)[O-])cc1)[NH+](C)C ZINC000582137956 518606289 /nfs/dbraw/zinc/60/62/89/518606289.db2.gz NDABLOJDKGMBLD-ROUUACIJSA-N 2 2 359.474 2.984 20 5 FFBDLP C[NH+](Cc1ccccc1)C[C@@H](O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000586773223 518637351 /nfs/dbraw/zinc/63/73/51/518637351.db2.gz JKPVVXOZEJHRPQ-IBGZPJMESA-N 2 2 357.454 2.562 20 5 FFBDLP C[NH+](Cc1ccccc1)C[C@@H](O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000586773223 518637360 /nfs/dbraw/zinc/63/73/60/518637360.db2.gz JKPVVXOZEJHRPQ-IBGZPJMESA-N 2 2 357.454 2.562 20 5 FFBDLP C[NH+](CCc1ccccc1[N+](=O)[O-])C[C@H](O)C[N@H+](C)Cc1ccccc1 ZINC000586773223 518637364 /nfs/dbraw/zinc/63/73/64/518637364.db2.gz JKPVVXOZEJHRPQ-IBGZPJMESA-N 2 2 357.454 2.562 20 5 FFBDLP C[NH+](CCc1ccccc1[N+](=O)[O-])C[C@H](O)C[N@@H+](C)Cc1ccccc1 ZINC000586773223 518637370 /nfs/dbraw/zinc/63/73/70/518637370.db2.gz JKPVVXOZEJHRPQ-IBGZPJMESA-N 2 2 357.454 2.562 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C1CC[NH+]([C@H]2CCC[C@@H]2O)CC1 ZINC000595023345 520260341 /nfs/dbraw/zinc/26/03/41/520260341.db2.gz VZVWJHHNSDJOPR-KKXDTOCCSA-N 2 2 363.458 2.632 20 5 FFBDLP CC(C)(C)[N@@H+]1CC[C@H](CNC(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)C1 ZINC000597859762 520286718 /nfs/dbraw/zinc/28/67/18/520286718.db2.gz HGCDQRZCIGYINO-CQSZACIVSA-N 2 2 371.441 2.631 20 5 FFBDLP CC(C)(C)[N@H+]1CC[C@H](CNC(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)C1 ZINC000597859762 520286724 /nfs/dbraw/zinc/28/67/24/520286724.db2.gz HGCDQRZCIGYINO-CQSZACIVSA-N 2 2 371.441 2.631 20 5 FFBDLP CC[C@H]1C[N@H+](Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])CC[C@H]1[NH3+] ZINC000592427617 520388510 /nfs/dbraw/zinc/38/85/10/520388510.db2.gz HWYPGLPDMPHNLI-WCQYABFASA-N 2 2 373.400 2.807 20 5 FFBDLP CC[C@H]1C[N@@H+](Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])CC[C@H]1[NH3+] ZINC000592427617 520388513 /nfs/dbraw/zinc/38/85/13/520388513.db2.gz HWYPGLPDMPHNLI-WCQYABFASA-N 2 2 373.400 2.807 20 5 FFBDLP Cc1c(NC(=O)CC[N@@H+]2CCc3ccccc3[C@@H]2C[NH3+])cccc1[N+](=O)[O-] ZINC000592494840 520417672 /nfs/dbraw/zinc/41/76/72/520417672.db2.gz ABNMEDTZMNITKY-IBGZPJMESA-N 2 2 368.437 2.790 20 5 FFBDLP Cc1c(NC(=O)CC[N@H+]2CCc3ccccc3[C@@H]2C[NH3+])cccc1[N+](=O)[O-] ZINC000592494840 520417681 /nfs/dbraw/zinc/41/76/81/520417681.db2.gz ABNMEDTZMNITKY-IBGZPJMESA-N 2 2 368.437 2.790 20 5 FFBDLP O=[N+]([O-])c1ccc2[nH+]ccc(N3CCC[C@H](C[NH+]4CCOCC4)C3)c2c1 ZINC000601162432 520667425 /nfs/dbraw/zinc/66/74/25/520667425.db2.gz NTZXNDZYXAAMPQ-OAHLLOKOSA-N 2 2 356.426 2.692 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CCC(Nc3cccc[nH+]3)CC2)c1 ZINC000593019234 520688318 /nfs/dbraw/zinc/68/83/18/520688318.db2.gz DSMVGYKFHUEOMW-UHFFFAOYSA-N 2 2 370.409 2.853 20 5 FFBDLP O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CC[C@H](C[NH+]3CCCCC3)C1)OCCO2 ZINC000611274028 521073606 /nfs/dbraw/zinc/07/36/06/521073606.db2.gz HNQGCMMYADSHOX-OAHLLOKOSA-N 2 2 361.442 2.674 20 5 FFBDLP O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@H](C[NH+]3CCCCC3)C1)OCCO2 ZINC000611274028 521073616 /nfs/dbraw/zinc/07/36/16/521073616.db2.gz HNQGCMMYADSHOX-OAHLLOKOSA-N 2 2 361.442 2.674 20 5 FFBDLP C[C@@H]1C[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])CC[C@@H]1N1CC[NH+](C)CC1 ZINC000611275112 521075511 /nfs/dbraw/zinc/07/55/11/521075511.db2.gz DZXSOFJFPAQGJB-JVEIWDLLSA-N 2 2 358.486 2.566 20 5 FFBDLP C[C@@H]1C[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])CC[C@@H]1N1CC[NH+](C)CC1 ZINC000611275112 521075522 /nfs/dbraw/zinc/07/55/22/521075522.db2.gz DZXSOFJFPAQGJB-JVEIWDLLSA-N 2 2 358.486 2.566 20 5 FFBDLP Cn1cc[nH+]c1N1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000597250293 521596291 /nfs/dbraw/zinc/59/62/91/521596291.db2.gz VTNFEJJGUBJRGS-UHFFFAOYSA-N 2 2 367.409 2.911 20 5 FFBDLP CC[NH+](CC)CC[NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173006989 1012176256 /nfs/dbraw/zinc/17/62/56/1012176256.db2.gz HJGOCJZHOIEXNK-UHFFFAOYSA-N 2 2 356.417 2.773 20 5 FFBDLP COc1cc(N2CCC([NH2+][C@H]3CC[N@H+](CC4CC4)C3)CC2)ccc1[N+](=O)[O-] ZINC001256088031 1038372417 /nfs/dbraw/zinc/37/24/17/1038372417.db2.gz ASDBBZUQIQZVCO-KRWDZBQOSA-N 2 2 374.485 2.646 20 5 FFBDLP COc1cc(N2CCC([NH2+][C@H]3CC[N@@H+](CC4CC4)C3)CC2)ccc1[N+](=O)[O-] ZINC001256088031 1038372434 /nfs/dbraw/zinc/37/24/34/1038372434.db2.gz ASDBBZUQIQZVCO-KRWDZBQOSA-N 2 2 374.485 2.646 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H]2C[NH+](Cc3cccnc3)C[C@H]2C1 ZINC001254561857 1040800772 /nfs/dbraw/zinc/80/07/72/1040800772.db2.gz MXXGTEIHYXXHGI-AHRSYUTCSA-N 2 2 366.465 2.985 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H]2C[NH+](Cc3cccnc3)C[C@H]2C1 ZINC001254561857 1040800796 /nfs/dbraw/zinc/80/07/96/1040800796.db2.gz MXXGTEIHYXXHGI-AHRSYUTCSA-N 2 2 366.465 2.985 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH+]1C[C@H]2C[N@@H+](Cc3cccnc3)C[C@H]2C1 ZINC001254561857 1040800816 /nfs/dbraw/zinc/80/08/16/1040800816.db2.gz MXXGTEIHYXXHGI-AHRSYUTCSA-N 2 2 366.465 2.985 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH+]1C[C@H]2C[N@H+](Cc3cccnc3)C[C@H]2C1 ZINC001254561857 1040800829 /nfs/dbraw/zinc/80/08/29/1040800829.db2.gz MXXGTEIHYXXHGI-AHRSYUTCSA-N 2 2 366.465 2.985 20 5 FFBDLP CC(C)[N@@H+]1CCOC[C@]2(CCC[NH+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1 ZINC001254592713 1040823281 /nfs/dbraw/zinc/82/32/81/1040823281.db2.gz GAANOPWFXBAFGJ-LEWJYISDSA-N 2 2 373.497 2.885 20 5 FFBDLP CC(C)[N@H+]1CCOC[C@]2(CCC[NH+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1 ZINC001254592713 1040823288 /nfs/dbraw/zinc/82/32/88/1040823288.db2.gz GAANOPWFXBAFGJ-LEWJYISDSA-N 2 2 373.497 2.885 20 5 FFBDLP CC(C)[NH+]1CCOC[C@]2(CCC[N@@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1 ZINC001254592713 1040823296 /nfs/dbraw/zinc/82/32/96/1040823296.db2.gz GAANOPWFXBAFGJ-LEWJYISDSA-N 2 2 373.497 2.885 20 5 FFBDLP CC(C)[NH+]1CCOC[C@]2(CCC[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1 ZINC001254592713 1040823306 /nfs/dbraw/zinc/82/33/06/1040823306.db2.gz GAANOPWFXBAFGJ-LEWJYISDSA-N 2 2 373.497 2.885 20 5 FFBDLP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])C1 ZINC000272441808 252039855 /nfs/dbraw/zinc/03/98/55/252039855.db2.gz OPTUVVRBJAMCQN-LBPRGKRZSA-N 2 2 373.400 2.679 20 5 FFBDLP CC[N@H+]1CC[C@@H](C[NH2+]Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])C1 ZINC000272441808 252039858 /nfs/dbraw/zinc/03/98/58/252039858.db2.gz OPTUVVRBJAMCQN-LBPRGKRZSA-N 2 2 373.400 2.679 20 5 FFBDLP C[NH+](C)CCCOc1cnccc1C[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000288499026 257196989 /nfs/dbraw/zinc/19/69/89/257196989.db2.gz HVKZTMGBHNNOLE-UHFFFAOYSA-N 2 2 350.444 2.672 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@@H+]2Cc1cc([N+](=O)[O-])ccc1Cl ZINC000371294773 512312324 /nfs/dbraw/zinc/31/23/24/512312324.db2.gz MZJTZDINJUBACJ-XOKHGSTOSA-N 2 2 353.850 2.932 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@H+]2Cc1cc([N+](=O)[O-])ccc1Cl ZINC000371294773 512312328 /nfs/dbraw/zinc/31/23/28/512312328.db2.gz MZJTZDINJUBACJ-XOKHGSTOSA-N 2 2 353.850 2.932 20 5 FFBDLP C[NH+](C)C1(CNC(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)CCCCC1 ZINC000049929733 507642432 /nfs/dbraw/zinc/64/24/32/507642432.db2.gz PZBUWSACWAYBLN-UHFFFAOYSA-N 2 2 371.441 2.775 20 5 FFBDLP CC(=O)c1ccc(NC2CC[NH+](C3CC[NH+](C)CC3)CC2)c([N+](=O)[O-])c1 ZINC000050954594 507720541 /nfs/dbraw/zinc/72/05/41/507720541.db2.gz DNOAGMFYFDTLAO-UHFFFAOYSA-N 2 2 360.458 2.768 20 5 FFBDLP O=[N+]([O-])c1cccc(CCNc2[nH+]cnc3c2cnn3-c2cc[nH+]cc2)c1 ZINC000092900118 508107814 /nfs/dbraw/zinc/10/78/14/508107814.db2.gz QAIYCECMMFJAAJ-UHFFFAOYSA-N 2 2 361.365 2.773 20 5 FFBDLP CCOc1ccc([C@@H](C)[NH2+]C[C@H](C)C[NH+]2CCOCC2)cc1[N+](=O)[O-] ZINC000153902154 508673859 /nfs/dbraw/zinc/67/38/59/508673859.db2.gz FLSQBSSYHZZVNM-LSDHHAIUSA-N 2 2 351.447 2.612 20 5 FFBDLP CC[N@@H+]1CC[C@H]([NH+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H](C)C1 ZINC000245437696 509933949 /nfs/dbraw/zinc/93/39/49/509933949.db2.gz RRAUKAZGKSQIFP-BBRMVZONSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[N@H+]1CC[C@H]([NH+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H](C)C1 ZINC000245437696 509933953 /nfs/dbraw/zinc/93/39/53/509933953.db2.gz RRAUKAZGKSQIFP-BBRMVZONSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[NH+]1CC[C@H]([N@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H](C)C1 ZINC000245437696 509933957 /nfs/dbraw/zinc/93/39/57/509933957.db2.gz RRAUKAZGKSQIFP-BBRMVZONSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[NH+]1CC[C@H]([N@@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H](C)C1 ZINC000245437696 509933959 /nfs/dbraw/zinc/93/39/59/509933959.db2.gz RRAUKAZGKSQIFP-BBRMVZONSA-N 2 2 359.430 2.807 20 5 FFBDLP O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c([N+](=O)[O-])c1 ZINC000194078930 510204742 /nfs/dbraw/zinc/20/47/42/510204742.db2.gz SNHQXWXIHBPPGF-DYVFJYSZSA-N 2 2 360.414 2.952 20 5 FFBDLP O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c([N+](=O)[O-])c1 ZINC000194078930 510204754 /nfs/dbraw/zinc/20/47/54/510204754.db2.gz SNHQXWXIHBPPGF-DYVFJYSZSA-N 2 2 360.414 2.952 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c([N+](=O)[O-])c1 ZINC000194078930 510204764 /nfs/dbraw/zinc/20/47/64/510204764.db2.gz SNHQXWXIHBPPGF-DYVFJYSZSA-N 2 2 360.414 2.952 20 5 FFBDLP O=[N+]([O-])c1ccc(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c([N+](=O)[O-])c1 ZINC000194078930 510204772 /nfs/dbraw/zinc/20/47/72/510204772.db2.gz SNHQXWXIHBPPGF-DYVFJYSZSA-N 2 2 360.414 2.952 20 5 FFBDLP CCCn1cc[nH+]c1CCC[N@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000191510492 510696752 /nfs/dbraw/zinc/69/67/52/510696752.db2.gz QUXAEDJIEZEFLV-UHFFFAOYSA-N 2 2 359.430 2.704 20 5 FFBDLP CCCn1cc[nH+]c1CCC[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000191510492 510696756 /nfs/dbraw/zinc/69/67/56/510696756.db2.gz QUXAEDJIEZEFLV-UHFFFAOYSA-N 2 2 359.430 2.704 20 5 FFBDLP Cc1[nH+]c2ccccc2n1C[C@H]1CCC[N@@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000270346377 510770555 /nfs/dbraw/zinc/77/05/55/510770555.db2.gz OUDFUWBUHRXVJA-OAHLLOKOSA-N 2 2 354.414 2.614 20 5 FFBDLP Cc1[nH+]c2ccccc2n1C[C@H]1CCC[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000270346377 510770559 /nfs/dbraw/zinc/77/05/59/510770559.db2.gz OUDFUWBUHRXVJA-OAHLLOKOSA-N 2 2 354.414 2.614 20 5 FFBDLP CCOc1cc(C[N@@H+]2CCC[C@H](C[NH+]3CCOCC3)C2)ccc1[N+](=O)[O-] ZINC000282583712 511034638 /nfs/dbraw/zinc/03/46/38/511034638.db2.gz WFSYNLNBYUEIDV-QGZVFWFLSA-N 2 2 363.458 2.538 20 5 FFBDLP CCOc1cc(C[N@H+]2CCC[C@H](C[NH+]3CCOCC3)C2)ccc1[N+](=O)[O-] ZINC000282583712 511034639 /nfs/dbraw/zinc/03/46/39/511034639.db2.gz WFSYNLNBYUEIDV-QGZVFWFLSA-N 2 2 363.458 2.538 20 5 FFBDLP COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+]1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000363562303 511629640 /nfs/dbraw/zinc/62/96/40/511629640.db2.gz LLLIARJLBOAOFQ-CHWSQXEVSA-N 2 2 373.413 2.533 20 5 FFBDLP COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+]1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000363562303 511629647 /nfs/dbraw/zinc/62/96/47/511629647.db2.gz LLLIARJLBOAOFQ-CHWSQXEVSA-N 2 2 373.413 2.533 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@@H+]2Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000374423167 512826566 /nfs/dbraw/zinc/82/65/66/512826566.db2.gz VFKLPNBCIIMKJM-FRFSOERESA-N 2 2 353.850 2.932 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@H+]2Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000374423167 512826571 /nfs/dbraw/zinc/82/65/71/512826571.db2.gz VFKLPNBCIIMKJM-FRFSOERESA-N 2 2 353.850 2.932 20 5 FFBDLP C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@H]1CCCC[N@@H+]1C1CC1 ZINC000446976931 513372436 /nfs/dbraw/zinc/37/24/36/513372436.db2.gz ZEDUSGDRFVWYLG-KBXCAEBGSA-N 2 2 360.458 2.918 20 5 FFBDLP C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@H]1CCCC[N@H+]1C1CC1 ZINC000446976931 513372444 /nfs/dbraw/zinc/37/24/44/513372444.db2.gz ZEDUSGDRFVWYLG-KBXCAEBGSA-N 2 2 360.458 2.918 20 5 FFBDLP C[C@@H]1CCCC[N@@H+]1CCNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000447812628 513577604 /nfs/dbraw/zinc/57/76/04/513577604.db2.gz NBGOKBQQBZPWAQ-MRXNPFEDSA-N 2 2 362.474 2.713 20 5 FFBDLP C[C@@H]1CCCC[N@H+]1CCNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000447812628 513577608 /nfs/dbraw/zinc/57/76/08/513577608.db2.gz NBGOKBQQBZPWAQ-MRXNPFEDSA-N 2 2 362.474 2.713 20 5 FFBDLP CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1 ZINC000432364138 514173524 /nfs/dbraw/zinc/17/35/24/514173524.db2.gz ZVEYYHWEVSDAOF-HNNXBMFYSA-N 2 2 351.447 2.584 20 5 FFBDLP CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCC[N@H+]1CCCO[C@@H](C)C1 ZINC000432364138 514173532 /nfs/dbraw/zinc/17/35/32/514173532.db2.gz ZVEYYHWEVSDAOF-HNNXBMFYSA-N 2 2 351.447 2.584 20 5 FFBDLP Cn1cc[nH+]c1C[C@@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000444664253 514287963 /nfs/dbraw/zinc/28/79/63/514287963.db2.gz QMHNXXKOSGBZPP-ZDUSSCGKSA-N 2 2 354.414 2.659 20 5 FFBDLP Cn1cc[nH+]c1C[C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000444664253 514287966 /nfs/dbraw/zinc/28/79/66/514287966.db2.gz QMHNXXKOSGBZPP-ZDUSSCGKSA-N 2 2 354.414 2.659 20 5 FFBDLP Cn1cc[nH+]c1C[C@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000444664252 514288086 /nfs/dbraw/zinc/28/80/86/514288086.db2.gz QMHNXXKOSGBZPP-CYBMUJFWSA-N 2 2 354.414 2.659 20 5 FFBDLP Cn1cc[nH+]c1C[C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000444664252 514288088 /nfs/dbraw/zinc/28/80/88/514288088.db2.gz QMHNXXKOSGBZPP-CYBMUJFWSA-N 2 2 354.414 2.659 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2C[NH2+][C@@H]2CC[NH2+]C2)cc1 ZINC000414888513 514342656 /nfs/dbraw/zinc/34/26/56/514342656.db2.gz SCGHEVVXERCGJJ-QGZVFWFLSA-N 2 2 363.421 2.899 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@@H]3C[NH2+]CCO3)o2)c(Cl)c1 ZINC000415090646 514439031 /nfs/dbraw/zinc/43/90/31/514439031.db2.gz AWPLDPRVJDGTSV-ZDUSSCGKSA-N 2 2 351.790 2.586 20 5 FFBDLP C[C@H]([NH2+]CCC[NH+]1CCN(c2cc[nH+]cc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000467839941 515143051 /nfs/dbraw/zinc/14/30/51/515143051.db2.gz FXPOGFMFDOTFOF-KRWDZBQOSA-N 3 2 369.469 2.853 20 5 FFBDLP COc1ccc(C[NH2+]C2CC[NH+](Cc3cccnc3)CC2)cc1[N+](=O)[O-] ZINC000481442866 515329689 /nfs/dbraw/zinc/32/96/89/515329689.db2.gz WURYLWLQDURMDE-UHFFFAOYSA-N 2 2 356.426 2.753 20 5 FFBDLP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]Cc1c([N+](=O)[O-])ncn1C ZINC000469764072 515955604 /nfs/dbraw/zinc/95/56/04/515955604.db2.gz NDDBUGOJRHNKQJ-HUUCEWRRSA-N 2 2 357.458 2.575 20 5 FFBDLP O=[N+]([O-])c1cccc2c1CC[N@H+](Cc1ccc(C[NH+]3CCOCC3)cc1)C2 ZINC000564198358 518346215 /nfs/dbraw/zinc/34/62/15/518346215.db2.gz SDSHEYBVCABQPR-UHFFFAOYSA-N 2 2 367.449 2.985 20 5 FFBDLP O=[N+]([O-])c1cccc2c1CC[N@@H+](Cc1ccc(C[NH+]3CCOCC3)cc1)C2 ZINC000564198358 518346219 /nfs/dbraw/zinc/34/62/19/518346219.db2.gz SDSHEYBVCABQPR-UHFFFAOYSA-N 2 2 367.449 2.985 20 5 FFBDLP O=C(NC[C@H]1CC[N@@H+]1C1CCCC1)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000600470895 520278503 /nfs/dbraw/zinc/27/85/03/520278503.db2.gz JOBZAGAWPVBHOJ-MRXNPFEDSA-N 2 2 369.425 2.527 20 5 FFBDLP O=C(NC[C@H]1CC[N@H+]1C1CCCC1)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000600470895 520278508 /nfs/dbraw/zinc/27/85/08/520278508.db2.gz JOBZAGAWPVBHOJ-MRXNPFEDSA-N 2 2 369.425 2.527 20 5 FFBDLP CC[N@H+](CC[NH3+])Cc1ccc(OC)c(OCc2ccc([N+](=O)[O-])cc2)c1 ZINC000600774587 520461205 /nfs/dbraw/zinc/46/12/05/520461205.db2.gz LDDMGGOSLPEMMA-UHFFFAOYSA-N 2 2 359.426 2.963 20 5 FFBDLP CC[N@@H+](CC[NH3+])Cc1ccc(OC)c(OCc2ccc([N+](=O)[O-])cc2)c1 ZINC000600774587 520461210 /nfs/dbraw/zinc/46/12/10/520461210.db2.gz LDDMGGOSLPEMMA-UHFFFAOYSA-N 2 2 359.426 2.963 20 5 FFBDLP CCOc1cc(C[N@@H+]2CCO[C@H](CCC[NH+](C)C)C2)ccc1[N+](=O)[O-] ZINC000595905264 520811560 /nfs/dbraw/zinc/81/15/60/520811560.db2.gz AVDSCNLDNUUNMI-MRXNPFEDSA-N 2 2 351.447 2.536 20 5 FFBDLP CCOc1cc(C[N@H+]2CCO[C@H](CCC[NH+](C)C)C2)ccc1[N+](=O)[O-] ZINC000595905264 520811568 /nfs/dbraw/zinc/81/15/68/520811568.db2.gz AVDSCNLDNUUNMI-MRXNPFEDSA-N 2 2 351.447 2.536 20 5 FFBDLP O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CC[C@@H](C[NH+]3CCCCC3)C1)OCCO2 ZINC000611274026 521073889 /nfs/dbraw/zinc/07/38/89/521073889.db2.gz HNQGCMMYADSHOX-HNNXBMFYSA-N 2 2 361.442 2.674 20 5 FFBDLP O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@@H](C[NH+]3CCCCC3)C1)OCCO2 ZINC000611274026 521073896 /nfs/dbraw/zinc/07/38/96/521073896.db2.gz HNQGCMMYADSHOX-HNNXBMFYSA-N 2 2 361.442 2.674 20 5 FFBDLP C[C@H](C[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)[N@@H+]1CCC[C@H](C)C1 ZINC000602514455 521387718 /nfs/dbraw/zinc/38/77/18/521387718.db2.gz JOFTZWNYYFOLOD-JKSUJKDBSA-N 2 2 361.490 2.669 20 5 FFBDLP C[C@H](C[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)[N@H+]1CCC[C@H](C)C1 ZINC000602514455 521387728 /nfs/dbraw/zinc/38/77/28/521387728.db2.gz JOFTZWNYYFOLOD-JKSUJKDBSA-N 2 2 361.490 2.669 20 5 FFBDLP C[C@@H](C[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)[N@@H+]1CCCC[C@H]1C ZINC000602513211 521387738 /nfs/dbraw/zinc/38/77/38/521387738.db2.gz ARNDWKRDYSJGIZ-CVEARBPZSA-N 2 2 361.490 2.811 20 5 FFBDLP C[C@@H](C[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)[N@H+]1CCCC[C@H]1C ZINC000602513211 521387744 /nfs/dbraw/zinc/38/77/44/521387744.db2.gz ARNDWKRDYSJGIZ-CVEARBPZSA-N 2 2 361.490 2.811 20 5 FFBDLP O=[N+]([O-])c1cnn(C2CC([NH2+]Cc3ccccc3Cn3cc[nH+]c3)C2)c1 ZINC000876921071 1014420819 /nfs/dbraw/zinc/42/08/19/1014420819.db2.gz JJXNWSAARSIYEF-UHFFFAOYSA-N 2 2 352.398 2.529 20 5 FFBDLP Cn1cc(C[NH2+][C@@H]2Cc3ccccc3[C@H]2[NH3+])c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000904459796 980280924 /nfs/dbraw/zinc/28/09/24/980280924.db2.gz XDGXOPOBYNTDQQ-RTBURBONSA-N 2 2 363.421 2.710 20 5 FFBDLP O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]Cc2ccc(-n3cc[nH+]c3)c(F)c2)cc1 ZINC000731678373 998143412 /nfs/dbraw/zinc/14/34/12/998143412.db2.gz LBQFBQGNWHEGKW-SFHVURJKSA-N 2 2 356.357 2.743 20 5 FFBDLP C[NH+](C)CCOc1cc(NCCc2cn3ccccc3[nH+]2)ccc1[N+](=O)[O-] ZINC001169003901 1000014673 /nfs/dbraw/zinc/01/46/73/1000014673.db2.gz KAKVMMLYTOVZQQ-UHFFFAOYSA-N 2 2 369.425 2.838 20 5 FFBDLP O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)cc1 ZINC000791623345 1002748765 /nfs/dbraw/zinc/74/87/65/1002748765.db2.gz TVWBGHFXGLMKHU-SVFBPWRDSA-N 2 2 367.449 2.692 20 5 FFBDLP O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)cc1 ZINC000791623345 1002748775 /nfs/dbraw/zinc/74/87/75/1002748775.db2.gz TVWBGHFXGLMKHU-SVFBPWRDSA-N 2 2 367.449 2.692 20 5 FFBDLP O=[N+]([O-])c1ccc([C@H](O)C[NH+]2C[C@H]3C[N@H+](Cc4ccccc4)C[C@H]3C2)cc1 ZINC000791623345 1002748789 /nfs/dbraw/zinc/74/87/89/1002748789.db2.gz TVWBGHFXGLMKHU-SVFBPWRDSA-N 2 2 367.449 2.692 20 5 FFBDLP O=[N+]([O-])c1ccc([C@H](O)C[NH+]2C[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]3C2)cc1 ZINC000791623345 1002748799 /nfs/dbraw/zinc/74/87/99/1002748799.db2.gz TVWBGHFXGLMKHU-SVFBPWRDSA-N 2 2 367.449 2.692 20 5 FFBDLP C[C@H]1CC[N@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C[C@@H]1n1cc[nH+]c1 ZINC000121643761 1011065667 /nfs/dbraw/zinc/06/56/67/1011065667.db2.gz DWCHIVFCZPOTDP-YOEHRIQHSA-N 2 2 367.413 2.590 20 5 FFBDLP C[C@H]1CC[N@@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C[C@@H]1n1cc[nH+]c1 ZINC000121643761 1011065676 /nfs/dbraw/zinc/06/56/76/1011065676.db2.gz DWCHIVFCZPOTDP-YOEHRIQHSA-N 2 2 367.413 2.590 20 5 FFBDLP O=[N+]([O-])c1cc(F)c(N2CCC([NH2+]CC[NH+]3CCCC3)CC2)c(F)c1 ZINC001173005290 1012173969 /nfs/dbraw/zinc/17/39/69/1012173969.db2.gz BCDJTEBYDDMHBY-UHFFFAOYSA-N 2 2 354.401 2.527 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CC[C@]3(C2)CCC[NH2+]C3)c1F ZINC001246600010 1039411361 /nfs/dbraw/zinc/41/13/61/1039411361.db2.gz CNTAXULRMWHZGN-SCLBCKFNSA-N 2 2 351.422 2.749 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CC[C@]3(C2)CCC[NH2+]C3)c1F ZINC001246600010 1039411365 /nfs/dbraw/zinc/41/13/65/1039411365.db2.gz CNTAXULRMWHZGN-SCLBCKFNSA-N 2 2 351.422 2.749 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@H+]1C[C@H]3C[NH+](Cc4cccnc4)C[C@H]3C1)C2 ZINC001254599386 1040830614 /nfs/dbraw/zinc/83/06/14/1040830614.db2.gz YNFPGGMGPPABAK-ZVDOUQERSA-N 2 2 364.449 2.521 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@@H+]1C[C@H]3C[NH+](Cc4cccnc4)C[C@H]3C1)C2 ZINC001254599386 1040830626 /nfs/dbraw/zinc/83/06/26/1040830626.db2.gz YNFPGGMGPPABAK-ZVDOUQERSA-N 2 2 364.449 2.521 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH+]1C[C@H]3C[N@@H+](Cc4cccnc4)C[C@H]3C1)C2 ZINC001254599386 1040830640 /nfs/dbraw/zinc/83/06/40/1040830640.db2.gz YNFPGGMGPPABAK-ZVDOUQERSA-N 2 2 364.449 2.521 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH+]1C[C@H]3C[N@H+](Cc4cccnc4)C[C@H]3C1)C2 ZINC001254599386 1040830657 /nfs/dbraw/zinc/83/06/57/1040830657.db2.gz YNFPGGMGPPABAK-ZVDOUQERSA-N 2 2 364.449 2.521 20 5 FFBDLP C[N@@H+]1CCC[C@H]1C[NH2+]CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001308888403 1052513476 /nfs/dbraw/zinc/51/34/76/1052513476.db2.gz PCNIRUPCMBWCCC-FQEVSTJZSA-N 3 2 360.502 2.533 20 5 FFBDLP C[N@H+]1CCC[C@H]1C[NH2+]CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001308888403 1052513481 /nfs/dbraw/zinc/51/34/81/1052513481.db2.gz PCNIRUPCMBWCCC-FQEVSTJZSA-N 3 2 360.502 2.533 20 5 FFBDLP Cn1cc[nH+]c1C[C@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC001356532126 1055559050 /nfs/dbraw/zinc/55/90/50/1055559050.db2.gz IJTREQVZQIACIX-OALUTQOASA-N 2 2 366.421 2.935 20 5 FFBDLP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1 ZINC000093693280 250040916 /nfs/dbraw/zinc/04/09/16/250040916.db2.gz CKCNZQVHVVNJOD-AWEZNQCLSA-N 2 2 351.447 2.776 20 5 FFBDLP CC[NH+](CC)C[C@@H]1CC[N@@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1 ZINC000093693280 250040921 /nfs/dbraw/zinc/04/09/21/250040921.db2.gz CKCNZQVHVVNJOD-AWEZNQCLSA-N 2 2 351.447 2.776 20 5 FFBDLP C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+](C)CCCn1cc[nH+]c1 ZINC000181108609 251242315 /nfs/dbraw/zinc/24/23/15/251242315.db2.gz CVYSTDMVSJDVBM-LBPRGKRZSA-N 2 2 365.821 2.794 20 5 FFBDLP C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)CCCn1cc[nH+]c1 ZINC000181108609 251242320 /nfs/dbraw/zinc/24/23/20/251242320.db2.gz CVYSTDMVSJDVBM-LBPRGKRZSA-N 2 2 365.821 2.794 20 5 FFBDLP CC(C)[NH+]1CCC([NH+]2CCN(Cc3csc([N+](=O)[O-])c3)CC2)CC1 ZINC000332424873 258229931 /nfs/dbraw/zinc/22/99/31/258229931.db2.gz SYEUPBAKIHSILA-UHFFFAOYSA-N 2 2 352.504 2.647 20 5 FFBDLP O=[N+]([O-])c1cc(C[NH+]2CCC(C[NH+]3CCOCC3)CC2)ccc1Cl ZINC000122551889 508552966 /nfs/dbraw/zinc/55/29/66/508552966.db2.gz FPTQILDSNWMNOA-UHFFFAOYSA-N 2 2 353.850 2.792 20 5 FFBDLP CCOc1ccc([C@H](C)[NH2+]C[C@@H](C)C[NH+]2CCOCC2)cc1[N+](=O)[O-] ZINC000153902062 508673821 /nfs/dbraw/zinc/67/38/21/508673821.db2.gz FLSQBSSYHZZVNM-CABCVRRESA-N 2 2 351.447 2.612 20 5 FFBDLP Cc1c(NC(=O)[C@@H](C)[N@@H+]2CC[C@H](Oc3cc[nH+]cc3)C2)cccc1[N+](=O)[O-] ZINC000154073880 508711915 /nfs/dbraw/zinc/71/19/15/508711915.db2.gz WNVPWLPUKDIDCY-ZBFHGGJFSA-N 2 2 370.409 2.779 20 5 FFBDLP Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@H](Oc3cc[nH+]cc3)C2)cccc1[N+](=O)[O-] ZINC000154073880 508711920 /nfs/dbraw/zinc/71/19/20/508711920.db2.gz WNVPWLPUKDIDCY-ZBFHGGJFSA-N 2 2 370.409 2.779 20 5 FFBDLP O=C(C[N@@H+]1CCC[C@@H](c2[nH]cc[nH+]2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000266901289 509247369 /nfs/dbraw/zinc/24/73/69/509247369.db2.gz GOUYMIGUCKAIIK-LLVKDONJSA-N 2 2 363.805 2.789 20 5 FFBDLP O=C(C[N@H+]1CCC[C@@H](c2[nH]cc[nH+]2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000266901289 509247375 /nfs/dbraw/zinc/24/73/75/509247375.db2.gz GOUYMIGUCKAIIK-LLVKDONJSA-N 2 2 363.805 2.789 20 5 FFBDLP C[C@H]1CC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H]1n1cc[nH+]c1 ZINC000245711221 510101158 /nfs/dbraw/zinc/10/11/58/510101158.db2.gz STPCRHRMIOFILM-WMLDXEAASA-N 2 2 357.414 2.703 20 5 FFBDLP C[C@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H]1n1cc[nH+]c1 ZINC000245711221 510101164 /nfs/dbraw/zinc/10/11/64/510101164.db2.gz STPCRHRMIOFILM-WMLDXEAASA-N 2 2 357.414 2.703 20 5 FFBDLP CC[C@H]([NH2+]CCC[N@@H+]1CCC[C@H]1C(=O)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000268857831 510104316 /nfs/dbraw/zinc/10/43/16/510104316.db2.gz QWEWMYGCHQCPPJ-ROUUACIJSA-N 2 2 362.474 2.578 20 5 FFBDLP CC[C@H]([NH2+]CCC[N@H+]1CCC[C@H]1C(=O)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000268857831 510104321 /nfs/dbraw/zinc/10/43/21/510104321.db2.gz QWEWMYGCHQCPPJ-ROUUACIJSA-N 2 2 362.474 2.578 20 5 FFBDLP Cc1cccc([N+](=O)[O-])c1C(=O)NCC1([NH+]2CCCCC2)CC[NH+](C)CC1 ZINC000194765188 510517649 /nfs/dbraw/zinc/51/76/49/510517649.db2.gz CYKRBRSLSKJDKL-UHFFFAOYSA-N 2 2 374.485 2.583 20 5 FFBDLP C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000246985603 510783319 /nfs/dbraw/zinc/78/33/19/510783319.db2.gz WCDXYMFMJJEDRK-RKVPGOIHSA-N 2 2 372.469 2.871 20 5 FFBDLP C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000246985603 510783326 /nfs/dbraw/zinc/78/33/26/510783326.db2.gz WCDXYMFMJJEDRK-RKVPGOIHSA-N 2 2 372.469 2.871 20 5 FFBDLP C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000246985603 510783334 /nfs/dbraw/zinc/78/33/34/510783334.db2.gz WCDXYMFMJJEDRK-RKVPGOIHSA-N 2 2 372.469 2.871 20 5 FFBDLP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC)[C@@H](C)C1 ZINC000247078828 510828137 /nfs/dbraw/zinc/82/81/37/510828137.db2.gz QSLYPOMPHPUGCX-MAUKXSAKSA-N 2 2 365.474 2.830 20 5 FFBDLP CCOCCC[N@H+]1CC[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC)[C@@H](C)C1 ZINC000247078828 510828139 /nfs/dbraw/zinc/82/81/39/510828139.db2.gz QSLYPOMPHPUGCX-MAUKXSAKSA-N 2 2 365.474 2.830 20 5 FFBDLP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC(=O)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000285664527 511001683 /nfs/dbraw/zinc/00/16/83/511001683.db2.gz MLZRLZNEYKSWQV-PHSGOXPASA-N 2 2 374.485 2.719 20 5 FFBDLP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC(=O)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000285664527 511001688 /nfs/dbraw/zinc/00/16/88/511001688.db2.gz MLZRLZNEYKSWQV-PHSGOXPASA-N 2 2 374.485 2.719 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H](c2[nH+]ccn2C)C1 ZINC000365633339 511570971 /nfs/dbraw/zinc/57/09/71/511570971.db2.gz VHESNDUSEWTSCE-HNNXBMFYSA-N 2 2 371.441 2.845 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@H](c2[nH+]ccn2C)C1 ZINC000365633339 511570975 /nfs/dbraw/zinc/57/09/75/511570975.db2.gz VHESNDUSEWTSCE-HNNXBMFYSA-N 2 2 371.441 2.845 20 5 FFBDLP Cc1c(NC(=O)CC[NH+]2CCC(c3c[nH]c[nH+]3)CC2)cccc1[N+](=O)[O-] ZINC000374200861 512705805 /nfs/dbraw/zinc/70/58/05/512705805.db2.gz SBQGBDPPDRBMKE-UHFFFAOYSA-N 2 2 357.414 2.835 20 5 FFBDLP COc1cc(C[N@H+](C)[C@H]2CCC[NH2+]CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000435620616 513641436 /nfs/dbraw/zinc/64/14/36/513641436.db2.gz DPWYVOMNAJDBNE-LBPRGKRZSA-N 2 2 359.373 2.779 20 5 FFBDLP COc1cc(C[N@@H+](C)[C@H]2CCC[NH2+]CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000435620616 513641441 /nfs/dbraw/zinc/64/14/41/513641441.db2.gz DPWYVOMNAJDBNE-LBPRGKRZSA-N 2 2 359.373 2.779 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[NH2+]C2CC[NH+](C3CCC3)CC2)cccc1[N+](=O)[O-] ZINC000419296551 513767007 /nfs/dbraw/zinc/76/70/07/513767007.db2.gz RZQLQRRLYWJGJZ-AWEZNQCLSA-N 2 2 360.458 2.837 20 5 FFBDLP C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@@H]1C[NH2+]C[C@H]1c1ccccc1 ZINC000423535296 514164570 /nfs/dbraw/zinc/16/45/70/514164570.db2.gz XJDDEZLMNUPSIC-ZOCIIQOWSA-N 2 2 368.437 2.657 20 5 FFBDLP CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCC[N@@H+]1CCCO[C@H](C)C1 ZINC000432364139 514173240 /nfs/dbraw/zinc/17/32/40/514173240.db2.gz ZVEYYHWEVSDAOF-OAHLLOKOSA-N 2 2 351.447 2.584 20 5 FFBDLP CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCC[N@H+]1CCCO[C@H](C)C1 ZINC000432364139 514173247 /nfs/dbraw/zinc/17/32/47/514173247.db2.gz ZVEYYHWEVSDAOF-OAHLLOKOSA-N 2 2 351.447 2.584 20 5 FFBDLP COc1ccc(C[NH2+][C@@H]2CC[NH2+]C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414864026 514329364 /nfs/dbraw/zinc/32/93/64/514329364.db2.gz BGTCRKBTPVFRGX-MRXNPFEDSA-N 2 2 357.410 2.634 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2C[NH2+][C@H]2CC[NH2+]C2)cc1 ZINC000414888511 514343055 /nfs/dbraw/zinc/34/30/55/514343055.db2.gz SCGHEVVXERCGJJ-KRWDZBQOSA-N 2 2 363.421 2.899 20 5 FFBDLP C[NH+](C)CC[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)C(C)(C)C ZINC000449879730 514405564 /nfs/dbraw/zinc/40/55/64/514405564.db2.gz JJHTUMGPHHWZEW-QGZVFWFLSA-N 2 2 373.457 2.877 20 5 FFBDLP O=[N+]([O-])c1cc(C[NH2+]C[C@H]2C[NH2+]CCO2)ccc1Oc1ccc(F)cc1 ZINC000415095371 514439976 /nfs/dbraw/zinc/43/99/76/514439976.db2.gz MJQSLJCNJGPCSF-MRXNPFEDSA-N 2 2 361.373 2.604 20 5 FFBDLP Cc1cc(NC[C@@]2([NH+](C)C)CCSC2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000479459332 514591702 /nfs/dbraw/zinc/59/17/02/514591702.db2.gz XOYPHIACAXOCOD-SFHVURJKSA-N 2 2 373.482 2.631 20 5 FFBDLP O=C(NC1CC[NH+](C2CCC2)CC1)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000456736211 515391365 /nfs/dbraw/zinc/39/13/65/515391365.db2.gz RWDCIOJRZYVRTB-UHFFFAOYSA-N 2 2 369.425 2.527 20 5 FFBDLP CC[N@@H+]1CC[C@H](N(C)C(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000524879800 516856870 /nfs/dbraw/zinc/85/68/70/516856870.db2.gz UGVOEKONXGITFT-HOCLYGCPSA-N 2 2 371.441 2.725 20 5 FFBDLP CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000524879800 516856877 /nfs/dbraw/zinc/85/68/77/516856877.db2.gz UGVOEKONXGITFT-HOCLYGCPSA-N 2 2 371.441 2.725 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC(=O)N(C)C ZINC000552338772 517204960 /nfs/dbraw/zinc/20/49/60/517204960.db2.gz PCEYXUQVPCDCNF-MGNMYUMUSA-N 2 2 374.485 2.637 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC(=O)N(C)C ZINC000552338772 517204968 /nfs/dbraw/zinc/20/49/68/517204968.db2.gz PCEYXUQVPCDCNF-MGNMYUMUSA-N 2 2 374.485 2.637 20 5 FFBDLP CC[N@H+](CCC[NH+]1CCCC1)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000521318205 517688692 /nfs/dbraw/zinc/68/86/92/517688692.db2.gz QLBDEMTYGBXJDH-UHFFFAOYSA-N 2 2 351.447 2.920 20 5 FFBDLP CC[N@@H+](CCC[NH+]1CCCC1)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000521318205 517688703 /nfs/dbraw/zinc/68/87/03/517688703.db2.gz QLBDEMTYGBXJDH-UHFFFAOYSA-N 2 2 351.447 2.920 20 5 FFBDLP O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C[C@@]1(O)CC[N@H+](Cc2ccccc2)C1 ZINC000579376483 518651375 /nfs/dbraw/zinc/65/13/75/518651375.db2.gz SPDCCAOKOPDTNM-CTNGQTDRSA-N 2 2 367.449 2.809 20 5 FFBDLP O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000579376483 518651382 /nfs/dbraw/zinc/65/13/82/518651382.db2.gz SPDCCAOKOPDTNM-CTNGQTDRSA-N 2 2 367.449 2.809 20 5 FFBDLP C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCCN(c2cc[nH+]cc2)CC1 ZINC000602847994 519924158 /nfs/dbraw/zinc/92/41/58/519924158.db2.gz XCVOOHGKDIIILA-HNNXBMFYSA-N 2 2 369.425 2.529 20 5 FFBDLP C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCCN(c2cc[nH+]cc2)CC1 ZINC000602847994 519924166 /nfs/dbraw/zinc/92/41/66/519924166.db2.gz XCVOOHGKDIIILA-HNNXBMFYSA-N 2 2 369.425 2.529 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000595003044 520250493 /nfs/dbraw/zinc/25/04/93/520250493.db2.gz BMEQGJBVWQLXHP-QLFBSQMISA-N 2 2 351.447 2.753 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000595003044 520250500 /nfs/dbraw/zinc/25/05/00/520250500.db2.gz BMEQGJBVWQLXHP-QLFBSQMISA-N 2 2 351.447 2.753 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCC[N@@H+]1CCCO[C@H](C)C1 ZINC000595048853 520270356 /nfs/dbraw/zinc/27/03/56/520270356.db2.gz RQAZIEOAYOASLM-HUUCEWRRSA-N 2 2 351.447 2.755 20 5 FFBDLP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCC[N@H+]1CCCO[C@H](C)C1 ZINC000595048853 520270364 /nfs/dbraw/zinc/27/03/64/520270364.db2.gz RQAZIEOAYOASLM-HUUCEWRRSA-N 2 2 351.447 2.755 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@@H]([C@H]4CCC[NH2+]4)C3)n2)cc1 ZINC000592478411 520406595 /nfs/dbraw/zinc/40/65/95/520406595.db2.gz APRVUNOHHGYVIQ-GDBMZVCRSA-N 2 2 357.414 2.609 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@@H]([C@H]4CCC[NH2+]4)C3)n2)cc1 ZINC000592478411 520406605 /nfs/dbraw/zinc/40/66/05/520406605.db2.gz APRVUNOHHGYVIQ-GDBMZVCRSA-N 2 2 357.414 2.609 20 5 FFBDLP C[NH2+]Cc1ccccc1C[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000593320687 520907571 /nfs/dbraw/zinc/90/75/71/520907571.db2.gz DAKJLZFOTMNQOC-IBGZPJMESA-N 2 2 365.437 2.927 20 5 FFBDLP C[NH2+]Cc1ccccc1C[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000593320688 520907870 /nfs/dbraw/zinc/90/78/70/520907870.db2.gz DAKJLZFOTMNQOC-LJQANCHMSA-N 2 2 365.437 2.927 20 5 FFBDLP O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CCC[C@@H]([NH+]3CCCC3)CC1)OCCO2 ZINC000611273147 521072954 /nfs/dbraw/zinc/07/29/54/521072954.db2.gz HZPBSDRFEZACRC-MRXNPFEDSA-N 2 2 361.442 2.816 20 5 FFBDLP O=[N+]([O-])c1cc2c(cc1C[N@H+]1CCC[C@@H]([NH+]3CCCC3)CC1)OCCO2 ZINC000611273147 521072966 /nfs/dbraw/zinc/07/29/66/521072966.db2.gz HZPBSDRFEZACRC-MRXNPFEDSA-N 2 2 361.442 2.816 20 5 FFBDLP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3c(Br)cccc3[N+](=O)[O-])C[C@H]21 ZINC000843059945 747758017 /nfs/dbraw/zinc/75/80/17/747758017.db2.gz VRLGGQCEAAFMFE-MISXGVKJSA-N 2 2 354.248 2.917 20 5 FFBDLP [NH3+][C@@H]1CCC[C@H]2C[N@@H+](Cc3c(Br)cccc3[N+](=O)[O-])C[C@H]21 ZINC000843059945 747758027 /nfs/dbraw/zinc/75/80/27/747758027.db2.gz VRLGGQCEAAFMFE-MISXGVKJSA-N 2 2 354.248 2.917 20 5 FFBDLP CC[NH+](CC)CC1CC[NH+](Cn2c3cc([N+](=O)[O-])ccc3oc2=O)CC1 ZINC000738070547 999615761 /nfs/dbraw/zinc/61/57/61/999615761.db2.gz IPQJYCQGRMPCMC-UHFFFAOYSA-N 2 2 362.430 2.514 20 5 FFBDLP C[C@@H](c1ccncc1)[NH+]1CCC([NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000819184253 1008060997 /nfs/dbraw/zinc/06/09/97/1008060997.db2.gz XQSNWOZQPCEQNZ-YWZLYKJASA-N 2 2 370.453 2.838 20 5 FFBDLP CC[N@H+](CCn1cc[nH+]c1)[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173192152 1012335565 /nfs/dbraw/zinc/33/55/65/1012335565.db2.gz IXTZMXLWYSKHCJ-CYBMUJFWSA-N 2 2 350.394 2.892 20 5 FFBDLP CC[N@@H+](CCn1cc[nH+]c1)[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173192152 1012335574 /nfs/dbraw/zinc/33/55/74/1012335574.db2.gz IXTZMXLWYSKHCJ-CYBMUJFWSA-N 2 2 350.394 2.892 20 5 FFBDLP [NH3+]C[C@@]1(F)CCCC[N@@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001246580954 1039403548 /nfs/dbraw/zinc/40/35/48/1039403548.db2.gz ONNHHEDISNWTOC-SFHVURJKSA-N 2 2 350.438 2.717 20 5 FFBDLP [NH3+]C[C@@]1(F)CCCC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001246580954 1039403552 /nfs/dbraw/zinc/40/35/52/1039403552.db2.gz ONNHHEDISNWTOC-SFHVURJKSA-N 2 2 350.438 2.717 20 5 FFBDLP Cn1cc[nH+]c1C[C@@H]1CCC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC001342038237 1050634934 /nfs/dbraw/zinc/63/49/34/1050634934.db2.gz VDHMPWVIGQCOMJ-AWEZNQCLSA-N 2 2 372.425 2.554 20 5 FFBDLP Cn1cc[nH+]c1C[C@@H]1CCC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC001342038237 1050634942 /nfs/dbraw/zinc/63/49/42/1050634942.db2.gz VDHMPWVIGQCOMJ-AWEZNQCLSA-N 2 2 372.425 2.554 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[NH+]2CCC(c3c[nH+]cn3C)CC2)cccc1[N+](=O)[O-] ZINC001308167802 1052423182 /nfs/dbraw/zinc/42/31/82/1052423182.db2.gz JLUKXQKPMBQWCQ-AWEZNQCLSA-N 2 2 371.441 2.843 20 5 FFBDLP C[C@@H]1C[NH2+]C[C@H]1C[NH+]1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC001579455837 1078631617 /nfs/dbraw/zinc/63/16/17/1078631617.db2.gz TXFNSUMMPXAARG-OLZOCXBDSA-N 2 2 372.391 2.591 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)cccc1[N+](=O)[O-] ZINC000267398033 251345745 /nfs/dbraw/zinc/34/57/45/251345745.db2.gz FHHSJYSHPAQTLG-UONOGXRCSA-N 2 2 357.414 2.833 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)cccc1[N+](=O)[O-] ZINC000267398033 251345748 /nfs/dbraw/zinc/34/57/48/251345748.db2.gz FHHSJYSHPAQTLG-UONOGXRCSA-N 2 2 357.414 2.833 20 5 FFBDLP C[C@@H]1C[N@@H+](CC2CC[NH+](Cc3csc([N+](=O)[O-])c3)CC2)C[C@H](C)O1 ZINC000330427432 258163802 /nfs/dbraw/zinc/16/38/02/258163802.db2.gz KLCXZVCISANDLQ-OKILXGFUSA-N 2 2 353.488 2.978 20 5 FFBDLP C[C@@H]1C[N@H+](CC2CC[NH+](Cc3csc([N+](=O)[O-])c3)CC2)C[C@H](C)O1 ZINC000330427432 258163803 /nfs/dbraw/zinc/16/38/03/258163803.db2.gz KLCXZVCISANDLQ-OKILXGFUSA-N 2 2 353.488 2.978 20 5 FFBDLP Cn1cc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000092043074 508037066 /nfs/dbraw/zinc/03/70/66/508037066.db2.gz XPECEGDJMIGYJN-VQIMIIECSA-N 2 2 369.469 2.911 20 5 FFBDLP Cn1cc(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000092043074 508037069 /nfs/dbraw/zinc/03/70/69/508037069.db2.gz XPECEGDJMIGYJN-VQIMIIECSA-N 2 2 369.469 2.911 20 5 FFBDLP Cn1cc(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000092043074 508037070 /nfs/dbraw/zinc/03/70/70/508037070.db2.gz XPECEGDJMIGYJN-VQIMIIECSA-N 2 2 369.469 2.911 20 5 FFBDLP Cn1cc(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000092043074 508037073 /nfs/dbraw/zinc/03/70/73/508037073.db2.gz XPECEGDJMIGYJN-VQIMIIECSA-N 2 2 369.469 2.911 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000080960259 508118038 /nfs/dbraw/zinc/11/80/38/508118038.db2.gz KMNMWNZZBNVSGB-CQSZACIVSA-N 2 2 357.414 2.835 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000080960259 508118042 /nfs/dbraw/zinc/11/80/42/508118042.db2.gz KMNMWNZZBNVSGB-CQSZACIVSA-N 2 2 357.414 2.835 20 5 FFBDLP C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000156413477 508417219 /nfs/dbraw/zinc/41/72/19/508417219.db2.gz XTBUISOICGAPIQ-KEYYUXOJSA-N 2 2 357.414 2.701 20 5 FFBDLP C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](C)[C@@H](n2cc[nH+]c2)C1 ZINC000156413477 508417222 /nfs/dbraw/zinc/41/72/22/508417222.db2.gz XTBUISOICGAPIQ-KEYYUXOJSA-N 2 2 357.414 2.701 20 5 FFBDLP Cc1c(C[NH+]2CCN(CC[NH+]3[C@H](C)CC[C@H]3C)CC2)cccc1[N+](=O)[O-] ZINC000153920442 508677054 /nfs/dbraw/zinc/67/70/54/508677054.db2.gz XXDQTAZVUJBSKR-IAGOWNOFSA-N 2 2 360.502 2.894 20 5 FFBDLP C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000118841527 508683387 /nfs/dbraw/zinc/68/33/87/508683387.db2.gz PVZGBFMRTKXPRU-ZIAGYGMSSA-N 2 2 359.430 2.979 20 5 FFBDLP C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000118841527 508683389 /nfs/dbraw/zinc/68/33/89/508683389.db2.gz PVZGBFMRTKXPRU-ZIAGYGMSSA-N 2 2 359.430 2.979 20 5 FFBDLP C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+](C)C[C@@H]1CCC[N@H+](C)C1 ZINC000118841527 508683394 /nfs/dbraw/zinc/68/33/94/508683394.db2.gz PVZGBFMRTKXPRU-ZIAGYGMSSA-N 2 2 359.430 2.979 20 5 FFBDLP C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+](C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000118841527 508683398 /nfs/dbraw/zinc/68/33/98/508683398.db2.gz PVZGBFMRTKXPRU-ZIAGYGMSSA-N 2 2 359.430 2.979 20 5 FFBDLP Cc1cc(C(=O)NCC2([NH+]3CCCCC3)CC[NH+](C)CC2)cc([N+](=O)[O-])c1 ZINC000172749117 509210718 /nfs/dbraw/zinc/21/07/18/509210718.db2.gz PTXCCJZNLCTUJR-UHFFFAOYSA-N 2 2 374.485 2.583 20 5 FFBDLP C[N@@H+]1CCC[C@H]2C[NH+](Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)CC[C@H]21 ZINC000248163836 509251072 /nfs/dbraw/zinc/25/10/72/509251072.db2.gz SPPLINHUNNJSBU-GOEBONIOSA-N 2 2 357.414 2.561 20 5 FFBDLP C[N@H+]1CCC[C@H]2C[NH+](Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)CC[C@H]21 ZINC000248163836 509251079 /nfs/dbraw/zinc/25/10/79/509251079.db2.gz SPPLINHUNNJSBU-GOEBONIOSA-N 2 2 357.414 2.561 20 5 FFBDLP C[NH+]1CCC[C@H]2C[N@H+](Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)CC[C@H]21 ZINC000248163836 509251085 /nfs/dbraw/zinc/25/10/85/509251085.db2.gz SPPLINHUNNJSBU-GOEBONIOSA-N 2 2 357.414 2.561 20 5 FFBDLP C[NH+]1CCC[C@H]2C[N@@H+](Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)CC[C@H]21 ZINC000248163836 509251091 /nfs/dbraw/zinc/25/10/91/509251091.db2.gz SPPLINHUNNJSBU-GOEBONIOSA-N 2 2 357.414 2.561 20 5 FFBDLP COc1cc[nH+]c(N2CC[NH+](C/C=C\c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000255474677 509925372 /nfs/dbraw/zinc/92/53/72/509925372.db2.gz MEZGZCQXSBCJCK-XQRVVYSFSA-N 2 2 354.410 2.834 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261634039 510008719 /nfs/dbraw/zinc/00/87/19/510008719.db2.gz FCILXLGQGXERAA-OGWOLHLISA-N 2 2 368.437 2.596 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261634039 510008726 /nfs/dbraw/zinc/00/87/26/510008726.db2.gz FCILXLGQGXERAA-OGWOLHLISA-N 2 2 368.437 2.596 20 5 FFBDLP C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000265443712 510056951 /nfs/dbraw/zinc/05/69/51/510056951.db2.gz AGUFLYAOXWNGMB-STQMWFEESA-N 2 2 368.865 2.849 20 5 FFBDLP C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)C[C@H]1CCC[NH+](C)C1 ZINC000265443712 510056959 /nfs/dbraw/zinc/05/69/59/510056959.db2.gz AGUFLYAOXWNGMB-STQMWFEESA-N 2 2 368.865 2.849 20 5 FFBDLP C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[NH+](C)C[C@H]1CCC[N@H+](C)C1 ZINC000265443712 510056965 /nfs/dbraw/zinc/05/69/65/510056965.db2.gz AGUFLYAOXWNGMB-STQMWFEESA-N 2 2 368.865 2.849 20 5 FFBDLP C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[NH+](C)C[C@H]1CCC[N@@H+](C)C1 ZINC000265443712 510056977 /nfs/dbraw/zinc/05/69/77/510056977.db2.gz AGUFLYAOXWNGMB-STQMWFEESA-N 2 2 368.865 2.849 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000171388708 510124864 /nfs/dbraw/zinc/12/48/64/510124864.db2.gz VWXUJYAWNDIWQS-UHFFFAOYSA-N 2 2 360.458 2.650 20 5 FFBDLP CC(C)[NH+]1CCC([NH+]2CCN(c3cccc(F)c3[N+](=O)[O-])CC2)CC1 ZINC000269327529 510343716 /nfs/dbraw/zinc/34/37/16/510343716.db2.gz LIDVPHHWIJRZCR-UHFFFAOYSA-N 2 2 350.438 2.729 20 5 FFBDLP C[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000364725633 511045049 /nfs/dbraw/zinc/04/50/49/511045049.db2.gz ZXXYXNBCELMKJM-KSSFIOAISA-N 2 2 366.893 2.706 20 5 FFBDLP C[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000364725633 511045055 /nfs/dbraw/zinc/04/50/55/511045055.db2.gz ZXXYXNBCELMKJM-KSSFIOAISA-N 2 2 366.893 2.706 20 5 FFBDLP C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000364725632 511045155 /nfs/dbraw/zinc/04/51/55/511045155.db2.gz ZXXYXNBCELMKJM-KDOFPFPSSA-N 2 2 366.893 2.706 20 5 FFBDLP C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000364725632 511045159 /nfs/dbraw/zinc/04/51/59/511045159.db2.gz ZXXYXNBCELMKJM-KDOFPFPSSA-N 2 2 366.893 2.706 20 5 FFBDLP Cn1cc[nH+]c1[C@@H]1CCC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000365628516 511568491 /nfs/dbraw/zinc/56/84/91/511568491.db2.gz LKZPYLNTMMMHGK-CQSZACIVSA-N 2 2 368.397 2.758 20 5 FFBDLP Cn1cc[nH+]c1[C@@H]1CCC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000365628516 511568493 /nfs/dbraw/zinc/56/84/93/511568493.db2.gz LKZPYLNTMMMHGK-CQSZACIVSA-N 2 2 368.397 2.758 20 5 FFBDLP Cn1cc[nH+]c1[C@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000365627904 511568998 /nfs/dbraw/zinc/56/89/98/511568998.db2.gz KQGFYKQEWLSXPW-AWEZNQCLSA-N 2 2 357.414 2.537 20 5 FFBDLP C[C@@H](Nc1ccc(N2CC[C@H]([NH+](C)C)C2)c[nH+]1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000284985852 511957562 /nfs/dbraw/zinc/95/75/62/511957562.db2.gz GHDVTXUSDOLILN-CJNGLKHVSA-N 2 2 370.457 2.885 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@@H+]2Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000374423169 512826206 /nfs/dbraw/zinc/82/62/06/512826206.db2.gz VFKLPNBCIIMKJM-UKPHBRMFSA-N 2 2 353.850 2.932 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@H]2[C@@H](C1)OCC[N@H+]2Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000374423169 512826208 /nfs/dbraw/zinc/82/62/08/512826208.db2.gz VFKLPNBCIIMKJM-UKPHBRMFSA-N 2 2 353.850 2.932 20 5 FFBDLP C[C@H]1C[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC[C@@H]1N1CC[NH+](C)CC1 ZINC000376636961 512912232 /nfs/dbraw/zinc/91/22/32/512912232.db2.gz NCJFKCGVOAYZBC-YOEHRIQHSA-N 2 2 366.893 2.706 20 5 FFBDLP C[C@H]1C[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC[C@@H]1N1CC[NH+](C)CC1 ZINC000376636961 512912234 /nfs/dbraw/zinc/91/22/34/512912234.db2.gz NCJFKCGVOAYZBC-YOEHRIQHSA-N 2 2 366.893 2.706 20 5 FFBDLP Cn1cc(C[NH2+]Cc2c[nH+]c3n2CCCC3)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000376716833 512955401 /nfs/dbraw/zinc/95/54/01/512955401.db2.gz OZANMBKEACOWSB-UHFFFAOYSA-N 2 2 366.425 2.818 20 5 FFBDLP C[C@@H](C1CC[NH+](C)CC1)N(C)C(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000450487109 513216645 /nfs/dbraw/zinc/21/66/45/513216645.db2.gz UGYFAKVEBWKTGP-AWEZNQCLSA-N 2 2 371.441 2.583 20 5 FFBDLP Cc1cc(NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000450832795 513359910 /nfs/dbraw/zinc/35/99/10/513359910.db2.gz WVCKJFDMXCPNBO-ZXFUBFMLSA-N 2 2 353.426 2.819 20 5 FFBDLP Cc1cc(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000450832795 513359919 /nfs/dbraw/zinc/35/99/19/513359919.db2.gz WVCKJFDMXCPNBO-ZXFUBFMLSA-N 2 2 353.426 2.819 20 5 FFBDLP CCC[NH+]1CCC(Nc2cc(C[NH+]3CCOCC3)ccc2[N+](=O)[O-])CC1 ZINC000447804064 513575965 /nfs/dbraw/zinc/57/59/65/513575965.db2.gz VZZHINOVDFNPJF-UHFFFAOYSA-N 2 2 362.474 2.713 20 5 FFBDLP Cc1c(NC(=O)[C@@H](C)[NH2+]C2CC[NH+](C3CCC3)CC2)cccc1[N+](=O)[O-] ZINC000419296552 513766319 /nfs/dbraw/zinc/76/63/19/513766319.db2.gz RZQLQRRLYWJGJZ-CQSZACIVSA-N 2 2 360.458 2.837 20 5 FFBDLP C[C@@H](C[N@@H+]1CCC[C@@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000448780391 513894751 /nfs/dbraw/zinc/89/47/51/513894751.db2.gz JTEABVRVSHWLKH-CABCVRRESA-N 2 2 371.441 2.631 20 5 FFBDLP C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000448780391 513894754 /nfs/dbraw/zinc/89/47/54/513894754.db2.gz JTEABVRVSHWLKH-CABCVRRESA-N 2 2 371.441 2.631 20 5 FFBDLP C[C@@H](C[N@@H+]1CCC[C@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000448780392 513894871 /nfs/dbraw/zinc/89/48/71/513894871.db2.gz JTEABVRVSHWLKH-GJZGRUSLSA-N 2 2 371.441 2.631 20 5 FFBDLP C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000448780392 513894876 /nfs/dbraw/zinc/89/48/76/513894876.db2.gz JTEABVRVSHWLKH-GJZGRUSLSA-N 2 2 371.441 2.631 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCCC[C@@H]3[C@@H]3CC[NH2+]C3)n2)cc1 ZINC000420390997 514126224 /nfs/dbraw/zinc/12/62/24/514126224.db2.gz IFMFNOSGOWPUJT-GDBMZVCRSA-N 2 2 357.414 2.609 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCCC[C@@H]3[C@@H]3CC[NH2+]C3)n2)cc1 ZINC000420390997 514126232 /nfs/dbraw/zinc/12/62/32/514126232.db2.gz IFMFNOSGOWPUJT-GDBMZVCRSA-N 2 2 357.414 2.609 20 5 FFBDLP Cn1cc[nH+]c1CC1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000444621010 514275746 /nfs/dbraw/zinc/27/57/46/514275746.db2.gz ATAMDKIKYUDLFC-UHFFFAOYSA-N 2 2 354.414 2.659 20 5 FFBDLP C[C@@H]([NH2+]C[C@@]1(O)CC[N@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000467849782 515145925 /nfs/dbraw/zinc/14/59/25/515145925.db2.gz IRKZSXCAQWFDJD-UZLBHIALSA-N 2 2 355.438 2.882 20 5 FFBDLP C[C@@H]([NH2+]C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000467849782 515145937 /nfs/dbraw/zinc/14/59/37/515145937.db2.gz IRKZSXCAQWFDJD-UZLBHIALSA-N 2 2 355.438 2.882 20 5 FFBDLP C[N@H+](CCN1CC[NH+](Cc2ccccc2)CC1)Cc1cccc([N+](=O)[O-])c1 ZINC000511799989 516036407 /nfs/dbraw/zinc/03/64/07/516036407.db2.gz RWIBMSWMJLTWBV-UHFFFAOYSA-N 2 2 368.481 2.844 20 5 FFBDLP C[N@@H+](CCN1CC[NH+](Cc2ccccc2)CC1)Cc1cccc([N+](=O)[O-])c1 ZINC000511799989 516036412 /nfs/dbraw/zinc/03/64/12/516036412.db2.gz RWIBMSWMJLTWBV-UHFFFAOYSA-N 2 2 368.481 2.844 20 5 FFBDLP O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@@H](O)C[N@@H+]1CCc2ccccc2C1 ZINC000549907964 517772520 /nfs/dbraw/zinc/77/25/20/517772520.db2.gz SSWLKEYAWBEIRJ-FMSOUQGNSA-N 2 2 367.449 2.617 20 5 FFBDLP O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000549907964 517772526 /nfs/dbraw/zinc/77/25/26/517772526.db2.gz SSWLKEYAWBEIRJ-FMSOUQGNSA-N 2 2 367.449 2.617 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@]1(O)CC[N@H+](Cc2ccccc2)C1 ZINC000543613949 518153524 /nfs/dbraw/zinc/15/35/24/518153524.db2.gz QMIUNWVHGRPHPX-HXUWFJFHSA-N 2 2 355.438 2.630 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000543613949 518153530 /nfs/dbraw/zinc/15/35/30/518153530.db2.gz QMIUNWVHGRPHPX-HXUWFJFHSA-N 2 2 355.438 2.630 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCc2ccccc2[C@@H]1C[NH3+] ZINC000572483593 518213723 /nfs/dbraw/zinc/21/37/23/518213723.db2.gz GXOFOIARYDCOIW-IBGZPJMESA-N 2 2 368.437 2.790 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCc2ccccc2[C@@H]1C[NH3+] ZINC000572483593 518213726 /nfs/dbraw/zinc/21/37/26/518213726.db2.gz GXOFOIARYDCOIW-IBGZPJMESA-N 2 2 368.437 2.790 20 5 FFBDLP C[N@@H+]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)[C@@H](C[NH3+])C1 ZINC000578443103 518214006 /nfs/dbraw/zinc/21/40/06/518214006.db2.gz VVABVQUQFDGWNO-ZDUSSCGKSA-N 2 2 364.833 2.583 20 5 FFBDLP C[N@H+]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)[C@@H](C[NH3+])C1 ZINC000578443103 518214010 /nfs/dbraw/zinc/21/40/10/518214010.db2.gz VVABVQUQFDGWNO-ZDUSSCGKSA-N 2 2 364.833 2.583 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c1 ZINC000589503016 519020724 /nfs/dbraw/zinc/02/07/24/519020724.db2.gz KBQXXXDKKISPMK-HNNXBMFYSA-N 2 2 361.442 2.689 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c1 ZINC000589503016 519020729 /nfs/dbraw/zinc/02/07/29/519020729.db2.gz KBQXXXDKKISPMK-HNNXBMFYSA-N 2 2 361.442 2.689 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCc2ccccc2[C@H]1C[NH3+] ZINC000569246110 519452916 /nfs/dbraw/zinc/45/29/16/519452916.db2.gz UUXHTTQCNSRXCB-LJQANCHMSA-N 2 2 368.437 2.790 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCc2ccccc2[C@H]1C[NH3+] ZINC000569246110 519452922 /nfs/dbraw/zinc/45/29/22/519452922.db2.gz UUXHTTQCNSRXCB-LJQANCHMSA-N 2 2 368.437 2.790 20 5 FFBDLP C[NH+]1CCC2(CC[N@H+](CC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)C2)CC1 ZINC000602876603 519941264 /nfs/dbraw/zinc/94/12/64/519941264.db2.gz HBHZWDCYNGXKEJ-UHFFFAOYSA-N 2 2 366.849 2.604 20 5 FFBDLP C[NH+]1CCC2(CC[N@@H+](CC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)C2)CC1 ZINC000602876603 519941269 /nfs/dbraw/zinc/94/12/69/519941269.db2.gz HBHZWDCYNGXKEJ-UHFFFAOYSA-N 2 2 366.849 2.604 20 5 FFBDLP Cc1cccn2cc(CC[NH2+]CCC(=O)Nc3ccccc3[N+](=O)[O-])[nH+]c12 ZINC000591748265 520021052 /nfs/dbraw/zinc/02/10/52/520021052.db2.gz FUAIAYNCWMKATE-UHFFFAOYSA-N 2 2 367.409 2.712 