smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1cc([N+](=O)[O-])ccc1C[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000430201505 835028819 /nfs/dbraw/zinc/02/88/19/835028819.db2.gz KBLMTLBOEGTEQZ-UHFFFAOYSA-N 2 0 384.480 3.737 20 5 GHBDRP Cc1c([C@H](C)[NH2+]CC2(O)CC[NH+](Cc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000414310002 837033946 /nfs/dbraw/zinc/03/39/46/837033946.db2.gz SNUWNZOODWKQMY-SFHVURJKSA-N 2 0 383.492 3.581 20 5 GHBDRP C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000377992068 838259734 /nfs/dbraw/zinc/25/97/34/838259734.db2.gz BZCYMMPPRGIGHG-SFHVURJKSA-N 2 0 388.556 3.784 20 5 GHBDRP COc1cc(C[NH2+][C@H]2CCCC[C@@H]2C[NH3+])ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414803414 838847276 /nfs/dbraw/zinc/84/72/76/838847276.db2.gz NVKQRLRVUSXGNP-QUCCMNQESA-N 2 0 399.491 3.790 20 5 GHBDRP COc1cc(C[NH2+][C@H]2CCCC[C@H]2C[NH3+])ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414803413 838847330 /nfs/dbraw/zinc/84/73/30/838847330.db2.gz NVKQRLRVUSXGNP-ICSRJNTNSA-N 2 0 399.491 3.790 20 5 GHBDRP COc1cc(C[N@@H+]2CC[C@@H](C)[C@@H](C[NH3+])C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000415123325 839243078 /nfs/dbraw/zinc/24/30/78/839243078.db2.gz JJXIBHABDGNORS-APWZRJJASA-N 2 0 399.491 3.599 20 5 GHBDRP O=[N+]([O-])c1ccc(CCCC[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422922348 847890317 /nfs/dbraw/zinc/89/03/17/847890317.db2.gz QBHOSKYBRQEYAQ-RBBKRZOGSA-N 2 0 381.476 3.763 20 5 GHBDRP COc1ccc(-c2ccc(C[N@@H+]3CC4(C[C@H]3C)CC[NH2+]CC4)o2)c([N+](=O)[O-])c1 ZINC000424379773 850417967 /nfs/dbraw/zinc/41/79/67/850417967.db2.gz PBSKCIZQGMJMRU-OAHLLOKOSA-N 2 0 385.464 3.827 20 5 GHBDRP C[C@@H]1C[C@@H](C[NH3+])C[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000435372852 850420921 /nfs/dbraw/zinc/42/09/21/850420921.db2.gz LENVGPAWTJHCLN-NEPJUHHUSA-N 2 0 394.269 3.786 20 5 GHBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC(C[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000489143244 852044968 /nfs/dbraw/zinc/04/49/68/852044968.db2.gz XVLXWPWNNDMAEM-KURKYZTESA-N 2 0 375.513 3.785 20 5 GHBDRP O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CCC[C@H](C4CC[NH2+]CC4)C3)cs2)c1 ZINC000594735708 858268820 /nfs/dbraw/zinc/26/88/20/858268820.db2.gz NIMLPKAEJWIELW-KRWDZBQOSA-N 2 0 386.521 3.930 20 5 GHBDRP C[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000611303342 859687081 /nfs/dbraw/zinc/68/70/81/859687081.db2.gz ULMOGOPJSYJPJC-UHFFFAOYSA-N 2 0 398.507 3.997 20 5 GHBDRP O=[N+]([O-])c1ccc(N2CCC([NH2+]C3CC[NH+](CC4CCCC4)CC3)CC2)cc1 ZINC000765458055 859978287 /nfs/dbraw/zinc/97/82/87/859978287.db2.gz PSYYPZPVFADHHW-UHFFFAOYSA-N 2 0 386.540 3.808 20 5 GHBDRP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccnc(OCC[NH+](C)C)c1 ZINC000872051589 891131778 /nfs/dbraw/zinc/13/17/78/891131778.db2.gz LOJMVXCKWNAZTH-AWEZNQCLSA-N 2 0 390.509 3.503 20 5 GHBDRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)C1 ZINC000876932469 893392525 /nfs/dbraw/zinc/39/25/25/893392525.db2.gz MXLMCKYAQOYQAL-PBPGXSGUSA-N 2 0 383.496 3.517 20 5 GHBDRP CCOc1ccc([C@H](C)[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1[N+](=O)[O-] ZINC000902504032 922244058 /nfs/dbraw/zinc/24/40/58/922244058.db2.gz VQEIDLGKOOQBFP-LZFQIVBZSA-N 2 0 397.475 3.900 20 5 GHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(CCC[NH+]2CCOCC2)CC1 ZINC000470211997 930456408 /nfs/dbraw/zinc/45/64/08/930456408.db2.gz PBRJPNNSNJEKEJ-KNTRCKAVSA-N 2 0 387.524 3.823 20 5 GHBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO ZINC000468597606 1015833677 /nfs/dbraw/zinc/83/36/77/1015833677.db2.gz DTADXDVGZJAGNL-KELOHDTKSA-N 2 0 395.503 3.745 20 5 GHBDRP [NH3+]CCc1cn(-c2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)c2cc[nH+]cc12 ZINC001160952372 1035104280 /nfs/dbraw/zinc/10/42/80/1035104280.db2.gz XRIARQVGOAXWAF-UHFFFAOYSA-N 2 0 377.379 3.636 20 5 GHBDRP COc1ccc2c(c1)C1(C[C@@H]2[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])CC[NH2+]CC1 ZINC001246131308 1037208060 /nfs/dbraw/zinc/20/80/60/1037208060.db2.gz XHXZYMKWKXPHSI-KKSFZXQISA-N 2 0 395.503 3.890 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH2+]CC1(c3cccc(Cl)c3)CC[NH2+]CC1)C2 ZINC001246428020 1037386716 /nfs/dbraw/zinc/38/67/16/1037386716.db2.gz OIFYXFKSCWILIW-LJQANCHMSA-N 2 0 385.895 3.626 20 5 GHBDRP CC[C@@H]1C[C@@H]([NH2+]CCCNC(=O)c2c3ccccc3nc3ccccc32)CC[NH2+]1 ZINC001246485481 1037433281 /nfs/dbraw/zinc/43/32/81/1037433281.db2.gz UUZGAYUHSKYKRD-MSOLQXFVSA-N 2 0 390.531 3.628 20 5 GHBDRP COc1ccc(C[C@H](C)[N@H+](Cc2ccccc2)C2CC[NH2+]CC2)c([N+](=O)[O-])c1 ZINC001246913470 1037721690 /nfs/dbraw/zinc/72/16/90/1037721690.db2.gz JNGJZGLIOLSOHQ-KRWDZBQOSA-N 2 0 383.492 3.789 20 5 GHBDRP O=[N+]([O-])c1ccc(N2CCC([NH2+]C3CC[NH+](C[C@H]4CC=CCC4)CC3)CC2)cc1 ZINC001254476636 1040264786 /nfs/dbraw/zinc/26/47/86/1040264786.db2.gz VADAZQZYKSSIMB-IBGZPJMESA-N 2 0 398.551 3.974 20 5 GHBDRP Cc1ccc(N(C2CC[NH2+]CC2)C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)nc1 ZINC001254482952 1040271307 /nfs/dbraw/zinc/27/13/07/1040271307.db2.gz NHAPJHNFXBDCQG-UHFFFAOYSA-N 2 0 395.507 3.526 20 5 GHBDRP CC1(C)[C@@H](C[NH2+]CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)C1(F)F ZINC001462453991 1070263793 /nfs/dbraw/zinc/26/37/93/1070263793.db2.gz QVOFOGWYSFPMAF-GOSISDBHSA-N 2 0 381.467 3.730 20 5 GHBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCP(CCC[NH3+])c1ccccc1 ZINC001254549833 1040317504 /nfs/dbraw/zinc/31/75/04/1040317504.db2.gz XKOMUIDVRSVHOF-HSYKDVHTSA-N 2 0 387.464 3.662 20 5 GHBDRP CC1CC[NH+](C2CCC([NH2+][C@H]3CCCC[C@H]3n3ccc([N+](=O)[O-])n3)CC2)CC1 ZINC000573015316 835348710 /nfs/dbraw/zinc/34/87/10/835348710.db2.gz DJYXPRJIDHIZSE-GHBBCFCZSA-N 2 0 389.544 3.908 20 5 GHBDRP COc1ccc(OCC[NH+]2CCC(C[NH+]3CCCCCC3)CC2)c([N+](=O)[O-])c1 ZINC000610367521 838726138 /nfs/dbraw/zinc/72/61/38/838726138.db2.gz PTJNDPUVAHXSAX-UHFFFAOYSA-N 2 0 391.512 3.570 20 5 GHBDRP COc1cc(C[NH2+][C@@H](C)[C@H]2CCC[NH2+]C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414863177 838909289 /nfs/dbraw/zinc/90/92/89/838909289.db2.gz YARZWPQITSNRTJ-LPHOPBHVSA-N 2 0 399.491 3.660 20 5 GHBDRP COc1cc(C[NH2+]CC2(C)CC[NH2+]CC2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000414914244 838978219 /nfs/dbraw/zinc/97/82/19/838978219.db2.gz XRSVMSCELLVVRD-UHFFFAOYSA-N 2 0 399.491 3.662 20 5 GHBDRP [NH3+][C@H]1CCO[C@H](C2CC[NH+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)CC2)C1 ZINC000415126947 839237443 /nfs/dbraw/zinc/23/74/43/839237443.db2.gz QMQQUDKSJASNNJ-UWJYYQICSA-N 2 0 385.464 3.573 20 5 GHBDRP C[C@@H]1C[NH+](CCCC[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000513786497 847576440 /nfs/dbraw/zinc/57/64/40/847576440.db2.gz IATSJNSAVPBHIE-ANTGDGSKSA-N 2 0 389.540 3.785 20 5 GHBDRP CN(c1ccccc1C[N@H+](C)CCc1ccccc1[N+](=O)[O-])C1CC[NH+](C)CC1 ZINC000583170507 849250067 /nfs/dbraw/zinc/25/00/67/849250067.db2.gz BJPCFAMCCUWAES-UHFFFAOYSA-N 2 0 396.535 3.800 20 5 GHBDRP Cc1c(C[NH+]2CCC(CC[NH+]3C[C@@H](C)O[C@H](C)C3)CC2)cccc1[N+](=O)[O-] ZINC000426827509 852442337 /nfs/dbraw/zinc/44/23/37/852442337.db2.gz SHLOVMHTSKGNOC-IAGOWNOFSA-N 2 0 375.513 3.615 20 5 GHBDRP C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000173389271 856901692 /nfs/dbraw/zinc/90/16/92/856901692.db2.gz NCYIXRQJHYZPJE-CVEARBPZSA-N 2 0 386.471 3.898 20 5 GHBDRP C[N@H+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[NH+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C[C@@H]21 ZINC001169021989 871122256 /nfs/dbraw/zinc/12/22/56/871122256.db2.gz MBBJRYCPHMFYMG-RISVGRPXSA-N 2 0 377.554 3.726 20 5 GHBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO ZINC000540988351 872682718 /nfs/dbraw/zinc/68/27/18/872682718.db2.gz KILNUELEASIVDD-DYESRHJHSA-N 2 0 383.492 3.711 20 5 GHBDRP O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCCC[NH+]2CCOCC2)s1 ZINC000102422759 873056562 /nfs/dbraw/zinc/05/65/62/873056562.db2.gz LGTHGDSOCLYLQE-UHFFFAOYSA-N 2 0 375.494 3.525 20 5 GHBDRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000776585899 878236307 /nfs/dbraw/zinc/23/63/07/878236307.db2.gz CSGYDZBEAAKOEL-DYESRHJHSA-N 2 0 375.513 3.605 20 5 GHBDRP COc1ccc(C[C@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001170296671 881317368 /nfs/dbraw/zinc/31/73/68/881317368.db2.gz HMWATFKTFJGKCH-HKUYNNGSSA-N 2 0 383.492 3.646 20 5 GHBDRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H](C)c3cc([N+](=O)[O-])ccc3C)cc2)CC1 ZINC000532446535 885493449 /nfs/dbraw/zinc/49/34/49/885493449.db2.gz FQNADNJFNTTYQU-LJQANCHMSA-N 2 0 396.535 3.892 20 5 GHBDRP C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000866388674 888853651 /nfs/dbraw/zinc/85/36/51/888853651.db2.gz MBDFDPPDSHUTBJ-MRXNPFEDSA-N 2 0 386.471 3.562 20 5 GHBDRP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000872085228 891147378 /nfs/dbraw/zinc/14/73/78/891147378.db2.gz NWYBGCFUORYUGM-OAHLLOKOSA-N 2 0 393.553 3.858 20 5 GHBDRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000876932548 893392834 /nfs/dbraw/zinc/39/28/34/893392834.db2.gz PBNZASUMJSASLM-DZIBYMRMSA-N 2 0 383.496 3.659 20 5 GHBDRP O=C(CC[NH2+]C1CC[NH+](CC2CCCCC2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000818983907 896302526 /nfs/dbraw/zinc/30/25/26/896302526.db2.gz QNFGFEGOONZOGB-UHFFFAOYSA-N 2 0 388.512 3.558 20 5 GHBDRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000819100977 896375096 /nfs/dbraw/zinc/37/50/96/896375096.db2.gz YCJTWJDKKXIAMD-QFIPXVFZSA-N 2 0 395.459 3.643 20 5 GHBDRP C[C@@H]1C[C@H](CC[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)C[N@@H+]1Cc1ccccc1 ZINC000819190180 896460084 /nfs/dbraw/zinc/46/00/84/896460084.db2.gz MQHAVGLAZSGKOK-ZWCUEREDSA-N 2 0 383.492 3.519 20 5 GHBDRP COc1ccc(-c2ccc(C[NH+]3CCC([C@H]4CC[NH2+]C4)CC3)o2)c([N+](=O)[O-])c1 ZINC000568628474 897994308 /nfs/dbraw/zinc/99/43/08/897994308.db2.gz SKVACRAQUKSZHZ-INIZCTEOSA-N 2 0 385.464 3.685 20 5 GHBDRP [NH3+]C[C@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC12CCOCC2 ZINC000570682728 899504212 /nfs/dbraw/zinc/50/42/12/899504212.db2.gz NJEKTCGUMPOKTP-HNNXBMFYSA-N 2 0 387.505 3.511 20 5 GHBDRP CCCC[N@H+](C)CCC[NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173011463 906088919 /nfs/dbraw/zinc/08/89/19/906088919.db2.gz DMCWNNOYIMEETK-UHFFFAOYSA-N 2 0 384.471 3.553 20 5 GHBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC2(CC[N@H+](Cc3cccnc3)C2)CC1 ZINC001173225371 906306657 /nfs/dbraw/zinc/30/66/57/906306657.db2.gz JODACEJFHHFPFY-IBGZPJMESA-N 2 0 394.519 3.909 20 5 GHBDRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000179392764 906491859 /nfs/dbraw/zinc/49/18/59/906491859.db2.gz XSEXFBCDAKBSKG-UHFFFAOYSA-N 2 0 395.463 3.870 20 5 GHBDRP CCC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1cccc([N+](=O)[O-])c1 ZINC000182268634 907174098 /nfs/dbraw/zinc/17/40/98/907174098.db2.gz CPDKOLPGKHKOKJ-VXKWHMMOSA-N 2 0 383.492 3.792 20 5 GHBDRP CCC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1)c1cccc([N+](=O)[O-])c1 ZINC000182268653 907174313 /nfs/dbraw/zinc/17/43/13/907174313.db2.gz CPDKOLPGKHKOKJ-FCHUYYIVSA-N 2 0 383.492 3.792 20 5 GHBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(CCC[NH+]2CCOCC2)CC1 ZINC000470211998 930456737 /nfs/dbraw/zinc/45/67/37/930456737.db2.gz PBRJPNNSNJEKEJ-MNDPQUGUSA-N 2 0 387.524 3.823 20 5 GHBDRP C[C@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000781424791 930840100 /nfs/dbraw/zinc/84/01/00/930840100.db2.gz DFORYHOVZJSMGB-ZWKOTPCHSA-N 2 0 386.540 3.806 20 5 GHBDRP O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)ccc1Br ZINC000843127001 1029817918 /nfs/dbraw/zinc/81/79/18/1029817918.db2.gz NVOORRHTPRWNJW-CABCVRRESA-N 2 0 382.302 3.569 20 5 GHBDRP C[C@@H]1[NH2+]CCC[C@H]1C(=O)Nc1cc2oc3cc(=[NH2+])ccc-3nc2c2ccccc12 ZINC001219369248 1031383875 /nfs/dbraw/zinc/38/38/75/1031383875.db2.gz ARPFBYUEPHDVHV-DZGCQCFKSA-N 2 0 386.455 3.892 20 5 GHBDRP [NH3+][C@@H](Cc1c2ccccc2cc2ccccc21)C(=O)NC[C@@H]([NH3+])c1ccccc1 ZINC001220501567 1031966959 /nfs/dbraw/zinc/96/69/59/1031966959.db2.gz QUYIULWYTCFBQE-BJKOFHAPSA-N 2 0 383.495 3.679 20 5 GHBDRP COc1ccc(C[C@H](C)[N@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c([N+](=O)[O-])c1 ZINC001246936758 1037743047 /nfs/dbraw/zinc/74/30/47/1037743047.db2.gz JNIKNDPZRPLXAV-IRXDYDNUSA-N 2 0 375.513 3.779 20 5 GHBDRP Cc1cc(F)ccc1C[N@H+]([C@H]1Cc2ccc([N+](=O)[O-])cc2C1)C1CC[NH2+]CC1 ZINC001246963044 1037784606 /nfs/dbraw/zinc/78/46/06/1037784606.db2.gz WOKLDKIJXUWQJC-QFIPXVFZSA-N 2 0 383.467 3.764 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH2+][C@@H]1C[C@H]3CC[C@@H](C1)[N@H+]3Cc1ccccc1)C2 ZINC001254577882 1040353938 /nfs/dbraw/zinc/35/39/38/1040353938.db2.gz HHRCLWZIAJXCJU-MYGLTJDJSA-N 2 0 377.488 3.847 20 5 GHBDRP C[N@@H+](Cc1cccc(O)c1)CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001308558529 1050008369 /nfs/dbraw/zinc/00/83/69/1050008369.db2.gz RIAVNTNLMMWKGH-UHFFFAOYSA-N 2 0 383.492 3.687 20 5 GHBDRP CSC1(C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC[NH+](C)CC1 ZINC000582815081 836885665 /nfs/dbraw/zinc/88/56/65/836885665.db2.gz AEFCYQPTJBAASG-SJLPKXTDSA-N 2 0 377.554 3.723 20 5 GHBDRP CC(C)[C@H](C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)N1CC[NH+](C)CC1 ZINC000180070203 837065690 /nfs/dbraw/zinc/06/56/90/837065690.db2.gz WYLHQAMOVOWSMS-XZOQPEGZSA-N 2 0 396.535 3.546 20 5 GHBDRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000180441377 837258215 /nfs/dbraw/zinc/25/82/15/837258215.db2.gz OWKGYARLLKPQHC-AUSIDOKSSA-N 2 0 396.535 3.547 20 5 GHBDRP COc1cc(C[NH2+][C@@H](C)[C@@H]2CCC[NH2+]C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414863178 838909417 /nfs/dbraw/zinc/90/94/17/838909417.db2.gz YARZWPQITSNRTJ-QFBILLFUSA-N 2 0 399.491 3.660 20 5 GHBDRP COc1ccc(C[NH+]2CCC([C@@H](C)[NH3+])CC2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000435396793 850463212 /nfs/dbraw/zinc/46/32/12/850463212.db2.gz YPLJFCKSIWFEQG-MRXNPFEDSA-N 2 0 399.491 3.742 20 5 GHBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000489143243 852045011 /nfs/dbraw/zinc/04/50/11/852045011.db2.gz XVLXWPWNNDMAEM-KSZLIROESA-N 2 0 375.513 3.785 20 5 GHBDRP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000482157292 862751562 /nfs/dbraw/zinc/75/15/62/862751562.db2.gz OCJPPQFZTUNDGD-PXNSSMCTSA-N 2 0 390.528 3.722 20 5 GHBDRP CN1CCC([NH+]2CCC(Nc3ccc([N+](=O)[O-])c(-c4ccccc4)n3)CC2)CC1 ZINC000301849349 858218380 /nfs/dbraw/zinc/21/83/80/858218380.db2.gz DACNBWHLGPWEJJ-UHFFFAOYSA-N 2 0 395.507 3.627 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CC1CC[NH+](Cc3ccncc3)CC1)CCC2 ZINC000595064780 858368482 /nfs/dbraw/zinc/36/84/82/858368482.db2.gz BDDYNUHVJFBINH-JOCHJYFZSA-N 2 0 380.492 3.869 20 5 GHBDRP C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(c2cc(C3CC[NH2+]CC3)[nH]n2)CC1 ZINC000595908659 858715449 /nfs/dbraw/zinc/71/54/49/858715449.db2.gz OLFYAKNRTWENTQ-OAHLLOKOSA-N 2 0 383.496 3.726 20 5 GHBDRP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C2)C1 ZINC000593314721 859380067 /nfs/dbraw/zinc/38/00/67/859380067.db2.gz GKWHSECLDRJTPJ-ZOCZFRKYSA-N 2 0 385.464 3.573 20 5 GHBDRP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000154890088 860314115 /nfs/dbraw/zinc/31/41/15/860314115.db2.gz GUGONDMEVOQREE-HZPDHXFCSA-N 2 0 388.537 3.610 20 5 GHBDRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792878284 881765665 /nfs/dbraw/zinc/76/56/65/881765665.db2.gz UKERFLCFQRIZFI-BEFAXECRSA-N 2 0 384.436 3.503 20 5 GHBDRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)C1 ZINC000447543802 871813885 /nfs/dbraw/zinc/81/38/85/871813885.db2.gz MLLUDHDGFBPZKT-HCXYKTFWSA-N 2 0 377.533 3.623 20 5 GHBDRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000447564555 871870948 /nfs/dbraw/zinc/87/09/48/871870948.db2.gz XTQIOBSFGDUTEZ-UXHICEINSA-N 2 0 385.512 3.905 20 5 GHBDRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000447564556 871871434 /nfs/dbraw/zinc/87/14/34/871871434.db2.gz XTQIOBSFGDUTEZ-VQTJNVASSA-N 2 0 385.512 3.905 20 5 GHBDRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000449499520 874960640 /nfs/dbraw/zinc/96/06/40/874960640.db2.gz MFPYBMNDXQAIAP-GOSISDBHSA-N 2 0 377.448 3.864 20 5 GHBDRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776276554 876150452 /nfs/dbraw/zinc/15/04/52/876150452.db2.gz KNXOLIXRYBPBRX-HTAPYJJXSA-N 2 0 383.492 3.792 20 5 GHBDRP C[C@H]([NH2+]C1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788633840 878225386 /nfs/dbraw/zinc/22/53/86/878225386.db2.gz VGMCZMUCRXGWIK-ZACQAIPSSA-N 2 0 382.508 3.984 20 5 GHBDRP CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)CCCC[NH+](C)C ZINC001184059401 912988113 /nfs/dbraw/zinc/98/81/13/912988113.db2.gz BRWRDUKYCHADCN-UHFFFAOYSA-N 2 0 380.492 3.627 20 5 GHBDRP CCc1ccc([C@@H](NC[C@H]2CC3(CO2)CC[NH2+]CC3)c2ccc([N+](=O)[O-])cc2)o1 ZINC000873293946 891563313 /nfs/dbraw/zinc/56/33/13/891563313.db2.gz RSEVWCIRFHNHRQ-CTNGQTDRSA-N 2 0 399.491 3.588 20 5 GHBDRP COc1ccc(-c2ccc(C[NH+]3CCC([C@@H]4CC[NH2+]C4)CC3)o2)c([N+](=O)[O-])c1 ZINC000568628475 897994141 /nfs/dbraw/zinc/99/41/41/897994141.db2.gz SKVACRAQUKSZHZ-MRXNPFEDSA-N 2 0 385.464 3.685 20 5 GHBDRP Cc1ccc(C[NH+]2C[C@@H]3C[NH+]([C@H](C)Cc4ccc([N+](=O)[O-])cc4)C[C@H]3C2)cc1 ZINC001173223668 906305791 /nfs/dbraw/zinc/30/57/91/906305791.db2.gz GMCAQLPFJNDCBE-STZQEDGTSA-N 2 0 379.504 3.898 20 5 GHBDRP O=[N+]([O-])c1cccc(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c1 ZINC000559326569 932602227 /nfs/dbraw/zinc/60/22/27/932602227.db2.gz OLMYCQHLPHUPNB-NRFANRHFSA-N 2 0 395.503 3.613 20 5 GHBDRP C[C@]1(C[NH2+][C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)CC[N@H+](Cc2ccccc2)C1 ZINC000798934743 932823521 /nfs/dbraw/zinc/82/35/21/932823521.db2.gz HZSMDZNYJXSVQZ-KCZVDYSFSA-N 2 0 397.523 3.777 20 5 GHBDRP COc1ccc(C[C@@H](C)[NH2+]CC2(CC3CCC3)CC[NH2+]CC2)c([N+](=O)[O-])c1 ZINC001246423416 1037381709 /nfs/dbraw/zinc/38/17/09/1037381709.db2.gz JJUWEBPGZQTCGP-MRXNPFEDSA-N 2 0 375.513 3.684 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@@H]2CC[NH2+]C3(CCCCC3)C2)c1F ZINC001246511437 1037449804 /nfs/dbraw/zinc/44/98/04/1037449804.db2.gz IYHHIFLSNNIEDO-HUUCEWRRSA-N 2 0 379.476 3.718 20 5 GHBDRP COc1ccc(C[N@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])C2CC[NH2+]CC2)cc1 ZINC001246968711 1037791306 /nfs/dbraw/zinc/79/13/06/1037791306.db2.gz XDHALPYZBKTCIX-KRWDZBQOSA-N 2 0 383.492 3.789 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@@H+]1CC[C@@H]3C[NH+](Cc4ccccc4)C[C@H]3C1)C2 ZINC001254608259 1040379775 /nfs/dbraw/zinc/37/97/75/1040379775.db2.gz QBBHISUANQEGOE-UNWVZKJWSA-N 2 0 377.488 3.516 20 5 GHBDRP CC[N@H+](CCC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2OC)CC1)CC1CC1 ZINC000430206528 835076804 /nfs/dbraw/zinc/07/68/04/835076804.db2.gz WKROHTHMFRRXKI-UHFFFAOYSA-N 2 0 375.513 3.937 20 5 GHBDRP CC(C)[C@H](C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)N1CC[NH+](C)CC1 ZINC000180070172 837065745 /nfs/dbraw/zinc/06/57/45/837065745.db2.gz WYLHQAMOVOWSMS-GOTSBHOMSA-N 2 0 396.535 3.546 20 5 GHBDRP CN(C)CC[NH+]1CCC(C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000180452914 837268275 /nfs/dbraw/zinc/26/82/75/837268275.db2.gz UDHXUIOYHJUTIA-QHCPKHFHSA-N 2 0 396.535 3.547 20 5 GHBDRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000070870157 838770347 /nfs/dbraw/zinc/77/03/47/838770347.db2.gz ZUTSUFFAXLMWSY-MRXNPFEDSA-N 2 0 384.480 3.553 20 5 GHBDRP COc1ccc(C[NH2+][C@@H]2CCCC[C@H]2C[NH3+])cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414792597 838843287 /nfs/dbraw/zinc/84/32/87/838843287.db2.gz CLKDDDQUJNSREI-AZUAARDMSA-N 2 0 399.491 3.790 20 5 GHBDRP COc1ccc(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414928070 838982804 /nfs/dbraw/zinc/98/28/04/838982804.db2.gz PUXXYRBMRHCOEK-ZWKOTPCHSA-N 2 0 385.464 3.542 20 5 GHBDRP [NH3+][C@H]1CCC[C@@H]([NH2+]Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000414922442 838987908 /nfs/dbraw/zinc/98/79/08/838987908.db2.gz GSUTWQQPQFIPCW-RBUKOAKNSA-N 2 0 391.475 3.807 20 5 GHBDRP [NH3+][C@H]1CCO[C@@H](C2CC[NH+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)CC2)C1 ZINC000415123106 839244344 /nfs/dbraw/zinc/24/43/44/839244344.db2.gz KYLVHSCPOALKSI-LAUBAEHRSA-N 2 0 385.464 3.573 20 5 GHBDRP COc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](C)C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000108428921 853069736 /nfs/dbraw/zinc/06/97/36/853069736.db2.gz QNHCDHQLVXNAPT-IBGZPJMESA-N 2 0 399.491 3.614 20 5 GHBDRP C[NH+](C)CCC[C@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCO1 ZINC000597248305 859392594 /nfs/dbraw/zinc/39/25/94/859392594.db2.gz PTVKXEKGUOMIMP-INIZCTEOSA-N 2 0 389.521 3.866 20 5 GHBDRP COc1ccc(-c2ccc(CN3CC[C@@]4(C3)CCC[N@H+](C)C4)o2)c([N+](=O)[O-])c1 ZINC000552110819 859825421 /nfs/dbraw/zinc/82/54/21/859825421.db2.gz BSUKRCKDNFTAIQ-NRFANRHFSA-N 2 0 385.464 3.781 20 5 GHBDRP Cn1cc(C[NH+]2CCC(CCC[NH+](C)C)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000093688339 860331239 /nfs/dbraw/zinc/33/12/39/860331239.db2.gz FTAFZGFWKYXBTO-UHFFFAOYSA-N 2 0 385.512 3.549 20 5 GHBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1(SC)CC[NH+](C)CC1 ZINC000555003044 865319459 /nfs/dbraw/zinc/31/94/59/865319459.db2.gz RAKOMBKUXPHCCD-OAHLLOKOSA-N 2 0 383.583 3.883 20 5 GHBDRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000447554183 871843734 /nfs/dbraw/zinc/84/37/34/871843734.db2.gz ZGALIIACANFJQE-VQTJNVASSA-N 2 0 385.512 3.905 20 5 GHBDRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000105464809 875299880 /nfs/dbraw/zinc/29/98/80/875299880.db2.gz ZTGJDUHVLMYGOM-INIZCTEOSA-N 2 0 386.471 3.727 20 5 GHBDRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]C[C@H](O)c3ccc([N+](=O)[O-])cc3)cc2)C1 ZINC000776276911 876146489 /nfs/dbraw/zinc/14/64/89/876146489.db2.gz LRYDQGKGTQHSKT-JTSKRJEESA-N 2 0 383.492 3.650 20 5 GHBDRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)[C@@H](C)C1 ZINC000248872529 912506026 /nfs/dbraw/zinc/50/60/26/912506026.db2.gz IGIDIJQEQVPYSV-NDXORKPFSA-N 2 0 375.513 3.699 20 5 GHBDRP Cc1cc([N+](=O)[O-])cc(-n2cc(CC[NH+]3CCC([NH3+])CC3)c3ccccc32)c1F ZINC001170528219 885544518 /nfs/dbraw/zinc/54/45/18/885544518.db2.gz GDNSBOFXXWEMTJ-UHFFFAOYSA-N 2 0 396.466 3.952 20 5 GHBDRP CCOc1ccc([C@H](C)[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000153322974 887652998 /nfs/dbraw/zinc/65/29/98/887652998.db2.gz RYYWDYXAZGXSRK-BBWFWOEESA-N 2 0 379.501 3.534 20 5 GHBDRP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccnc(OCC[NH+](C)C)c1 ZINC000872051590 891131829 /nfs/dbraw/zinc/13/18/29/891131829.db2.gz LOJMVXCKWNAZTH-CQSZACIVSA-N 2 0 390.509 3.503 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)c1F ZINC001173180879 906259354 /nfs/dbraw/zinc/25/93/54/906259354.db2.gz YVOOKBICEOQMFX-CQSZACIVSA-N 2 0 375.444 3.525 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+](Cc2ccccc2)C[C@H](C)C[NH3+])c1F ZINC001173181506 906261924 /nfs/dbraw/zinc/26/19/24/906261924.db2.gz FDCIDBGQDLDMTM-HZPDHXFCSA-N 2 0 389.471 3.771 20 5 GHBDRP C[C@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000284294816 911817267 /nfs/dbraw/zinc/81/72/67/911817267.db2.gz UNYIWBKMAQOQGP-HNNXBMFYSA-N 2 0 384.480 3.501 20 5 GHBDRP CC1CC[NH+](Cc2ccc(C[NH2+]C[C@@H](O)c3cccc([N+](=O)[O-])c3)cc2)CC1 ZINC000749671382 927229149 /nfs/dbraw/zinc/22/91/49/927229149.db2.gz NUYMVXCQJGDFQK-JOCHJYFZSA-N 2 0 383.492 3.650 20 5 GHBDRP C[C@H]([NH2+]CCCN1CC[N@H+](C)C[C@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000467837608 929488032 /nfs/dbraw/zinc/48/80/32/929488032.db2.gz DMJCALWIZDFXML-AVRDEDQJSA-N 2 0 382.508 3.624 20 5 GHBDRP C[NH+]1CCC(C(=O)Nc2cc3oc4cc(=[NH2+])ccc-4nc3c3ccccc23)CC1 ZINC001143313458 1030018510 /nfs/dbraw/zinc/01/85/10/1030018510.db2.gz GFQCYNCTBVEROW-UHFFFAOYSA-N 2 0 386.455 3.846 20 5 GHBDRP C[NH+](C)CCC(C)(C)NC(=O)[C@@H]([NH3+])Cc1c2ccccc2cc2ccccc21 ZINC001220386303 1031921622 /nfs/dbraw/zinc/92/16/22/1031921622.db2.gz OLZQWWPEOKOVLN-QFIPXVFZSA-N 2 0 377.532 3.709 20 5 GHBDRP C[C@@H]([NH2+]CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1)[C@@H](O)c1ccccc1 ZINC001206122807 1033728219 /nfs/dbraw/zinc/72/82/19/1033728219.db2.gz VUGNZFKIAYXDJA-WZONZLPQSA-N 2 0 397.519 3.561 20 5 GHBDRP CC[NH+]1CCC(N(C)C(=O)[C@@H]([NH3+])Cc2c3ccccc3cc3ccccc32)CC1 ZINC001160537674 1034997795 /nfs/dbraw/zinc/99/77/95/1034997795.db2.gz OVOFSVZYVOSTOM-DEOSSOPVSA-N 2 0 389.543 3.806 20 5 GHBDRP CN(C(=O)[C@@H]([NH3+])Cc1c2ccccc2cc2ccccc21)[C@H]1CCCC[C@H]1[NH3+] ZINC001161063812 1035130428 /nfs/dbraw/zinc/13/04/28/1035130428.db2.gz NFRPNTTUIGSHGL-VJBWXMMDSA-N 2 0 375.516 3.591 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH2+]CC1(c3ccc(Cl)cc3)CC[NH2+]CC1)C2 ZINC001246343024 1037303178 /nfs/dbraw/zinc/30/31/78/1037303178.db2.gz ULVSWBFWSADALJ-IBGZPJMESA-N 2 0 385.895 3.626 20 5 GHBDRP CC(C)(C[NH2+]CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1)c1ccccn1 ZINC001462245255 1070115787 /nfs/dbraw/zinc/11/57/87/1070115787.db2.gz CZBGVVHTGDOGKR-UHFFFAOYSA-N 2 0 396.535 3.812 20 5 GHBDRP CC[NH+](CC)C[C@H](O)CNc1cc2oc3cc(=[NH2+])ccc-3nc2c2ccccc12 ZINC001253201993 1039473191 /nfs/dbraw/zinc/47/31/91/1039473191.db2.gz YOOSZTPVVHWNKL-MRXNPFEDSA-N 2 0 390.487 3.680 20 5 GHBDRP C[N@@H+]1CCC[C@H]([NH2+]CCCNC(=O)c2c3ccccc3nc3ccccc32)CC1 ZINC001254514598 1040291182 /nfs/dbraw/zinc/29/11/82/1040291182.db2.gz MWUQTGVHHVFNCR-SFHVURJKSA-N 2 0 390.531 3.582 20 5 GHBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCSCc1ccc(C[NH+](C)C)o1 ZINC001254532324 1040303368 /nfs/dbraw/zinc/30/33/68/1040303368.db2.gz MVEFEROVYSEZFF-HNNXBMFYSA-N 2 0 377.510 3.703 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH2+]CC1CC[NH+](Cc3ccccc3F)CC1)C2 ZINC001254585794 1040359826 /nfs/dbraw/zinc/35/98/26/1040359826.db2.gz OIDDCDNZNWVQFU-HXUWFJFHSA-N 2 0 383.467 3.703 20 5 GHBDRP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cccc(F)c2)[C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254588007 1040361451 /nfs/dbraw/zinc/36/14/51/1040361451.db2.gz UQHOJCZKZVBVBU-ONTIZHBOSA-N 2 0 383.467 3.973 20 5 GHBDRP CCCC[N@H+](C)CC1CC[NH+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000510263216 837151291 /nfs/dbraw/zinc/15/12/91/837151291.db2.gz CPVCZUGGBHHCIC-UHFFFAOYSA-N 2 0 390.528 3.676 20 5 GHBDRP C[C@H]([NH2+]CCCN1CC[N@H+](C)C[C@@H]1c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000480797711 837838688 /nfs/dbraw/zinc/83/86/88/837838688.db2.gz QJLZIKPNZCCLTB-PGRDOPGGSA-N 2 0 382.508 3.624 20 5 GHBDRP O=[N+]([O-])c1ccc(CCCC[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422922346 847890100 /nfs/dbraw/zinc/89/01/00/847890100.db2.gz QBHOSKYBRQEYAQ-IFMALSPDSA-N 2 0 381.476 3.763 20 5 GHBDRP [NH3+]CCCOC1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000435370475 850437128 /nfs/dbraw/zinc/43/71/28/850437128.db2.gz ILSQCQAXJLKLJJ-UHFFFAOYSA-N 2 0 375.494 3.653 20 5 GHBDRP COc1cc(C[N@H+](C)[C@H]2CCC[NH2+]CC2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000435430914 850514376 /nfs/dbraw/zinc/51/43/76/850514376.db2.gz FXQJDFZEJNULJB-IBGZPJMESA-N 2 0 399.491 3.756 20 5 GHBDRP O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CCC[C@H]([C@H]4CCC[NH2+]C4)C3)cs2)c1 ZINC000592433549 857440202 /nfs/dbraw/zinc/44/02/02/857440202.db2.gz APZXDVPHXISNHM-IRXDYDNUSA-N 2 0 386.521 3.930 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C[N@H+]3CC[C@H](O)C3)cc1)CCCC2 ZINC000595066104 858369069 /nfs/dbraw/zinc/36/90/69/858369069.db2.gz BYGIPOOQYQWPQF-GMAHTHKFSA-N 2 0 395.503 3.719 20 5 GHBDRP CCC[C@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000595051975 858380904 /nfs/dbraw/zinc/38/09/04/858380904.db2.gz ZJGVFFXGLPGQRQ-NRFANRHFSA-N 2 0 375.513 3.917 20 5 GHBDRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000160359642 858843798 /nfs/dbraw/zinc/84/37/98/858843798.db2.gz XWWVRPTVRNCRDT-SFHVURJKSA-N 2 0 382.508 3.583 20 5 GHBDRP CC[N@H+](C)Cc1cc(O[C@@H]2CC[NH+]([C@H](C)c3ccccc3[N+](=O)[O-])C2)ccn1 ZINC000856593080 881565503 /nfs/dbraw/zinc/56/55/03/881565503.db2.gz ZIBRFOSCTRTZRQ-VQIMIIECSA-N 2 0 384.480 3.656 20 5 GHBDRP Cc1ccc2c(c1)[C@@H]([NH3+])CCCN2c1ccc([N+](=O)[O-])c(OCC[NH+](C)C)c1 ZINC001169692401 871762685 /nfs/dbraw/zinc/76/26/85/871762685.db2.gz SUWBVWXUAOLXIW-SFHVURJKSA-N 2 0 384.480 3.775 20 5 GHBDRP O=C(CC[NH+]1CCC(C[NH+]2CCCCCC2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000052713757 885390119 /nfs/dbraw/zinc/39/01/19/885390119.db2.gz JVLBRIPQLVPLNI-UHFFFAOYSA-N 2 0 388.512 3.511 20 5 GHBDRP CCC[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1cccc([N+](=O)[O-])c1 ZINC000090522335 885433592 /nfs/dbraw/zinc/43/35/92/885433592.db2.gz PMRCRNRCKCJVBE-ACRUOGEOSA-N 2 0 375.513 3.794 20 5 GHBDRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000237463237 892065871 /nfs/dbraw/zinc/06/58/71/892065871.db2.gz UKSOOHAINPKYQD-QGZVFWFLSA-N 2 0 385.512 3.597 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)c1F ZINC001173181455 906261224 /nfs/dbraw/zinc/26/12/24/906261224.db2.gz WMEWNSBCNFSXAF-JYJNAYRXSA-N 2 0 381.492 3.901 20 5 GHBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1 ZINC000271123868 910789522 /nfs/dbraw/zinc/78/95/22/910789522.db2.gz JZZXIZYHLZQJGQ-IAGOWNOFSA-N 2 0 393.553 3.556 20 5 GHBDRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(C[NH2+]C[C@H](O)c3cccc([N+](=O)[O-])c3)cc2)C1 ZINC000749678411 927232202 /nfs/dbraw/zinc/23/22/02/927232202.db2.gz RTBOJLFJQNWLNA-PNCHPQGNSA-N 2 0 397.519 3.896 20 5 GHBDRP C[C@@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000781424789 930839920 /nfs/dbraw/zinc/83/99/20/930839920.db2.gz DFORYHOVZJSMGB-QZTJIDSGSA-N 2 0 386.540 3.806 20 5 GHBDRP O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cc1 ZINC000781423399 930840415 /nfs/dbraw/zinc/84/04/15/930840415.db2.gz PSQXXILWLZKXGY-KZKAQZJJSA-N 2 0 395.503 3.519 20 5 GHBDRP C[C@]1(C[NH2+][C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)CC[N@H+](Cc2ccccc2)C1 ZINC000798934744 932823596 /nfs/dbraw/zinc/82/35/96/932823596.db2.gz HZSMDZNYJXSVQZ-RZUBCFFCSA-N 2 0 397.523 3.777 20 5 GHBDRP [NH3+][C@@H](Cc1c2ccccc2cc2ccccc21)C(=O)N[C@H]1C[C@H]2CCC[C@@H](C1)[NH2+]2 ZINC001220680867 1032060174 /nfs/dbraw/zinc/06/01/74/1032060174.db2.gz UKENYUZHNQWKPS-SMOZNVCYSA-N 2 0 387.527 3.652 20 5 GHBDRP Cc1ccc2c(c1)[C@H](Nc1cc3c(cc1[N+](=O)[O-])C[NH2+]C3)CC21CC[NH2+]CC1 ZINC001163034830 1026017279 /nfs/dbraw/zinc/01/72/79/1026017279.db2.gz WQALWSFAXIASKN-HXUWFJFHSA-N 2 0 378.476 3.685 20 5 GHBDRP CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)CC[NH+]1CCCCC1 ZINC001142919596 1029695270 /nfs/dbraw/zinc/69/52/70/1029695270.db2.gz