20 5 FFBDLP C[N@@H+]1CCN(Cc2ccccc2)[C@H](C[NH2+]Cc2cccc([N+](=O)[O-])c2)C1 ZINC000594995028 520248331 /nfs/dbraw/zinc/24/83/31/520248331.db2.gz NBKVUGYDWYGVDZ-HXUWFJFHSA-N 2 2 354.454 2.501 20 5 FFBDLP C[N@H+]1CCN(Cc2ccccc2)[C@H](C[NH2+]Cc2cccc([N+](=O)[O-])c2)C1 ZINC000594995028 520248340 /nfs/dbraw/zinc/24/83/40/520248340.db2.gz NBKVUGYDWYGVDZ-HXUWFJFHSA-N 2 2 354.454 2.501 20 5 FFBDLP C[NH+]1CCC2(CC1)C[N@H+](Cc1coc(-c3ccc([N+](=O)[O-])cc3)n1)CCO2 ZINC000592183818 520250035 /nfs/dbraw/zinc/25/00/35/520250035.db2.gz BVNLLPNUBHQWQH-UHFFFAOYSA-N 2 2 372.425 2.546 20 5 FFBDLP C[NH+]1CCC2(CC1)C[N@@H+](Cc1coc(-c3ccc([N+](=O)[O-])cc3)n1)CCO2 ZINC000592183818 520250039 /nfs/dbraw/zinc/25/00/39/520250039.db2.gz BVNLLPNUBHQWQH-UHFFFAOYSA-N 2 2 372.425 2.546 20 5 FFBDLP Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@@H+]2CC[C@H](C[NH3+])C2)c([N+](=O)[O-])c1 ZINC000592471487 520404125 /nfs/dbraw/zinc/40/41/25/520404125.db2.gz MCKOUYMGZWODON-BEFAXECRSA-N 2 2 368.437 2.864 20 5 FFBDLP Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@H+]2CC[C@H](C[NH3+])C2)c([N+](=O)[O-])c1 ZINC000592471487 520404131 /nfs/dbraw/zinc/40/41/31/520404131.db2.gz MCKOUYMGZWODON-BEFAXECRSA-N 2 2 368.437 2.864 20 5 FFBDLP CC(C)c1ccc(C[NH+]2CCN([C@H]3CCC[N@H+](C)C3)CC2)cc1[N+](=O)[O-] ZINC000611270999 521071532 /nfs/dbraw/zinc/07/15/32/521071532.db2.gz YYBHFCAGPFLOJH-SFHVURJKSA-N 2 2 360.502 2.930 20 5 FFBDLP CC(C)c1ccc(C[NH+]2CCN([C@H]3CCC[N@@H+](C)C3)CC2)cc1[N+](=O)[O-] ZINC000611270999 521071540 /nfs/dbraw/zinc/07/15/40/521071540.db2.gz YYBHFCAGPFLOJH-SFHVURJKSA-N 2 2 360.502 2.930 20 5 FFBDLP C[C@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@H]1CC[NH3+] ZINC000593735706 521181915 /nfs/dbraw/zinc/18/19/15/521181915.db2.gz ZHELPGDCRUUCHJ-FZMZJTMJSA-N 2 2 354.838 2.636 20 5 FFBDLP C[C@H]1CCC[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@H]1CC[NH3+] ZINC000593735706 521181924 /nfs/dbraw/zinc/18/19/24/521181924.db2.gz ZHELPGDCRUUCHJ-FZMZJTMJSA-N 2 2 354.838 2.636 20 5 FFBDLP CC[C@H]1CCCC[N@@H+]1CC[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602549353 521405395 /nfs/dbraw/zinc/40/53/95/521405395.db2.gz UNKBMIQHILCHNK-KRWDZBQOSA-N 2 2 361.490 2.813 20 5 FFBDLP CC[C@H]1CCCC[N@H+]1CC[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602549353 521405399 /nfs/dbraw/zinc/40/53/99/521405399.db2.gz UNKBMIQHILCHNK-KRWDZBQOSA-N 2 2 361.490 2.813 20 5 FFBDLP CCC[N@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C1CC[NH2+]CC1 ZINC000843360632 747817758 /nfs/dbraw/zinc/81/77/58/747817758.db2.gz DVPOMINUQSANPC-UHFFFAOYSA-N 2 2 354.838 2.651 20 5 FFBDLP CCC[N@@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C1CC[NH2+]CC1 ZINC000843360632 747817767 /nfs/dbraw/zinc/81/77/67/747817767.db2.gz DVPOMINUQSANPC-UHFFFAOYSA-N 2 2 354.838 2.651 20 5 FFBDLP Cc1nn(C[N@H+]2CC[C@H](C)[C@@H](n3cc[nH+]c3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000765084592 984956407 /nfs/dbraw/zinc/95/64/07/984956407.db2.gz WEDJSFZCPNKNSV-UGSOOPFHSA-N 2 2 354.414 2.990 20 5 FFBDLP Cc1nn(C[N@@H+]2CC[C@H](C)[C@@H](n3cc[nH+]c3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000765084592 984956412 /nfs/dbraw/zinc/95/64/12/984956412.db2.gz WEDJSFZCPNKNSV-UGSOOPFHSA-N 2 2 354.414 2.990 20 5 FFBDLP Cc1c(NC(=O)CC[NH+]2C[C@@]3(C)C[N@@H+](C)C[C@@]3(C)C2)cccc1[N+](=O)[O-] ZINC000823755628 999074366 /nfs/dbraw/zinc/07/43/66/999074366.db2.gz UZBUEFWPCLERTO-KDURUIRLSA-N 2 2 360.458 2.505 20 5 FFBDLP Cc1c(NC(=O)CC[NH+]2C[C@@]3(C)C[N@H+](C)C[C@@]3(C)C2)cccc1[N+](=O)[O-] ZINC000823755628 999074369 /nfs/dbraw/zinc/07/43/69/999074369.db2.gz UZBUEFWPCLERTO-KDURUIRLSA-N 2 2 360.458 2.505 20 5 FFBDLP Cc1c(NC(=O)CC[N@H+]2C[C@@]3(C)C[NH+](C)C[C@@]3(C)C2)cccc1[N+](=O)[O-] ZINC000823755628 999074374 /nfs/dbraw/zinc/07/43/74/999074374.db2.gz UZBUEFWPCLERTO-KDURUIRLSA-N 2 2 360.458 2.505 20 5 FFBDLP Cc1c(NC(=O)CC[N@@H+]2C[C@@]3(C)C[NH+](C)C[C@@]3(C)C2)cccc1[N+](=O)[O-] ZINC000823755628 999074380 /nfs/dbraw/zinc/07/43/80/999074380.db2.gz UZBUEFWPCLERTO-KDURUIRLSA-N 2 2 360.458 2.505 20 5 FFBDLP [NH3+][C@@H](CO)Cc1c[nH+]cn1-c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC001169074497 1000020047 /nfs/dbraw/zinc/02/00/47/1000020047.db2.gz PSPOZBNJHHJGHB-CYBMUJFWSA-N 2 2 370.434 2.794 20 5 FFBDLP O=[N+]([O-])c1ccc2nc(Cl)nc(-n3c[nH+]cc3C3CC[NH2+]CC3)c2c1 ZINC001155053946 1028559909 /nfs/dbraw/zinc/55/99/09/1028559909.db2.gz TXKYEQSBSOXICM-UHFFFAOYSA-N 2 2 358.789 2.844 20 5 FFBDLP [NH3+][C@H]1CC[N@@H+](C2CCN(c3ccc([N+](=O)[O-])c(-c4ccccc4)n3)CC2)C1 ZINC001158268113 1029780075 /nfs/dbraw/zinc/78/00/75/1029780075.db2.gz ZIHWRHMYTPXEAO-INIZCTEOSA-N 2 2 367.453 2.659 20 5 FFBDLP [NH3+][C@H]1CC[N@H+](C2CCN(c3ccc([N+](=O)[O-])c(-c4ccccc4)n3)CC2)C1 ZINC001158268113 1029780082 /nfs/dbraw/zinc/78/00/82/1029780082.db2.gz ZIHWRHMYTPXEAO-INIZCTEOSA-N 2 2 367.453 2.659 20 5 FFBDLP O=C(CC[N@@H+]1CCCC[C@H]1[C@H]1CCC[NH2+]1)Nc1cc([N+](=O)[O-])ccc1F ZINC000842473128 1030748082 /nfs/dbraw/zinc/74/80/82/1030748082.db2.gz PSORPNPXYLGNQQ-WBVHZDCISA-N 2 2 364.421 2.669 20 5 FFBDLP O=C(CC[N@H+]1CCCC[C@H]1[C@H]1CCC[NH2+]1)Nc1cc([N+](=O)[O-])ccc1F ZINC000842473128 1030748096 /nfs/dbraw/zinc/74/80/96/1030748096.db2.gz PSORPNPXYLGNQQ-WBVHZDCISA-N 2 2 364.421 2.669 20 5 FFBDLP Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)[C@H]([NH3+])CCC[NH3+] ZINC001219207929 1033556682 /nfs/dbraw/zinc/55/66/82/1033556682.db2.gz OKLUJVDCYUWXMG-QGZVFWFLSA-N 3 2 365.481 2.767 20 5 FFBDLP COc1cc(N2CCC([NH2+][C@H]3CC[N@@H+](C4CCC4)C3)CC2)ccc1[N+](=O)[O-] ZINC001256088047 1038373201 /nfs/dbraw/zinc/37/32/01/1038373201.db2.gz BIWWARXESOMHHW-INIZCTEOSA-N 2 2 374.485 2.789 20 5 FFBDLP COc1cc(N2CCC([NH2+][C@H]3CC[N@H+](C4CCC4)C3)CC2)ccc1[N+](=O)[O-] ZINC001256088047 1038373213 /nfs/dbraw/zinc/37/32/13/1038373213.db2.gz BIWWARXESOMHHW-INIZCTEOSA-N 2 2 374.485 2.789 20 5 FFBDLP C[C@H](COC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)[NH+]1CCCCC1 ZINC000847962410 1058525424 /nfs/dbraw/zinc/52/54/24/1058525424.db2.gz GDPVERWLISTBQU-CQSZACIVSA-N 2 2 358.398 2.812 20 5 FFBDLP C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848483145 1060121167 /nfs/dbraw/zinc/12/11/67/1060121167.db2.gz YUPQNXYUUYPKQJ-QAPCUYQASA-N 2 2 355.442 2.832 20 5 FFBDLP C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848483145 1060121173 /nfs/dbraw/zinc/12/11/73/1060121173.db2.gz YUPQNXYUUYPKQJ-QAPCUYQASA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848483145 1060121176 /nfs/dbraw/zinc/12/11/76/1060121176.db2.gz YUPQNXYUUYPKQJ-QAPCUYQASA-N 2 2 355.442 2.832 20 5 FFBDLP C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848483145 1060121186 /nfs/dbraw/zinc/12/11/86/1060121186.db2.gz YUPQNXYUUYPKQJ-QAPCUYQASA-N 2 2 355.442 2.832 20 5 FFBDLP CC[NH+](CC)CC[C@H](C)NC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC001522858252 1062311170 /nfs/dbraw/zinc/31/11/70/1062311170.db2.gz QNQOGUYGCFDRNA-AWEZNQCLSA-N 2 2 359.430 2.631 20 5 FFBDLP CN(C)C(=O)[C@@H]1CCC[N@@H+]1CCC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000278160385 256283351 /nfs/dbraw/zinc/28/33/51/256283351.db2.gz AVIXKCMPLYYDDY-OALUTQOASA-N 2 2 374.485 2.505 20 5 FFBDLP CN(C)C(=O)[C@@H]1CCC[N@H+]1CCC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000278160385 256283353 /nfs/dbraw/zinc/28/33/53/256283353.db2.gz AVIXKCMPLYYDDY-OALUTQOASA-N 2 2 374.485 2.505 20 5 FFBDLP CCOC(=O)C[N@@H+]1CCCN(c2cc(C)[nH+]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000302179418 258093310 /nfs/dbraw/zinc/09/33/10/258093310.db2.gz NOPSBQMKTXAGBE-UHFFFAOYSA-N 2 2 372.425 2.527 20 5 FFBDLP CCOC(=O)C[N@H+]1CCCN(c2cc(C)[nH+]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000302179418 258093311 /nfs/dbraw/zinc/09/33/11/258093311.db2.gz NOPSBQMKTXAGBE-UHFFFAOYSA-N 2 2 372.425 2.527 20 5 FFBDLP C[C@H]1CCCC[N@@H+]1CCCNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000052842946 506261669 /nfs/dbraw/zinc/26/16/69/506261669.db2.gz KWHPXEZZFFAJTD-HNNXBMFYSA-N 2 2 371.441 2.775 20 5 FFBDLP C[C@H]1CCCC[N@H+]1CCCNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000052842946 506261675 /nfs/dbraw/zinc/26/16/75/506261675.db2.gz KWHPXEZZFFAJTD-HNNXBMFYSA-N 2 2 371.441 2.775 20 5 FFBDLP O=C1[C@H]([N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000157436647 508566383 /nfs/dbraw/zinc/56/63/83/508566383.db2.gz VCFASGCALNDLNG-QFBILLFUSA-N 2 2 372.469 2.650 20 5 FFBDLP O=C1[C@H]([N@H+]2CCC[C@H]([NH+]3CCCC3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000157436647 508566386 /nfs/dbraw/zinc/56/63/86/508566386.db2.gz VCFASGCALNDLNG-QFBILLFUSA-N 2 2 372.469 2.650 20 5 FFBDLP C[N@@H+]1CCC[C@@H]2C[NH+](CC(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)CC[C@@H]21 ZINC000139940133 508798253 /nfs/dbraw/zinc/79/82/53/508798253.db2.gz NAMXVAZLCAUTKH-DOMZBBRYSA-N 2 2 366.849 2.603 20 5 FFBDLP C[N@H+]1CCC[C@@H]2C[NH+](CC(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)CC[C@@H]21 ZINC000139940133 508798256 /nfs/dbraw/zinc/79/82/56/508798256.db2.gz NAMXVAZLCAUTKH-DOMZBBRYSA-N 2 2 366.849 2.603 20 5 FFBDLP C[NH+]1CCC[C@@H]2C[N@H+](CC(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)CC[C@@H]21 ZINC000139940133 508798259 /nfs/dbraw/zinc/79/82/59/508798259.db2.gz NAMXVAZLCAUTKH-DOMZBBRYSA-N 2 2 366.849 2.603 20 5 FFBDLP C[NH+]1CCC[C@@H]2C[N@@H+](CC(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)CC[C@@H]21 ZINC000139940133 508798263 /nfs/dbraw/zinc/79/82/63/508798263.db2.gz NAMXVAZLCAUTKH-DOMZBBRYSA-N 2 2 366.849 2.603 20 5 FFBDLP C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)CCCn1cc[nH+]c1 ZINC000124359658 508820343 /nfs/dbraw/zinc/82/03/43/508820343.db2.gz YWKIIQYESOWNAC-ZDUSSCGKSA-N 2 2 356.386 2.924 20 5 FFBDLP C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)CCCn1cc[nH+]c1 ZINC000124359658 508820346 /nfs/dbraw/zinc/82/03/46/508820346.db2.gz YWKIIQYESOWNAC-ZDUSSCGKSA-N 2 2 356.386 2.924 20 5 FFBDLP Cc1ccc([N+](=O)[O-])c(C(=O)NCC2([NH+]3CCCCC3)CC[NH+](C)CC2)c1 ZINC000172748847 509210464 /nfs/dbraw/zinc/21/04/64/509210464.db2.gz JLEVSYDJWFKUGQ-UHFFFAOYSA-N 2 2 374.485 2.583 20 5 FFBDLP Cc1cc[nH+]c(N2CC[NH+](CCCOc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000166089445 509593127 /nfs/dbraw/zinc/59/31/27/509593127.db2.gz TUHVEKTYEXOGAL-UHFFFAOYSA-N 2 2 356.426 2.889 20 5 FFBDLP Cc1ccc(C[N@@H+](C)C[C@@]2(O)CC[NH+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000190315010 510059425 /nfs/dbraw/zinc/05/94/25/510059425.db2.gz NVNMLFOJDSPQFH-NRFANRHFSA-N 2 2 369.465 2.972 20 5 FFBDLP Cc1ccc(C[N@H+](C)C[C@@]2(O)CC[NH+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000190315010 510059434 /nfs/dbraw/zinc/05/94/34/510059434.db2.gz NVNMLFOJDSPQFH-NRFANRHFSA-N 2 2 369.465 2.972 20 5 FFBDLP Cc1ccc(C[NH+](C)C[C@@]2(O)CC[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000190315010 510059439 /nfs/dbraw/zinc/05/94/39/510059439.db2.gz NVNMLFOJDSPQFH-NRFANRHFSA-N 2 2 369.465 2.972 20 5 FFBDLP Cc1ccc(C[NH+](C)C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000190315010 510059448 /nfs/dbraw/zinc/05/94/48/510059448.db2.gz NVNMLFOJDSPQFH-NRFANRHFSA-N 2 2 369.465 2.972 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261814840 510075569 /nfs/dbraw/zinc/07/55/69/510075569.db2.gz RUWRVMIHQOHPIG-AEFFLSMTSA-N 2 2 368.437 2.516 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000261814840 510075576 /nfs/dbraw/zinc/07/55/76/510075576.db2.gz RUWRVMIHQOHPIG-AEFFLSMTSA-N 2 2 368.437 2.516 20 5 FFBDLP COc1cc(C[N@@H+]2CCC[C@H](Cc3[nH+]ccn3C)C2)c([N+](=O)[O-])cc1F ZINC000184289098 510242383 /nfs/dbraw/zinc/24/23/83/510242383.db2.gz NJANADIQNMNMSX-CYBMUJFWSA-N 2 2 362.405 2.931 20 5 FFBDLP COc1cc(C[N@H+]2CCC[C@H](Cc3[nH+]ccn3C)C2)c([N+](=O)[O-])cc1F ZINC000184289098 510242389 /nfs/dbraw/zinc/24/23/89/510242389.db2.gz NJANADIQNMNMSX-CYBMUJFWSA-N 2 2 362.405 2.931 20 5 FFBDLP CC(C)C[N@@H+]1CCO[C@H](C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000178328434 510548851 /nfs/dbraw/zinc/54/88/51/510548851.db2.gz RNYAJKLQHSFFLD-MOPGFXCFSA-N 2 2 361.486 2.862 20 5 FFBDLP CC(C)C[N@H+]1CCO[C@H](C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000178328434 510548860 /nfs/dbraw/zinc/54/88/60/510548860.db2.gz RNYAJKLQHSFFLD-MOPGFXCFSA-N 2 2 361.486 2.862 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000246944444 510761969 /nfs/dbraw/zinc/76/19/69/510761969.db2.gz CBMLPFOHMIGJCE-CKEIUWERSA-N 2 2 357.414 2.701 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000246944444 510761975 /nfs/dbraw/zinc/76/19/75/510761975.db2.gz CBMLPFOHMIGJCE-CKEIUWERSA-N 2 2 357.414 2.701 20 5 FFBDLP C[C@@H](CCNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)[NH+]1CCCCC1 ZINC000182237613 510828769 /nfs/dbraw/zinc/82/87/69/510828769.db2.gz UVXUYVQZDPKFSO-HNNXBMFYSA-N 2 2 371.441 2.775 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[NH+]3CCC(c4c[nH]c[nH+]4)CC3)n2)c1 ZINC000374197802 512704175 /nfs/dbraw/zinc/70/41/75/512704175.db2.gz FQAMCLMOIYVXTI-UHFFFAOYSA-N 2 2 354.370 2.748 20 5 FFBDLP C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@@H]1CCCC[N@@H+]1C1CC1 ZINC000446976934 513373767 /nfs/dbraw/zinc/37/37/67/513373767.db2.gz ZEDUSGDRFVWYLG-KSSFIOAISA-N 2 2 360.458 2.918 20 5 FFBDLP C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@@H]1CCCC[N@H+]1C1CC1 ZINC000446976934 513373774 /nfs/dbraw/zinc/37/37/74/513373774.db2.gz ZEDUSGDRFVWYLG-KSSFIOAISA-N 2 2 360.458 2.918 20 5 FFBDLP C[N@@H+]1CCCC(C)(C)[C@H]1CNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000451298221 513660590 /nfs/dbraw/zinc/66/05/90/513660590.db2.gz VSHXRUJEBKWYDO-QGZVFWFLSA-N 2 2 371.441 2.631 20 5 FFBDLP C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000451298221 513660598 /nfs/dbraw/zinc/66/05/98/513660598.db2.gz VSHXRUJEBKWYDO-QGZVFWFLSA-N 2 2 371.441 2.631 20 5 FFBDLP CC(C)[NH+](CCNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)C(C)C ZINC000448604834 513804790 /nfs/dbraw/zinc/80/47/90/513804790.db2.gz JPHRDKQUTNPMDB-UHFFFAOYSA-N 2 2 359.430 2.629 20 5 FFBDLP O=[N+]([O-])c1ccn(C2CC[NH+](Cc3cc(-n4cc[nH+]c4)cs3)CC2)n1 ZINC000426005737 513824542 /nfs/dbraw/zinc/82/45/42/513824542.db2.gz YMWROWDMKAGFOA-UHFFFAOYSA-N 2 2 358.427 2.876 20 5 FFBDLP CC[N@@H+]1CC[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)C[C@@H]1C ZINC000449971135 514447831 /nfs/dbraw/zinc/44/78/31/514447831.db2.gz JSYSWFMKGGLGER-GOEBONIOSA-N 2 2 371.441 2.725 20 5 FFBDLP CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)C[C@@H]1C ZINC000449971135 514447836 /nfs/dbraw/zinc/44/78/36/514447836.db2.gz JSYSWFMKGGLGER-GOEBONIOSA-N 2 2 371.441 2.725 20 5 FFBDLP CCC[N@H+](C)C[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)C1 ZINC000449986022 514453728 /nfs/dbraw/zinc/45/37/28/514453728.db2.gz FVZPVMXTMZJLGW-OAHLLOKOSA-N 2 2 371.441 2.584 20 5 FFBDLP CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)C1 ZINC000449986022 514453733 /nfs/dbraw/zinc/45/37/33/514453733.db2.gz FVZPVMXTMZJLGW-OAHLLOKOSA-N 2 2 371.441 2.584 20 5 FFBDLP Cc1cc(N[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000489179376 514741146 /nfs/dbraw/zinc/74/11/46/514741146.db2.gz ZAEKPCMZZXICNV-NVXWUHKLSA-N 2 2 353.426 2.821 20 5 FFBDLP Cc1cc(N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000489179376 514741156 /nfs/dbraw/zinc/74/11/56/514741156.db2.gz ZAEKPCMZZXICNV-NVXWUHKLSA-N 2 2 353.426 2.821 20 5 FFBDLP CC[C@H]1CCCC[N@@H+]1CCNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000499724386 515428689 /nfs/dbraw/zinc/42/86/89/515428689.db2.gz RLDXMNBQZNKADM-INIZCTEOSA-N 2 2 371.441 2.775 20 5 FFBDLP CC[C@H]1CCCC[N@H+]1CCNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000499724386 515428696 /nfs/dbraw/zinc/42/86/96/515428696.db2.gz RLDXMNBQZNKADM-INIZCTEOSA-N 2 2 371.441 2.775 20 5 FFBDLP CC[C@@H]([NH2+][C@@H]1CCCN(Cc2[nH+]ccn2C)C1=O)c1cccc([N+](=O)[O-])c1 ZINC000544017195 516540238 /nfs/dbraw/zinc/54/02/38/516540238.db2.gz TWVNPONNMILBJW-IAGOWNOFSA-N 2 2 371.441 2.560 20 5 FFBDLP C[C@@H](C[N@@H+]1CCC[C@@H](C)C1)NC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000518462265 516670926 /nfs/dbraw/zinc/67/09/26/516670926.db2.gz XWTVORWYCAUNKQ-CABCVRRESA-N 2 2 371.441 2.631 20 5 FFBDLP C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000518462265 516670931 /nfs/dbraw/zinc/67/09/31/516670931.db2.gz XWTVORWYCAUNKQ-CABCVRRESA-N 2 2 371.441 2.631 20 5 FFBDLP CC[C@@H](C)[N@H+](C)CCNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000562234658 516972478 /nfs/dbraw/zinc/97/24/78/516972478.db2.gz XYWDZGPBJIBBDW-OAHLLOKOSA-N 2 2 350.463 2.569 20 5 FFBDLP CC[C@@H](C)[N@@H+](C)CCNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000562234658 516972490 /nfs/dbraw/zinc/97/24/90/516972490.db2.gz XYWDZGPBJIBBDW-OAHLLOKOSA-N 2 2 350.463 2.569 20 5 FFBDLP C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[NH+]1CCC(C[NH+](C)C)CC1 