RQDIOWFDINWRST-UHFFFAOYSA-N 2 0 392.503 3.771 20 5 GHBDRP COc1ccc2c(c1)C1(C[C@H]2[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC[NH2+]CC1 ZINC001246127789 1037205739 /nfs/dbraw/zinc/20/57/39/1037205739.db2.gz PEDXFJJORGQQPA-KSFYIVLOSA-N 2 0 395.503 3.890 20 5 GHBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC1(Cc2ccccc2F)CC[NH2+]CC1 ZINC001246439148 1037402541 /nfs/dbraw/zinc/40/25/41/1037402541.db2.gz RXFPBFBAHSMCTI-KRWDZBQOSA-N 2 0 385.483 3.867 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH+]2CCC(CC3CC[NH2+]CC3)CC2)c1F ZINC001246978253 1037802272 /nfs/dbraw/zinc/80/22/72/1037802272.db2.gz HDKCEAVVQVMPII-HNNXBMFYSA-N 2 0 393.503 3.775 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@@H+]1CC[C@@H]3C[NH+](Cc4ccccc4)CC[C@@H]3C1)C2 ZINC001254611113 1040384459 /nfs/dbraw/zinc/38/44/59/1040384459.db2.gz VTQKSDHLIOXPEI-PQNGQFLHSA-N 2 0 391.515 3.906 20 5 GHBDRP COc1cc(N2CCC([NH+]3C(C)(C)CC([NH3+])CC3(C)C)CC2)ccc1[N+](=O)[O-] ZINC001256087128 1041517285 /nfs/dbraw/zinc/51/72/85/1041517285.db2.gz PBGQRKQYUYKSSB-UHFFFAOYSA-N 2 0 390.528 3.553 20 5 GHBDRP COc1cc(C[NH2+]CC[C@H]2CCC[NH2+]C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414846646 838887849 /nfs/dbraw/zinc/88/78/49/838887849.db2.gz URJKATVFYWMKGD-QGZVFWFLSA-N 2 0 399.491 3.662 20 5 GHBDRP [NH3+]C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)C1 ZINC000415042964 839109438 /nfs/dbraw/zinc/10/94/38/839109438.db2.gz RMZNZUZGXGZFFJ-VXGBXAGGSA-N 2 0 394.269 3.834 20 5 GHBDRP [NH3+][C@@H]1CCCO[C@@H]1C1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000415101482 839205285 /nfs/dbraw/zinc/20/52/85/839205285.db2.gz BNDDJRYVJNGYQW-TZIWHRDSSA-N 2 0 385.464 3.573 20 5 GHBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCC(CCC[NH+]2CCOCC2)CC1 ZINC000506036953 853031407 /nfs/dbraw/zinc/03/14/07/853031407.db2.gz PIBZJCPXSWDQNA-GOSISDBHSA-N 2 0 375.513 3.789 20 5 GHBDRP CCOc1ccc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1[N+](=O)[O-] ZINC000595067375 858369671 /nfs/dbraw/zinc/36/96/71/858369671.db2.gz PCXWDBGHQRYVNL-KRWDZBQOSA-N 2 0 398.507 3.951 20 5 GHBDRP COc1ccc(C[C@@H](C)[N@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001170352913 881387601 /nfs/dbraw/zinc/38/76/01/881387601.db2.gz UDTMFWLXPNTFIC-QUCCMNQESA-N 2 0 397.519 3.988 20 5 GHBDRP C[C@@H]([NH2+][C@@H](C)CN1CC[NH+](C)CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000154889973 860313909 /nfs/dbraw/zinc/31/39/09/860313909.db2.gz GUGONDMEVOQREE-JKSUJKDBSA-N 2 0 388.537 3.610 20 5 GHBDRP C[C@@H]1C[N@@H+](CCCC[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H](C)O1 ZINC000608837114 865740768 /nfs/dbraw/zinc/74/07/68/865740768.db2.gz QNMPNYFBAWVWFC-CALCHBBNSA-N 2 0 387.480 3.834 20 5 GHBDRP Cc1ccc(C[NH+]2CCC(CC[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)cc1[N+](=O)[O-] ZINC000539861818 869910970 /nfs/dbraw/zinc/91/09/70/869910970.db2.gz LPAXTDNCARCIRO-HDICACEKSA-N 2 0 375.513 3.615 20 5 GHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1 ZINC000526063451 872064442 /nfs/dbraw/zinc/06/44/42/872064442.db2.gz LHRMECWXUIIBRH-QYAIIROKSA-N 2 0 394.519 3.576 20 5 GHBDRP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1[NH2+]CCOc1cccc([N+](=O)[O-])c1 ZINC000460355209 872955729 /nfs/dbraw/zinc/95/57/29/872955729.db2.gz WLXZGWHGNFEUIF-ROUUACIJSA-N 2 0 383.492 3.720 20 5 GHBDRP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCCC[NH+]3CCOCC3)o2)c(Cl)c1 ZINC000237814871 878071850 /nfs/dbraw/zinc/07/18/50/878071850.db2.gz WARUIGQCMYNTSM-UHFFFAOYSA-N 2 0 393.871 3.710 20 5 GHBDRP C[C@H]([NH2+]C1[C@@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788633839 878225674 /nfs/dbraw/zinc/22/56/74/878225674.db2.gz VGMCZMUCRXGWIK-ULQDDVLXSA-N 2 0 382.508 3.984 20 5 GHBDRP CC(C)[NH+]1CCC(O)(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000532119796 881228851 /nfs/dbraw/zinc/22/88/51/881228851.db2.gz HSMIHWVGACWVPA-UHFFFAOYSA-N 2 0 389.521 3.648 20 5 GHBDRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000876930938 893393517 /nfs/dbraw/zinc/39/35/17/893393517.db2.gz HNGYAHGLADCNEU-DZIBYMRMSA-N 2 0 383.496 3.659 20 5 GHBDRP C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCC2(CC[NH+](C)CC2)CC1 ZINC000879249170 894930266 /nfs/dbraw/zinc/93/02/66/894930266.db2.gz HENMJVLEMWGFRO-OAHLLOKOSA-N 2 0 385.468 3.514 20 5 GHBDRP Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000565389346 895586071 /nfs/dbraw/zinc/58/60/71/895586071.db2.gz BKVLJPCLWFNLLH-HDICACEKSA-N 2 0 375.513 3.615 20 5 GHBDRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000818960110 896266859 /nfs/dbraw/zinc/26/68/59/896266859.db2.gz XNFBMIZDEUTVIJ-VGOFRKELSA-N 2 0 383.492 3.650 20 5 GHBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1 ZINC000570497640 899344664 /nfs/dbraw/zinc/34/46/64/899344664.db2.gz VGCBRFASSUGWOT-GOSISDBHSA-N 2 0 383.492 3.581 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH+]1CCC([NH+]3CCC(F)CC3)CC1)CC2 ZINC001172916849 905988471 /nfs/dbraw/zinc/98/84/71/905988471.db2.gz UFPGKIPKAVHRTJ-LJQANCHMSA-N 2 0 375.488 3.741 20 5 GHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H]2C[NH+](Cc3ccccc3)C[C@H]2C1 ZINC001173233276 906317449 /nfs/dbraw/zinc/31/74/49/906317449.db2.gz VDMFDSXPARMPBE-COPCDDAFSA-N 2 0 379.504 3.980 20 5 GHBDRP CCC[C@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000268818505 910031344 /nfs/dbraw/zinc/03/13/44/910031344.db2.gz GCHHSNHHUUEUPS-NRFANRHFSA-N 2 0 398.507 3.517 20 5 GHBDRP O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[NH2+]CCC[C@@H]3CCCCO3)CC2)cc1 ZINC001180631568 910276393 /nfs/dbraw/zinc/27/63/93/910276393.db2.gz DHGFWVZNUONLTP-QFIPXVFZSA-N 2 0 389.540 3.788 20 5 GHBDRP C[NH+]1CCN(Cc2cccc(C[NH2+][C@@H]3CCCc4ccc([N+](=O)[O-])cc43)c2)CC1 ZINC001116821319 933776177 /nfs/dbraw/zinc/77/61/77/933776177.db2.gz LEFGAABTVVAAGP-HSZRJFAPSA-N 2 0 394.519 3.509 20 5 GHBDRP CSC1(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[NH+](C)CC1 ZINC000562083410 934682760 /nfs/dbraw/zinc/68/27/60/934682760.db2.gz TYCZYSWMUBBJQQ-UHFFFAOYSA-N 2 0 375.494 3.772 20 5 GHBDRP CC(C)(C)[PH+](CCCNc1ncc([N+](=O)[O-])c(C2C[NH2+]C2)n1)C(C)(C)C ZINC001162473588 1025761486 /nfs/dbraw/zinc/76/14/86/1025761486.db2.gz UDPJZSMIMBQASH-UHFFFAOYSA-N 2 0 381.461 3.953 20 5 GHBDRP CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)C[C@H]([NH3+])[C@@H](C)CC ZINC001219005881 1031207756 /nfs/dbraw/zinc/20/77/56/1031207756.db2.gz XHTKWVQZJLYVFC-UGSOOPFHSA-N 2 0 380.492 3.659 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)c1F ZINC001246653642 1037528423 /nfs/dbraw/zinc/52/84/23/1037528423.db2.gz IPNAUNRJSZYSAS-RHSMWYFYSA-N 2 0 379.476 3.528 20 5 GHBDRP CC[C@@H](CSC)[N@H+](C)CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001462196849 1070073709 /nfs/dbraw/zinc/07/37/09/1070073709.db2.gz ADCYBVYNORMUOA-IBGZPJMESA-N 2 0 379.570 3.923 20 5 GHBDRP COc1ccc(C[C@@H](C)[N@H+](Cc2ccccc2)C2CC[NH2+]CC2)c([N+](=O)[O-])c1 ZINC001246914072 1037721077 /nfs/dbraw/zinc/72/10/77/1037721077.db2.gz JNGJZGLIOLSOHQ-QGZVFWFLSA-N 2 0 383.492 3.789 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c1F ZINC001246936771 1037741816 /nfs/dbraw/zinc/74/18/16/1037741816.db2.gz JOUQOLLBFMWSAW-JKSUJKDBSA-N 2 0 393.503 3.918 20 5 GHBDRP COc1ccc(C[N@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)C2CC[NH2+]CC2)cc1 ZINC001246955331 1037764421 /nfs/dbraw/zinc/76/44/21/1037764421.db2.gz RZPCGOMBURLFLT-QGZVFWFLSA-N 2 0 383.492 3.789 20 5 GHBDRP C[NH+](C)CC[C@@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 ZINC001254465732 1040252502 /nfs/dbraw/zinc/25/25/02/1040252502.db2.gz IWAKLNXCIMRWGL-JOCHJYFZSA-N 2 0 382.508 3.846 20 5 GHBDRP O=[N+]([O-])c1ccc(N2CCC([N@@H+]3CCCC[C@H]3CC[NH+]3CCCC3)CC2)cc1 ZINC001254479453 1040266169 /nfs/dbraw/zinc/26/61/69/1040266169.db2.gz ZWEJNJSTOWPVHG-FQEVSTJZSA-N 2 0 386.540 3.904 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@@H+]1CC[C@]3(CC[NH+](Cc4ccccc4)C3)C1)C2 ZINC001254604368 1040374105 /nfs/dbraw/zinc/37/41/05/1040374105.db2.gz WIJLVJODGZYBOZ-PKTZIBPZSA-N 2 0 377.488 3.660 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@@H+]1CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C1)C2 ZINC001254604366 1040374299 /nfs/dbraw/zinc/37/42/99/1040374299.db2.gz WIJLVJODGZYBOZ-DHIUTWEWSA-N 2 0 377.488 3.660 20 5 GHBDRP O=[N+]([O-])c1ccc([C@H](O)C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC001325856171 1057374533 /nfs/dbraw/zinc/37/45/33/1057374533.db2.gz XWLLVFUEISFVKU-XGBAPZKQSA-N 2 0 395.503 3.804 20 5 GHBDRP Cc1ccc([C@H](C)[NH2+]CC2(O)CC[NH+](Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000414302171 836996447 /nfs/dbraw/zinc/99/64/47/836996447.db2.gz KEMBASFSYONIOX-SFHVURJKSA-N 2 0 383.492 3.581 20 5 GHBDRP CC(C)c1ccc(C[NH2+]CC2(N)CC[NH+](Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000415140373 839266214 /nfs/dbraw/zinc/26/62/14/839266214.db2.gz YYPDKLQJTFBVCL-UHFFFAOYSA-N 2 0 396.535 3.801 20 5 GHBDRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000599661296 861493654 /nfs/dbraw/zinc/49/36/54/861493654.db2.gz SOZSUFKSABVVSA-KRWDZBQOSA-N 2 0 398.507 3.814 20 5 GHBDRP O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423039609 847951423 /nfs/dbraw/zinc/95/14/23/847951423.db2.gz FRVPGPLDAFWWKF-PXNSSMCTSA-N 2 0 387.867 3.636 20 5 GHBDRP C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(CC[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000426830307 852417809 /nfs/dbraw/zinc/41/78/09/852417809.db2.gz XFEQRRQIDFIGTJ-KURKYZTESA-N 2 0 375.513 3.867 20 5 GHBDRP O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CCC[C@@H](C4CC[NH2+]CC4)C3)cs2)c1 ZINC000594735709 858268646 /nfs/dbraw/zinc/26/86/46/858268646.db2.gz NIMLPKAEJWIELW-QGZVFWFLSA-N 2 0 386.521 3.930 20 5 GHBDRP O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]CC3CC[NH+](C4CCOCC4)CC3)o2)c1 ZINC000594955980 858344810 /nfs/dbraw/zinc/34/48/10/858344810.db2.gz ROKBNDKUZHJTKC-UHFFFAOYSA-N 2 0 399.491 3.835 20 5 GHBDRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000160348861 858826662 /nfs/dbraw/zinc/82/66/62/858826662.db2.gz VDQQPHRKVOCXBK-LJQANCHMSA-N 2 0 396.535 3.892 20 5 GHBDRP COc1ccc(C[C@H](C)[N@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001170352912 881389815 /nfs/dbraw/zinc/38/98/15/881389815.db2.gz UDTMFWLXPNTFIC-ICSRJNTNSA-N 2 0 397.519 3.988 20 5 GHBDRP [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C2)C1 ZINC000593314671 859380569 /nfs/dbraw/zinc/38/05/69/859380569.db2.gz DZSUCKQAYAFVIL-FVJLSDCUSA-N 2 0 385.464 3.573 20 5 GHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1 ZINC000526063452 872064784 /nfs/dbraw/zinc/06/47/84/872064784.db2.gz LHRMECWXUIIBRH-UWUFYVNFSA-N 2 0 394.519 3.576 20 5 GHBDRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000237672065 877760152 /nfs/dbraw/zinc/76/01/52/877760152.db2.gz LIEJVFAHQJURTI-QGZVFWFLSA-N 2 0 385.512 3.740 20 5 GHBDRP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3csc([N+](=O)[O-])c3)CC2)c1 ZINC000237722269 877880901 /nfs/dbraw/zinc/88/09/01/877880901.db2.gz NKBULXBSEKOPJF-UHFFFAOYSA-N 2 0 388.537 3.657 20 5 GHBDRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000776585900 878235736 /nfs/dbraw/zinc/23/57/36/878235736.db2.gz CSGYDZBEAAKOEL-LAUBAEHRSA-N 2 0 375.513 3.605 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H]1CO)CCC2 ZINC000193277346 885198207 /nfs/dbraw/zinc/19/82/07/885198207.db2.gz QSGHIUQZSJKTJB-GGAORHGYSA-N 2 0 395.503 3.719 20 5 GHBDRP CCC1(C[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC[NH+](Cc2ccccc2)CC1 ZINC000819189471 896458213 /nfs/dbraw/zinc/45/82/13/896458213.db2.gz HBWXPTYNDAXKRI-JOCHJYFZSA-N 2 0 397.519 3.910 20 5 GHBDRP O=[N+]([O-])c1cccc([C@H](O)C[NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)c1 ZINC000819323715 896567722 /nfs/dbraw/zinc/56/77/22/896567722.db2.gz PJJKXZMTKFNWPO-SIKLNZKXSA-N 2 0 383.492 3.520 20 5 GHBDRP COc1cc(C[NH+]2CCC(CC[NH3+])CC2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000575321026 901190396 /nfs/dbraw/zinc/19/03/96/901190396.db2.gz PWJCWRSJCZJRMZ-UHFFFAOYSA-N 2 0 399.491 3.743 20 5 GHBDRP C[C@H]1CCCC[N@@H+]1CCC[NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173012099 906089839 /nfs/dbraw/zinc/08/98/39/906089839.db2.gz NWFRQAPXLYTABY-HNNXBMFYSA-N 2 0 396.482 3.696 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]CC2CC[NH+](C3CCC3)CC2)c1F ZINC001173183374 906264349 /nfs/dbraw/zinc/26/43/49/906264349.db2.gz YYHAMWNZCUKNOU-CQSZACIVSA-N 2 0 379.476 3.528 20 5 GHBDRP O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]C2CCC([NH+]3CCCCC3)CC2)n1 ZINC000774217180 911532602 /nfs/dbraw/zinc/53/26/02/911532602.db2.gz LAEOFVIWQYQNQD-BTRQGYIVSA-N 2 0 375.517 3.662 20 5 GHBDRP COc1cc(C[NH2+]C2CCC([NH3+])CC2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000843104951 1029809988 /nfs/dbraw/zinc/80/99/88/1029809988.db2.gz PARYYEDKJMEPJL-UHFFFAOYSA-N 2 0 385.464 3.542 20 5 GHBDRP COc1ccc2c(c1)C1(C[C@@H]2[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC[NH2+]CC1 ZINC001246127797 1037205962 /nfs/dbraw/zinc/20/59/62/1037205962.db2.gz PEDXFJJORGQQPA-ZHRRBRCNSA-N 2 0 395.503 3.890 20 5 GHBDRP COc1ccc2c(c1)C1(C[C@H]2[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC[NH2+]CC1 ZINC001246127794 1037206364 /nfs/dbraw/zinc/20/63/64/1037206364.db2.gz PEDXFJJORGQQPA-OPAMFIHVSA-N 2 0 395.503 3.890 20 5 GHBDRP COc1ccc(C2([NH2+][C@@H]3CCc4ccc([N+](=O)[O-])cc4CC3)CC[NH2+]CC2)cc1 ZINC001246379395 1037337482 /nfs/dbraw/zinc/33/74/82/1037337482.db2.gz DEYCONHNGIVNBG-HXUWFJFHSA-N 2 0 395.503 3.719 20 5 GHBDRP COc1ccc(CC2(C[NH2+][C@H](C)Cc3ccc([N+](=O)[O-])cc3)CC[NH2+]CC2)cc1 ZINC001246391965 1037351123 /nfs/dbraw/zinc/35/11/23/1037351123.db2.gz WGDWKVQCGDMWHK-GOSISDBHSA-N 2 0 397.519 3.737 20 5 GHBDRP COc1ccc(C[C@H](C)[N@@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)c([N+](=O)[O-])c1 ZINC001246601012 1037498943 /nfs/dbraw/zinc/49/89/43/1037498943.db2.gz FTLVCFPUGFIGSS-UWJYYQICSA-N 2 0 375.513 3.780 20 5 GHBDRP COc1ccc(C[C@H](C)N2Cc3ccccc3C23CC[NH2+]CC3)c([N+](=O)[O-])c1 ZINC001247006401 1037828913 /nfs/dbraw/zinc/82/89/13/1037828913.db2.gz CGMSLXONUHMBJL-INIZCTEOSA-N 2 0 381.476 3.629 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@@H+]1CC[C@]3(CC[NH+](Cc4ccccc4)C3)C1)C2 ZINC001254604367 1040375309 /nfs/dbraw/zinc/37/53/09/1040375309.db2.gz WIJLVJODGZYBOZ-GOTSBHOMSA-N 2 0 377.488 3.660 20 5 GHBDRP CC(C)(C[NH2+]CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1)c1cccnc1 ZINC001308821257 1050107008 /nfs/dbraw/zinc/10/70/08/1050107008.db2.gz QVWJYDBXHIXJCG-UHFFFAOYSA-N 2 0 396.535 3.812 20 5 GHBDRP C[C@@H]([NH2+]C[C@@H](C)N1CC[NH+](C)CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000127315735 842252832 /nfs/dbraw/zinc/25/28/32/842252832.db2.gz XFTDQYZUBFXUTQ-HZPDHXFCSA-N 2 0 388.537 3.610 20 5 GHBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1 ZINC000132697053 861397601 /nfs/dbraw/zinc/39/76/01/861397601.db2.gz VCZAKIITVLFVNM-KRWDZBQOSA-N 2 0 383.492 3.711 20 5 GHBDRP COc1ccc(C[NH2+][C@H](C)[C@H]2CCC[NH2+]C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414858099 849880551 /nfs/dbraw/zinc/88/05/51/849880551.db2.gz QUBRFRSSCZBSGM-APWZRJJASA-N 2 0 399.491 3.660 20 5 GHBDRP C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000589184994 854737110 /nfs/dbraw/zinc/73/71/10/854737110.db2.gz JGZXTHFAEUKISR-UHFFFAOYSA-N 2 0 383.492 3.744 20 5 GHBDRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H](C)c3cccc([N+](=O)[O-])c3)cc2)CC1 ZINC000173327064 856858513 /nfs/dbraw/zinc/85/85/13/856858513.db2.gz XVQNMZOCVHGQOK-GOSISDBHSA-N 2 0 382.508 3.583 20 5 GHBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000595066684 858369389 /nfs/dbraw/zinc/36/93/89/858369389.db2.gz LYGIYIRGYGODQX-SFHVURJKSA-N 2 0 382.508 3.813 20 5 GHBDRP [NH3+][C@@H]1CCO[C@H]([C@H]2CCCC[N@@H+]2Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000593316305 859388563 /nfs/dbraw/zinc/38/85/63/859388563.db2.gz BQDCKWGVZDPCSI-BSIFCXSSSA-N 2 0 385.464 3.716 20 5 GHBDRP O=[N+]([O-])c1ccccc1-c1ccc(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)o1 ZINC000093735028 860340275 /nfs/dbraw/zinc/34/02/75/860340275.db2.gz LXNJZNAWOAEKFD-UHFFFAOYSA-N 2 0 399.491 3.932 20 5 GHBDRP C[C@@H]([NH2+]CCCN1CC[N@H+](C)C[C@H]1c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000480797710 865290616 /nfs/dbraw/zinc/29/06/16/865290616.db2.gz QJLZIKPNZCCLTB-GCJKJVERSA-N 2 0 382.508 3.624 20 5 GHBDRP C[C@@H]1C[NH+](CCCC[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H](C)O1 ZINC000608837115 865740688 /nfs/dbraw/zinc/74/06/88/865740688.db2.gz QNMPNYFBAWVWFC-IAGOWNOFSA-N 2 0 387.480 3.834 20 5 GHBDRP O=[N+]([O-])c1ccc(N2CCC([NH2+]C[C@H]3CC[N@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000793206194 882032865 /nfs/dbraw/zinc/03/28/65/882032865.db2.gz CIWUYTRAGQVMNX-HXUWFJFHSA-N 2 0 394.519 3.675 20 5 GHBDRP Cc1ccc(C[NH2+]Cc2ccccc2C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1[N+](=O)[O-] ZINC000069833356 871597919 /nfs/dbraw/zinc/59/79/19/871597919.db2.gz ALYLGPWCBNRUCV-QZTJIDSGSA-N 2 0 383.492 3.802 20 5 GHBDRP COc1cc(C[NH2+]CC2CC[NH+](C)CC2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000105459287 875298644 /nfs/dbraw/zinc/29/86/44/875298644.db2.gz FYKSQBLFQLLCOD-UHFFFAOYSA-N 2 0 399.491 3.614 20 5 GHBDRP COc1cc(C[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)ccc1[N+](=O)[O-] ZINC000492851753 877677900 /nfs/dbraw/zinc/67/79/00/877677900.db2.gz KYMYCWMWECGGSQ-UHFFFAOYSA-N 2 0 384.480 3.737 20 5 GHBDRP CC[N@H+](CCC1CC[NH+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1)CC(C)C ZINC000776606136 878478739 /nfs/dbraw/zinc/47/87/39/878478739.db2.gz SCBRPVQZFFWKTH-NRFANRHFSA-N 2 0 377.529 3.708 20 5 GHBDRP CN(c1ccccc1)c1ccc(C[NH2+]CCCC[NH+]2CCOCC2)cc1[N+](=O)[O-] ZINC000520206107 880213526 /nfs/dbraw/zinc/21/35/26/880213526.db2.gz YCHLCSAQKTXIOJ-UHFFFAOYSA-N 2 0 398.507 3.565 20 5 GHBDRP O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)c1 ZINC000814640091 893030665 /nfs/dbraw/zinc/03/06/65/893030665.db2.gz RHEXOFJPCDVQGU-JOCHJYFZSA-N 2 0 395.503 3.616 20 5 GHBDRP COc1cc(CNC[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)c([N+](=O)[O-])cc1O ZINC000564498419 895037964 /nfs/dbraw/zinc/03/79/64/895037964.db2.gz SBGTZIOYQSHGPU-SFHVURJKSA-N 2 0 399.491 3.701 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C1)CC2 ZINC001172913605 905984888 /nfs/dbraw/zinc/98/48/88/905984888.db2.gz SPVSCNCHVVJUKE-ZRBLBEILSA-N 2 0 391.515 3.906 20 5 GHBDRP C[NH+]1CCN(c2ccc(Nc3ccc4cc5ccc(N)cc5[nH+]c4c3)cn2)CC1 ZINC001176660282 908224712 /nfs/dbraw/zinc/22/47/12/908224712.db2.gz ORWATWJJXUUULV-UHFFFAOYSA-N 2 0 384.487 3.861 20 5 GHBDRP COC[C@H](CC(C)(C)C)[NH2+]CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001182605761 911921405 /nfs/dbraw/zinc/92/14/05/911921405.db2.gz WNEMRRIKUFKRPX-FQEVSTJZSA-N 2 0 391.556 3.890 20 5 GHBDRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(C[NH2+]C[C@@H](O)c3cccc([N+](=O)[O-])c3)cc2)C1 ZINC000749678408 927232280 /nfs/dbraw/zinc/23/22/80/927232280.db2.gz RTBOJLFJQNWLNA-PMAPCBKXSA-N 2 0 397.519 3.896 20 5 GHBDRP C[C@H]([NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccc(OCC[NH+](C)C)cc1 ZINC000558167016 931867763 /nfs/dbraw/zinc/86/77/63/931867763.db2.gz WEMUVGNCLDZUMD-INIZCTEOSA-N 2 0 396.491 3.910 20 5 GHBDRP C[C@@H]([NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1cccc(OCC[NH+](C)C)c1 ZINC000561785292 934452345 /nfs/dbraw/zinc/45/23/45/934452345.db2.gz PPCPBGMFWABGPO-MRXNPFEDSA-N 2 0 396.491 3.910 20 5 GHBDRP Cc1cc([C@@H]2CCC[N@@H+]2CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)on1 ZINC001461972723 1069923943 /nfs/dbraw/zinc/92/39/43/1069923943.db2.gz XUIKETZNRIWUCF-NRFANRHFSA-N 2 0 398.507 3.983 20 5 GHBDRP Cc1ccc2c(c1)C1(C[C@H]2[NH2+][C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC[NH2+]CC1 ZINC001246169476 1037222701 /nfs/dbraw/zinc/22/27/01/1037222701.db2.gz HAZVYEXLWKBFNT-XMSQKQJNSA-N 2 0 377.488 3.726 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH2+][C@@H](CC1CC[NH2+]CC1)c1ccc(F)cc1)C2 ZINC001246454415 1037414353 /nfs/dbraw/zinc/41/43/53/1037414353.db2.gz WUILEXAXKIQQOW-IRLDBZIGSA-N 2 0 383.467 3.922 20 5 GHBDRP C[C@H]1CC([NH2+]CCCNC(=O)c2c3ccccc3nc3ccccc32)C[C@H](C)[NH2+]1 ZINC001246484857 1037430955 /nfs/dbraw/zinc/43/09/55/1037430955.db2.gz RYTDUGPWKUZQOD-IRXDYDNUSA-N 2 0 390.531 3.627 20 5 GHBDRP C[N@H+](CC1CC[NH+](Cc2ccccc2)CC1)[C@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254603776 1040374983 /nfs/dbraw/zinc/37/49/83/1040374983.db2.gz QQZGSNSHRZLMLU-QHCPKHFHSA-N 2 0 379.504 3.906 20 5 GHBDRP C[C@H](c1ccncc1)[N@H+](C)CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001308678740 1050056763 /nfs/dbraw/zinc/05/67/63/1050056763.db2.gz XSHBCBCZIDXJDB-GOSISDBHSA-N 2 0 382.508 3.937 20 5 GHBDRP COc1ccc(C[NH2+]CC[C@@H]2CCC[NH2+]C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414844942 838885887 /nfs/dbraw/zinc/88/58/87/838885887.db2.gz RWDLTVPOIWJNPJ-KRWDZBQOSA-N 2 0 399.491 3.662 20 5 GHBDRP CC1CC[NH+](CCCC[NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000236842366 840173610 /nfs/dbraw/zinc/17/36/10/840173610.db2.gz CVKSXRIWXUPQIX-UHFFFAOYSA-N 2 0 385.512 3.597 20 5 GHBDRP CC1(C)C[C@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c2cc([N+](=O)[O-])ccc21 ZINC000433240210 843890250 /nfs/dbraw/zinc/89/02/50/843890250.db2.gz NMDQVTAZIBGSFY-KNQAVFIVSA-N 2 0 395.503 3.674 20 5 GHBDRP COc1cc(C[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c([N+](=O)[O-])cc1O ZINC000513499028 845552785 /nfs/dbraw/zinc/55/27/85/845552785.db2.gz DBGCYYNCUSBPIM-WMZOPIPTSA-N 2 0 399.491 3.699 20 5 GHBDRP COc1cc(C[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c([N+](=O)[O-])cc1O ZINC000513499025 845552919 /nfs/dbraw/zinc/55/29/19/845552919.db2.gz DBGCYYNCUSBPIM-AEFFLSMTSA-N 2 0 399.491 3.699 20 5 GHBDRP Cc1cc(NC2CC[NH+]([C@H](C)c3ccncc3)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000425237129 849883707 /nfs/dbraw/zinc/88/37/07/849883707.db2.gz KRIBCVKPDPMIEP-MRXNPFEDSA-N 2 0 391.475 3.906 20 5 GHBDRP C[C@@H]1C[C@H](C[NH3+])C[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000435372856 850422280 /nfs/dbraw/zinc/42/22/80/850422280.db2.gz LENVGPAWTJHCLN-VXGBXAGGSA-N 2 0 394.269 3.786 20 5 GHBDRP C[C@@H]([NH3+])[C@@H]1CC[N@H+](Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000435381041 850446382 /nfs/dbraw/zinc/44/63/82/850446382.db2.gz UTMRAXUWASILQJ-SJLPKXTDSA-N 2 0 391.475 3.617 20 5 GHBDRP C[NH2+]CC1CC[NH+](Cc2cc(OC)c(OCc3ccccc3)cc2[N+](=O)[O-])CC1 ZINC000435394116 850462039 /nfs/dbraw/zinc/46/20/39/850462039.db2.gz MBAIXKMPJDKNPX-UHFFFAOYSA-N 2 0 399.491 3.614 20 5 GHBDRP COc1ccc(C[NH2+][C@H]2CCCC[C@H]2C[NH3+])cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414792600 850496170 /nfs/dbraw/zinc/49/61/70/850496170.db2.gz CLKDDDQUJNSREI-ICSRJNTNSA-N 2 0 399.491 3.790 20 5 GHBDRP COc1cc(C[NH2+][C@@H]2CC[NH2+]CC2(C)C)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414976355 853209507 /nfs/dbraw/zinc/20/95/07/853209507.db2.gz PQLMFLDEGQEYFZ-OAQYLSRUSA-N 2 0 399.491 3.660 20 5 GHBDRP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000246327437 857348990 /nfs/dbraw/zinc/34/89/90/857348990.db2.gz HRHOPULBMGMHIF-ROUUACIJSA-N 2 0 388.512 3.510 20 5 GHBDRP CCOc1ccc([C@@H](C)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1[N+](=O)[O-] ZINC000595048334 858379246 /nfs/dbraw/zinc/37/92/46/858379246.db2.gz KGUGVQYCHGIVLW-MRXNPFEDSA-N 2 0 391.512 3.535 20 5 GHBDRP COc1ccc(C[C@H](C)[NH2+]CC2CC[NH+](CC(C)(C)C)CC2)c([N+](=O)[O-])c1 ZINC001170319660 881352935 /nfs/dbraw/zinc/35/29/35/881352935.db2.gz YDVJSSTWIXANEB-INIZCTEOSA-N 2 0 377.529 3.882 20 5 GHBDRP [NH3+][C@@H]1CCO[C@H]([C@H]2CCCC[N@@H+]2Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000593323745 859406872 /nfs/dbraw/zinc/40/68/72/859406872.db2.gz WGYPKTRQAMNELW-BSIFCXSSSA-N 2 0 385.464 3.716 20 5 GHBDRP Cc1nccn1CCCCN1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000792892927 881779967 /nfs/dbraw/zinc/77/99/67/881779967.db2.gz WEOOCUNDLKENDX-UHFFFAOYSA-N 2 0 393.285 3.701 20 5 GHBDRP COc1cc(CN[C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)c([N+](=O)[O-])cc1F ZINC000481188153 865966323 /nfs/dbraw/zinc/96/63/23/865966323.db2.gz HNWSJKXHRCOLBQ-HNAYVOBHSA-N 2 0 387.455 3.743 20 5 GHBDRP O=C(CC[NH+]1CCC(CCC[NH+]2CCCC2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000121593000 868872622 /nfs/dbraw/zinc/87/26/22/868872622.db2.gz CNVJKFLMYFENNT-UHFFFAOYSA-N 2 0 388.512 3.511 20 5 GHBDRP COc1cc(C[N@@H+]2CCC[C@@H](CC[NH3+])C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000442917430 869076245 /nfs/dbraw/zinc/07/62/45/869076245.db2.gz ALLMNSPMPVTHNZ-KRWDZBQOSA-N 2 0 399.491 3.743 20 5 GHBDRP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]C2CC[NH+](C3CCCCC3)CC2)n1 ZINC000447563089 871871844 /nfs/dbraw/zinc/87/18/44/871871844.db2.gz OBDQJQCTKMABMV-RTBURBONSA-N 2 0 375.517 3.662 20 5 GHBDRP CC[N@H+](CCC1CC[NH+](Cn2ncc3ccc([N+](=O)[O-])cc32)CC1)CC1CC1 ZINC000770685906 874823049 /nfs/dbraw/zinc/82/30/49/874823049.db2.gz MQBJYRBSLMOUBF-UHFFFAOYSA-N 2 0 385.512 3.736 20 5 GHBDRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776276559 876149425 /nfs/dbraw/zinc/14/94/25/876149425.db2.gz KNXOLIXRYBPBRX-VGOFRKELSA-N 2 0 383.492 3.792 20 5 GHBDRP CCOc1ccc([C@@H](C)[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000153322872 887651638 /nfs/dbraw/zinc/65/16/38/887651638.db2.gz RYYWDYXAZGXSRK-IXDOHACOSA-N 2 0 379.501 3.534 20 5 GHBDRP C[C@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815578360 894015397 /nfs/dbraw/zinc/01/53/97/894015397.db2.gz MTHRJCKPXAIMHW-INIZCTEOSA-N 2 0 384.480 3.502 20 5 GHBDRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3ccc(N)c([N+](=O)[O-])c3)CC2)cc1 ZINC000815572284 894040608 /nfs/dbraw/zinc/04/06/08/894040608.db2.gz ZGKMGNKQZVGHLH-MRXNPFEDSA-N 2 0 398.507 3.748 20 5 GHBDRP O=[N+]([O-])c1ccc([C@H](O)C[NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)cc1 ZINC000818984640 896302923 /nfs/dbraw/zinc/30/29/23/896302923.db2.gz JVADEVYUXDKQCF-JOCHJYFZSA-N 2 0 383.492 3.794 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]CCc2ccc(C[NH+](C)C)cc2)c1F ZINC001173192082 906275042 /nfs/dbraw/zinc/27/50/42/906275042.db2.gz OSHCKPRVAVVJNW-HNNXBMFYSA-N 2 0 389.471 3.567 20 5 GHBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCCP(CCC[NH3+])c1ccccc1 ZINC001173229264 906312051 /nfs/dbraw/zinc/31/20/51/906312051.db2.gz MBLOTRZVYGKSOY-HSYKDVHTSA-N 2 0 387.464 3.662 20 5 GHBDRP COC[C@H]1CCCC[N@H+](CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001180603217 910266593 /nfs/dbraw/zinc/26/65/93/910266593.db2.gz QCANUELUUBWRAJ-NRFANRHFSA-N 2 0 389.540 3.598 20 5 GHBDRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000544349080 929079844 /nfs/dbraw/zinc/07/98/44/929079844.db2.gz PUPMRHYXMJZQIL-UHFFFAOYSA-N 2 0 393.447 3.527 20 5 GHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1 ZINC000468626962 1015855897 /nfs/dbraw/zinc/85/58/97/1015855897.db2.gz JZXFWMOHVSXJFJ-XMHGGMMESA-N 2 0 394.519 3.535 20 5 GHBDRP Cc1cccc([N+](=O)[O-])c1NC[C@H]1C[N@H+](Cc2ccccc2)CC12CC[NH2+]CC2 ZINC001162935526 1025972688 /nfs/dbraw/zinc/97/26/88/1025972688.db2.gz RUBFXGSNFALUTL-FQEVSTJZSA-N 2 0 394.519 3.817 20 5 GHBDRP C[NH+](C)CCOc1cc(-n2c(C[NH3+])cc3cc(Cl)ccc32)ccc1[N+](=O)[O-] ZINC001163901744 1026355480 /nfs/dbraw/zinc/35/54/80/1026355480.db2.gz HXZIJOZJFCIUFQ-UHFFFAOYSA-N 2 0 388.855 3.591 20 5 GHBDRP C[NH+](C)CCOc1cc(NC[C@H](c2ccccc2)[NH+]2CCCC2)ccc1[N+](=O)[O-] ZINC001166911391 1027149993 /nfs/dbraw/zinc/14/99/93/1027149993.db2.gz UUUKUNKOBPVQSQ-OAQYLSRUSA-N 2 0 398.507 3.784 20 5 GHBDRP [NH3+][C@@H](Cc1c2ccccc2cc2ccccc21)C(=O)N1CCC2(CCC[NH2+]2)CC1 ZINC001158168912 1033950200 /nfs/dbraw/zinc/95/02/00/1033950200.db2.gz JEGJHCBKHQHZCS-QHCPKHFHSA-N 2 0 387.527 3.607 20 5 GHBDRP CN(C(=O)[C@@H]([NH3+])Cc1c2ccccc2cc2ccccc21)[C@H]1CCCC[C@@H]1[NH3+] ZINC001161063811 1035130278 /nfs/dbraw/zinc/13/02/78/1035130278.db2.gz NFRPNTTUIGSHGL-VABKMULXSA-N 2 0 375.516 3.591 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH2+][C@H]1CC3(CC[NH2+]CC3)c3cc(F)ccc31)C2 ZINC001246186756 1037228468 /nfs/dbraw/zinc/22/84/68/1037228468.db2.gz YZTLJDCLIUQGGL-UTKZUKDTSA-N 2 0 381.451 3.557 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CC1(c3ccc(F)cc3)CC[NH2+]CC1)CC2 ZINC001246211819 1037240439 /nfs/dbraw/zinc/24/04/39/1037240439.db2.gz NRJNFDUIIZFORI-OAQYLSRUSA-N 2 0 397.494 3.892 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@H](NC1(c3ccccc3F)CC[NH2+]CC1)CC2 ZINC001246427666 1037386168 /nfs/dbraw/zinc/38/61/68/1037386168.db2.gz FKDWBJQOBYAZSQ-GOSISDBHSA-N 2 0 383.467 3.850 20 5 GHBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC1(Cc2ccccc2F)CC[NH2+]CC1 ZINC001246434976 1037395007 /nfs/dbraw/zinc/39/50/07/1037395007.db2.gz RKNYRGLCGWQIEB-QGZVFWFLSA-N 2 0 385.483 3.867 20 5 GHBDRP COc1ccc2c(c1)C1(CC[NH2+]CC1)[N@@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001246632194 1037519281 /nfs/dbraw/zinc/51/92/81/1037519281.db2.gz UVZRGJAUHNMDBV-KRWDZBQOSA-N 2 0 395.503 3.671 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+](CC(C)(C)C)C2CC[NH2+]CC2)c1F ZINC001246950025 1037752623 /nfs/dbraw/zinc/75/26/23/1037752623.db2.gz OMBMAWIIIUWEOZ-CQSZACIVSA-N 2 0 381.492 3.774 20 5 GHBDRP O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[NH2+]C[C@H]3CCCC3(F)F)CC2)cc1 ZINC001462245027 1070116072 /nfs/dbraw/zinc/11/60/72/1070116072.db2.gz CLZOFGPHHMHUDT-GOSISDBHSA-N 2 0 381.467 3.874 20 5 GHBDRP CCOc1ccc([C@H](C)[NH2+]Cc2ccccc2N2CC[NH+](C)CC2)cc1[N+](=O)[O-] ZINC001253957152 1039921790 /nfs/dbraw/zinc/92/17/90/1039921790.db2.gz WBROAUPVVZYPHO-KRWDZBQOSA-N 2 0 398.507 3.596 20 5 GHBDRP CC1(C)[C@H](C[NH2+]CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)C1(F)F ZINC001462453995 1070263726 /nfs/dbraw/zinc/26/37/26/1070263726.db2.gz QVOFOGWYSFPMAF-SFHVURJKSA-N 2 0 381.467 3.730 20 5 GHBDRP CC[NH+](CC)CCC[C@@H](C)[NH2+]C1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC001256087138 1041517105 /nfs/dbraw/zinc/51/71/05/1041517105.db2.gz PFPQJZMOCXZTPK-QGZVFWFLSA-N 2 0 392.544 3.672 20 5 GHBDRP CSCC1CC[NH+](CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC001462618130 1070417290 /nfs/dbraw/zinc/41/72/90/1070417290.db2.gz BGVULAWHQLWFFC-UHFFFAOYSA-N 2 0 391.581 3.924 20 5 GHBDRP CC(C)(C)C[N@H+](CCCO)CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001308587059 1050021496 /nfs/dbraw/zinc/02/14/96/1050021496.db2.gz RNSHKELHSLLDCR-UHFFFAOYSA-N 2 0 391.556 3.580 20 5 GHBDRP