ZINC000532922025 517204544 /nfs/dbraw/zinc/20/45/44/517204544.db2.gz ZBQDIFNKHDBHAE-LBPRGKRZSA-N 2 2 368.865 2.849 20 5 FFBDLP Cc1[nH+]c2ccccc2n1C[C@@H]1CCC[N@H+]1Cc1c([N+](=O)[O-])ncn1C ZINC000533760471 517601300 /nfs/dbraw/zinc/60/13/00/517601300.db2.gz BPBMHDHOTFOOSL-AWEZNQCLSA-N 2 2 354.414 2.651 20 5 FFBDLP Cc1[nH+]c2ccccc2n1C[C@@H]1CCC[N@@H+]1Cc1c([N+](=O)[O-])ncn1C ZINC000533760471 517601310 /nfs/dbraw/zinc/60/13/10/517601310.db2.gz BPBMHDHOTFOOSL-AWEZNQCLSA-N 2 2 354.414 2.651 20 5 FFBDLP C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCC(Nc2cccc[nH+]2)CC1 ZINC000534127886 517754844 /nfs/dbraw/zinc/75/48/44/517754844.db2.gz JARWUIAOZXPPCI-AWEZNQCLSA-N 2 2 369.425 2.893 20 5 FFBDLP Cc1cn2c([nH+]1)[C@@H](C[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])CCC2 ZINC000564851854 518653526 /nfs/dbraw/zinc/65/35/26/518653526.db2.gz GQDHTBCWSVPXMB-CQSZACIVSA-N 2 2 357.414 2.596 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCOC2)CC1)C1CC1 ZINC000595102180 520294933 /nfs/dbraw/zinc/29/49/33/520294933.db2.gz LANXIYSWSPOQIF-MOPGFXCFSA-N 2 2 359.470 2.759 20 5 FFBDLP Cc1cc(C)c([N+](=O)[O-])c(NCC2([NH+]3CCCCC3)CC[NH+](C)CC2)n1 ZINC000611616854 521250824 /nfs/dbraw/zinc/25/08/24/521250824.db2.gz RJXCNFQJPDXNOZ-UHFFFAOYSA-N 2 2 361.490 2.969 20 5 FFBDLP CC[C@H](C)COc1cc([N+](=O)[O-])c(C[NH+]2C[C@H]3C[NH2+]C[C@@H]3C2)cc1OC ZINC000611661359 521269985 /nfs/dbraw/zinc/26/99/85/521269985.db2.gz WCKKWBMOTQXFGW-NUEKZKHPSA-N 2 2 363.458 2.680 20 5 FFBDLP C[C@H](C[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)[NH+]1CCC(C)CC1 ZINC000602523340 521394287 /nfs/dbraw/zinc/39/42/87/521394287.db2.gz BFMBXISJWDYMLS-MRXNPFEDSA-N 2 2 361.490 2.669 20 5 FFBDLP O=C(N[C@H]1CCC[N@@H+]2CCCC[C@H]12)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000594200289 521466501 /nfs/dbraw/zinc/46/65/01/521466501.db2.gz KMSQHOWGEBEMOB-JKSUJKDBSA-N 2 2 369.425 2.527 20 5 FFBDLP O=C(N[C@H]1CCC[N@H+]2CCCC[C@H]12)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000594200289 521466505 /nfs/dbraw/zinc/46/65/05/521466505.db2.gz KMSQHOWGEBEMOB-JKSUJKDBSA-N 2 2 369.425 2.527 20 5 FFBDLP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCC[NH+]1CCC(O)CC1 ZINC000872026538 731721568 /nfs/dbraw/zinc/72/15/68/731721568.db2.gz FULAEXALPQERHG-ZDUSSCGKSA-N 2 2 353.488 2.814 20 5 FFBDLP O=[N+]([O-])c1ccc2oc(C[NH+]3CCC(O)(C[NH+]4CCCCC4)CC3)nc2c1 ZINC001176879760 1013791774 /nfs/dbraw/zinc/79/17/74/1013791774.db2.gz OCUNDFPJQRMPSY-UHFFFAOYSA-N 2 2 374.441 2.549 20 5 FFBDLP Cc1c(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2CO)cccc1[N+](=O)[O-] ZINC000788469134 1001807612 /nfs/dbraw/zinc/80/76/12/1001807612.db2.gz NTVGKWYEVUOQEJ-PMACEKPBSA-N 2 2 369.465 2.876 20 5 FFBDLP Cc1c(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2CO)cccc1[N+](=O)[O-] ZINC000788469134 1001807622 /nfs/dbraw/zinc/80/76/22/1001807622.db2.gz NTVGKWYEVUOQEJ-PMACEKPBSA-N 2 2 369.465 2.876 20 5 FFBDLP O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)cc1 ZINC000791623347 1002748431 /nfs/dbraw/zinc/74/84/31/1002748431.db2.gz TVWBGHFXGLMKHU-ZVDOUQERSA-N 2 2 367.449 2.692 20 5 FFBDLP O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)cc1 ZINC000791623347 1002748436 /nfs/dbraw/zinc/74/84/36/1002748436.db2.gz TVWBGHFXGLMKHU-ZVDOUQERSA-N 2 2 367.449 2.692 20 5 FFBDLP O=[N+]([O-])c1ccc([C@@H](O)C[NH+]2C[C@H]3C[N@H+](Cc4ccccc4)C[C@H]3C2)cc1 ZINC000791623347 1002748442 /nfs/dbraw/zinc/74/84/42/1002748442.db2.gz TVWBGHFXGLMKHU-ZVDOUQERSA-N 2 2 367.449 2.692 20 5 FFBDLP O=[N+]([O-])c1ccc([C@@H](O)C[NH+]2C[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]3C2)cc1 ZINC000791623347 1002748450 /nfs/dbraw/zinc/74/84/50/1002748450.db2.gz TVWBGHFXGLMKHU-ZVDOUQERSA-N 2 2 367.449 2.692 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@H]1CC[N@@H+](C3CCOCC3)C1)CC2 ZINC001172902770 1012078156 /nfs/dbraw/zinc/07/81/56/1012078156.db2.gz CBWOACRHZPDUPY-ROUUACIJSA-N 2 2 359.470 2.685 20 5 FFBDLP O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@H]1CC[N@H+](C3CCOCC3)C1)CC2 ZINC001172902770 1012078176 /nfs/dbraw/zinc/07/81/76/1012078176.db2.gz CBWOACRHZPDUPY-ROUUACIJSA-N 2 2 359.470 2.685 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CC[C@]3(CC[NH+](C)C3)C2)c1F ZINC001173192459 1012335985 /nfs/dbraw/zinc/33/59/85/1012335985.db2.gz LDFMQNNHLZSCTN-UGSOOPFHSA-N 2 2 351.422 2.701 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CC[C@]3(CC[NH+](C)C3)C2)c1F ZINC001173192459 1012335997 /nfs/dbraw/zinc/33/59/97/1012335997.db2.gz LDFMQNNHLZSCTN-UGSOOPFHSA-N 2 2 351.422 2.701 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH+]2CC[C@]3(CC[N@H+](C)C3)C2)c1F ZINC001173192459 1012336013 /nfs/dbraw/zinc/33/60/13/1012336013.db2.gz LDFMQNNHLZSCTN-UGSOOPFHSA-N 2 2 351.422 2.701 20 5 FFBDLP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH+]2CC[C@]3(CC[N@@H+](C)C3)C2)c1F ZINC001173192459 1012336031 /nfs/dbraw/zinc/33/60/31/1012336031.db2.gz LDFMQNNHLZSCTN-UGSOOPFHSA-N 2 2 351.422 2.701 20 5 FFBDLP CN(Cc1c2ccccc2cc2ccccc21)C(=O)[C@@]12C[NH2+]C[C@H]1CC[NH2+]2 ZINC001160740207 1027846879 /nfs/dbraw/zinc/84/68/79/1027846879.db2.gz YWODZRBRPBCFET-WZONZLPQSA-N 2 2 359.473 2.903 20 5 FFBDLP O=[N+]([O-])c1cc2c(Cl)ncnc2cc1-n1c[nH+]cc1C1CC[NH2+]CC1 ZINC001155052586 1028559044 /nfs/dbraw/zinc/55/90/44/1028559044.db2.gz CWYCJRHXSNEILG-UHFFFAOYSA-N 2 2 358.789 2.844 20 5 FFBDLP Cc1cc(N2CC[NH+]([C@H](C)Cc3ccccc3[N+](=O)[O-])CC2)nc(C)[nH+]1 ZINC001254562134 1040800353 /nfs/dbraw/zinc/80/03/53/1040800353.db2.gz JUNFOFRCOHXTJF-OAHLLOKOSA-N 2 2 355.442 2.755 20 5 FFBDLP C[C@@H]1C[C@H]([NH+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[N@@H+]1C ZINC000093643725 250038337 /nfs/dbraw/zinc/03/83/37/250038337.db2.gz HMVXHNNZSXELAV-RDTXWAMCSA-N 2 2 357.458 2.910 20 5 FFBDLP C[C@@H]1C[C@H]([NH+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000093643725 250038341 /nfs/dbraw/zinc/03/83/41/250038341.db2.gz HMVXHNNZSXELAV-RDTXWAMCSA-N 2 2 357.458 2.910 20 5 FFBDLP C[C@@H]1C[C@H]([N@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[NH+]1C ZINC000093643725 250038346 /nfs/dbraw/zinc/03/83/46/250038346.db2.gz HMVXHNNZSXELAV-RDTXWAMCSA-N 2 2 357.458 2.910 20 5 FFBDLP C[C@@H]1C[C@H]([N@@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[NH+]1C ZINC000093643725 250038350 /nfs/dbraw/zinc/03/83/50/250038350.db2.gz HMVXHNNZSXELAV-RDTXWAMCSA-N 2 2 357.458 2.910 20 5 FFBDLP Cc1c([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC(=O)N(C)C)cccc1[N+](=O)[O-] ZINC000285766617 257003649 /nfs/dbraw/zinc/00/36/49/257003649.db2.gz SYOKZQPTAQGVBD-XYTVBORESA-N 2 2 374.485 2.637 20 5 FFBDLP Cc1c([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC(=O)N(C)C)cccc1[N+](=O)[O-] ZINC000285766617 257003650 /nfs/dbraw/zinc/00/36/50/257003650.db2.gz SYOKZQPTAQGVBD-XYTVBORESA-N 2 2 374.485 2.637 20 5 FFBDLP CCOc1cc(NC2CC[NH+](C3CC[NH+](C)CC3)CC2)ccc1[N+](=O)[O-] ZINC000301494879 258052505 /nfs/dbraw/zinc/05/25/05/258052505.db2.gz AGLWINNHXRDUBB-UHFFFAOYSA-N 2 2 362.474 2.964 20 5 FFBDLP CCC[N@H+](C)C[C@@H]1CCN(C(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)C1 ZINC000081361073 508167163 /nfs/dbraw/zinc/16/71/63/508167163.db2.gz WHWZCDYLAIEFOE-HNNXBMFYSA-N 2 2 371.441 2.584 20 5 FFBDLP CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)C1 ZINC000081361073 508167164 /nfs/dbraw/zinc/16/71/64/508167164.db2.gz WHWZCDYLAIEFOE-HNNXBMFYSA-N 2 2 371.441 2.584 20 5 FFBDLP C[NH+](C)CC[C@H]([NH2+][C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)C(C)(C)C ZINC000116396834 508507100 /nfs/dbraw/zinc/50/71/00/508507100.db2.gz FRIIVFNHBFOMMO-SJORKVTESA-N 2 2 362.474 2.656 20 5 FFBDLP Cn1cc[nH+]c1C[C@H]1CCC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000123817051 508742677 /nfs/dbraw/zinc/74/26/77/508742677.db2.gz NEEZZXFPMKKXPH-OAHLLOKOSA-N 2 2 371.441 2.612 20 5 FFBDLP Cn1cc[nH+]c1C[C@H]1CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000123817051 508742679 /nfs/dbraw/zinc/74/26/79/508742679.db2.gz NEEZZXFPMKKXPH-OAHLLOKOSA-N 2 2 371.441 2.612 20 5 FFBDLP C[N@@H+]1CCCC[C@H]1CN1CC[NH+](C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000255019852 509915744 /nfs/dbraw/zinc/91/57/44/509915744.db2.gz AMTNCQZPQKAXQW-QJSCKGPTSA-N 2 2 358.486 2.710 20 5 FFBDLP C[N@H+]1CCCC[C@H]1CN1CC[NH+](C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000255019852 509915748 /nfs/dbraw/zinc/91/57/48/509915748.db2.gz AMTNCQZPQKAXQW-QJSCKGPTSA-N 2 2 358.486 2.710 20 5 FFBDLP CC[N@@H+]1CC[C@H]([NH+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@@H](C)C1 ZINC000245432936 509928640 /nfs/dbraw/zinc/92/86/40/509928640.db2.gz OYJZDIHMMSOEPM-LRDDRELGSA-N 2 2 368.865 2.849 20 5 FFBDLP CC[N@H+]1CC[C@H]([NH+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@@H](C)C1 ZINC000245432936 509928646 /nfs/dbraw/zinc/92/86/46/509928646.db2.gz OYJZDIHMMSOEPM-LRDDRELGSA-N 2 2 368.865 2.849 20 5 FFBDLP CC[NH+]1CC[C@H]([N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@@H](C)C1 ZINC000245432936 509928649 /nfs/dbraw/zinc/92/86/49/509928649.db2.gz OYJZDIHMMSOEPM-LRDDRELGSA-N 2 2 368.865 2.849 20 5 FFBDLP CC[NH+]1CC[C@H]([N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@@H](C)C1 ZINC000245432936 509928653 /nfs/dbraw/zinc/92/86/53/509928653.db2.gz OYJZDIHMMSOEPM-LRDDRELGSA-N 2 2 368.865 2.849 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](CC[NH3+])CCc1ccccc1 ZINC000261746644 510048028 /nfs/dbraw/zinc/04/80/28/510048028.db2.gz LIQLCSJKIBJMFD-UHFFFAOYSA-N 2 2 370.453 2.735 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](CC[NH3+])CCc1ccccc1 ZINC000261746644 510048034 /nfs/dbraw/zinc/04/80/34/510048034.db2.gz LIQLCSJKIBJMFD-UHFFFAOYSA-N 2 2 370.453 2.735 20 5 FFBDLP COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CC[N@H+](Cc2ccccn2)C[C@@H]1C ZINC000178730436 510742508 /nfs/dbraw/zinc/74/25/08/510742508.db2.gz HIGNNOBBQDMSSD-KXBFYZLASA-N 2 2 370.453 2.999 20 5 FFBDLP COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CC[N@@H+](Cc2ccccn2)C[C@@H]1C ZINC000178730436 510742516 /nfs/dbraw/zinc/74/25/16/510742516.db2.gz HIGNNOBBQDMSSD-KXBFYZLASA-N 2 2 370.453 2.999 20 5 FFBDLP Cc1cc(NC[C@H](O)C[NH+]2CCCCC2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000195303214 510773724 /nfs/dbraw/zinc/77/37/24/510773724.db2.gz IMKVAOZBPXSFCD-KRWDZBQOSA-N 2 2 371.441 2.619 20 5 FFBDLP Cc1ccc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC(=O)N(C)C)cc1[N+](=O)[O-] ZINC000285609661 510977296 /nfs/dbraw/zinc/97/72/96/510977296.db2.gz JCXHKPJEAFWULZ-MIGBEJBISA-N 2 2 374.485 2.637 20 5 FFBDLP Cc1ccc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC(=O)N(C)C)cc1[N+](=O)[O-] ZINC000285609661 510977299 /nfs/dbraw/zinc/97/72/99/510977299.db2.gz JCXHKPJEAFWULZ-MIGBEJBISA-N 2 2 374.485 2.637 20 5 FFBDLP CC(C)[NH+]1CCC(N(C)C(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)CC1 ZINC000298203640 511207630 /nfs/dbraw/zinc/20/76/30/511207630.db2.gz ZWPKIPVPIQIEFC-UHFFFAOYSA-N 2 2 371.441 2.725 20 5 FFBDLP C[C@H]([NH2+]C1CC[NH+](Cc2ccccn2)CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000293579539 512016325 /nfs/dbraw/zinc/01/63/25/512016325.db2.gz DVANZPUDSBYOOG-AWEZNQCLSA-N 2 2 355.442 2.887 20 5 FFBDLP CCC(=O)c1ccc(N[C@@H]2CC[N@@H+](C3CC[NH+](C)CC3)C2)c([N+](=O)[O-])c1 ZINC000366430238 512018846 /nfs/dbraw/zinc/01/88/46/512018846.db2.gz ICOUJTODVSCRBA-OAHLLOKOSA-N 2 2 360.458 2.768 20 5 FFBDLP CCC(=O)c1ccc(N[C@@H]2CC[N@H+](C3CC[NH+](C)CC3)C2)c([N+](=O)[O-])c1 ZINC000366430238 512018854 /nfs/dbraw/zinc/01/88/54/512018854.db2.gz ICOUJTODVSCRBA-OAHLLOKOSA-N 2 2 360.458 2.768 20 5 FFBDLP Cn1cc(C[N@@H+]2CC[C@@H](c3[nH+]ccn3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000377890444 512500496 /nfs/dbraw/zinc/50/04/96/512500496.db2.gz VHFLFAAHJNITDD-OAHLLOKOSA-N 2 2 366.425 2.718 20 5 FFBDLP Cn1cc(C[N@H+]2CC[C@@H](c3[nH+]ccn3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000377890444 512500499 /nfs/dbraw/zinc/50/04/99/512500499.db2.gz VHFLFAAHJNITDD-OAHLLOKOSA-N 2 2 366.425 2.718 20 5 FFBDLP COc1ccc(C[N@H+](C)[C@@H](C)C[NH3+])cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000435372656 513567428 /nfs/dbraw/zinc/56/74/28/513567428.db2.gz BADLPBHLOUIEKY-AWEZNQCLSA-N 2 2 359.426 2.961 20 5 FFBDLP COc1ccc(C[N@@H+](C)[C@@H](C)C[NH3+])cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000435372656 513567432 /nfs/dbraw/zinc/56/74/32/513567432.db2.gz BADLPBHLOUIEKY-AWEZNQCLSA-N 2 2 359.426 2.961 20 5 FFBDLP C[NH+](C)[C@@H]1CCC[C@H](Nc2cc(C[NH+]3CCOCC3)ccc2[N+](=O)[O-])C1 ZINC000447817234 513581907 /nfs/dbraw/zinc/58/19/07/513581907.db2.gz NNCPNWMIHCKYEQ-DLBZAZTESA-N 2 2 362.474 2.712 20 5 FFBDLP CCOc1ccc([C@@H](C)Nc2ccc(N3CC[NH2+]CC3)c[nH+]2)cc1[N+](=O)[O-] ZINC000423234808 514086146 /nfs/dbraw/zinc/08/61/46/514086146.db2.gz QLGUAVRYOMLTGD-CQSZACIVSA-N 2 2 371.441 2.971 20 5 FFBDLP CC[NH+]1CCC([N@@H+]2CCCN(c3ncc([N+](=O)[O-])cc3Cl)CC2)CC1 ZINC000420634584 514210200 /nfs/dbraw/zinc/21/02/00/514210200.db2.gz ZYAFCEQGTDPINO-UHFFFAOYSA-N 2 2 367.881 2.640 20 5 FFBDLP CC[NH+]1CCC([N@H+]2CCCN(c3ncc([N+](=O)[O-])cc3Cl)CC2)CC1 ZINC000420634584 514210203 /nfs/dbraw/zinc/21/02/03/514210203.db2.gz ZYAFCEQGTDPINO-UHFFFAOYSA-N 2 2 367.881 2.640 20 5 FFBDLP Cn1cc(C[NH2+]C[C@H]2[NH2+]CCCC2(C)C)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000414923045 514358802 /nfs/dbraw/zinc/35/88/02/514358802.db2.gz DRPUYJHPUKZJEZ-QGZVFWFLSA-N 2 2 357.458 2.863 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@@H]3C[NH2+]CCCO3)o2)c(Cl)c1 ZINC000415047719 514415335 /nfs/dbraw/zinc/41/53/35/514415335.db2.gz WFDWBUMHHCUXQG-AWEZNQCLSA-N 2 2 365.817 2.976 20 5 FFBDLP CC[NH+]1CCC(CCNC(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)CC1 ZINC000449950798 514437014 /nfs/dbraw/zinc/43/70/14/514437014.db2.gz RIFBSWYKTUWRAZ-UHFFFAOYSA-N 2 2 371.441 2.632 20 5 FFBDLP CCC[N@H+](CC)C[C@H](C)NC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000461544595 514651829 /nfs/dbraw/zinc/65/18/29/514651829.db2.gz JZRFADMXTJXWJJ-AWEZNQCLSA-N 2 2 359.430 2.631 20 5 FFBDLP CCC[N@@H+](CC)C[C@H](C)NC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000461544595 514651837 /nfs/dbraw/zinc/65/18/37/514651837.db2.gz JZRFADMXTJXWJJ-AWEZNQCLSA-N 2 2 359.430 2.631 20 5 FFBDLP Cc1cc(N[C@H]2CC[N@@H+]3CCC[C@H]3C2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000489179377 514740191 /nfs/dbraw/zinc/74/01/91/514740191.db2.gz ZAEKPCMZZXICNV-RDJZCZTQSA-N 2 2 353.426 2.821 20 5 FFBDLP Cc1cc(N[C@H]2CC[N@H+]3CCC[C@H]3C2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000489179377 514740201 /nfs/dbraw/zinc/74/02/01/514740201.db2.gz ZAEKPCMZZXICNV-RDJZCZTQSA-N 2 2 353.426 2.821 20 5 FFBDLP O=C(NC1CC[NH+](C2CCC2)CC1)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000456702964 515366233 /nfs/dbraw/zinc/36/62/33/515366233.db2.gz QMCXWRROLMIZDM-UHFFFAOYSA-N 2 2 369.425 2.527 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@@H+]2Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000491890191 515480487 /nfs/dbraw/zinc/48/04/87/515480487.db2.gz KGMNWBWRNGPQBP-CSMYWGQOSA-N 2 2 353.850 2.932 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@H+]2Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000491890191 515480493 /nfs/dbraw/zinc/48/04/93/515480493.db2.gz KGMNWBWRNGPQBP-CSMYWGQOSA-N 2 2 353.850 2.932 20 5 FFBDLP C[C@H]1C[N@H+](Cc2c(Cl)cccc2[N+](=O)[O-])CC[C@@H]1N1CC[NH+](C)CC1 ZINC000491978287 515488235 /nfs/dbraw/zinc/48/82/35/515488235.db2.gz JHLAQOUXOHNYKB-YOEHRIQHSA-N 2 2 366.893 2.706 20 5 FFBDLP C[C@H]1C[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])CC[C@@H]1N1CC[NH+](C)CC1 ZINC000491978287 515488241 /nfs/dbraw/zinc/48/82/41/515488241.db2.gz JHLAQOUXOHNYKB-YOEHRIQHSA-N 2 2 366.893 2.706 20 5 FFBDLP Cc1cn2c([nH+]1)[C@@H](C[NH2+][C@@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000531988146 516745106 /nfs/dbraw/zinc/74/51/06/516745106.db2.gz DNKZNUGFDDFGKY-DZGCQCFKSA-N 2 2 371.441 2.984 20 5 FFBDLP Cc1[nH+]ccn1CCC[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000559071536 517068828 /nfs/dbraw/zinc/06/88/28/517068828.db2.gz CZSRBZNNYCUAIT-KRWDZBQOSA-N 2 2 354.414 2.603 20 5 FFBDLP C[N@@H+]1CC[C@H]([NH2+]CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000589267641 518968348 /nfs/dbraw/zinc/96/83/48/518968348.db2.gz CMDHYZBUXSCCDU-ICSRJNTNSA-N 2 2 368.437 2.958 20 5 FFBDLP C[N@H+]1CC[C@H]([NH2+]CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000589267641 518968355 /nfs/dbraw/zinc/96/83/55/518968355.db2.gz CMDHYZBUXSCCDU-ICSRJNTNSA-N 2 2 368.437 2.958 20 5 FFBDLP Cc1cn2c([nH+]1)[C@H](C[NH2+][C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)CCC2 ZINC000575206887 519554444 /nfs/dbraw/zinc/55/44/44/519554444.db2.gz IZWCHFSOKIWCGK-HRCADAONSA-N 2 2 358.446 2.947 20 5 FFBDLP