Cn1ccnc1C[C@@H]1CCCN(Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC001339997061 1059605296 /nfs/dbraw/zinc/60/52/96/1059605296.db2.gz AXVDARALWSTSPN-ZDUSSCGKSA-N 2 0 393.285 3.546 20 5 GHBDRP CC(C)[C@@H]1C[N@H+](CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)CCS1 ZINC001474360081 1074363052 /nfs/dbraw/zinc/36/30/52/1074363052.db2.gz JHDLIUFJRVJCNK-NRFANRHFSA-N 2 0 391.581 3.923 20 5 GHBDRP COc1ccc(-c2ccc(C[N@@H+]3CCC[C@H]([C@@H]4CC[NH2+]C4)C3)o2)c([N+](=O)[O-])c1 ZINC000584291282 835849503 /nfs/dbraw/zinc/84/95/03/835849503.db2.gz JBWMDGGYURHKNM-CVEARBPZSA-N 2 0 385.464 3.685 20 5 GHBDRP COc1cc(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414930154 838987024 /nfs/dbraw/zinc/98/70/24/838987024.db2.gz SNLJHFXUCNTAOQ-QZTJIDSGSA-N 2 0 385.464 3.542 20 5 GHBDRP [NH3+][C@@H]1CCCO[C@H]1C1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000415101467 839204774 /nfs/dbraw/zinc/20/47/74/839204774.db2.gz BNDDJRYVJNGYQW-CTNGQTDRSA-N 2 0 385.464 3.573 20 5 GHBDRP COc1ccc(C[N@@H+]2CC[C@H](C)[C@@H](C[NH3+])C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000415125844 839235340 /nfs/dbraw/zinc/23/53/40/839235340.db2.gz LLJQAVDODLNDDB-LPHOPBHVSA-N 2 0 399.491 3.599 20 5 GHBDRP CSC1(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[NH+](C)CC1 ZINC000581339766 841106732 /nfs/dbraw/zinc/10/67/32/841106732.db2.gz MYEUUOUVPFTMLZ-UHFFFAOYSA-N 2 0 375.494 3.772 20 5 GHBDRP Cc1ccc([C@H](C)[NH2+]Cc2ccc(CN3CC[NH+](C)CC3)cc2)cc1[N+](=O)[O-] ZINC000126688115 841841578 /nfs/dbraw/zinc/84/15/78/841841578.db2.gz BLGBJJVAPLLNBO-SFHVURJKSA-N 2 0 382.508 3.501 20 5 GHBDRP O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CCC[C@H]([NH+]4CCCC4)CC3)o2)c1 ZINC000157089540 845846847 /nfs/dbraw/zinc/84/68/47/845846847.db2.gz LRTFOHWXCOXGPA-SFHVURJKSA-N 2 0 384.480 3.743 20 5 GHBDRP C[NH2+]C[C@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)C1 ZINC000435376655 850425016 /nfs/dbraw/zinc/42/50/16/850425016.db2.gz SMSYINSTZCBDOI-GFCCVEGCSA-N 2 0 394.269 3.659 20 5 GHBDRP [NH3+]C[C@@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)C1 ZINC000435386938 850454270 /nfs/dbraw/zinc/45/42/70/850454270.db2.gz ZCQRTPRTFRIYTF-LBPRGKRZSA-N 2 0 394.269 3.788 20 5 GHBDRP Cn1ccnc1CC1CCN(Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000425396328 850691871 /nfs/dbraw/zinc/69/18/71/850691871.db2.gz PMXLKVWPTXZLIG-UHFFFAOYSA-N 2 0 393.285 3.546 20 5 GHBDRP O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]Cc1cccc(CN2CCOCC2)c1)C1CC1 ZINC000163689163 862522330 /nfs/dbraw/zinc/52/23/30/862522330.db2.gz HYIMJZBYZGOWNI-JOCHJYFZSA-N 2 0 395.503 3.538 20 5 GHBDRP C[C@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000173389260 856902087 /nfs/dbraw/zinc/90/20/87/856902087.db2.gz NCYIXRQJHYZPJE-HOTGVXAUSA-N 2 0 386.471 3.898 20 5 GHBDRP CC(C)c1ccc(C[NH2+]Cc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)cc1[N+](=O)[O-] ZINC000594973533 858335868 /nfs/dbraw/zinc/33/58/68/858335868.db2.gz FDORDHLQCFCIOF-HXUWFJFHSA-N 2 0 383.492 3.575 20 5 GHBDRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H](C)c3ccc([N+](=O)[O-])cc3)cc2)CC1 ZINC000160327614 858803690 /nfs/dbraw/zinc/80/36/90/858803690.db2.gz BISHWQCIRDYALL-SFHVURJKSA-N 2 0 382.508 3.583 20 5 GHBDRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H](C)c3ccc([N+](=O)[O-])cc3)cc2)CC1 ZINC000160327754 858819682 /nfs/dbraw/zinc/81/96/82/858819682.db2.gz BISHWQCIRDYALL-GOSISDBHSA-N 2 0 382.508 3.583 20 5 GHBDRP COc1ccc(C[C@@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)c([N+](=O)[O-])c1 ZINC001170319659 881353775 /nfs/dbraw/zinc/35/37/75/881353775.db2.gz XYUOWUGLNXEHCE-MRXNPFEDSA-N 2 0 375.513 3.921 20 5 GHBDRP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCCC[N@@H+]2Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000593316309 859388831 /nfs/dbraw/zinc/38/88/31/859388831.db2.gz BQDCKWGVZDPCSI-OZOXKJRCSA-N 2 0 385.464 3.716 20 5 GHBDRP Cc1ccc(C[NH+]2CC[C@@H](Oc3ccnc(C[N@@H+](C)C(C)C)c3)C2)cc1[N+](=O)[O-] ZINC000856560571 881440806 /nfs/dbraw/zinc/44/08/06/881440806.db2.gz IYEQYRSATPTDMQ-OAQYLSRUSA-N 2 0 398.507 3.792 20 5 GHBDRP C[C@@H](CN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000154889747 860314080 /nfs/dbraw/zinc/31/40/80/860314080.db2.gz GUGONDMEVOQREE-HOTGVXAUSA-N 2 0 388.537 3.610 20 5 GHBDRP CC[N@H+](C)Cc1cc(O[C@@H]2CC[NH+]([C@H](C)c3cccc([N+](=O)[O-])c3)C2)ccn1 ZINC000856594220 881566964 /nfs/dbraw/zinc/56/69/64/881566964.db2.gz XVRORTFCDNHYAY-IIBYNOLFSA-N 2 0 384.480 3.656 20 5 GHBDRP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)n1 ZINC000447512382 871773812 /nfs/dbraw/zinc/77/38/12/871773812.db2.gz YEIIZXKPOIINGN-VQTJNVASSA-N 2 0 383.496 3.661 20 5 GHBDRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H](C)c3cc([N+](=O)[O-])ccc3C)cc2)CC1 ZINC000532446526 885493403 /nfs/dbraw/zinc/49/34/03/885493403.db2.gz FQNADNJFNTTYQU-IBGZPJMESA-N 2 0 396.535 3.892 20 5 GHBDRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000495439875 885808844 /nfs/dbraw/zinc/80/88/44/885808844.db2.gz OHEBYJSILKLTFX-CRAIPNDOSA-N 2 0 383.920 3.517 20 5 GHBDRP CSC1(C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC[NH+](C)CC1 ZINC000811513558 889709974 /nfs/dbraw/zinc/70/99/74/889709974.db2.gz KDPKPPVETHUBJV-UHFFFAOYSA-N 2 0 378.325 3.819 20 5 GHBDRP O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CC[C@H](C[NH+]4CCCCC4)C3)o2)c1 ZINC000173600758 889995107 /nfs/dbraw/zinc/99/51/07/889995107.db2.gz YKUKBEZRTDDRCM-QGZVFWFLSA-N 2 0 384.480 3.600 20 5 GHBDRP O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)cc1 ZINC000818987564 896307216 /nfs/dbraw/zinc/30/72/16/896307216.db2.gz ZMKKRSXPNIQLTJ-QFIPXVFZSA-N 2 0 383.492 3.794 20 5 GHBDRP COc1cccc(C2([NH3+])CC[NH+]([C@H]3CCc4ccc([N+](=O)[O-])cc4CC3)CC2)c1 ZINC001172900082 905921746 /nfs/dbraw/zinc/92/17/46/905921746.db2.gz BVXFYQSWKFJORP-FQEVSTJZSA-N 2 0 395.503 3.801 20 5 GHBDRP O=[N+]([O-])c1cc(F)c(N2CCC([NH2+]CCCCC[NH+]3CCCC3)CC2)c(F)c1 ZINC001173007338 906082089 /nfs/dbraw/zinc/08/20/89/906082089.db2.gz IIYFWTYIUZVAPE-UHFFFAOYSA-N 2 0 396.482 3.698 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]C2CC[NH+](C3CCCC3)CC2)c1F ZINC001173184950 906265550 /nfs/dbraw/zinc/26/55/50/906265550.db2.gz SXUUDEOTPQWLEP-AWEZNQCLSA-N 2 0 379.476 3.670 20 5 GHBDRP CC1CC[NH+](CC[C@H]2CCC[N@@H+]2CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC001175353020 907515205 /nfs/dbraw/zinc/51/52/05/907515205.db2.gz SQGYSENCTYEJAP-GOSISDBHSA-N 2 0 388.512 3.510 20 5 GHBDRP [NH2+]=c1ccc2nc3c(cc(NC(=O)C45CC[NH+](CC4)CC5)c4ccccc43)oc-2c1 ZINC001181550196 910833093 /nfs/dbraw/zinc/83/30/93/910833093.db2.gz CGAOIDLRZMDXLH-UHFFFAOYSA-N 2 0 398.466 3.990 20 5 GHBDRP COCC[N@H+](C)CCCC1CC[NH+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000783571415 931585737 /nfs/dbraw/zinc/58/57/37/931585737.db2.gz CWOLFWVEJXBPHA-UHFFFAOYSA-N 2 0 383.920 3.819 20 5 GHBDRP O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)ccc1Br ZINC000843127003 1029817419 /nfs/dbraw/zinc/81/74/19/1029817419.db2.gz NVOORRHTPRWNJW-GJZGRUSLSA-N 2 0 382.302 3.569 20 5 GHBDRP O=C1C[N@H+](Cc2ccc3ccc4cccc5ccc2c3c45)CC2(CC[NH2+]CC2)N1 ZINC001222515659 1030176293 /nfs/dbraw/zinc/17/62/93/1030176293.db2.gz WWPRKZBDHDKQCE-UHFFFAOYSA-N 2 0 383.495 3.638 20 5 GHBDRP O=C1C[N@@H+](Cc2c3ccccc3c(Cl)c3ccccc32)CC2(CC[NH2+]CC2)N1 ZINC001222515208 1030176687 /nfs/dbraw/zinc/17/66/87/1030176687.db2.gz NRGPTNWFTSRMSN-UHFFFAOYSA-N 2 0 393.918 3.700 20 5 GHBDRP CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)C1CCC(C[NH3+])CC1 ZINC001219005548 1031207989 /nfs/dbraw/zinc/20/79/89/1031207989.db2.gz QKRZDLLSAWFENF-UHFFFAOYSA-N 2 0 392.503 3.660 20 5 GHBDRP [NH3+][C@@H](Cc1c2ccccc2cc2ccccc21)C(=O)NC1CC2(C1)CC[NH2+]CC2 ZINC001219777520 1031613438 /nfs/dbraw/zinc/61/34/38/1031613438.db2.gz KPGHGQVONLEYSW-QHCPKHFHSA-N 2 0 387.527 3.511 20 5 GHBDRP COc1ccc2c(c1)C1(C[C@H]2[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])CC[NH2+]CC1 ZINC001246131299 1037208256 /nfs/dbraw/zinc/20/82/56/1037208256.db2.gz XHXZYMKWKXPHSI-HRAATJIYSA-N 2 0 395.503 3.890 20 5 GHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC1(Cc2ccc(F)cc2)CC[NH2+]CC1 ZINC001246383139 1037343310 /nfs/dbraw/zinc/34/33/10/1037343310.db2.gz DKPSXLDSOHZDGQ-QGZVFWFLSA-N 2 0 385.483 3.867 20 5 GHBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC1(Cc2ccccc2F)CC[NH2+]CC1 ZINC001246434972 1037395146 /nfs/dbraw/zinc/39/51/46/1037395146.db2.gz RKNYRGLCGWQIEB-KRWDZBQOSA-N 2 0 385.483 3.867 20 5 GHBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@]2(c3ccccc3)CC[NH2+]C[C@@H]2C1 ZINC001246669856 1037537060 /nfs/dbraw/zinc/53/70/60/1037537060.db2.gz ACECSDBWEAJCAP-JMUQELJHSA-N 2 0 379.504 3.779 20 5 GHBDRP COc1ccc(C[C@@H](C)N2Cc3ccccc3C23CC[NH2+]CC3)c([N+](=O)[O-])c1 ZINC001247006405 1037828818 /nfs/dbraw/zinc/82/88/18/1037828818.db2.gz CGMSLXONUHMBJL-MRXNPFEDSA-N 2 0 381.476 3.629 20 5 GHBDRP Cc1cc(N2CC[NH+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)CC2)c2ccccc2[nH+]1 ZINC001254595435 1040368813 /nfs/dbraw/zinc/36/88/13/1040368813.db2.gz XFXZKUCDBYUERE-HXUWFJFHSA-N 2 0 388.471 3.741 20 5 GHBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1cccc(CN2CC[NH+](C)CC2)c1 ZINC001326144768 1057422275 /nfs/dbraw/zinc/42/22/75/1057422275.db2.gz VGDBODFTNLMMMR-UYRXBGFRSA-N 2 0 394.519 3.535 20 5 GHBDRP Cc1c(C[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cccc1[N+](=O)[O-] ZINC001473988406 1074226903 /nfs/dbraw/zinc/22/69/03/1074226903.db2.gz CZEIIJHJMDTRAM-INIZCTEOSA-N 2 0 386.471 3.645 20 5 GHBDRP C[NH+](C)CCCC[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000608837093 835101750 /nfs/dbraw/zinc/10/17/50/835101750.db2.gz OBHFLGDVVSUXOJ-UHFFFAOYSA-N 2 0 393.491 3.879 20 5 GHBDRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(OCc3ccc([N+](=O)[O-])cc3)c(OC)c2)C1 ZINC000120796714 836539485 /nfs/dbraw/zinc/53/94/85/836539485.db2.gz KFZJURZBLJJQTB-IBGZPJMESA-N 2 0 399.491 3.614 20 5 GHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1 ZINC000414524151 838602203 /nfs/dbraw/zinc/60/22/03/838602203.db2.gz JMELVDJOVPDFFI-XMHGGMMESA-N 2 0 395.503 3.615 20 5 GHBDRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000414946581 839009969 /nfs/dbraw/zinc/00/99/69/839009969.db2.gz UCDDAIRWMBAAEY-IERDGZPVSA-N 2 0 391.475 3.535 20 5 GHBDRP COc1cc(C[NH2+][C@H]2CC[NH2+]CC2(C)C)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414976354 839031441 /nfs/dbraw/zinc/03/14/41/839031441.db2.gz PQLMFLDEGQEYFZ-NRFANRHFSA-N 2 0 399.491 3.660 20 5 GHBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCC[N@@H+]1CCCO[C@H](C)C1 ZINC000432413946 842423446 /nfs/dbraw/zinc/42/34/46/842423446.db2.gz PDKUGWQGHPGHDT-SJORKVTESA-N 2 0 381.542 3.556 20 5 GHBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1 ZINC000432413945 842423592 /nfs/dbraw/zinc/42/35/92/842423592.db2.gz PDKUGWQGHPGHDT-IRXDYDNUSA-N 2 0 381.542 3.556 20 5 GHBDRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000513786500 847576568 /nfs/dbraw/zinc/57/65/68/847576568.db2.gz IATSJNSAVPBHIE-YOUFYPILSA-N 2 0 389.540 3.785 20 5 GHBDRP C[C@H]1C[C@H](C[NH3+])C[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000435372853 850421259 /nfs/dbraw/zinc/42/12/59/850421259.db2.gz LENVGPAWTJHCLN-NWDGAFQWSA-N 2 0 394.269 3.786 20 5 GHBDRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000025702206 853688537 /nfs/dbraw/zinc/68/85/37/853688537.db2.gz CJVVVCUEFWSHMV-QGZVFWFLSA-N 2 0 396.491 3.698 20 5 GHBDRP CC[NH+](CC)C[C@H]1CCCC[C@@H]1[NH2+]CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000482161611 862758259 /nfs/dbraw/zinc/75/82/59/862758259.db2.gz DXRAYPHMLUEXSO-MJGOQNOKSA-N 2 0 390.528 3.722 20 5 GHBDRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])CC1 ZINC000594495426 858192536 /nfs/dbraw/zinc/19/25/36/858192536.db2.gz XLLOAJIPLFCVJU-JOCHJYFZSA-N 2 0 394.519 3.509 20 5 GHBDRP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCCC[N@@H+]2Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000593323747 859407149 /nfs/dbraw/zinc/40/71/49/859407149.db2.gz WGYPKTRQAMNELW-OZOXKJRCSA-N 2 0 385.464 3.716 20 5 GHBDRP COc1ccc(C[C@H](C)[N@@H+]2CCCC[C@@H]2C[C@@H]2CCC[NH+]2C)c([N+](=O)[O-])c1 ZINC001170351723 881498458 /nfs/dbraw/zinc/49/84/58/881498458.db2.gz HETDSXLYDGQXPF-YTQUADARSA-N 2 0 375.513 3.873 20 5 GHBDRP CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC001199678864 875122170 /nfs/dbraw/zinc/12/21/70/875122170.db2.gz QSZARYSBLCHADM-UHFFFAOYSA-N 2 0 383.492 3.995 20 5 GHBDRP C[C@@H]1C[NH+](CCC2CC[NH+](C/C=C/c3ccccc3[N+](=O)[O-])CC2)C[C@@H](C)O1 ZINC000537659563 883005967 /nfs/dbraw/zinc/00/59/67/883005967.db2.gz YJYANOWGHMLXCC-VRKMBTERSA-N 2 0 387.524 3.819 20 5 GHBDRP CCOc1cc(C[N@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)ccc1[N+](=O)[O-] ZINC000492722280 877453376 /nfs/dbraw/zinc/45/33/76/877453376.db2.gz NGFPYKPVRCFSHW-UHFFFAOYSA-N 2 0 384.480 3.737 20 5 GHBDRP O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]Cc2ccccc2C[NH+]2CCCCCC2)cc1 ZINC000819059208 896346109 /nfs/dbraw/zinc/34/61/09/896346109.db2.gz JBHCKAOFNHCIBD-QFIPXVFZSA-N 2 0 383.492 3.794 20 5 GHBDRP COCC[NH2+]C1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC1 ZINC000570574763 899400831 /nfs/dbraw/zinc/40/08/31/899400831.db2.gz XEXKMGWVZUBFAN-UHFFFAOYSA-N 2 0 393.871 3.709 20 5 GHBDRP [NH3+]C1(Cc2ccccc2)CC[NH+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172900012 905921993 /nfs/dbraw/zinc/92/19/93/905921993.db2.gz BAWGYVCTVGYMIG-OAQYLSRUSA-N 2 0 379.504 3.878 20 5 GHBDRP CCC[C@@H]([NH2+]Cc1cccc(C(=O)NCC[NH+](C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000268818507 910030871 /nfs/dbraw/zinc/03/08/71/910030871.db2.gz GCHHSNHHUUEUPS-OAQYLSRUSA-N 2 0 398.507 3.517 20 5 GHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1cccc(CN2CCOCC2)c1 ZINC000468653785 1015875917 /nfs/dbraw/zinc/87/59/17/1015875917.db2.gz YFRREDVUWYVQJK-LDADJPATSA-N 2 0 381.476 3.620 20 5 GHBDRP COc1ccc(C[C@H](C)[NH2+][C@H]2CC3(CC[NH2+]CC3)c3ccccc32)c([N+](=O)[O-])c1 ZINC001246259114 1037258260 /nfs/dbraw/zinc/25/82/60/1037258260.db2.gz ZFRNSKGRCWPLED-KKSFZXQISA-N 2 0 395.503 3.890 20 5 GHBDRP COc1cccc(CC2(C[NH2+][C@@H](C)Cc3ccccc3[N+](=O)[O-])CC[NH2+]CC2)c1 ZINC001246381919 1037341652 /nfs/dbraw/zinc/34/16/52/1037341652.db2.gz VPNLFDJLLGWLBZ-SFHVURJKSA-N 2 0 397.519 3.737 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH2+][C@H](CC1CC[NH2+]CC1)c1ccccc1F)C2 ZINC001246442308 1037404476 /nfs/dbraw/zinc/40/44/76/1037404476.db2.gz JBDHCEXPNUBWAM-PGRDOPGGSA-N 2 0 383.467 3.922 20 5 GHBDRP Cc1cc(F)cc(C[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C2CC[NH2+]CC2)c1 ZINC001246952017 1037754622 /nfs/dbraw/zinc/75/46/22/1037754622.db2.gz QJFTWLRERMISGJ-QFIPXVFZSA-N 2 0 383.467 3.764 20 5 GHBDRP Cc1c[nH+]ccc1N(C1CC[NH2+]CC1)C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001254481519 1040270056 /nfs/dbraw/zinc/27/00/56/1040270056.db2.gz DIVMLFSWJZTHDM-UHFFFAOYSA-N 2 0 395.507 3.526 20 5 GHBDRP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccccc2F)[C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254584873 1040358404 /nfs/dbraw/zinc/35/84/04/1040358404.db2.gz AUGSUPZFHJEPMF-SFHLNBCPSA-N 2 0 383.467 3.973 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH+]1CCC3(CC[N@H+](Cc4ccoc4)C3)CC1)C2 ZINC001254595017 1040367619 /nfs/dbraw/zinc/36/76/19/1040367619.db2.gz HWGZATSNIGXGQN-OAQYLSRUSA-N 2 0 381.476 3.643 20 5 GHBDRP COc1ccc(-c2ccc(C[N@@H+]3CCC[C@@H]4C[NH+](C)CC[C@H]43)o2)c([N+](=O)[O-])c1 ZINC000583532987 834586647 /nfs/dbraw/zinc/58/66/47/834586647.db2.gz ZOEYVWBRSZKRPP-DNVCBOLYSA-N 2 0 385.464 3.780 20 5 GHBDRP O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CCC(OCC[NH+]4CCCC4)CC3)o2)cc1 ZINC000179987753 836532721 /nfs/dbraw/zinc/53/27/21/836532721.db2.gz LSGKYWGAHUBPAA-UHFFFAOYSA-N 2 0 399.491 3.932 20 5 GHBDRP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CC[C@H]3CC[NH2+]C3)o2)c(Br)c1 ZINC000414830215 838876678 /nfs/dbraw/zinc/87/66/78/838876678.db2.gz LUGFTWYSSNBGPT-GFCCVEGCSA-N 2 0 394.269 3.707 20 5 GHBDRP COc1ccc(C[NH2+]C[C@@]2(C)CCC[NH2+]C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414903938 838968207 /nfs/dbraw/zinc/96/82/07/838968207.db2.gz JADZONYULGDUQI-QFIPXVFZSA-N 2 0 399.491 3.662 20 5 GHBDRP COc1cc(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414930150 838987134 /nfs/dbraw/zinc/98/71/34/838987134.db2.gz SNLJHFXUCNTAOQ-MSOLQXFVSA-N 2 0 385.464 3.542 20 5 GHBDRP COc1cc(C[NH2+]C[C@H]2CCC[C@@H]([NH3+])C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000415005531 839061140 /nfs/dbraw/zinc/06/11/40/839061140.db2.gz PCVUVVJBHXQWIX-PKOBYXMFSA-N 2 0 399.491 3.790 20 5 GHBDRP COc1cc(C[N@@H+]2CC[C@H](C)[C@@H](C[NH3+])C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000415123328 839243311 /nfs/dbraw/zinc/24/33/11/839243311.db2.gz JJXIBHABDGNORS-LPHOPBHVSA-N 2 0 399.491 3.599 20 5 GHBDRP O=[N+]([O-])c1ccc(CCCC[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422922347 847889918 /nfs/dbraw/zinc/88/99/18/847889918.db2.gz QBHOSKYBRQEYAQ-IRLDBZIGSA-N 2 0 381.476 3.763 20 5 GHBDRP Cc1cc(NC2CC[NH+]([C@@H](C)c3ccncc3)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000425237128 849883450 /nfs/dbraw/zinc/88/34/50/849883450.db2.gz KRIBCVKPDPMIEP-INIZCTEOSA-N 2 0 391.475 3.906 20 5 GHBDRP CC[NH+](CC)C[C@H]1CCCC[C@@H]1[NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000482157293 862751175 /nfs/dbraw/zinc/75/11/75/862751175.db2.gz OCJPPQFZTUNDGD-XLIONFOSSA-N 2 0 390.528 3.722 20 5 GHBDRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])CC1 ZINC000594495427 858192287 /nfs/dbraw/zinc/19/22/87/858192287.db2.gz XLLOAJIPLFCVJU-QFIPXVFZSA-N 2 0 394.519 3.509 20 5 GHBDRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000575059038 858508554 /nfs/dbraw/zinc/50/85/54/858508554.db2.gz CPEDDFFAMLLOJX-JKSUJKDBSA-N 2 0 379.464 3.663 20 5 GHBDRP COc1ccc(C[C@H](C)[NH2+]C2CC[NH+](C[C@@H]3CC=CCC3)CC2)c([N+](=O)[O-])c1 ZINC001170327144 881364448 /nfs/dbraw/zinc/36/44/48/881364448.db2.gz FDONZMFPHFDTHC-ZWKOTPCHSA-N 2 0 387.524 3.945 20 5 GHBDRP CC[N@H+](C)Cc1cc(O[C@@H]2CC[NH+](C/C=C\c3ccccc3[N+](=O)[O-])C2)ccn1 ZINC000856552962 881380779 /nfs/dbraw/zinc/38/07/79/881380779.db2.gz IZWMEJULVIYVLB-RFFSMVSESA-N 2 0 396.491 3.608 20 5 GHBDRP Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000543630775 859118445 /nfs/dbraw/zinc/11/84/45/859118445.db2.gz BEMXLNFMRRXKAH-UHFFFAOYSA-N 2 0 388.556 3.531 20 5 GHBDRP [NH3+][C@@H]1CCO[C@H]([C@H]2CCCC[N@@H+]2Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000593316238 859388887 /nfs/dbraw/zinc/38/88/87/859388887.db2.gz BFXQDOJVQLVGEZ-VMRPVKRXSA-N 2 0 385.464 3.716 20 5 GHBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1 ZINC000161186928 859678749 /nfs/dbraw/zinc/67/87/49/859678749.db2.gz BMOZZXVWBNUNDI-QGZVFWFLSA-N 2 0 383.492 3.711 20 5 GHBDRP CC[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)c1cccc([N+](=O)[O-])c1 ZINC000161210462 859702334 /nfs/dbraw/zinc/70/23/34/859702334.db2.gz POWVWXVMPZALDG-JOCHJYFZSA-N 2 0 383.492 3.792 20 5 GHBDRP CC(C)[N@H+](C)Cc1cc(O[C@H]2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)C2)ccn1 ZINC000856600568 881575057 /nfs/dbraw/zinc/57/50/57/881575057.db2.gz VCBMJHVMLPZFIN-QFIPXVFZSA-N 2 0 398.507 3.526 20 5 GHBDRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792878287 881766043 /nfs/dbraw/zinc/76/60/43/881766043.db2.gz UKERFLCFQRIZFI-HNAYVOBHSA-N 2 0 384.436 3.503 20 5 GHBDRP O=[N+]([O-])C[C@@H]1CC[C@H]([NH+]2CCC3(CC[NH+](Cc4cccs4)CC3)CC2)C1 ZINC001169020475 871122382 /nfs/dbraw/zinc/12/23/82/871122382.db2.gz JFFQKOSIUNNTGA-MSOLQXFVSA-N 2 0 377.554 3.872 20 5 GHBDRP COc1cc(C[NH2+]CC2CC[NH+](C)CC2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000105458846 875298459 /nfs/dbraw/zinc/29/84/59/875298459.db2.gz RAEGIOHOISJJRQ-UHFFFAOYSA-N 2 0 399.491 3.614 20 5 GHBDRP C[NH+](C)CCOc1ccc(CC[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000761519615 879226027 /nfs/dbraw/zinc/22/60/27/879226027.db2.gz CAQYGFDWVCGWLH-UHFFFAOYSA-N 2 0 377.872 3.521 20 5 GHBDRP CC[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000132753086 903304181 /nfs/dbraw/zinc/30/41/81/903304181.db2.gz AIJQKVJGYJSQDC-QFIPXVFZSA-N 2 0 383.492 3.792 20 5 GHBDRP O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)n1 ZINC000578952493 904249544 /nfs/dbraw/zinc/24/95/44/904249544.db2.gz MWEUNHQKEPPQMN-PMACEKPBSA-N 2 0 383.496 3.661 20 5 GHBDRP C[C@@H](C[NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1)CC(C)(C)CC[NH3+] ZINC001173010098 906086791 /nfs/dbraw/zinc/08/67/91/906086791.db2.gz RNMKSVMJHWNTPT-CQSZACIVSA-N 2 0 398.498 3.833 20 5 GHBDRP C[NH+](C)CC1CCC([NH2+]C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC1 ZINC001173014155 906092560 /nfs/dbraw/zinc/09/25/60/906092560.db2.gz LUFLGOAXXUYGIO-UHFFFAOYSA-N 2 0 396.482 3.552 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c1F ZINC001173179021 906256616 /nfs/dbraw/zinc/25/66/16/906256616.db2.gz ISTKKQZGQLCNRR-DZKIICNBSA-N 2 0 379.476 3.798 20 5 GHBDRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000246294038 910219027 /nfs/dbraw/zinc/21/90/27/910219027.db2.gz OZYOKDRJIIUIFJ-LAUBAEHRSA-N 2 0 375.513 3.605 20 5 GHBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1 ZINC000271123869 910789207 /nfs/dbraw/zinc/78/92/07/910789207.db2.gz JZZXIZYHLZQJGQ-IRXDYDNUSA-N 2 0 393.553 3.556 20 5 GHBDRP CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)C1(C)CC[NH+](C)CC1 ZINC001181987440 911111538 /nfs/dbraw/zinc/11/15/38/911111538.db2.gz LPMSPWMGMAAYJL-UHFFFAOYSA-N 2 0 392.503 3.627 20 5 GHBDRP C[C@H]1CC[NH2+][C@H](C(=O)Nc2cc3oc4cc(=[NH2+])ccc-4nc3c3ccccc23)C1 ZINC001219369300 1031383893 /nfs/dbraw/zinc/38/38/93/1031383893.db2.gz CHJVOMLCUFDSLQ-DJJJIMSYSA-N 2 0 386.455 3.892 20 5 GHBDRP [NH2+]=c1ccc2nc3c(cc(NC(=O)C=C4CC[NH2+]CC4)c4ccccc43)oc-2c1 ZINC001219371983 1031384674 /nfs/dbraw/zinc/38/46/74/1031384674.db2.gz RSNTWKIGNWMYRY-UHFFFAOYSA-N 2 0 384.439 3.814 20 5 GHBDRP [NH2+]=c1ccc2nc3c(cc(NC(=O)C[C@H]4CCC[NH2+]C4)c4ccccc43)oc-2c1 ZINC001219371913 1031384886 /nfs/dbraw/zinc/38/48/86/1031384886.db2.gz OLBSHADPMOUZER-CQSZACIVSA-N 2 0 386.455 3.893 20 5 GHBDRP [NH3+]C1CC[NH+](CCc2cn(-c3cc([N+](=O)[O-])cc(Cl)n3)c3ccccc23)CC1 ZINC001159460662 1034606147 /nfs/dbraw/zinc/60/61/47/1034606147.db2.gz XCFNRDLIBVMXLF-UHFFFAOYSA-N 2 0 399.882 3.553 20 5 GHBDRP C[C@@H](c1ccccn1)[N@H+](C)CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001462068931 1069978030 /nfs/dbraw/zinc/97/80/30/1069978030.db2.gz CJTWZZJGPVZQNM-SFHVURJKSA-N 2 0 382.508 3.937 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH2+]CC1(Cc3cccc(Cl)c3)CC[NH2+]CC1)C2 ZINC001246424688 1037382987 /nfs/dbraw/zinc/38/29/87/1037382987.db2.gz HJGHEPHRBBPTRS-FQEVSTJZSA-N 2 0 399.922 3.918 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH2+][C@@H](CC1CC[NH2+]CC1)c1cccc(F)c1)C2 ZINC001246446102 1037407960 /nfs/dbraw/zinc/40/79/60/1037407960.db2.gz BLEFYWDUSKLMDE-UNMCSNQZSA-N 2 0 383.467 3.922 20 5 GHBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]([C@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001254561839 1040334883 /nfs/dbraw/zinc/33/48/83/1040334883.db2.gz MIRNBCRAIPXNBC-SJLPKXTDSA-N 2 0 375.513 3.537 20 5 GHBDRP Cc1c([C@@H](C)[NH2+]Cc2cccc(CN3CC[NH+](C)CC3)c2)cccc1[N+](=O)[O-] ZINC001319762021 1055450159 /nfs/dbraw/zinc/45/01/59/1055450159.db2.gz ARZZFKZVSPKOCX-GOSISDBHSA-N 2 0 382.508 3.501 20 5 GHBDRP O=[N+]([O-])c1cccc([C@H](O)CN2CCC(c3ccccc3)([NH+]3CCCC3)CC2)c1 ZINC001460851560 1069221474 /nfs/dbraw/zinc/22/14/74/1069221474.db2.gz UXJJYPCKOJRQQW-JOCHJYFZSA-N 2 0 395.503 3.715 20 5 GHBDRP O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]CC[C@H]2CCC[NH2+]2)cc1 ZINC000414902817 838967396 /nfs/dbraw/zinc/96/73/96/838967396.db2.gz IPGGLMFUUCJSCG-LJQANCHMSA-N 2 0 391.475 3.679 20 5 GHBDRP COc1cc(C[NH2+]C[C@H]2CCC[C@@H]([NH3+])C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000415012030 839055582 /nfs/dbraw/zinc/05/55/82/839055582.db2.gz WUTDCNSMNIZSBU-PKOBYXMFSA-N 2 0 399.491 3.790 20 5 GHBDRP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3C[C@H]3C3CC[NH2+]CC3)o2)c(Cl)c1 ZINC000415015344 839063122 /nfs/dbraw/zinc/06/31/22/839063122.db2.gz YIZHKZJFJFSTOH-FUHWJXTLSA-N 2 0 375.856 3.986 20 5 GHBDRP [NH3+]C[C@H]1CC[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)C1 ZINC000415042958 839109257 /nfs/dbraw/zinc/10/92/57/839109257.db2.gz RMZNZUZGXGZFFJ-NWDGAFQWSA-N 2 0 394.269 3.834 20 5 GHBDRP CC1(C)C[C@@H]([NH2+]Cc2cccc(CN3CCOCC3)c2)c2cc([N+](=O)[O-])ccc21 ZINC000433138496 845479367 /nfs/dbraw/zinc/47/93/67/845479367.db2.gz YFNXKRVBHRVLNN-JOCHJYFZSA-N 2 0 395.503 3.939 20 5 GHBDRP Cc1c([C@H](C)[NH2+]CC2(N)CC[NH+](Cc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000423581159 849987740 /nfs/dbraw/zinc/98/77/40/849987740.db2.gz YVKIBDDZEPMGCK-SFHVURJKSA-N 2 0 382.508 3.547 20 5 GHBDRP C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(CC[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000426782151 852387375 /nfs/dbraw/zinc/38/73/75/852387375.db2.gz FWEZGMKGOLWBNB-KSZLIROESA-N 2 0 375.513 3.867 20 5 GHBDRP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000595071039 858371728 /nfs/dbraw/zinc/37/17/28/858371728.db2.gz XPZUTNTZXXGYDL-INIZCTEOSA-N 2 0 384.480 3.561 20 5 GHBDRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H](C)CC(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000540174775 870662502 /nfs/dbraw/zinc/66/25/02/870662502.db2.gz ZEEKMDVRBMTSJM-QGZVFWFLSA-N 2 0 398.507 3.942 20 5 GHBDRP Cc1ccc2c(c1)[C@H]([NH3+])CCCN2c1ccc([N+](=O)[O-])c(OCC[NH+](C)C)c1 ZINC001169692399 871762655 /nfs/dbraw/zinc/76/26/55/871762655.db2.gz SUWBVWXUAOLXIW-GOSISDBHSA-N 2 0 384.480 3.775 20 5 GHBDRP C[C@@H]1C[NH+](CCC2CC[NH+](C/C=C\c3ccccc3[N+](=O)[O-])CC2)C[C@@H](C)O1 ZINC000537659559 883006041 /nfs/dbraw/zinc/00/60/41/883006041.db2.gz YJYANOWGHMLXCC-MFDDNUIFSA-N 2 0 387.524 3.819 20 5 GHBDRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000179917067 878212942 /nfs/dbraw/zinc/21/29/42/878212942.db2.gz XREKIFNIJCYVSP-UHFFFAOYSA-N 2 0 394.479 3.536 20 5 GHBDRP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000237721886 884826099 /nfs/dbraw/zinc/82/60/99/884826099.db2.gz MOPTWBNGONWYGS-UHFFFAOYSA-N 2 0 382.508 3.595 20 5 GHBDRP COc1cccc(C2([NH3+])CC[NH+]([C@@H]3CCc4ccc([N+](=O)[O-])cc4CC3)CC2)c1 ZINC001172900083 905921473 /nfs/dbraw/zinc/92/14/73/905921473.db2.gz BVXFYQSWKFJORP-HXUWFJFHSA-N 2 0 395.503 3.801 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+](C2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c1F ZINC001173179022 906256976 /nfs/dbraw/zinc/25/69/76/906256976.db2.gz ISTKKQZGQLCNRR-IIAWOOMASA-N 2 0 379.476 3.798 20 5 GHBDRP COC[C@@H]1CCCC[N@H+](CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001180603219 910266315 /nfs/dbraw/zinc/26/63/15/910266315.db2.gz QCANUELUUBWRAJ-OAQYLSRUSA-N 2 0 389.540 3.598 20 5 GHBDRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000749678442 927231525 /nfs/dbraw/zinc/23/15/25/927231525.db2.gz SAAKJXCASKGTBY-VGSWGCGISA-N 2 0 383.492 3.792 20 5 GHBDRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000469760918 1016616228 /nfs/dbraw/zinc/61/62/28/1016616228.db2.gz ORQITFLWOYZRIW-OEWRPIJISA-N 2 0 383.492 3.720 20 5 GHBDRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC001461698326 1069685915 /nfs/dbraw/zinc/68/59/15/1069685915.db2.gz QVJDPFLQIRHLCE-UHFFFAOYSA-N 2 0 382.508 3.725 20 5 GHBDRP C[C@@H]1[NH2+]CCC[C@@H]1C(=O)Nc1cc2oc3cc(=[NH2+])ccc-3nc2c2ccccc12 ZINC001219369251 1031383802 /nfs/dbraw/zinc/38/38/02/1031383802.db2.gz ARPFBYUEPHDVHV-ZFWWWQNUSA-N 2 0 386.455 3.892 20 5 GHBDRP [NH3+]CCc1cn(-c2ccc(-c3ccc(Cl)c([N+](=O)[O-])c3)nn2)c2cc[nH+]cc12 ZINC001160952159 1035103278 /nfs/dbraw/zinc/10/32/78/1035103278.db2.gz SUNMBYRRAVAHPU-UHFFFAOYSA-N 2 0 394.822 3.545 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]C1(c3cccc(F)c3)CC[NH2+]CC1)CC2 ZINC001246436868 1037400376 /nfs/dbraw/zinc/40/03/76/1037400376.db2.gz KQVAGRAGEBPIMI-FQEVSTJZSA-N 2 0 383.467 3.850 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH2+][C@@H](CC1CC[NH2+]CC1)c1ccccc1F)C2 ZINC001246442304 1037403628 /nfs/dbraw/zinc/40/36/28/1037403628.db2.gz JBDHCEXPNUBWAM-GCJKJVERSA-N 2 0 383.467 3.922 20 5 GHBDRP [NH3+]CC1(c2ccccc2)CC[NH+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001246588260 1037489393 /nfs/dbraw/zinc/48/93/93/1037489393.db2.gz LAGKXXAEBXCXHD-OAQYLSRUSA-N 2 0 379.504 3.835 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH+]2CCC([C@H]3CCCC[NH2+]3)CC2)c1F ZINC001246663407 1037533812 /nfs/dbraw/zinc/53/38/12/1037533812.db2.gz JZZICYBYZHFYMC-RHSMWYFYSA-N 2 0 379.476 3.528 20 5 GHBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@]2(c3ccccc3)CC[NH2+]C[C@@H]2C1 ZINC001246669850 1037538047 /nfs/dbraw/zinc/53/80/47/1037538047.db2.gz ACECSDBWEAJCAP-AAIMPIBUSA-N 2 0 379.504 3.779 20 5 GHBDRP O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[NH2+]C3Cc4ccccc4C3)CC2)cc1 ZINC001308670905 1050054193 /nfs/dbraw/zinc/05/41/93/1050054193.db2.gz XNCDRAFOHRYHJJ-UHFFFAOYSA-N 2 0 379.504 3.606 20 5 GHBDRP O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[N@@H+]3CCCc4occc4C3)CC2)cc1 ZINC001308797064 1050097762 /nfs/dbraw/zinc/09/77/62/1050097762.db2.gz AQDABKYVLINCLO-UHFFFAOYSA-N 2 0 383.492 3.891 20 5 GHBDRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000583630662 834784708 /nfs/dbraw/zinc/78/47/08/834784708.db2.gz NHTPKURLTIMVLO-QWRGUYRKSA-N 2 0 382.258 3.833 20 5 GHBDRP [NH3+][C@@H]1CCC[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)C1 ZINC000414925379 838990391 /nfs/dbraw/zinc/99/03/91/838990391.db2.gz LSTZJNYRKOYSQL-VXGBXAGGSA-N 2 0 394.269 3.977 20 5 GHBDRP [NH3+]C[C@H]1CC[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)C1 ZINC000415042961 839109139 /nfs/dbraw/zinc/10/91/39/839109139.db2.gz RMZNZUZGXGZFFJ-RYUDHWBXSA-N 2 0 394.269 3.834 20 5 GHBDRP C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000126743149 842014355 /nfs/dbraw/zinc/01/43/55/842014355.db2.gz SHXFWOPIMAEKIE-CVEARBPZSA-N 2 0 386.471 3.898 20 5 GHBDRP CN(c1ccccc1)c1ccc(C[NH+]2CCC(OCCC[NH3+])CC2)cc1[N+](=O)[O-] ZINC000514790342 850290824 /nfs/dbraw/zinc/29/08/24/850290824.db2.gz QFVRGNBFFOQMIQ-UHFFFAOYSA-N 2 0 398.507 3.693 20 5 GHBDRP C[C@H]([NH3+])[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)C1 ZINC000435374646 850421824 /nfs/dbraw/zinc/42/18/24/850421824.db2.gz JEPVPPBCGOQDHQ-RYUDHWBXSA-N 2 0 394.269 3.786 20 5 GHBDRP C[NH+](C)CCCOc1cnccc1C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000573242189 856019449 /nfs/dbraw/zinc/01/94/49/856019449.db2.gz