C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCC[N@@H+]2CCCC[C@@H]12 ZINC000594519480 520011388 /nfs/dbraw/zinc/01/13/88/520011388.db2.gz LCTQOTRKDXYKMO-JLSDUUJJSA-N 2 2 360.458 2.918 20 5 FFBDLP C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594519480 520011396 /nfs/dbraw/zinc/01/13/96/520011396.db2.gz LCTQOTRKDXYKMO-JLSDUUJJSA-N 2 2 360.458 2.918 20 5 FFBDLP O=C(C[N@@H+]1CCC[C@H](n2cc[nH+]c2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609157618 520213715 /nfs/dbraw/zinc/21/37/15/520213715.db2.gz KOSPPYYWBTVNDB-ZDUSSCGKSA-N 2 2 363.805 2.720 20 5 FFBDLP O=C(C[N@H+]1CCC[C@H](n2cc[nH+]c2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609157618 520213724 /nfs/dbraw/zinc/21/37/24/520213724.db2.gz KOSPPYYWBTVNDB-ZDUSSCGKSA-N 2 2 363.805 2.720 20 5 FFBDLP Cc1c(NC(=O)CC[N@@H+]2CCC[C@H](n3cc[nH+]c3)C2)cccc1[N+](=O)[O-] ZINC000609157386 520213979 /nfs/dbraw/zinc/21/39/79/520213979.db2.gz HSWIFQRRJYJSOE-HNNXBMFYSA-N 2 2 357.414 2.765 20 5 FFBDLP Cc1c(NC(=O)CC[N@H+]2CCC[C@H](n3cc[nH+]c3)C2)cccc1[N+](=O)[O-] ZINC000609157386 520213982 /nfs/dbraw/zinc/21/39/82/520213982.db2.gz HSWIFQRRJYJSOE-HNNXBMFYSA-N 2 2 357.414 2.765 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@@H]([C@@H]4CCC[NH2+]4)C3)n2)c1 ZINC000592478694 520407275 /nfs/dbraw/zinc/40/72/75/520407275.db2.gz IGEFJCQRQNEVED-ZBFHGGJFSA-N 2 2 357.414 2.609 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@@H]([C@@H]4CCC[NH2+]4)C3)n2)c1 ZINC000592478694 520407282 /nfs/dbraw/zinc/40/72/82/520407282.db2.gz IGEFJCQRQNEVED-ZBFHGGJFSA-N 2 2 357.414 2.609 20 5 FFBDLP Cc1cc(NC[C@H]2CC[N@@H+](C3CC3)C2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000604508528 520583091 /nfs/dbraw/zinc/58/30/91/520583091.db2.gz HMKQSHPLOWIPJF-CQSZACIVSA-N 2 2 353.426 2.678 20 5 FFBDLP Cc1cc(NC[C@H]2CC[N@H+](C3CC3)C2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000604508528 520583101 /nfs/dbraw/zinc/58/31/01/520583101.db2.gz HMKQSHPLOWIPJF-CQSZACIVSA-N 2 2 353.426 2.678 20 5 FFBDLP CCC[N@H+](C)CC(C)(C)NC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000598465942 520629889 /nfs/dbraw/zinc/62/98/89/520629889.db2.gz OTWDRLMUQCJNLZ-UHFFFAOYSA-N 2 2 359.430 2.631 20 5 FFBDLP CCC[N@@H+](C)CC(C)(C)NC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000598465942 520629895 /nfs/dbraw/zinc/62/98/95/520629895.db2.gz OTWDRLMUQCJNLZ-UHFFFAOYSA-N 2 2 359.430 2.631 20 5 FFBDLP Cn1cc[nH+]c1[C@H](N[C@@H]1CC[NH2+]CC(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000602019706 521081431 /nfs/dbraw/zinc/08/14/31/521081431.db2.gz GGGXVWHLYIFEHT-NVXWUHKLSA-N 2 2 357.458 2.786 20 5 FFBDLP CC[C@H](C)COc1cc([N+](=O)[O-])c(C[NH+]2C[C@@H]3C[NH2+]C[C@H]3C2)cc1OC ZINC000611661355 521270493 /nfs/dbraw/zinc/27/04/93/521270493.db2.gz WCKKWBMOTQXFGW-BPUTZDHNSA-N 2 2 363.458 2.680 20 5 FFBDLP CC(C)OCC[NH+]1CCC([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000602572773 521416846 /nfs/dbraw/zinc/41/68/46/521416846.db2.gz NAGOXGGIODXDTB-UHFFFAOYSA-N 2 2 362.430 2.715 20 5 FFBDLP O=[N+]([O-])c1ccc(N2CCC([NH2+]C[C@@H]3CC[N@@H+]3C3CCCC3)CC2)cn1 ZINC000602725250 521498180 /nfs/dbraw/zinc/49/81/80/521498180.db2.gz KOOXWMFEFVREKX-SFHVURJKSA-N 2 2 359.474 2.565 20 5 FFBDLP O=[N+]([O-])c1ccc(N2CCC([NH2+]C[C@@H]3CC[N@H+]3C3CCCC3)CC2)cn1 ZINC000602725250 521498192 /nfs/dbraw/zinc/49/81/92/521498192.db2.gz KOOXWMFEFVREKX-SFHVURJKSA-N 2 2 359.474 2.565 20 5 FFBDLP O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]CCc2cn3c([nH+]2)CCCC3)n1 ZINC000616008180 521601395 /nfs/dbraw/zinc/60/13/95/521601395.db2.gz WNOZOCCQKYAXEO-CVEARBPZSA-N 2 2 358.446 2.640 20 5 FFBDLP C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(c2c[nH+]cn2C)CC1 ZINC001176977994 1013819789 /nfs/dbraw/zinc/81/97/89/1013819789.db2.gz PMITUYSGQQZENH-ZDUSSCGKSA-N 2 2 357.414 2.535 20 5 FFBDLP CC(C)c1ccc(C[NH+]2CCC(N3CC[NH+](C)CC3)CC2)cc1[N+](=O)[O-] ZINC000877747523 1014706903 /nfs/dbraw/zinc/70/69/03/1014706903.db2.gz PBUMNRIGQYPCRI-UHFFFAOYSA-N 2 2 360.502 2.930 20 5 FFBDLP O=[N+]([O-])c1cnn(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)c1 ZINC000762498665 988414531 /nfs/dbraw/zinc/41/45/31/988414531.db2.gz ACMQDTQYUOUZAZ-UHFFFAOYSA-N 2 2 355.442 2.737 20 5 FFBDLP O=[N+]([O-])c1cnn(C[NH+]2CCC3(CC[N@@H+](Cc4ccccc4)C3)CC2)c1 ZINC000762498665 988414536 /nfs/dbraw/zinc/41/45/36/988414536.db2.gz ACMQDTQYUOUZAZ-UHFFFAOYSA-N 2 2 355.442 2.737 20 5 FFBDLP CC[NH+]1CCC([N@@H+]2CCCN(Cc3cc(F)ccc3[N+](=O)[O-])CC2)CC1 ZINC000817286405 1007510539 /nfs/dbraw/zinc/51/05/39/1007510539.db2.gz ULLUVJONLKOXRJ-UHFFFAOYSA-N 2 2 364.465 2.726 20 5 FFBDLP CC[NH+]1CCC([N@H+]2CCCN(Cc3cc(F)ccc3[N+](=O)[O-])CC2)CC1 ZINC000817286405 1007510542 /nfs/dbraw/zinc/51/05/42/1007510542.db2.gz ULLUVJONLKOXRJ-UHFFFAOYSA-N 2 2 364.465 2.726 20 5 FFBDLP C[C@H](c1ccncc1)[NH+]1CCC([NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000819183518 1008060392 /nfs/dbraw/zinc/06/03/92/1008060392.db2.gz PQODVHIDTWTWCD-FOIQADDNSA-N 2 2 370.453 2.838 20 5 FFBDLP Cc1cc(NCC[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)nc(C(C)C)[nH+]1 ZINC000863575164 1010260350 /nfs/dbraw/zinc/26/03/50/1010260350.db2.gz FSFKQHFRXFPAFQ-INIZCTEOSA-N 2 2 359.430 2.552 20 5 FFBDLP C[C@@H]1CC[N@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C[C@@H]1n1cc[nH+]c1 ZINC000121643605 1011065977 /nfs/dbraw/zinc/06/59/77/1011065977.db2.gz DWCHIVFCZPOTDP-PBHICJAKSA-N 2 2 367.413 2.590 20 5 FFBDLP C[C@@H]1CC[N@@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C[C@@H]1n1cc[nH+]c1 ZINC000121643605 1011065980 /nfs/dbraw/zinc/06/59/80/1011065980.db2.gz DWCHIVFCZPOTDP-PBHICJAKSA-N 2 2 367.413 2.590 20 5 FFBDLP O=[N+]([O-])c1ccc2c(cnn2C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000246569837 1026273586 /nfs/dbraw/zinc/27/35/86/1026273586.db2.gz RHZKAPPCNKGVBE-KSSFIOAISA-N 2 2 355.442 2.851 20 5 FFBDLP O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000246569837 1026273601 /nfs/dbraw/zinc/27/36/01/1026273601.db2.gz RHZKAPPCNKGVBE-KSSFIOAISA-N 2 2 355.442 2.851 20 5 FFBDLP O=[N+]([O-])c1ccc2c(cnn2C[NH+]2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000246569837 1026273613 /nfs/dbraw/zinc/27/36/13/1026273613.db2.gz RHZKAPPCNKGVBE-KSSFIOAISA-N 2 2 355.442 2.851 20 5 FFBDLP O=[N+]([O-])c1ccc2c(cnn2C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000246569837 1026273625 /nfs/dbraw/zinc/27/36/25/1026273625.db2.gz RHZKAPPCNKGVBE-KSSFIOAISA-N 2 2 355.442 2.851 20 5 FFBDLP O=[N+]([O-])c1ccc(-c2ccc(-n3c[nH+]cc3C3CC[NH2+]CC3)nn2)cc1 ZINC001155064335 1028563407 /nfs/dbraw/zinc/56/34/07/1028563407.db2.gz OXUNKUOJHFAXAF-UHFFFAOYSA-N 2 2 350.382 2.705 20 5 FFBDLP CC[N@@H+]1CCO[C@@H]2C[NH+](Cc3ccc4ccc5cccnc5c4n3)C[C@@H]2C1 ZINC001232222713 1035503332 /nfs/dbraw/zinc/50/33/32/1035503332.db2.gz QAPJJUSKPXPGQC-AZUAARDMSA-N 2 2 362.477 2.936 20 5 FFBDLP CC[N@H+]1CCO[C@@H]2C[NH+](Cc3ccc4ccc5cccnc5c4n3)C[C@@H]2C1 ZINC001232222713 1035503339 /nfs/dbraw/zinc/50/33/39/1035503339.db2.gz QAPJJUSKPXPGQC-AZUAARDMSA-N 2 2 362.477 2.936 20 5 FFBDLP CC[NH+]1CCO[C@@H]2C[N@H+](Cc3ccc4ccc5cccnc5c4n3)C[C@@H]2C1 ZINC001232222713 1035503344 /nfs/dbraw/zinc/50/33/44/1035503344.db2.gz QAPJJUSKPXPGQC-AZUAARDMSA-N 2 2 362.477 2.936 20 5 FFBDLP CC[NH+]1CCO[C@@H]2C[N@@H+](Cc3ccc4ccc5cccnc5c4n3)C[C@@H]2C1 ZINC001232222713 1035503350 /nfs/dbraw/zinc/50/33/50/1035503350.db2.gz QAPJJUSKPXPGQC-AZUAARDMSA-N 2 2 362.477 2.936 20 5 FFBDLP COc1cc(N2CCC([N@H+](C)C3CC[NH+](C)CC3)CC2)ccc1[N+](=O)[O-] ZINC001256093665 1038378830 /nfs/dbraw/zinc/37/88/30/1038378830.db2.gz DBCDXTDCVPWXDB-UHFFFAOYSA-N 2 2 362.474 2.598 20 5 FFBDLP COc1cc(N2CCC([N@@H+](C)C3CC[NH+](C)CC3)CC2)ccc1[N+](=O)[O-] ZINC001256093665 1038378846 /nfs/dbraw/zinc/37/88/46/1038378846.db2.gz DBCDXTDCVPWXDB-UHFFFAOYSA-N 2 2 362.474 2.598 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@@H](Cc3[nH+]ccn3C)C2)c1 ZINC001326387971 1046911597 /nfs/dbraw/zinc/91/15/97/1046911597.db2.gz NHFVHWKWTPTFLO-AWEZNQCLSA-N 2 2 372.425 2.570 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H](Cc3[nH+]ccn3C)C2)c1 ZINC001326387971 1046911609 /nfs/dbraw/zinc/91/16/09/1046911609.db2.gz NHFVHWKWTPTFLO-AWEZNQCLSA-N 2 2 372.425 2.570 20 5 FFBDLP O=[N+]([O-])c1cccc(Br)c1C[NH2+][C@H]1CCn2cc[nH+]c2C1 ZINC001474120413 1065458529 /nfs/dbraw/zinc/45/85/29/1065458529.db2.gz ZQNFMYMIMBMMEZ-JTQLQIEISA-N 2 2 351.204 2.658 20 5 FFBDLP O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)o1 ZINC001559616891 1076177498 /nfs/dbraw/zinc/17/74/98/1076177498.db2.gz SLMJSNPGLTWXIK-GFCCVEGCSA-N 2 2 354.370 2.748 20 5 FFBDLP O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)o1 ZINC001559616891 1076177502 /nfs/dbraw/zinc/17/75/02/1076177502.db2.gz SLMJSNPGLTWXIK-GFCCVEGCSA-N 2 2 354.370 2.748 20 5 FFBDLP CCCC[NH+]1CCC(NC(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)CC1 ZINC000068443481 507235447 /nfs/dbraw/zinc/23/54/47/507235447.db2.gz MQXUGURLKQOKQA-UHFFFAOYSA-N 2 2 371.441 2.775 20 5 FFBDLP O=C(NCCC[NH+]1CCCCCC1)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000069617399 507524284 /nfs/dbraw/zinc/52/42/84/507524284.db2.gz PTHINACRFKIJMY-UHFFFAOYSA-N 2 2 371.441 2.776 20 5 FFBDLP Cc1ccc(C[NH+]2CCN(CC[NH+]3[C@H](C)CC[C@H]3C)CC2)cc1[N+](=O)[O-] ZINC000092665004 508091940 /nfs/dbraw/zinc/09/19/40/508091940.db2.gz UHXZMDPRMYOJGV-QZTJIDSGSA-N 2 2 360.502 2.894 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000118841700 508683121 /nfs/dbraw/zinc/68/31/21/508683121.db2.gz UIOHIAQFRDTFHP-CHWSQXEVSA-N 2 2 368.865 2.849 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)C[C@@H]1CCC[NH+](C)C1 ZINC000118841700 508683124 /nfs/dbraw/zinc/68/31/24/508683124.db2.gz UIOHIAQFRDTFHP-CHWSQXEVSA-N 2 2 368.865 2.849 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[NH+](C)C[C@@H]1CCC[N@H+](C)C1 ZINC000118841700 508683126 /nfs/dbraw/zinc/68/31/26/508683126.db2.gz UIOHIAQFRDTFHP-CHWSQXEVSA-N 2 2 368.865 2.849 20 5 FFBDLP C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[NH+](C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000118841700 508683130 /nfs/dbraw/zinc/68/31/30/508683130.db2.gz UIOHIAQFRDTFHP-CHWSQXEVSA-N 2 2 368.865 2.849 20 5 FFBDLP C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)CCCn1cc[nH+]c1 ZINC000124359915 508820733 /nfs/dbraw/zinc/82/07/33/508820733.db2.gz YWKIIQYESOWNAC-CYBMUJFWSA-N 2 2 356.386 2.924 20 5 FFBDLP C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)CCCn1cc[nH+]c1 ZINC000124359915 508820736 /nfs/dbraw/zinc/82/07/36/508820736.db2.gz YWKIIQYESOWNAC-CYBMUJFWSA-N 2 2 356.386 2.924 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCN(CC[NH+]2[C@@H](C)CC[C@@H]2C)CC1 ZINC000183308949 509708762 /nfs/dbraw/zinc/70/87/62/509708762.db2.gz LVLOGTMOOASPDW-ROUUACIJSA-N 2 2 360.502 2.894 20 5 FFBDLP C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000246944474 510761179 /nfs/dbraw/zinc/76/11/79/510761179.db2.gz CBMLPFOHMIGJCE-JKIFEVAISA-N 2 2 357.414 2.701 20 5 FFBDLP C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](C)[C@H](n2cc[nH+]c2)C1 ZINC000246944474 510761184 /nfs/dbraw/zinc/76/11/84/510761184.db2.gz CBMLPFOHMIGJCE-JKIFEVAISA-N 2 2 357.414 2.701 20 5 FFBDLP C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246985654 510782744 /nfs/dbraw/zinc/78/27/44/510782744.db2.gz WCDXYMFMJJEDRK-VKJFTORMSA-N 2 2 372.469 2.871 20 5 FFBDLP C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246985654 510782753 /nfs/dbraw/zinc/78/27/53/510782753.db2.gz WCDXYMFMJJEDRK-VKJFTORMSA-N 2 2 372.469 2.871 20 5 FFBDLP C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246985654 510782758 /nfs/dbraw/zinc/78/27/58/510782758.db2.gz WCDXYMFMJJEDRK-VKJFTORMSA-N 2 2 372.469 2.871 20 5 FFBDLP CCOc1cc(N2CC[NH+](CC[C@H]3CCC[N@@H+]3C)CC2)ccc1[N+](=O)[O-] ZINC000280322633 511420461 /nfs/dbraw/zinc/42/04/61/511420461.db2.gz YNQBIXCJRJIOPR-MRXNPFEDSA-N 2 2 362.474 2.600 20 5 FFBDLP CCOc1cc(N2CC[NH+](CC[C@H]3CCC[N@H+]3C)CC2)ccc1[N+](=O)[O-] ZINC000280322633 511420465 /nfs/dbraw/zinc/42/04/65/511420465.db2.gz YNQBIXCJRJIOPR-MRXNPFEDSA-N 2 2 362.474 2.600 20 5 FFBDLP C[N@@H+]1CC[C@H]([NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000283662561 511452755 /nfs/dbraw/zinc/45/27/55/511452755.db2.gz BZZAAGJLLMQGIK-FXAWDEMLSA-N 2 2 368.437 2.958 20 5 FFBDLP C[N@H+]1CC[C@H]([NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000283662561 511452762 /nfs/dbraw/zinc/45/27/62/511452762.db2.gz BZZAAGJLLMQGIK-FXAWDEMLSA-N 2 2 368.437 2.958 20 5 FFBDLP Cn1cc[nH+]c1[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000365633065 511571177 /nfs/dbraw/zinc/57/11/77/511571177.db2.gz URKOPWBWVHRRDF-CYBMUJFWSA-N 2 2 358.398 2.574 20 5 FFBDLP Cn1cc[nH+]c1[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000365633065 511571185 /nfs/dbraw/zinc/57/11/85/511571185.db2.gz URKOPWBWVHRRDF-CYBMUJFWSA-N 2 2 358.398 2.574 20 5 FFBDLP CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCO[C@@H]2C[C@H]([NH+](C)C)CC[C@@H]21 ZINC000374429928 512829961 /nfs/dbraw/zinc/82/99/61/512829961.db2.gz QOUBTSVFGHACGJ-HHXXYDBFSA-N 2 2 363.458 2.677 20 5 FFBDLP CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCO[C@@H]2C[C@H]([NH+](C)C)CC[C@@H]21 ZINC000374429928 512829967 /nfs/dbraw/zinc/82/99/67/512829967.db2.gz QOUBTSVFGHACGJ-HHXXYDBFSA-N 2 2 363.458 2.677 20 5 FFBDLP O=C(NC[C@@H]1CCCC[N@@H+]1C1CC1)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000434419754 513318994 /nfs/dbraw/zinc/31/89/94/513318994.db2.gz BJIRCDDVNLOVKX-INIZCTEOSA-N 2 2 369.425 2.527 20 5 FFBDLP O=C(NC[C@@H]1CCCC[N@H+]1C1CC1)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000434419754 513318999 /nfs/dbraw/zinc/31/89/99/513318999.db2.gz BJIRCDDVNLOVKX-INIZCTEOSA-N 2 2 369.425 2.527 20 5 FFBDLP C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)[N@@H+]1CCCC[C@H]1C ZINC000448699168 513852361 /nfs/dbraw/zinc/85/23/61/513852361.db2.gz SMHIYWVZXWZRMW-CABCVRRESA-N 2 2 371.441 2.773 20 5 FFBDLP C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1)[N@H+]1CCCC[C@H]1C ZINC000448699168 513852362 /nfs/dbraw/zinc/85/23/62/513852362.db2.gz SMHIYWVZXWZRMW-CABCVRRESA-N 2 2 371.441 2.773 20 5 FFBDLP [NH3+]C[C@@H]([NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1CCCCC1 ZINC000420356629 514109352 /nfs/dbraw/zinc/10/93/52/514109352.db2.gz GPZORLCSVFQXRC-CQSZACIVSA-N 2 2 354.838 2.684 20 5 FFBDLP C[C@@H]([NH2+]C[C@H]1C[NH2+]CCN1C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423481866 514149636 /nfs/dbraw/zinc/14/96/36/514149636.db2.gz QYFDOSCQDUNVHX-ZIAGYGMSSA-N 2 2 360.483 2.878 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCC[N@H+]1CCCO ZINC000449386005 514189632 /nfs/dbraw/zinc/18/96/32/514189632.db2.gz HBSZHWGOTIQTDG-QXAKKESOSA-N 2 2 361.486 2.742 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCC[N@@H+]1CCCO ZINC000449386005 514189633 /nfs/dbraw/zinc/18/96/33/514189633.db2.gz HBSZHWGOTIQTDG-QXAKKESOSA-N 2 2 361.486 2.742 20 5 FFBDLP COc1ccc(-c2ccc(C[NH2+]CCc3cn(C)c[nH+]3)o2)c([N+](=O)[O-])c1 ZINC000459659446 515725702 /nfs/dbraw/zinc/72/57/02/515725702.db2.gz KAGGBQDDKUMNPC-UHFFFAOYSA-N 2 2 356.382 2.929 20 5 FFBDLP [NH3+]CCCOC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000469855454 515999371 /nfs/dbraw/zinc/99/93/71/515999371.db2.gz VWZRETIAQNLMHW-UHFFFAOYSA-N 2 2 359.373 2.526 20 5 FFBDLP COc1cc(CNc2ccc(Cn3cc[nH+]c3)c[nH+]2)c([N+](=O)[O-])cc1OC ZINC000513076755 516463781 /nfs/dbraw/zinc/46/37/81/516463781.db2.gz QICPNZKJGRRSSD-UHFFFAOYSA-N 2 2 369.381 2.864 20 5 FFBDLP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C[C@@H]1C ZINC000537618196 517261602 /nfs/dbraw/zinc/26/16/02/517261602.db2.gz PSLKXCJVJROUFU-ZFWWWQNUSA-N 2 2 351.447 2.917 20 5 FFBDLP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C[C@@H]1C ZINC000537618196 517261610 /nfs/dbraw/zinc/26/16/10/517261610.db2.gz PSLKXCJVJROUFU-ZFWWWQNUSA-N 2 2 351.447 2.917 20 5 FFBDLP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C[C@@H]1C ZINC000537618196 517261613 /nfs/dbraw/zinc/26/16/13/517261613.db2.gz PSLKXCJVJROUFU-ZFWWWQNUSA-N 2 2 351.447 2.917 20 5 FFBDLP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C[C@@H]1C ZINC000537618196 517261615 /nfs/dbraw/zinc/26/16/15/517261615.db2.gz PSLKXCJVJROUFU-ZFWWWQNUSA-N 2 2 351.447 2.917 20 5 FFBDLP C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCC(Nc2cccc[nH+]2)CC1 ZINC000534127888 517755646 /nfs/dbraw/zinc/75/56/46/517755646.db2.gz JARWUIAOZXPPCI-CQSZACIVSA-N 2 2 369.425 2.893 20 5 FFBDLP CC(C)C[C@H](CN[C@@H](c1[nH+]ccn1C)c1cccc([N+](=O)[O-])c1)[NH+](C)C ZINC000557393527 517988312 /nfs/dbraw/zinc/98/83/12/517988312.db2.gz SQFNXLGTFHMHHP-QZTJIDSGSA-N 2 2 359.474 2.984 20 5 FFBDLP Cc1cc2[nH+]cn(C[C@@H](O)C[NH2+]Cc3cccc([N+](=O)[O-])c3)c2cc1C ZINC000582020522 518548853 /nfs/dbraw/zinc/54/88/53/518548853.db2.gz QBEFMBDFSMJMGV-KRWDZBQOSA-N 2 2 354.410 2.712 20 5 