DQSYNUOVVXWCIC-HXUWFJFHSA-N 2 0 398.507 3.833 20 5 GHBDRP C[NH+](C)CCCC1CC[NH+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000123308379 856723348 /nfs/dbraw/zinc/72/33/48/856723348.db2.gz NZGSTTUGTXWEKX-UHFFFAOYSA-N 2 0 386.496 3.846 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CC1CC[NH+](Cc3ccncc3)CC1)CCC2 ZINC000595064783 858368272 /nfs/dbraw/zinc/36/82/72/858368272.db2.gz BDDYNUHVJFBINH-QFIPXVFZSA-N 2 0 380.492 3.869 20 5 GHBDRP O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)C1CC1 ZINC000595065072 858369395 /nfs/dbraw/zinc/36/93/95/858369395.db2.gz BWZZAOORQSDQHX-QFIPXVFZSA-N 2 0 394.519 3.813 20 5 GHBDRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000160352891 858826885 /nfs/dbraw/zinc/82/68/85/858826885.db2.gz WVMHTDAWUPTZFS-LJQANCHMSA-N 2 0 396.535 3.892 20 5 GHBDRP [NH3+]CC1(CC[NH2+]Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000593316354 859392406 /nfs/dbraw/zinc/39/24/06/859392406.db2.gz PNHACSODZXSSAH-UHFFFAOYSA-N 2 0 391.475 3.666 20 5 GHBDRP O=[N+]([O-])c1ccc(OCC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000618571808 871738583 /nfs/dbraw/zinc/73/85/83/871738583.db2.gz ZZZCIVSCTVOEQU-NUZGMZIFSA-N 2 0 381.476 3.759 20 5 GHBDRP CC[N@H+](CCC1CC[NH+](Cn2ncc3cc([N+](=O)[O-])ccc32)CC1)CC1CC1 ZINC000770685821 874822450 /nfs/dbraw/zinc/82/24/50/874822450.db2.gz MGBOYZOEOBMDLY-UHFFFAOYSA-N 2 0 385.512 3.736 20 5 GHBDRP C[NH+](C)C1(C)CCC([NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)CC1 ZINC000877711235 893774656 /nfs/dbraw/zinc/77/46/56/893774656.db2.gz ACSTVLBJVVYUBI-UHFFFAOYSA-N 2 0 376.320 3.771 20 5 GHBDRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000818959390 896296909 /nfs/dbraw/zinc/29/69/09/896296909.db2.gz JFDWODLRWPGMSU-HTAPYJJXSA-N 2 0 383.492 3.792 20 5 GHBDRP [NH3+][C@@H]1CCO[C@H]1C1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000578323761 903733741 /nfs/dbraw/zinc/73/37/41/903733741.db2.gz VWHBCYZHKUKVSP-QUCCMNQESA-N 2 0 387.505 3.652 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc3ccccc3)C1)CC2 ZINC001172900671 905921595 /nfs/dbraw/zinc/92/15/95/905921595.db2.gz XTPNPUDRMZNOBM-KNQAVFIVSA-N 2 0 379.504 3.954 20 5 GHBDRP CC(C)[NH+]1CCC(C[NH2+]C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC1 ZINC001173011471 906088529 /nfs/dbraw/zinc/08/85/29/906088529.db2.gz DOIQEEFNCIUQMK-UHFFFAOYSA-N 2 0 396.482 3.552 20 5 GHBDRP CC1(C)CC([NH3+])CC(C)(C)[NH+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173011843 906089072 /nfs/dbraw/zinc/08/90/72/906089072.db2.gz LPVLZTUITSCZSM-UHFFFAOYSA-N 2 0 396.482 3.822 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)c1F ZINC001173176232 906251418 /nfs/dbraw/zinc/25/14/18/906251418.db2.gz GVAFTJPSQOZANY-CQSZACIVSA-N 2 0 375.444 3.525 20 5 GHBDRP CC[NH+](CC)C1CCC([NH2+][C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])CC1 ZINC001173183289 906264488 /nfs/dbraw/zinc/26/44/88/906264488.db2.gz LUNYKQPNWLJNIT-QQFBHYJXSA-N 2 0 381.492 3.916 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+](C)CC2CC[NH+](C(C)C)CC2)c1F ZINC001173188834 906269791 /nfs/dbraw/zinc/26/97/91/906269791.db2.gz HGHODPCDAFNOGI-HNNXBMFYSA-N 2 0 381.492 3.726 20 5 GHBDRP C[C@@]1(CC[NH2+]CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)CC1(F)F ZINC001182940975 912146465 /nfs/dbraw/zinc/14/64/65/912146465.db2.gz GIEFHKYSGQNPRP-LJQANCHMSA-N 2 0 381.467 3.874 20 5 GHBDRP CC(C)N(C(=O)[C@@H]([NH3+])Cc1c2ccccc2cc2ccccc21)C(C)(C)C[NH3+] ZINC001221395650 1032394978 /nfs/dbraw/zinc/39/49/78/1032394978.db2.gz WVNQAJFRZHXYGK-QFIPXVFZSA-N 2 0 377.532 3.837 20 5 GHBDRP CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)[C@H](CC(C)C)[NH2+]C ZINC001219005886 1031208021 /nfs/dbraw/zinc/20/80/21/1031208021.db2.gz XNCXPKFJKBJLLS-SFHVURJKSA-N 2 0 380.492 3.529 20 5 GHBDRP CC1([NH+]2CCC2)CCC([NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)CC1 ZINC001207720129 1034543226 /nfs/dbraw/zinc/54/32/26/1034543226.db2.gz VEHAWLXSVYCIOO-UHFFFAOYSA-N 2 0 388.331 3.915 20 5 GHBDRP Cc1cccc2c1C1(C[C@@H]2[NH2+][C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC[NH2+]CC1 ZINC001246248655 1037253599 /nfs/dbraw/zinc/25/35/99/1037253599.db2.gz OTATZWXGGAODCZ-NQIIRXRSSA-N 2 0 377.488 3.726 20 5 GHBDRP O=[N+]([O-])c1ccc(N2CCC([NH2+]CC3(CC4CCC4)CC[NH2+]CC3)CC2)cc1 ZINC001246425624 1037383158 /nfs/dbraw/zinc/38/31/58/1037383158.db2.gz YMRQITICEZCRQS-UHFFFAOYSA-N 2 0 386.540 3.713 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@H]2CC[NH2+]C3(CCCCC3)C2)c1F ZINC001246511436 1037450727 /nfs/dbraw/zinc/45/07/27/1037450727.db2.gz IYHHIFLSNNIEDO-GJZGRUSLSA-N 2 0 379.476 3.718 20 5 GHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@]2(c3ccccc3)CC[NH2+]C[C@@H]2C1 ZINC001246681863 1037545458 /nfs/dbraw/zinc/54/54/58/1037545458.db2.gz ABARJUKECPNDEC-AAIMPIBUSA-N 2 0 379.504 3.779 20 5 GHBDRP CCC[C@@H]([NH2+]Cc1cccc(CN2CC[NH+](C)CC2)c1)c1cccc([N+](=O)[O-])c1 ZINC001253103843 1039426506 /nfs/dbraw/zinc/42/65/06/1039426506.db2.gz MNVHCXHEMVCPOD-HSZRJFAPSA-N 2 0 396.535 3.973 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@@H+]1CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C1)C2 ZINC001254604369 1040375973 /nfs/dbraw/zinc/37/59/73/1040375973.db2.gz WIJLVJODGZYBOZ-XZOQPEGZSA-N 2 0 377.488 3.660 20 5 GHBDRP COc1cc(N2CCC([N@H+](C(C)C)[C@H]3CC[C@H]([NH3+])CC3)CC2)ccc1[N+](=O)[O-] ZINC001256088963 1041518393 /nfs/dbraw/zinc/51/83/93/1041518393.db2.gz OAHIJQCFDLEFBW-QAQDUYKDSA-N 2 0 390.528 3.553 20 5 GHBDRP COc1cccc(C[NH2+]CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)c1C ZINC001308872462 1050132411 /nfs/dbraw/zinc/13/24/11/1050132411.db2.gz RUIWSPMMLMPJOX-UHFFFAOYSA-N 2 0 397.519 3.956 20 5 GHBDRP O=[N+]([O-])c1cc(C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)cs1 ZINC000176985423 837831849 /nfs/dbraw/zinc/83/18/49/837831849.db2.gz CKTMDXLIKBTOMV-UHFFFAOYSA-N 2 0 389.521 3.817 20 5 GHBDRP [NH3+][C@@H]1CCC[C@@H]([NH2+]Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000414922443 838988228 /nfs/dbraw/zinc/98/82/28/838988228.db2.gz GSUTWQQPQFIPCW-RTBURBONSA-N 2 0 391.475 3.807 20 5 GHBDRP CC1CC[NH+](C2CCC([NH2+]CCC(=O)Nc3ccccc3[N+](=O)[O-])CC2)CC1 ZINC000581305814 841048150 /nfs/dbraw/zinc/04/81/50/841048150.db2.gz ZGNYXKLCNFVNRA-UHFFFAOYSA-N 2 0 388.512 3.556 20 5 GHBDRP C[C@@H]1C[NH+](CCCC[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C[C@@H](C)O1 ZINC000433147492 845500920 /nfs/dbraw/zinc/50/09/20/845500920.db2.gz OUAKNUCWCHARBG-QINHECLXSA-N 2 0 375.513 3.796 20 5 GHBDRP C[C@H]([NH3+])[C@H]1CC[N@H+](Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000435381042 850446244 /nfs/dbraw/zinc/44/62/44/850446244.db2.gz UTMRAXUWASILQJ-WMZOPIPTSA-N 2 0 391.475 3.617 20 5 GHBDRP CC[C@H]([NH2+]Cc1ccccc1CN1CC[NH+](CC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000160353839 858828083 /nfs/dbraw/zinc/82/80/83/858828083.db2.gz XAVKFPUFIVRHQV-QHCPKHFHSA-N 2 0 396.535 3.973 20 5 GHBDRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602592069 860132924 /nfs/dbraw/zinc/13/29/24/860132924.db2.gz HPNCEZQYFMMGQE-UHFFFAOYSA-N 2 0 397.523 3.589 20 5 GHBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H](CN1CC[NH+](C)CC1)c1ccccc1 ZINC000526063450 872064892 /nfs/dbraw/zinc/06/48/92/872064892.db2.gz LHRMECWXUIIBRH-PFFSESEHSA-N 2 0 394.519 3.576 20 5 GHBDRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000105464806 875300130 /nfs/dbraw/zinc/30/01/30/875300130.db2.gz ZTGJDUHVLMYGOM-MRXNPFEDSA-N 2 0 386.471 3.727 20 5 GHBDRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000237460401 892055021 /nfs/dbraw/zinc/05/50/21/892055021.db2.gz KIVCAIUDNVMBII-QZTJIDSGSA-N 2 0 399.539 3.843 20 5 GHBDRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000818959393 896296541 /nfs/dbraw/zinc/29/65/41/896296541.db2.gz JFDWODLRWPGMSU-VGSWGCGISA-N 2 0 383.492 3.792 20 5 GHBDRP O=[N+]([O-])c1ccc([C@H](O)C[NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)cc1 ZINC000818987562 896306578 /nfs/dbraw/zinc/30/65/78/896306578.db2.gz ZMKKRSXPNIQLTJ-JOCHJYFZSA-N 2 0 383.492 3.794 20 5 GHBDRP O=[N+]([O-])c1cccc([C@H](O)C[NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)c1 ZINC000818987132 896306976 /nfs/dbraw/zinc/30/69/76/896306976.db2.gz TUVFDIUJDZVDND-JOCHJYFZSA-N 2 0 383.492 3.794 20 5 GHBDRP Cc1ccc2c(C[C@H](C)[NH3+])cn(-c3ccc([N+](=O)[O-])c4c3CC[N@H+](C)C4)c2c1 ZINC001171169119 901935611 /nfs/dbraw/zinc/93/56/11/901935611.db2.gz YUPKPKIZHWVKMY-HNNXBMFYSA-N 2 0 378.476 3.725 20 5 GHBDRP Cc1c([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)cccc1[N+](=O)[O-] ZINC000132698379 903297965 /nfs/dbraw/zinc/29/79/65/903297965.db2.gz XZOANNQKMFADLX-QGZVFWFLSA-N 2 0 383.492 3.711 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CC1CC[NH+](Cc3cccnc3)CC1)CC2 ZINC001172906632 905933309 /nfs/dbraw/zinc/93/33/09/905933309.db2.gz YVOITSPYTLFWHN-JOCHJYFZSA-N 2 0 394.519 3.739 20 5 GHBDRP COc1ccc(C2([NH3+])CC[NH+]([C@@H]3CCc4ccc([N+](=O)[O-])cc4CC3)CC2)cc1 ZINC001172906691 905933684 /nfs/dbraw/zinc/93/36/84/905933684.db2.gz OHXMKJLZHCHIRQ-HXUWFJFHSA-N 2 0 395.503 3.801 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)c1F ZINC001173191431 906273671 /nfs/dbraw/zinc/27/36/71/906273671.db2.gz LCSJBFFDORCXAQ-CYBMUJFWSA-N 2 0 381.492 3.915 20 5 GHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCSCc1ccc(C[NH+](C)C)o1 ZINC001173210109 906327097 /nfs/dbraw/zinc/32/70/97/906327097.db2.gz IJRLQHFLCXONPN-OAHLLOKOSA-N 2 0 377.510 3.703 20 5 GHBDRP C[NH+]1CCN(Cc2cccc(C[NH2+][C@H]3CCCc4ccc([N+](=O)[O-])cc43)c2)CC1 ZINC001116821320 933776588 /nfs/dbraw/zinc/77/65/88/933776588.db2.gz LEFGAABTVVAAGP-QHCPKHFHSA-N 2 0 394.519 3.509 20 5 GHBDRP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000469760920 1016616187 /nfs/dbraw/zinc/61/61/87/1016616187.db2.gz ORQITFLWOYZRIW-ROUUACIJSA-N 2 0 383.492 3.720 20 5 GHBDRP CC[C@H]1C[N@H+](CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)CCS1 ZINC001204769014 1033081572 /nfs/dbraw/zinc/08/15/72/1033081572.db2.gz PHXPHZCBFHNRSV-FQEVSTJZSA-N 2 0 377.554 3.677 20 5 GHBDRP COc1cc(C[N@H+](C)C2CCC([NH3+])CC2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000843054764 1029789316 /nfs/dbraw/zinc/78/93/16/1029789316.db2.gz GMTFESWBSCYVLB-UHFFFAOYSA-N 2 0 399.491 3.884 20 5 GHBDRP Cc1ccc2c(c1)C1(C[C@@H]2[NH2+][C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC[NH2+]CC1 ZINC001246169469 1037222004 /nfs/dbraw/zinc/22/20/04/1037222004.db2.gz HAZVYEXLWKBFNT-GCJKJVERSA-N 2 0 377.488 3.726 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH2+]C1(Cc3cccc(Cl)c3)CC[NH2+]CC1)C2 ZINC001246431462 1037394464 /nfs/dbraw/zinc/39/44/64/1037394464.db2.gz ZHPFHBIYSLGYRA-IBGZPJMESA-N 2 0 385.895 3.670 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]C2(CC3CCC3)CC[NH2+]CC2)c1F ZINC001246446067 1037408377 /nfs/dbraw/zinc/40/83/77/1037408377.db2.gz KLQGGROUUXYTPO-CQSZACIVSA-N 2 0 379.476 3.576 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]C1(Cc3cccc(F)c3)CC[NH2+]CC1)CC2 ZINC001246449631 1037410412 /nfs/dbraw/zinc/41/04/12/1037410412.db2.gz ANLIKSVEPUDJHW-NRFANRHFSA-N 2 0 397.494 3.936 20 5 GHBDRP COc1ccc(C[C@H](C)[NH+]2CCC3(CC2)C[NH2+]Cc2ccccc23)c([N+](=O)[O-])c1 ZINC001246639076 1037523278 /nfs/dbraw/zinc/52/32/78/1037523278.db2.gz NEGBQTAGTVKUEO-KRWDZBQOSA-N 2 0 395.503 3.671 20 5 GHBDRP COc1ccc(C[C@H](C)[N@@H+]2CC[C@@]3(C[NH2+]C[C@@H]3c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001246682871 1037546340 /nfs/dbraw/zinc/54/63/40/1037546340.db2.gz OMNDWOYTJFPZBI-AMHTUMDSSA-N 2 0 395.503 3.614 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CC[C@]3(C[NH2+]C[C@@H]3c3ccccc3)C1)CC2 ZINC001246684715 1037548578 /nfs/dbraw/zinc/54/85/78/1037548578.db2.gz NVCLSWCAJFUCOC-JRFVFWCSSA-N 2 0 391.515 3.921 20 5 GHBDRP COc1ccc(C[C@@H](C)[N@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c([N+](=O)[O-])c1 ZINC001246965315 1037788163 /nfs/dbraw/zinc/78/81/63/1037788163.db2.gz PMAQMLNKNZDUNR-ATZDWAIDSA-N 2 0 375.513 3.906 20 5 GHBDRP C[NH+]1CCC(C2CC[NH+](C3CCN(c4ccc([N+](=O)[O-])cc4)CC3)CC2)CC1 ZINC001254479447 1040266075 /nfs/dbraw/zinc/26/60/75/1040266075.db2.gz ZRRURCZWJFXPNP-UHFFFAOYSA-N 2 0 386.540 3.617 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@@H+]1CC[C@@H]3C[NH+](Cc4ccccc4)CC[C@H]3C1)C2 ZINC001254611115 1040383767 /nfs/dbraw/zinc/38/37/67/1040383767.db2.gz VTQKSDHLIOXPEI-ZFGGDYGUSA-N 2 0 391.515 3.906 20 5 GHBDRP Cc1c([C@H](C)[NH2+]Cc2cccc(CN3CC[NH+](C)CC3)c2)cccc1[N+](=O)[O-] ZINC001319762023 1055450699 /nfs/dbraw/zinc/45/06/99/1055450699.db2.gz ARZZFKZVSPKOCX-SFHVURJKSA-N 2 0 382.508 3.501 20 5 GHBDRP Cc1cc(NCc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302067417 861194982 /nfs/dbraw/zinc/19/49/82/861194982.db2.gz FOOPMGUDEDDEGJ-LJQANCHMSA-N 2 0 392.459 3.630 20 5 GHBDRP C[C@H]([NH2+][C@@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000126742918 842015056 /nfs/dbraw/zinc/01/50/56/842015056.db2.gz SHXFWOPIMAEKIE-HOTGVXAUSA-N 2 0 386.471 3.898 20 5 GHBDRP CC[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccc(C[NH+](C)C)cc1 ZINC000599660900 861493604 /nfs/dbraw/zinc/49/36/04/861493604.db2.gz PQRMUUIWZDGVAZ-UHFFFAOYSA-N 2 0 384.480 3.507 20 5 GHBDRP O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423039610 847951373 /nfs/dbraw/zinc/95/13/73/847951373.db2.gz FRVPGPLDAFWWKF-XLIONFOSSA-N 2 0 387.867 3.636 20 5 GHBDRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000425967928 852174824 /nfs/dbraw/zinc/17/48/24/852174824.db2.gz QNBWVEDJUXJUPE-UHFFFAOYSA-N 2 0 385.512 3.586 20 5 GHBDRP COc1ccc(C[NH2+][C@@H]2CC[NH2+]CC2(C)C)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414967822 853086943 /nfs/dbraw/zinc/08/69/43/853086943.db2.gz HPQHDRICEHSFNZ-OAQYLSRUSA-N 2 0 399.491 3.660 20 5 GHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000594968473 858349554 /nfs/dbraw/zinc/34/95/54/858349554.db2.gz HELHSGNJDFWNTQ-QGOAFFKASA-N 2 0 380.492 3.895 20 5 GHBDRP C[C@H]([NH2+]CCCC[NH+]1CCN(Cc2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000481322296 861090960 /nfs/dbraw/zinc/09/09/60/861090960.db2.gz ZTCBBMFXARQVRP-FQEVSTJZSA-N 2 0 396.535 3.843 20 5 GHBDRP CC(C)[N@H+](C)CC1CC[NH+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000534347835 866594316 /nfs/dbraw/zinc/59/43/16/866594316.db2.gz YCXMZSFCXVYKEB-UHFFFAOYSA-N 2 0 385.512 3.548 20 5 GHBDRP COc1cc(C[N@@H+]2CCC[C@H](CC[NH3+])C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000442917434 869075030 /nfs/dbraw/zinc/07/50/30/869075030.db2.gz ALLMNSPMPVTHNZ-QGZVFWFLSA-N 2 0 399.491 3.743 20 5 GHBDRP O=[N+]([O-])c1ccc(N2CCC([NH2+]C3CCC([NH+]4CCCCC4)CC3)CC2)cc1 ZINC000766514857 870912087 /nfs/dbraw/zinc/91/20/87/870912087.db2.gz ZQMIRIOPCLEYJS-UHFFFAOYSA-N 2 0 386.540 3.950 20 5 GHBDRP C[C@@H]([NH2+]CCc1ccc(OCC[NH+]2CCCC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000540395348 871165500 /nfs/dbraw/zinc/16/55/00/871165500.db2.gz SRZNOVBMDQLYHT-GOSISDBHSA-N 2 0 383.492 3.963 20 5 GHBDRP O=C(CC[N@@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000533271191 890135340 /nfs/dbraw/zinc/13/53/40/890135340.db2.gz HMRONPPVTFSITO-SFHVURJKSA-N 2 0 388.512 3.511 20 5 GHBDRP CCc1ccc([C@@H](NC[C@@H]2CC3(CO2)CC[NH2+]CC3)c2ccc([N+](=O)[O-])cc2)o1 ZINC000873293948 891563483 /nfs/dbraw/zinc/56/34/83/891563483.db2.gz RSEVWCIRFHNHRQ-FPOVZHCZSA-N 