FFBDLP Cc1c(NC(=O)CC[N@@H+]2CCCC[C@@H]2[C@H]2CCC[NH2+]2)cccc1[N+](=O)[O-] ZINC000573670268 518778254 /nfs/dbraw/zinc/77/82/54/518778254.db2.gz PFBSNDUGAYMIPI-SJLPKXTDSA-N 2 2 360.458 2.838 20 5 FFBDLP Cc1c(NC(=O)CC[N@H+]2CCCC[C@@H]2[C@H]2CCC[NH2+]2)cccc1[N+](=O)[O-] ZINC000573670268 518778260 /nfs/dbraw/zinc/77/82/60/518778260.db2.gz PFBSNDUGAYMIPI-SJLPKXTDSA-N 2 2 360.458 2.838 20 5 FFBDLP Cc1cc(N2CC[C@@]3(C2)CCC[NH2+]C3)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000583555343 519308537 /nfs/dbraw/zinc/30/85/37/519308537.db2.gz XDZLLNIUBOLRHN-IBGZPJMESA-N 2 2 353.426 2.940 20 5 FFBDLP C[C@@H](C[NH+]1CCC(C)CC1)NC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1 ZINC000598261413 520524851 /nfs/dbraw/zinc/52/48/51/520524851.db2.gz FFLOQQKCXAPKAV-HNNXBMFYSA-N 2 2 371.441 2.631 20 5 FFBDLP C[NH2+]Cc1ccccc1C[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000593321286 520907944 /nfs/dbraw/zinc/90/79/44/520907944.db2.gz HQJFXRFWABAFGL-IBGZPJMESA-N 2 2 365.437 2.927 20 5 FFBDLP CC(C)c1ccc(C[NH+]2CCN([C@@H]3CCC[N@H+](C)C3)CC2)cc1[N+](=O)[O-] ZINC000611270998 521070505 /nfs/dbraw/zinc/07/05/05/521070505.db2.gz YYBHFCAGPFLOJH-GOSISDBHSA-N 2 2 360.502 2.930 20 5 FFBDLP CC(C)c1ccc(C[NH+]2CCN([C@@H]3CCC[N@@H+](C)C3)CC2)cc1[N+](=O)[O-] ZINC000611270998 521070511 /nfs/dbraw/zinc/07/05/11/521070511.db2.gz YYBHFCAGPFLOJH-GOSISDBHSA-N 2 2 360.502 2.930 20 5 FFBDLP CC[NH+]1CCC([N@@H+]2CCCN(c3ccc([N+](=O)[O-])cc3F)CC2)CC1 ZINC000817125691 742089882 /nfs/dbraw/zinc/08/98/82/742089882.db2.gz UKYZGZBKIDNLBI-UHFFFAOYSA-N 2 2 350.438 2.730 20 5 FFBDLP CC[NH+]1CCC([N@H+]2CCCN(c3ccc([N+](=O)[O-])cc3F)CC2)CC1 ZINC000817125691 742089887 /nfs/dbraw/zinc/08/98/87/742089887.db2.gz UKYZGZBKIDNLBI-UHFFFAOYSA-N 2 2 350.438 2.730 20 5 FFBDLP [NH3+][C@@H]1CCC[C@H]2C[N@H+](Cc3c(Br)cccc3[N+](=O)[O-])C[C@@H]21 ZINC000843059943 747758251 /nfs/dbraw/zinc/75/82/51/747758251.db2.gz VRLGGQCEAAFMFE-COPLHBTASA-N 2 2 354.248 2.917 20 5 FFBDLP [NH3+][C@@H]1CCC[C@H]2C[N@@H+](Cc3c(Br)cccc3[N+](=O)[O-])C[C@@H]21 ZINC000843059943 747758258 /nfs/dbraw/zinc/75/82/58/747758258.db2.gz VRLGGQCEAAFMFE-COPLHBTASA-N 2 2 354.248 2.917 20 5 FFBDLP C[C@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)[C@@H]1CC[NH3+] ZINC000846226687 748434180 /nfs/dbraw/zinc/43/41/80/748434180.db2.gz TWFARLKASMGXEZ-SMDDNHRTSA-N 2 2 354.838 2.636 20 5 FFBDLP C[C@H]1CCC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)[C@@H]1CC[NH3+] ZINC000846226687 748434181 /nfs/dbraw/zinc/43/41/81/748434181.db2.gz TWFARLKASMGXEZ-SMDDNHRTSA-N 2 2 354.838 2.636 20 5 FFBDLP C[N@H+](CCc1ccccc1[N+](=O)[O-])C[C@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC000711779443 964265092 /nfs/dbraw/zinc/26/50/92/964265092.db2.gz NKUAKRMBWSVEAM-OAQYLSRUSA-N 2 2 369.465 2.706 20 5 FFBDLP C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC000711779443 964265101 /nfs/dbraw/zinc/26/51/01/964265101.db2.gz NKUAKRMBWSVEAM-OAQYLSRUSA-N 2 2 369.465 2.706 20 5 FFBDLP C[NH+](CCc1ccccc1[N+](=O)[O-])C[C@]1(O)CC[N@H+](Cc2ccccc2)C1 ZINC000711779443 964265112 /nfs/dbraw/zinc/26/51/12/964265112.db2.gz NKUAKRMBWSVEAM-OAQYLSRUSA-N 2 2 369.465 2.706 20 5 FFBDLP C[NH+](CCc1ccccc1[N+](=O)[O-])C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000711779443 964265123 /nfs/dbraw/zinc/26/51/23/964265123.db2.gz NKUAKRMBWSVEAM-OAQYLSRUSA-N 2 2 369.465 2.706 20 5 FFBDLP Cn1cc[nH+]c1C[C@@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000877066043 1014467671 /nfs/dbraw/zinc/46/76/71/1014467671.db2.gz BCIPPSBDQWDJKB-LEOMRAHMSA-N 2 2 366.425 2.802 20 5 FFBDLP O=[N+]([O-])c1cn(C[NH+]2CCC(C[NH+]3CCCC3)CC2)nc1-c1ccccn1 ZINC000853496998 1006414008 /nfs/dbraw/zinc/41/40/08/1006414008.db2.gz MZFUTTMSFMWKTH-UHFFFAOYSA-N 2 2 370.457 2.619 20 5 FFBDLP O=[N+]([O-])c1ccc2c(cnn2C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000158003504 1022469879 /nfs/dbraw/zinc/46/98/79/1022469879.db2.gz RHZKAPPCNKGVBE-KDOFPFPSSA-N 2 2 355.442 2.851 20 5 FFBDLP O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000158003504 1022469888 /nfs/dbraw/zinc/46/98/88/1022469888.db2.gz RHZKAPPCNKGVBE-KDOFPFPSSA-N 2 2 355.442 2.851 20 5 FFBDLP O=[N+]([O-])c1ccc2c(cnn2C[NH+]2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000158003504 1022469900 /nfs/dbraw/zinc/46/99/00/1022469900.db2.gz RHZKAPPCNKGVBE-KDOFPFPSSA-N 2 2 355.442 2.851 20 5 FFBDLP O=[N+]([O-])c1ccc2c(cnn2C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000158003504 1022469909 /nfs/dbraw/zinc/46/99/09/1022469909.db2.gz RHZKAPPCNKGVBE-KDOFPFPSSA-N 2 2 355.442 2.851 20 5 FFBDLP COc1ccc(C[C@H](C)[N@@H+]2C[C@@H]3C[NH2+]C[C@]3(C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC001246655903 1039428259 /nfs/dbraw/zinc/42/82/59/1039428259.db2.gz MFVRZGHITPHQDV-RBOXIYTFSA-N 2 2 373.375 2.618 20 5 FFBDLP COc1ccc(C[C@H](C)[N@H+]2C[C@@H]3C[NH2+]C[C@]3(C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC001246655903 1039428266 /nfs/dbraw/zinc/42/82/66/1039428266.db2.gz MFVRZGHITPHQDV-RBOXIYTFSA-N 2 2 373.375 2.618 20 5 FFBDLP COC1CC[NH+](C2CC[NH+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)CC2)CC1 ZINC001254612631 1040841352 /nfs/dbraw/zinc/84/13/52/1040841352.db2.gz XCIKBHSLGSQCEP-IBGZPJMESA-N 2 2 359.470 2.637 20 5 FFBDLP Cc1[nH+]ccn1-c1cc[nH+]cc1NC(=O)COc1ccccc1[N+](=O)[O-] ZINC001328350425 1048269420 /nfs/dbraw/zinc/26/94/20/1048269420.db2.gz LDCNDRPONHOOHA-UHFFFAOYSA-N 2 2 353.338 2.501 20 5 FFBDLP Cn1cc[nH+]c1C[C@H]1CCC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC001342038241 1050635226 /nfs/dbraw/zinc/63/52/26/1050635226.db2.gz VDHMPWVIGQCOMJ-CQSZACIVSA-N 2 2 372.425 2.554 20 5 FFBDLP Cn1cc[nH+]c1C[C@H]1CCC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC001342038241 1050635232 /nfs/dbraw/zinc/63/52/32/1050635232.db2.gz VDHMPWVIGQCOMJ-CQSZACIVSA-N 2 2 372.425 2.554 20 5 FFBDLP COc1ccc(CNc2ccc(N3CC[C@H]([NH+](C)C)C3)c[nH+]2)cc1[N+](=O)[O-] ZINC001308336993 1052448090 /nfs/dbraw/zinc/44/80/90/1052448090.db2.gz HQIOBQACDLPTMP-INIZCTEOSA-N 2 2 371.441 2.751 20 5 FFBDLP O=[N+]([O-])c1ccc(F)cc1C[NH+]1CCC(O)(C[NH+]2CCCCC2)CC1 ZINC001460937934 1061156191 /nfs/dbraw/zinc/15/61/91/1061156191.db2.gz DKXGQNUZPKUDEE-UHFFFAOYSA-N 2 2 351.422 2.547 20 5 FFBDLP C[N@H+](CCc1cccc([N+](=O)[O-])c1)C[C@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC001473416821 1065259799 /nfs/dbraw/zinc/25/97/99/1065259799.db2.gz VIOLRXNMFWDQAT-OAQYLSRUSA-N 2 2 369.465 2.706 20 5 FFBDLP C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@]1(O)CC[NH+](Cc2ccccc2)C1 ZINC001473416821 1065259808 /nfs/dbraw/zinc/25/98/08/1065259808.db2.gz VIOLRXNMFWDQAT-OAQYLSRUSA-N 2 2 369.465 2.706 20 5 FFBDLP C[NH+](CCc1cccc([N+](=O)[O-])c1)C[C@]1(O)CC[N@H+](Cc2ccccc2)C1 ZINC001473416821 1065259818 /nfs/dbraw/zinc/25/98/18/1065259818.db2.gz VIOLRXNMFWDQAT-OAQYLSRUSA-N 2 2 369.465 2.706 20 5 FFBDLP C[NH+](CCc1cccc([N+](=O)[O-])c1)C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC001473416821 1065259828 /nfs/dbraw/zinc/25/98/28/1065259828.db2.gz VIOLRXNMFWDQAT-OAQYLSRUSA-N 2 2 369.465 2.706 20 5 FFBDLP O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@@H](Cn2cc[nH+]c2)c2ccccc2)cc1 ZINC001473748185 1065344259 /nfs/dbraw/zinc/34/42/59/1065344259.db2.gz WLJZDVREEMSSNX-OALUTQOASA-N 2 2 352.394 2.856 20 5 FFBDLP CC(C)c1ccc(C(=O)N[C@@H]2CC[N@@H+](C3CC[NH+](C)CC3)C2)cc1[N+](=O)[O-] ZINC000375534635 512381356 /nfs/dbraw/zinc/38/13/56/512381356.db2.gz QEGZIPKHAJGOGD-MRXNPFEDSA-N 2 2 374.485 2.617 20 5 FFBDLP CC(C)c1ccc(C(=O)N[C@@H]2CC[N@H+](C3CC[NH+](C)CC3)C2)cc1[N+](=O)[O-] ZINC000375534635 512381358 /nfs/dbraw/zinc/38/13/58/512381358.db2.gz QEGZIPKHAJGOGD-MRXNPFEDSA-N 2 2 374.485 2.617 20 5 FFBDLP COc1cc(C[N@@H+]2CC[C@@H](C[NH+](C)C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000113512326 508270152 /nfs/dbraw/zinc/27/01/52/508270152.db2.gz CKYVEUBTIOMVCF-NSHDSACASA-N 2 2 359.373 2.588 20 5 FFBDLP COc1cc(C[N@H+]2CC[C@@H](C[NH+](C)C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000113512326 508270153 /nfs/dbraw/zinc/27/01/53/508270153.db2.gz CKYVEUBTIOMVCF-NSHDSACASA-N 2 2 359.373 2.588 20 5 FFBDLP C[NH+](C)CCC1CC[NH+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000118868430 508688383 /nfs/dbraw/zinc/68/83/83/508688383.db2.gz NGNSGTQUAVWHMD-UHFFFAOYSA-N 2 2 368.865 2.850 20 5 FFBDLP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H](C)C1 ZINC000245437697 509933917 /nfs/dbraw/zinc/93/39/17/509933917.db2.gz RRAUKAZGKSQIFP-XJKSGUPXSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[N@H+]1CC[C@@H]([NH+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H](C)C1 ZINC000245437697 509933923 /nfs/dbraw/zinc/93/39/23/509933923.db2.gz RRAUKAZGKSQIFP-XJKSGUPXSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[NH+]1CC[C@@H]([N@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H](C)C1 ZINC000245437697 509933925 /nfs/dbraw/zinc/93/39/25/509933925.db2.gz RRAUKAZGKSQIFP-XJKSGUPXSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H](C)C1 ZINC000245437697 509933930 /nfs/dbraw/zinc/93/39/30/509933930.db2.gz RRAUKAZGKSQIFP-XJKSGUPXSA-N 2 2 359.430 2.807 20 5 FFBDLP CC[N@@H+]1CC[C@H]([NH+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@H](C)C1 ZINC000174773845 510304233 /nfs/dbraw/zinc/30/42/33/510304233.db2.gz OYJZDIHMMSOEPM-WBMJQRKESA-N 2 2 368.865 2.849 20 5 FFBDLP CC[N@H+]1CC[C@H]([NH+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@H](C)C1 ZINC000174773845 510304238 /nfs/dbraw/zinc/30/42/38/510304238.db2.gz OYJZDIHMMSOEPM-WBMJQRKESA-N 2 2 368.865 2.849 20 5 FFBDLP CC[NH+]1CC[C@H]([N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@H](C)C1 ZINC000174773845 510304244 /nfs/dbraw/zinc/30/42/44/510304244.db2.gz OYJZDIHMMSOEPM-WBMJQRKESA-N 2 2 368.865 2.849 20 5 FFBDLP CC[NH+]1CC[C@H]([N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@H](C)C1 ZINC000174773845 510304246 /nfs/dbraw/zinc/30/42/46/510304246.db2.gz OYJZDIHMMSOEPM-WBMJQRKESA-N 2 2 368.865 2.849 20 5 FFBDLP Cn1cc[nH+]c1C[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000194590000 510435318 /nfs/dbraw/zinc/43/53/18/510435318.db2.gz CWORRBGUFZICEU-CYBMUJFWSA-N 2 2 359.386 2.691 20 5 FFBDLP Cn1cc[nH+]c1C[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000194590000 510435327 /nfs/dbraw/zinc/43/53/27/510435327.db2.gz CWORRBGUFZICEU-CYBMUJFWSA-N 2 2 359.386 2.691 20 5 FFBDLP CCOc1cc(C[N@@H+]2CCO[C@@H]3C[C@@H]([NH+](C)C)CC[C@@H]32)ccc1[N+](=O)[O-] ZINC000365188767 511307787 /nfs/dbraw/zinc/30/77/87/511307787.db2.gz GAIIPLKMWKIBAR-TXPKVOOTSA-N 2 2 363.458 2.677 20 5 FFBDLP CCOc1cc(C[N@H+]2CCO[C@@H]3C[C@@H]([NH+](C)C)CC[C@@H]32)ccc1[N+](=O)[O-] ZINC000365188767 511307792 /nfs/dbraw/zinc/30/77/92/511307792.db2.gz GAIIPLKMWKIBAR-TXPKVOOTSA-N 2 2 363.458 2.677 20 5 FFBDLP C[C@H](Nc1ccc(N2CC[C@H]([NH+](C)C)C2)c[nH+]1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000284985840 511957091 /nfs/dbraw/zinc/95/70/91/511957091.db2.gz GHDVTXUSDOLILN-BBRMVZONSA-N 2 2 370.457 2.885 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@@H+]2Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000374426291 512827923 /nfs/dbraw/zinc/82/79/23/512827923.db2.gz DCFVKCCDCGNGLO-BFYDXBDKSA-N 2 2 353.850 2.932 20 5 FFBDLP C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCC[N@H+]2Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000374426291 512827925 /nfs/dbraw/zinc/82/79/25/512827925.db2.gz DCFVKCCDCGNGLO-BFYDXBDKSA-N 2 2 353.850 2.932 20 5 FFBDLP CCCN(CC[NH+](CC)CC)C(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1 ZINC000450633018 513281208 /nfs/dbraw/zinc/28/12/08/513281208.db2.gz VPGOBNZBENJQTD-UHFFFAOYSA-N 2 2 373.457 2.975 20 5 FFBDLP C[C@@H]1C[N@@H+](CCCCNc2[nH+]ccc3ccc([N+](=O)[O-])cc32)C[C@H](C)O1 ZINC000413179974 513502660 /nfs/dbraw/zinc/50/26/60/513502660.db2.gz DCFCCUFNSSXUCN-GASCZTMLSA-N 2 2 358.442 2.866 20 5 FFBDLP C[C@@H]1C[N@H+](CCCCNc2[nH+]ccc3ccc([N+](=O)[O-])cc32)C[C@H](C)O1 ZINC000413179974 513502668 /nfs/dbraw/zinc/50/26/68/513502668.db2.gz DCFCCUFNSSXUCN-GASCZTMLSA-N 2 2 358.442 2.866 20 5 FFBDLP COc1cc(C[N@@H+]2CCC[C@H]([C@@H](C)[NH3+])C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000435372741 513567693 /nfs/dbraw/zinc/56/76/93/513567693.db2.gz CDEAVCXIKUJYMR-NEPJUHHUSA-N 2 2 373.400 2.807 20 5 FFBDLP COc1cc(C[N@H+]2CCC[C@H]([C@@H](C)[NH3+])C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000435372741 513567697 /nfs/dbraw/zinc/56/76/97/513567697.db2.gz CDEAVCXIKUJYMR-NEPJUHHUSA-N 2 2 373.400 2.807 20 5 FFBDLP Cn1cc[nH+]c1CN(Cc1ccc([N+](=O)[O-])cc1F)[C@H]1CC12CC[NH2+]CC2 ZINC000435432565 513584843 /nfs/dbraw/zinc/58/48/43/513584843.db2.gz NRYKXPYHJHXWSF-KRWDZBQOSA-N 2 2 373.432 2.612 20 5 FFBDLP CC[NH2+]CC1CC[NH+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000430549175 513683530 /nfs/dbraw/zinc/68/35/30/513683530.db2.gz MZXCTJVXFQIZCY-UHFFFAOYSA-N 2 2 354.838 2.508 20 5 FFBDLP C[NH2+]C[C@@H]1CCC[N@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])C1 ZINC000430622106 513705620 /nfs/dbraw/zinc/70/56/20/513705620.db2.gz FCELIFRKPPEFPA-NSHDSACASA-N 2 2 359.373 2.636 20 5 FFBDLP C[NH2+]C[C@@H]1CCC[N@@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])C1 ZINC000430622106 513705622 /nfs/dbraw/zinc/70/56/22/513705622.db2.gz FCELIFRKPPEFPA-NSHDSACASA-N 2 2 359.373 2.636 20 5 FFBDLP CC(C)(C)[NH+]1CCC(NC(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)CC1 ZINC000448752443 513880009 /nfs/dbraw/zinc/88/00/09/513880009.db2.gz WQTIKQNCYWATIR-UHFFFAOYSA-N 2 2 371.441 2.773 20 5 FFBDLP C[NH+](C)CCC1CCN(C(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)CC1 ZINC000448976137 514003608 /nfs/dbraw/zinc/00/36/08/514003608.db2.gz LCGKEIMJWCUXBR-UHFFFAOYSA-N 2 2 371.441 2.584 20 5 FFBDLP CC1(C)CC(NC(=O)c2ccc([N+](=O)[O-])c(-n3cc[nH+]c3)c2)CC(C)(C)[NH2+]1 ZINC000449188291 514105833 /nfs/dbraw/zinc/10/58/33/514105833.db2.gz KFEKOJHEHONIKI-UHFFFAOYSA-N 2 2 371.441 2.820 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCC[N@H+]1CCCO ZINC000449386007 514189696 /nfs/dbraw/zinc/18/96/96/514189696.db2.gz HBSZHWGOTIQTDG-WDSOQIARSA-N 2 2 361.486 2.742 20 5 FFBDLP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCC[N@@H+]1CCCO ZINC000449386007 514189699 /nfs/dbraw/zinc/18/96/99/514189699.db2.gz HBSZHWGOTIQTDG-WDSOQIARSA-N 2 2 361.486 2.742 20 5 FFBDLP O=[N+]([O-])c1cccc([C@H]([NH2+]C[C@H](O)C[NH+]2CCCC2)c2ccccc2)c1 ZINC000490149313 515123631 /nfs/dbraw/zinc/12/36/31/515123631.db2.gz ITGFSVNKUFKHFO-VQTJNVASSA-N 2 2 355.438 2.731 20 5 FFBDLP O=[N+]([O-])c1ccc2[nH]c(C[NH+]3CCC(OCC[NH+]4CCCC4)CC3)nc2c1 ZINC000482703779 515775402 /nfs/dbraw/zinc/77/54/02/515775402.db2.gz FIPVAUQZBBLMDU-UHFFFAOYSA-N 2 2 373.457 2.548 20 5 FFBDLP O=[N+]([O-])c1cc(C[NH+]2CCC(Nc3cccc[nH+]3)CC2)c2c(c1)COCO2 ZINC000535577239 516409776 /nfs/dbraw/zinc/40/97/76/516409776.db2.gz ZZQNTUNGARYGTG-UHFFFAOYSA-N 2 2 370.409 2.933 20 5 FFBDLP Cc1ccc([C@@H](C[NH2+]C[C@H](O)COc2ccccc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000579111165 518526791 /nfs/dbraw/zinc/52/67/91/518526791.db2.gz VGLGRIOTDIYSBP-PKOBYXMFSA-N 2 2 373.453 2.535 20 5 FFBDLP Cc1cc(N(C)[C@@H]2CC[N@@H+](C3CC[NH+](C)CC3)C2)c(F)cc1[N+](=O)[O-] ZINC000589687925 519064498 /nfs/dbraw/zinc/06/44/98/519064498.db2.gz RPIYNPNLXPOFRY-OAHLLOKOSA-N 2 2 350.438 2.647 20 5 FFBDLP Cc1cc(N(C)[C@@H]2CC[N@H+](C3CC[NH+](C)CC3)C2)c(F)cc1[N+](=O)[O-] ZINC000589687925 519064502 /nfs/dbraw/zinc/06/45/02/519064502.db2.gz RPIYNPNLXPOFRY-OAHLLOKOSA-N 2 2 350.438 2.647 20 5 FFBDLP CC[N@H+](CCNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-])C(C)C ZINC000565865066 519167787 /nfs/dbraw/zinc/16/77/87/519167787.db2.gz HTEMRUKYCVJBJQ-UHFFFAOYSA-N 2 2 350.463 2.569 20 5 FFBDLP CC[N@@H+](CCNc1cc(C[NH+]2CCOCC2)ccc1[N+](=O)[O-])C(C)C ZINC000565865066 519167798 /nfs/dbraw/zinc/16/77/98/519167798.db2.gz HTEMRUKYCVJBJQ-UHFFFAOYSA-N 2 2 350.463 2.569 20 5 FFBDLP O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CC[C@H](n4c[nH+]c5c4CCCC5)C3)nc2c1 ZINC000578212777 519476651 /nfs/dbraw/zinc/47/66/51/519476651.db2.gz XKUQWNROOHHBDT-AWEZNQCLSA-N 2 2 366.425 2.993 20 5 FFBDLP O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@H](n4c[nH+]c5c4CCCC5)C3)nc2c1 ZINC000578212777 519476656 /nfs/dbraw/zinc/47/66/56/519476656.db2.gz XKUQWNROOHHBDT-AWEZNQCLSA-N 2 2 366.425 2.993 20 5 FFBDLP COc1cc(C[N@H+](C2CC2)C2CC[NH2+]CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000592471374 520402605 /nfs/dbraw/zinc/40/26/05/520402605.db2.gz ZLKJNGGWWOOYAC-UHFFFAOYSA-N 2 2 371.384 2.921 20 5 FFBDLP COc1cc(C[N@@H+](C2CC2)C2CC[NH2+]CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000592471374 520402615 /nfs/dbraw/zinc/40/26/15/520402615.db2.gz ZLKJNGGWWOOYAC-UHFFFAOYSA-N 2 2 371.384 2.921 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@H]([C@H]4CCC[NH2+]4)C3)n2)c1 ZINC000592478692 520407617 /nfs/dbraw/zinc/40/76/17/520407617.db2.gz IGEFJCQRQNEVED-GOEBONIOSA-N 2 2 357.414 2.609 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@H]([C@H]4CCC[NH2+]4)C3)n2)c1 ZINC000592478692 520407624 /nfs/dbraw/zinc/40/76/24/520407624.db2.gz IGEFJCQRQNEVED-GOEBONIOSA-N 2 2 357.414 2.609 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]3)C2)cccc1[N+](=O)[O-] ZINC000592479179 520407647 /nfs/dbraw/zinc/40/76/47/520407647.db2.gz UELHPKXRGZVSIC-ZMSDIMECSA-N 2 2 360.458 2.694 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@@H]([C@H]3CCC[NH2+]3)C2)cccc1[N+](=O)[O-] ZINC000592479179 520407651 /nfs/dbraw/zinc/40/76/51/520407651.db2.gz UELHPKXRGZVSIC-ZMSDIMECSA-N 2 2 360.458 2.694 20 5 FFBDLP O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC[C@H]([NH+]3CCOCC3)CC2)cc1 ZINC000595469667 520490914 /nfs/dbraw/zinc/49/09/14/520490914.db2.gz IUZKHLNZIHBBOC-KRWDZBQOSA-N 2 2 363.458 2.550 20 5 FFBDLP O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@H]([NH+]3CCOCC3)CC2)cc1 ZINC000595469667 520490920 /nfs/dbraw/zinc/49/09/20/520490920.db2.gz IUZKHLNZIHBBOC-KRWDZBQOSA-N 2 2 363.458 2.550 20 5 FFBDLP O=[N+]([O-])c1cc2c(cc1C[NH2+]C[C@H]1CCC[N@H+](CC3CC3)C1)OCCO2 ZINC000596058780 520885552 /nfs/dbraw/zinc/88/55/52/520885552.db2.gz JDHOJLITJQQJEX-OAHLLOKOSA-N 2 2 361.442 2.578 20 5 FFBDLP O=[N+]([O-])c1cc2c(cc1C[NH2+]C[C@H]1CCC[N@@H+](CC3CC3)C1)OCCO2 ZINC000596058780 520885557 /nfs/dbraw/zinc/88/55/57/520885557.db2.gz JDHOJLITJQQJEX-OAHLLOKOSA-N 2 2 361.442 2.578 20 5 FFBDLP Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@H](n3cc[nH+]c3)C2)cccc1[N+](=O)[O-] ZINC000610945208 520912244 /nfs/dbraw/zinc/91/22/44/520912244.db2.gz SQLPIECGDSEDIQ-CABCVRRESA-N 2 2 357.414 2.764 20 5 FFBDLP Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@H](n3cc[nH+]c3)C2)cccc1[N+](=O)[O-] ZINC000610945208 520912248 /nfs/dbraw/zinc/91/22/48/520912248.db2.gz SQLPIECGDSEDIQ-CABCVRRESA-N 2 2 357.414 2.764 20 5 FFBDLP C[NH2+]C[C@H](C)[NH2+]Cc1ccc(OCc2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000596103110 520914703 /nfs/dbraw/zinc/91/47/03/520914703.db2.gz AGGAYVWMVNDPIO-AWEZNQCLSA-N 2 2 359.426 2.880 20 5 FFBDLP COCCC[NH+]1CCC([NH2+][C@@H](C)c2cc(OC)cc([N+](=O)[O-])c2)CC1 ZINC000903086859 736028679 /nfs/dbraw/zinc/02/86/79/736028679.db2.gz BBOYPAYDFDFNRK-AWEZNQCLSA-N 2 2 351.447 2.755 20 5 FFBDLP COc1cc([C@H](C)[NH2+]CCC[N@@H+]2CCCO[C@H](C)C2)cc([N+](=O)[O-])c1 ZINC000903160466 736045164 /nfs/dbraw/zinc/04/51/64/736045164.db2.gz MMOYSLOTQZGUPN-CABCVRRESA-N 2 2 351.447 2.755 20 5 FFBDLP COc1cc([C@H](C)[NH2+]CCC[N@H+]2CCCO[C@H](C)C2)cc([N+](=O)[O-])c1 ZINC000903160466 736045168 /nfs/dbraw/zinc/04/51/68/736045168.db2.gz MMOYSLOTQZGUPN-CABCVRRESA-N 2 2 351.447 2.755 20 5 FFBDLP O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+]C[C@@H]2C[NH2+]CCC2(F)F)c1 ZINC000903955410 736195027 /nfs/dbraw/zinc/19/50/27/736195027.db2.gz RDWGCZRYYUFDLN-JTQLQIEISA-N 2 2 351.300 2.531 20 5 FFBDLP O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c1 ZINC000791624121 1002748356 /nfs/dbraw/zinc/74/83/56/1002748356.db2.gz XVWJNIFWYZXCNS-ZVDOUQERSA-N 2 2 367.449 2.692 20 5 FFBDLP O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)c1 ZINC000791624121 1002748364 /nfs/dbraw/zinc/74/83/64/1002748364.db2.gz XVWJNIFWYZXCNS-ZVDOUQERSA-N 2 2 367.449 2.692 20 5 FFBDLP O=[N+]([O-])c1cccc([C@@H](O)C[NH+]2C[C@H]3C[N@H+](Cc4ccccc4)C[C@H]3C2)c1 ZINC000791624121 1002748372 /nfs/dbraw/zinc/74/83/72/1002748372.db2.gz XVWJNIFWYZXCNS-ZVDOUQERSA-N 2 2 367.449 2.692 20 5 FFBDLP O=[N+]([O-])c1cccc([C@@H](O)C[NH+]2C[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]3C2)c1 ZINC000791624121 1002748381 /nfs/dbraw/zinc/74/83/81/1002748381.db2.gz XVWJNIFWYZXCNS-ZVDOUQERSA-N 2 2 367.449 2.692 20 5 FFBDLP C[C@@H]1CC[N@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H]1n1cc[nH+]c1 ZINC000246635779 1026303995 /nfs/dbraw/zinc/30/39/95/1026303995.db2.gz OOZXQPLWAAWOJO-RHSMWYFYSA-N 2 2 367.413 2.590 20 5 FFBDLP C[C@@H]1CC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H]1n1cc[nH+]c1 ZINC000246635779 1026304005 /nfs/dbraw/zinc/30/40/05/1026304005.db2.gz OOZXQPLWAAWOJO-RHSMWYFYSA-N 2 2 367.413 2.590 20 5 FFBDLP O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[NH+](C[C@@H]2CCC[NH2+]C2)CC1 ZINC001328398764 1048287272 /nfs/dbraw/zinc/28/72/72/1048287272.db2.gz MYJFJKPWYKOHAL-CYBMUJFWSA-N 2 2 372.391 2.735 20 5 FFBDLP O=[N+]([O-])c1cc(-c2nc([C@@H]3C[NH+]4CCC3CC4)no2)ccc1-n1cc[nH+]c1 ZINC001342547522 1051150956 /nfs/dbraw/zinc/15/09/56/1051150956.db2.gz YXBGRFQQPXTSFG-CQSZACIVSA-N 2 2 366.381 2.640 20 5 FFBDLP Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)cccc1[N+](=O)[O-] ZINC000267398035 251345846 /nfs/dbraw/zinc/34/58/46/251345846.db2.gz FHHSJYSHPAQTLG-ZIAGYGMSSA-N 2 2 357.414 2.833 20 5 FFBDLP Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)cccc1[N+](=O)[O-] ZINC000267398035 251345851 /nfs/dbraw/zinc/34/58/51/251345851.db2.gz FHHSJYSHPAQTLG-ZIAGYGMSSA-N 2 2 357.414 2.833 20 5 FFBDLP CN(C)C(=O)[C@@H]1CCC[N@@H+]1CCC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000278160380 256283146 /nfs/dbraw/zinc/28/31/46/256283146.db2.gz AVIXKCMPLYYDDY-MOPGFXCFSA-N 2 2 374.485 2.505 20 5 FFBDLP CN(C)C(=O)[C@@H]1CCC[N@H+]1CCC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000278160380 256283147 /nfs/dbraw/zinc/28/31/47/256283147.db2.gz AVIXKCMPLYYDDY-MOPGFXCFSA-N 2 2 374.485 2.505 20 5 FFBDLP CCN1CC[NH+]([C@@H]2CCN(c3cc(C)[nH+]c4ccc([N+](=O)[O-])cc43)C2)CC1 ZINC000302155551 258091569 /nfs/dbraw/zinc/09/15/69/258091569.db2.gz IRNZJNMKINTRAI-QGZVFWFLSA-N 2 2 369.469 2.668 20 5 FFBDLP CC(C)(CNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1)[NH+]1CCCCC1 ZINC000042159667 506604836 /nfs/dbraw/zinc/60/48/36/506604836.db2.gz VRFYSNZKCQSKJL-UHFFFAOYSA-N 2 2 371.441 2.775 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[NH+]3CCC(C[NH+]4CCCC4)CC3)n2)c1 ZINC000047970112 507426013 /nfs/dbraw/zinc/42/60/13/507426013.db2.gz XKJYTEOPAXZXTF-UHFFFAOYSA-N 2 2 371.441 2.953 20 5 FFBDLP COc1cc(C[N@@H+]2CC[C@@H](C)[C@@H](n3cc[nH+]c3)C2)c([N+](=O)[O-])cc1OC ZINC000091960394 508027511 /nfs/dbraw/zinc/02/75/11/508027511.db2.gz AJYAHHVFNQUKTA-CJNGLKHVSA-N 2 2 360.414 2.892 20 5 FFBDLP COc1cc(C[N@H+]2CC[C@@H](C)[C@@H](n3cc[nH+]c3)C2)c([N+](=O)[O-])cc1OC ZINC000091960394 508027513 /nfs/dbraw/zinc/02/75/13/508027513.db2.gz AJYAHHVFNQUKTA-CJNGLKHVSA-N 2 2 360.414 2.892 20 5 FFBDLP O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000116276849 508493411 /nfs/dbraw/zinc/49/34/11/508493411.db2.gz MBJSWHLMVATIPB-UHFFFAOYSA-N 2 2 353.850 2.792 20 5 FFBDLP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cccnc1N1CC[NH+](C)CC1 ZINC000158482215 508710480 /nfs/dbraw/zinc/71/04/80/508710480.db2.gz RSLXCLSVSPARSI-INIZCTEOSA-N 2 2 369.469 2.901 20 5 FFBDLP C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000123744066 508732855 /nfs/dbraw/zinc/73/28/55/508732855.db2.gz MQOHHRHEPCOFNP-HUUCEWRRSA-N 2 2 371.441 2.610 20 5 FFBDLP C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000123744066 508732858 /nfs/dbraw/zinc/73/28/58/508732858.db2.gz MQOHHRHEPCOFNP-HUUCEWRRSA-N 2 2 371.441 2.610 20 5 FFBDLP C[NH+]1CCC([N@H+](CCO)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000155498328 509013439 /nfs/dbraw/zinc/01/34/39/509013439.db2.gz VXZYJOGFLBZWEO-UHFFFAOYSA-N 2 2 359.426 2.743 20 5 FFBDLP C[NH+]1CCC([N@@H+](CCO)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000155498328 509013442 /nfs/dbraw/zinc/01/34/42/509013442.db2.gz VXZYJOGFLBZWEO-UHFFFAOYSA-N 2 2 359.426 2.743 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@H](Oc2cc[nH+]cc2)C1 ZINC000156321246 509159656 /nfs/dbraw/zinc/15/96/56/509159656.db2.gz CSMOOTNPRSLFMV-KRWDZBQOSA-N 2 2 370.409 2.780 20 5 FFBDLP Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](Oc2cc[nH+]cc2)C1 ZINC000156321246 509159661 /nfs/dbraw/zinc/15/96/61/509159661.db2.gz CSMOOTNPRSLFMV-KRWDZBQOSA-N 2 2 370.409 2.780 20 5 FFBDLP COc1ccc(NC(=O)CC[N@@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)c([N+](=O)[O-])c1 ZINC000266944798 509270441 /nfs/dbraw/zinc/27/04/41/509270441.db2.gz SIDKHURHZWKAPR-ZDUSSCGKSA-N 2 2 373.413 2.535 20 5 FFBDLP COc1ccc(NC(=O)CC[N@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)c([N+](=O)[O-])c1 ZINC000266944798 509270444 /nfs/dbraw/zinc/27/04/44/509270444.db2.gz SIDKHURHZWKAPR-ZDUSSCGKSA-N 2 2 373.413 2.535 20 5 FFBDLP CN(Cc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CC[N@@H+](C2CC[NH+](C)CC2)C1 ZINC000362253498 511155183 /nfs/dbraw/zinc/15/51/83/511155183.db2.gz DWKGTYVKDFUMMQ-KRWDZBQOSA-N 2 2 366.893 2.849 20 5 FFBDLP CN(Cc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CC[NH+](C)CC2)C1 ZINC000362253498 511155187 /nfs/dbraw/zinc/15/51/87/511155187.db2.gz DWKGTYVKDFUMMQ-KRWDZBQOSA-N 2 2 366.893 2.849 20 5 FFBDLP C[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000362253498 511155192 /nfs/dbraw/zinc/15/51/92/511155192.db2.gz DWKGTYVKDFUMMQ-KRWDZBQOSA-N 2 2 366.893 2.849 20 5 FFBDLP C[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000362253498 511155196 /nfs/dbraw/zinc/15/51/96/511155196.db2.gz DWKGTYVKDFUMMQ-KRWDZBQOSA-N 2 2 366.893 2.849 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@@H](Oc3cc[nH+]cc3)C2)cccc1[N+](=O)[O-] ZINC000376559511 512873891 /nfs/dbraw/zinc/87/38/91/512873891.db2.gz WNVPWLPUKDIDCY-GOEBONIOSA-N 2 2 370.409 2.779 20 5 FFBDLP Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H](Oc3cc[nH+]cc3)C2)cccc1[N+](=O)[O-] ZINC000376559511 512873895 /nfs/dbraw/zinc/87/38/95/512873895.db2.gz WNVPWLPUKDIDCY-GOEBONIOSA-N 2 2 370.409 2.779 20 5 FFBDLP Cn1cc[nH+]c1N1CCC(Nc2[nH+]ccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413256314 513551169 /nfs/dbraw/zinc/55/11/69/513551169.db2.gz CKAJSEPNPXSRRB-UHFFFAOYSA-N 2 2 352.398 2.957 20 5 FFBDLP C[NH+](C)C1(CNc2cc(C[NH+]3CCOCC3)ccc2[N+](=O)[O-])CCCC1 ZINC000447804466 513575516 /nfs/dbraw/zinc/57/55/16/513575516.db2.gz YTODXVKPCVWDHR-UHFFFAOYSA-N 2 2 362.474 2.713 20 5 FFBDLP CC[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCC[NH2+]CC1 ZINC000435626609 513642026 /nfs/dbraw/zinc/64/20/26/513642026.db2.gz LCJGMAXRYVDFJD-CYBMUJFWSA-N 2 2 354.838 2.651 20 5 FFBDLP CC[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCC[NH2+]CC1 ZINC000435626609 513642032 /nfs/dbraw/zinc/64/20/32/513642032.db2.gz LCJGMAXRYVDFJD-CYBMUJFWSA-N 2 2 354.838 2.651 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1C[C@H](O)C[N@@H+]1Cc1ccccc1 ZINC000449214768 514116760 /nfs/dbraw/zinc/11/67/60/514116760.db2.gz ZFXITLRAXJXCQE-UXPWSPDFSA-N 2 2 369.465 2.751 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1C[C@H](O)C[N@H+]1Cc1ccccc1 ZINC000449214768 514116768 /nfs/dbraw/zinc/11/67/68/514116768.db2.gz ZFXITLRAXJXCQE-UXPWSPDFSA-N 2 2 369.465 2.751 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1C[C@@H](O)C[N@@H+]1Cc1ccccc1 ZINC000449214767 514117126 /nfs/dbraw/zinc/11/71/26/514117126.db2.gz ZFXITLRAXJXCQE-NSISKUIASA-N 2 2 369.465 2.751 20 5 FFBDLP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1C[C@@H](O)C[N@H+]1Cc1ccccc1 ZINC000449214767 514117138 /nfs/dbraw/zinc/11/71/38/514117138.db2.gz ZFXITLRAXJXCQE-NSISKUIASA-N 2 2 369.465 2.751 20 5 FFBDLP Cn1cc[nH+]c1[C@H](NC[C@@H]1[NH2+]CCCC1(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000423392853 514126640 /nfs/dbraw/zinc/12/66/40/514126640.db2.gz QUWJQURYWVHMJK-DLBZAZTESA-N 2 2 357.458 2.786 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCCC[C@@H]3[C@H]3CC[NH2+]C3)n2)c1 ZINC000420413082 514138580 /nfs/dbraw/zinc/13/85/80/514138580.db2.gz ZPFVPAUHDQNXPO-GOEBONIOSA-N 2 2 357.414 2.609 20 5 FFBDLP O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCCC[C@@H]3[C@H]3CC[NH2+]C3)n2)c1 ZINC000420413082 514138586 /nfs/dbraw/zinc/13/85/86/514138586.db2.gz ZPFVPAUHDQNXPO-GOEBONIOSA-N 2 2 357.414 2.609 20 5 FFBDLP COc1cc(C[NH2+]C[C@@]2(C)CCC[NH2+]C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000414898275 514346684 /nfs/dbraw/zinc/34/66/84/514346684.db2.gz BBSMDACIMIAHED-KRWDZBQOSA-N 2 2 373.400 2.727 20 5 FFBDLP CC[NH+]1CCC([N@@H+]2CCCN(Cc3cccc([N+](=O)[O-])c3C)CC2)CC1 ZINC000420980855 514419350 /nfs/dbraw/zinc/41/93/50/514419350.db2.gz MCEYHYKWJDZCTP-UHFFFAOYSA-N 2 2 360.502 2.895 20 5 FFBDLP CC[NH+]1CCC([N@H+]2CCCN(Cc3cccc([N+](=O)[O-])c3C)CC2)CC1 ZINC000420980855 514419354 /nfs/dbraw/zinc/41/93/54/514419354.db2.gz MCEYHYKWJDZCTP-UHFFFAOYSA-N 2 2 360.502 2.895 20 5 FFBDLP CCC[N@@H+]1CC[C@@H](CNc2cc(C[NH+]3CCOCC3)ccc2[N+](=O)[O-])C1 ZINC000472345129 515236368 /nfs/dbraw/zinc/23/63/68/515236368.db2.gz VJIMWFQAASOZAI-KRWDZBQOSA-N 2 2 362.474 2.571 20 5 FFBDLP CCC[N@H+]1CC[C@@H](CNc2cc(C[NH+]3CCOCC3)ccc2[N+](=O)[O-])C1 ZINC000472345129 515236378 /nfs/dbraw/zinc/23/63/78/515236378.db2.gz VJIMWFQAASOZAI-KRWDZBQOSA-N 2 2 362.474 2.571 20 5 FFBDLP CCOc1cc(C[NH+]2CCN(c3cc[nH+]cc3OC)CC2)ccc1[N+](=O)[O-] ZINC000483220053 515992609 /nfs/dbraw/zinc/99/26/09/515992609.db2.gz NCEVVTOJBZBWMJ-UHFFFAOYSA-N 2 2 372.425 2.719 20 5 FFBDLP CCC[NH+]1CCC(CNC(=O)c2ccc(-n3cc[nH+]c3)c([N+](=O)[O-])c2)CC1 ZINC000524451231 516723658 /nfs/dbraw/zinc/72/36/58/516723658.db2.gz OYFKPZNDTNTGEM-UHFFFAOYSA-N 2 2 371.441 2.632 20 5 FFBDLP C[N@H+](CC[NH2+][C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)Cc1ccccc1 ZINC000572732061 518336406 /nfs/dbraw/zinc/33/64/06/518336406.db2.gz PJVAZPMSLYGULX-ROUUACIJSA-N 2 2 357.458 2.997 20 5 FFBDLP C[N@@H+](CC[NH2+][C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)Cc1ccccc1 ZINC000572732061 518336411 /nfs/dbraw/zinc/33/64/11/518336411.db2.gz PJVAZPMSLYGULX-ROUUACIJSA-N 2 2 357.458 2.997 20 5 FFBDLP C[NH+]1CCC(CCO)([NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000576412875 518581472 /nfs/dbraw/zinc/58/14/72/518581472.db2.gz SYDQMWJKLKCQOQ-UHFFFAOYSA-N 2 2 359.426 2.791 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000589505975 519019254 /nfs/dbraw/zinc/01/92/54/519019254.db2.gz SVUPVLKBWIWCPX-CRAIPNDOSA-N 2 2 373.453 2.830 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000589505975 519019263 /nfs/dbraw/zinc/01/92/63/519019263.db2.gz SVUPVLKBWIWCPX-CRAIPNDOSA-N 2 2 373.453 2.830 20 5 FFBDLP COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000589505975 519019271 /nfs/dbraw/zinc/01/92/71/519019271.db2.gz SVUPVLKBWIWCPX-CRAIPNDOSA-N 2 2 373.453 2.830 20 5 FFBDLP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(F)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000595439691 520472240 /nfs/dbraw/zinc/47/22/40/520472240.db2.gz KCMCNHWRIFMGTP-YOEHRIQHSA-N 2 2 353.438 2.961 20 5 FFBDLP CCOCCC[N@H+]1CC[C@H]([NH2+]Cc2ccc(F)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000595439691 520472247 /nfs/dbraw/zinc/47/22/47/520472247.db2.gz KCMCNHWRIFMGTP-YOEHRIQHSA-N 2 2 353.438 2.961 20 5 FFBDLP Cc1cc(NC[C@@H]2CC[N@@H+](C3CC3)C2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000604508527 520582484 /nfs/dbraw/zinc/58/24/84/520582484.db2.gz HMKQSHPLOWIPJF-AWEZNQCLSA-N 2 2 353.426 2.678 20 5 FFBDLP Cc1cc(NC[C@@H]2CC[N@H+](C3CC3)C2)nc(-c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000604508527 520582491 /nfs/dbraw/zinc/58/24/91/520582491.db2.gz HMKQSHPLOWIPJF-AWEZNQCLSA-N 2 2 353.426 2.678 20 5 FFBDLP C[NH2+]C[C@@H](C)[NH2+]Cc1ccc(OC)c(OCc2ccc([N+](=O)[O-])cc2)c1 ZINC000596103186 520914102 /nfs/dbraw/zinc/91/41/02/520914102.db2.gz BYKXPZYVWRFYLJ-CQSZACIVSA-N 2 2 359.426 2.880 20 5 FFBDLP O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CCC[C@H]([NH+]3CCCC3)CC1)OCCO2 ZINC000611273146 521073789 /nfs/dbraw/zinc/07/37/89/521073789.db2.gz HZPBSDRFEZACRC-INIZCTEOSA-N 2 2 361.442 2.816 20 5 FFBDLP O=[N+]([O-])c1cc2c(cc1C[N@H+]1CCC[C@H]([NH+]3CCCC3)CC1)OCCO2 ZINC000611273146 521073796 /nfs/dbraw/zinc/07/37/96/521073796.db2.gz HZPBSDRFEZACRC-INIZCTEOSA-N 2 2 361.442 2.816 20 5 FFBDLP CC(C)C[N@H+](C)CCCN[C@@H](c1[nH+]ccn1C)c1cccc([N+](=O)[O-])c1 ZINC000593646928 521127882 /nfs/dbraw/zinc/12/78/82/521127882.db2.gz UFWNLTZNZIQAEB-GOSISDBHSA-N 2 2 359.474 2.985 20 5 FFBDLP CC(C)C[N@@H+](C)CCCN[C@@H](c1[nH+]ccn1C)c1cccc([N+](=O)[O-])c1 ZINC000593646928 521127885 /nfs/dbraw/zinc/12/78/85/521127885.db2.gz UFWNLTZNZIQAEB-GOSISDBHSA-N 2 2 359.474 2.985 20 5 FFBDLP C[C@@H]1CCC[C@@H](C)[NH+]1CC[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602568890 521414613 /nfs/dbraw/zinc/41/46/13/521414613.db2.gz ZBVCXFVRPZFUII-HZPDHXFCSA-N 2 2 361.490 2.811 20 5 FFBDLP O=[N+]([O-])c1ccc(N2CCC([NH2+][C@H]3CCC[N@@H+]4CCCC[C@H]34)CC2)cn1 ZINC000602708501 521489867 /nfs/dbraw/zinc/48/98/67/521489867.db2.gz HWFLWNSMBLCCSA-ZWKOTPCHSA-N 2 2 359.474 2.565 20 5 FFBDLP O=[N+]([O-])c1ccc(N2CCC([NH2+][C@H]3CCC[N@H+]4CCCC[C@H]34)CC2)cn1 ZINC000602708501 521489874 /nfs/dbraw/zinc/48/98/74/521489874.db2.gz HWFLWNSMBLCCSA-ZWKOTPCHSA-N 2 2 359.474 2.565 20 5 FFBDLP