2 0 399.491 3.588 20 5 GHBDRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000818959779 896295571 /nfs/dbraw/zinc/29/55/71/896295571.db2.gz SUDHSEYIDDNHIP-VGSWGCGISA-N 2 0 383.492 3.792 20 5 GHBDRP CC1CC[NH+](Cc2cccc(C[NH2+]C[C@H](O)c3ccc([N+](=O)[O-])cc3)c2)CC1 ZINC000818996856 896314158 /nfs/dbraw/zinc/31/41/58/896314158.db2.gz XPKVFUANKBRHFN-QFIPXVFZSA-N 2 0 383.492 3.650 20 5 GHBDRP CCC1(C[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC[NH+](Cc2ccccc2)CC1 ZINC000819189466 896458463 /nfs/dbraw/zinc/45/84/63/896458463.db2.gz GZMQNRKUTPVRGG-JOCHJYFZSA-N 2 0 397.519 3.910 20 5 GHBDRP C[C@@H]1C[C@H](CC[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C[N@@H+]1Cc1ccccc1 ZINC000819189510 896458825 /nfs/dbraw/zinc/45/88/25/896458825.db2.gz HVJBHYVTCYFKIE-ZWCUEREDSA-N 2 0 383.492 3.519 20 5 GHBDRP O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000567367238 897096667 /nfs/dbraw/zinc/09/66/67/897096667.db2.gz YXGZDHSDZWXUAI-OAQYLSRUSA-N 2 0 381.476 3.847 20 5 GHBDRP CC1CC[NH+](C2CCC([NH2+][C@@H]3CCCC[C@H]3n3ccc([N+](=O)[O-])n3)CC2)CC1 ZINC000573015318 900342962 /nfs/dbraw/zinc/34/29/62/900342962.db2.gz DJYXPRJIDHIZSE-NTFDOXNWSA-N 2 0 389.544 3.908 20 5 GHBDRP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)n1 ZINC000578952496 904249989 /nfs/dbraw/zinc/24/99/89/904249989.db2.gz MWEUNHQKEPPQMN-WOJBJXKFSA-N 2 0 383.496 3.661 20 5 GHBDRP [NH3+][C@H]1CC[C@H]([N@H+](C2CCOCC2)[C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172906807 905933479 /nfs/dbraw/zinc/93/34/79/905933479.db2.gz OWTNTVUWGCPNIG-VAMGGRTRSA-N 2 0 387.524 3.593 20 5 GHBDRP C[NH+]1CCN(c2ccccc2C[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC001118026277 934080268 /nfs/dbraw/zinc/08/02/68/934080268.db2.gz DJRBPBWCLWKKMO-QFIPXVFZSA-N 2 0 394.519 3.904 20 5 GHBDRP C[NH+]1CCN(c2cc[nH+]cc2Nc2c(Cl)ccc([N+](=O)[O-])c2Cl)CC1 ZINC001215580376 1029291606 /nfs/dbraw/zinc/29/16/06/1029291606.db2.gz GLXCBEGMMXSQIT-UHFFFAOYSA-N 2 0 382.251 3.792 20 5 GHBDRP CCCc1ncc(C[NH2+]CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)o1 ZINC001205795458 1033577234 /nfs/dbraw/zinc/57/72/34/1033577234.db2.gz KYKFZHBZCDEORG-UHFFFAOYSA-N 2 0 386.496 3.580 20 5 GHBDRP C[C@@H]1SCC[N@H+](CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)[C@H]1C ZINC001461961626 1069916697 /nfs/dbraw/zinc/91/66/97/1069916697.db2.gz SSLJHDQTHCWUGG-IRXDYDNUSA-N 2 0 377.554 3.675 20 5 GHBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CC2(CC[NH2+]CC2)Oc2ccccc21 ZINC001246138541 1037211843 /nfs/dbraw/zinc/21/18/43/1037211843.db2.gz YQONFAHEZVECIG-JXFKEZNVSA-N 2 0 381.476 3.761 20 5 GHBDRP [NH3+]C1(Cc2ccc(Cl)cc2)CC[NH+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254586455 1040359750 /nfs/dbraw/zinc/35/97/50/1040359750.db2.gz JOYOJSZWSMQLDY-HXUWFJFHSA-N 2 0 385.895 3.751 20 5 GHBDRP CC1(C)CO[C@H](CC[NH2+]CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001308937625 1050197839 /nfs/dbraw/zinc/19/78/39/1050197839.db2.gz TYSAMUJLBQPCFS-OAQYLSRUSA-N 2 0 389.540 3.644 20 5 GHBDRP O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](C3CC[NH2+]CC3)C2)ccc1Br ZINC000849350859 1067817351 /nfs/dbraw/zinc/81/73/51/1067817351.db2.gz ZCFUDHMTPBIMQS-OAHLLOKOSA-N 2 0 382.302 3.569 20 5 GHBDRP COc1cc(C[N@@H+]2CCC[C@H]([C@@H](C)[NH3+])C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000580311728 839229586 /nfs/dbraw/zinc/22/95/86/839229586.db2.gz OZSQZUAVOVBSJK-APWZRJJASA-N 2 0 399.491 3.742 20 5 GHBDRP CN1CCC([NH+]2CCC(Nc3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)CC1 ZINC000050954367 842863728 /nfs/dbraw/zinc/86/37/28/842863728.db2.gz VBEYKTASBSINNO-UHFFFAOYSA-N 2 0 386.418 3.584 20 5 GHBDRP NC1(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC[NH+](Cc2ccccc2)CC1 ZINC000423576647 849985901 /nfs/dbraw/zinc/98/59/01/849985901.db2.gz RKCMAMKNZSGUBB-JOCHJYFZSA-N 2 0 394.519 3.555 20 5 GHBDRP CSC1(C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[NH+](C)CC1 ZINC000589325664 854791332 /nfs/dbraw/zinc/79/13/32/854791332.db2.gz XAPANWAVQQRVEQ-UHFFFAOYSA-N 2 0 375.494 3.772 20 5 GHBDRP CC[NH+](CC)CC1CC[NH+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000057847361 855762824 /nfs/dbraw/zinc/76/28/24/855762824.db2.gz ZQESPIIZMPDOHN-OAHLLOKOSA-N 2 0 387.484 3.760 20 5 GHBDRP CC[C@H]([NH2+]Cc1ccc(CN2CC[NH+](CC)CC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000160321854 858809845 /nfs/dbraw/zinc/80/98/45/858809845.db2.gz ISAHDTIIMVFUKU-QHCPKHFHSA-N 2 0 396.535 3.973 20 5 GHBDRP CCC[NH+]1CCN(c2ccccc2C[NH2+]Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000480445201 864669915 /nfs/dbraw/zinc/66/99/15/864669915.db2.gz OHPFWITZFRJDLA-UHFFFAOYSA-N 2 0 382.508 3.725 20 5 GHBDRP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1cccc([N+](=O)[O-])c1 ZINC000182250519 872103955 /nfs/dbraw/zinc/10/39/55/872103955.db2.gz MWPZELLFOPTYFS-YADHBBJMSA-N 2 0 383.492 3.792 20 5 GHBDRP C[NH+]1CCN(c2cc(Nc3ccc4cc5ccc(N)cc5[nH+]c4c3)cc[nH+]2)CC1 ZINC001201666895 875804628 /nfs/dbraw/zinc/80/46/28/875804628.db2.gz HUYYVGNJUNHZNN-UHFFFAOYSA-N 3 0 384.487 3.861 20 5 GHBDRP O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCCC[N@H+]2CCC[C@H]2CO)s1 ZINC000111386076 879082375 /nfs/dbraw/zinc/08/23/75/879082375.db2.gz RSMHEVZHBLGAAL-INIZCTEOSA-N 2 0 389.521 3.650 20 5 GHBDRP O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CC[C@@H](C[NH+]4CCCCC4)C3)o2)c1 ZINC000173600777 889996699 /nfs/dbraw/zinc/99/66/99/889996699.db2.gz YKUKBEZRTDDRCM-KRWDZBQOSA-N 2 0 384.480 3.600 20 5 GHBDRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000818959391 896296359 /nfs/dbraw/zinc/29/63/59/896296359.db2.gz JFDWODLRWPGMSU-JTSKRJEESA-N 2 0 383.492 3.792 20 5 GHBDRP CC[NH+](CC)CCOC1CCN(c2cc(C)[nH+]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000578359270 903765761 /nfs/dbraw/zinc/76/57/61/903765761.db2.gz WGIPFHGMZQAWOR-UHFFFAOYSA-N 2 0 386.496 3.779 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]C2CC[NH+](CC3CCC3)CC2)c1F ZINC001173181152 906259703 /nfs/dbraw/zinc/25/97/03/906259703.db2.gz NZLBOJOBXCUHGW-CQSZACIVSA-N 2 0 379.476 3.528 20 5 GHBDRP Cc1ccc(C[NH+]2C[C@@H]3C[N@H+]([C@@H](C)Cc4ccc([N+](=O)[O-])cc4)C[C@@H]3C2)cc1 ZINC001173223672 906306017 /nfs/dbraw/zinc/30/60/17/906306017.db2.gz GMCAQLPFJNDCBE-YUXAGFNASA-N 2 0 379.504 3.898 20 5 GHBDRP CC[NH+](CC)CCOC1CC[NH+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC1 ZINC000470176199 930433537 /nfs/dbraw/zinc/43/35/37/930433537.db2.gz JBCJJTURAWYPHU-SDXDJHTJSA-N 2 0 375.513 3.821 20 5 GHBDRP C[C@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000781424790 930839937 /nfs/dbraw/zinc/83/99/37/930839937.db2.gz DFORYHOVZJSMGB-ROUUACIJSA-N 2 0 386.540 3.806 20 5 GHBDRP O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cc1 ZINC000781423397 930840238 /nfs/dbraw/zinc/84/02/38/930840238.db2.gz PSQXXILWLZKXGY-JMJGKCIBSA-N 2 0 395.503 3.519 20 5 GHBDRP CC[N@@H+](Cc1ccccn1)CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001204881976 1033143920 /nfs/dbraw/zinc/14/39/20/1033143920.db2.gz XURPCOPVPJMIGA-UHFFFAOYSA-N 2 0 382.508 3.766 20 5 GHBDRP C[NH+]1CCN(c2cc[nH+]c(NCc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)c2)CC1 ZINC001203358732 1027290532 /nfs/dbraw/zinc/29/05/32/1027290532.db2.gz XQIVLOVEXYEGBQ-UHFFFAOYSA-N 2 0 393.447 3.614 20 5 GHBDRP [NH3+][C@@H](Cc1c2ccccc2cc2ccccc21)C(=O)N1CCC[C@]12CCC[NH2+]C2 ZINC001158161862 1033946304 /nfs/dbraw/zinc/94/63/04/1033946304.db2.gz ROEIHSBQMLPZSO-ZCYQVOJMSA-N 2 0 387.527 3.607 20 5 GHBDRP COc1ccc(C2([NH2+][C@H]3CCc4ccc([N+](=O)[O-])cc4CC3)CC[NH2+]CC2)cc1 ZINC001246379394 1037335982 /nfs/dbraw/zinc/33/59/82/1037335982.db2.gz DEYCONHNGIVNBG-FQEVSTJZSA-N 2 0 395.503 3.719 20 5 GHBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC1(Cc2ccc(F)cc2)CC[NH2+]CC1 ZINC001246383049 1037343333 /nfs/dbraw/zinc/34/33/33/1037343333.db2.gz CQTNMNRYYIABSP-KRWDZBQOSA-N 2 0 385.483 3.867 20 5 GHBDRP COc1ccc(CC2(C[NH2+][C@H](C)Cc3ccccc3[N+](=O)[O-])CC[NH2+]CC2)cc1 ZINC001246386549 1037346081 /nfs/dbraw/zinc/34/60/81/1037346081.db2.gz IBQJGSHKHIJSGE-GOSISDBHSA-N 2 0 397.519 3.737 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@@H](NC1(c3ccccc3F)CC[NH2+]CC1)CC2 ZINC001246427667 1037387532 /nfs/dbraw/zinc/38/75/32/1037387532.db2.gz FKDWBJQOBYAZSQ-SFHVURJKSA-N 2 0 383.467 3.850 20 5 GHBDRP CCO[C@@H]1CCCC[C@H]1[NH2+]CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001462340843 1070184686 /nfs/dbraw/zinc/18/46/86/1070184686.db2.gz RPXVEPHXHPITON-FGZHOGPDSA-N 2 0 389.540 3.787 20 5 GHBDRP CC(C)c1ccc(C[NH2+]Cc2cccc(CN3CC[NH+](C)CC3)c2)cc1[N+](=O)[O-] ZINC001200046179 1065066876 /nfs/dbraw/zinc/06/68/76/1065066876.db2.gz KNUVMTYOTCPRSK-UHFFFAOYSA-N 2 0 396.535 3.755 20 5 GHBDRP COc1cc(C[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)c([N+](=O)[O-])cc1OCC(F)F ZINC000414806052 838849562 /nfs/dbraw/zinc/84/95/62/838849562.db2.gz GZFNRPHDYOVKEM-LBPRGKRZSA-N 2 0 395.406 3.557 20 5 GHBDRP [NH3+][C@H]1CCC[C@H]([NH2+]Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000414922441 838987719 /nfs/dbraw/zinc/98/77/19/838987719.db2.gz GSUTWQQPQFIPCW-OALUTQOASA-N 2 0 391.475 3.807 20 5 GHBDRP Cc1cc(N2CCC(C[NH+]3C[C@H](C)O[C@@H](C)C3)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302171998 861231020 /nfs/dbraw/zinc/23/10/20/861231020.db2.gz MFFDWDAAKFBJCM-IRXDYDNUSA-N 2 0 398.507 3.777 20 5 GHBDRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000056184975 861448348 /nfs/dbraw/zinc/44/83/48/861448348.db2.gz RIVIKIRLVWVHND-MRXNPFEDSA-N 2 0 384.480 3.553 20 5 GHBDRP C[C@@H]1C[C@H](C[NH3+])C[N@@H+]1Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000435374819 850422103 /nfs/dbraw/zinc/42/21/03/850422103.db2.gz YSJPSFPVNYTJNK-IAGOWNOFSA-N 2 0 391.475 3.617 20 5 GHBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000489143242 852045314 /nfs/dbraw/zinc/04/53/14/852045314.db2.gz XVLXWPWNNDMAEM-FGTMMUONSA-N 2 0 375.513 3.785 20 5 GHBDRP COc1ccc(C[N@@H+]2CCC[C@H]([C@@H](C)[NH3+])C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000592427681 857403119 /nfs/dbraw/zinc/40/31/19/857403119.db2.gz PVVWXYAEQXLWNC-APWZRJJASA-N 2 0 399.491 3.742 20 5 GHBDRP C[NH+]1CCC2(CC1)C[N@H+](Cc1ccc(-c3ccc([N+](=O)[O-])cc3)s1)CCO2 ZINC000592525623 857672307 /nfs/dbraw/zinc/67/23/07/857672307.db2.gz BHVVIIAHVPRFRB-UHFFFAOYSA-N 2 0 387.505 3.620 20 5 GHBDRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000113934332 857795448 /nfs/dbraw/zinc/79/54/48/857795448.db2.gz HRHOPULBMGMHIF-QZTJIDSGSA-N 2 0 388.512 3.510 20 5 GHBDRP COc1ccc(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCC3)cc1[N+](=O)[O-] ZINC000595000175 858362492 /nfs/dbraw/zinc/36/24/92/858362492.db2.gz JPVQLUYAGZESEN-HXUWFJFHSA-N 2 0 395.503 3.995 20 5 GHBDRP CC[N@H+](C)Cc1cc(O[C@H]2CC[NH+](C/C=C\c3ccccc3[N+](=O)[O-])C2)ccn1 ZINC000856552960 881377031 /nfs/dbraw/zinc/37/70/31/881377031.db2.gz IZWMEJULVIYVLB-LHFJYWTJSA-N 2 0 396.491 3.608 20 5 GHBDRP Cc1nn(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c2cc([N+](=O)[O-])ccc12 ZINC000761292572 860658141 /nfs/dbraw/zinc/65/81/41/860658141.db2.gz LNWSZFJVPJZTNE-UHFFFAOYSA-N 2 0 385.512 3.798 20 5 GHBDRP Cc1c([C@@H](C)[NH2+]Cc2ccc(CN3CC[NH+](C)CC3)cc2)cccc1[N+](=O)[O-] ZINC000126701083 861125934 /nfs/dbraw/zinc/12/59/34/861125934.db2.gz NTVBDIOFTFMFDB-GOSISDBHSA-N 2 0 382.508 3.501 20 5 GHBDRP CC[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000126721648 861133189 /nfs/dbraw/zinc/13/31/89/861133189.db2.gz JMLSIYQEIPOQQL-JOCHJYFZSA-N 2 0 382.508 3.583 20 5 GHBDRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(OC)c(OCc3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000120795760 881758073 /nfs/dbraw/zinc/75/80/73/881758073.db2.gz ZCKICOIANRXUKA-IBGZPJMESA-N 2 0 399.491 3.614 20 5 GHBDRP CC[NH+](CC)CCO[C@H]1CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000538749588 870559260 /nfs/dbraw/zinc/55/92/60/870559260.db2.gz VRGKXIYQUKCEKJ-IBGZPJMESA-N 2 0 387.480 3.788 20 5 GHBDRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000540188065 870676977 /nfs/dbraw/zinc/67/69/77/870676977.db2.gz GKNOOFHYLJMULU-LJQANCHMSA-N 2 0 382.508 3.848 20 5 GHBDRP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)n1 ZINC000618570493 879881599 /nfs/dbraw/zinc/88/15/99/879881599.db2.gz KCCPMSOZHFQCGS-PWRODBHTSA-N 2 0 397.523 3.777 20 5 GHBDRP C[NH+]1CCN(Cc2ccc(C[NH2+][C@@H]3CCCc4ccc([N+](=O)[O-])cc43)cc2)CC1 ZINC000192706040 883801646 /nfs/dbraw/zinc/80/16/46/883801646.db2.gz BPERETRXBTWORX-HSZRJFAPSA-N 2 0 394.519 3.509 20 5 GHBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cccc(CN2CCO[C@H](C)C2)c1 ZINC000153481119 885817449 /nfs/dbraw/zinc/81/74/49/885817449.db2.gz RTCGHNFORIFUGY-MSOLQXFVSA-N 2 0 383.492 3.975 20 5 GHBDRP Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(CC[NH+]2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000565389355 895585992 /nfs/dbraw/zinc/58/59/92/895585992.db2.gz BKVLJPCLWFNLLH-ROUUACIJSA-N 2 0 375.513 3.615 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CC1CC[NH+](Cc3ccncc3)CC1)CC2 ZINC001172906528 905933235 /nfs/dbraw/zinc/93/32/35/905933235.db2.gz XURLVRYJTGWQTN-QFIPXVFZSA-N 2 0 394.519 3.739 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]CC2CC[NH+](CC3CCC3)CC2)c1F ZINC001173177784 906254688 /nfs/dbraw/zinc/25/46/88/906254688.db2.gz DCNRCGKNJFVSAY-OAHLLOKOSA-N 2 0 393.503 3.775 20 5 GHBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CCCN1CC[NH+](Cc2ccccc2)CC1 ZINC001177222747 908472278 /nfs/dbraw/zinc/47/22/78/908472278.db2.gz ODBCOUALQZWWEC-UHFFFAOYSA-N 2 0 396.535 3.509 20 5 GHBDRP CC1(C)C[N@H+](CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)C(C)(C)CO1 ZINC001180120254 909970165 /nfs/dbraw/zinc/97/01/65/909970165.db2.gz GKOTWFOICKIVIY-UHFFFAOYSA-N 2 0 389.540 3.739 20 5 GHBDRP C[C@H](C(=O)Nc1cc2oc3cc(=[NH2+])ccc-3nc2c2ccccc12)[NH+]1CCCC1 ZINC001180581675 910229255 /nfs/dbraw/zinc/22/92/55/910229255.db2.gz BJNXDADUZHIQPO-CQSZACIVSA-N 2 0 386.455 3.988 20 5 GHBDRP CC(C)c1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)cc1[N+](=O)[O-] ZINC001461432718 1069546869 /nfs/dbraw/zinc/54/68/69/1069546869.db2.gz RVGILWJEHRIAPD-HXUWFJFHSA-N 2 0 383.492 3.575 20 5 GHBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO ZINC001462000575 1069937771 /nfs/dbraw/zinc/93/77/71/1069937771.db2.gz WEZDFHQXEXITQR-AVRDEDQJSA-N 2 0 397.519 3.662 20 5 GHBDRP COc1ccc2c(c1)C1(C[C@@H]2[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC[NH2+]CC1 ZINC001246127788 1037206611 /nfs/dbraw/zinc/20/66/11/1037206611.db2.gz PEDXFJJORGQQPA-AOMKIAJQSA-N 2 0 395.503 3.890 20 5 GHBDRP Cc1cc(F)cc(C[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C2CC[NH2+]CC2)c1 ZINC001246952012 1037756756 /nfs/dbraw/zinc/75/67/56/1037756756.db2.gz QJFTWLRERMISGJ-JOCHJYFZSA-N 2 0 383.467 3.764 20 5 GHBDRP O=[N+]([O-])c1ccc(N2CCC([NH2+]CC3CC[NH+](CC4CCC4)CC3)CC2)cc1 ZINC001254469965 1040256404 /nfs/dbraw/zinc/25/64/04/1040256404.db2.gz KOUHUASHSVDZCE-UHFFFAOYSA-N 2 0 386.540 3.665 20 5 GHBDRP CCOC(=O)[C@@H]1C[N@H+](Cc2c3ccccc3cc3ccccc32)CCC12C[NH2+]C2 ZINC001237428735 1042204251 /nfs/dbraw/zinc/20/42/51/1042204251.db2.gz CKGXEPKGIOILLF-QHCPKHFHSA-N 2 0 388.511 3.968 20 5 GHBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cccc(CN2CC[NH+](C)CC2)c1 ZINC001322643750 1056783114 /nfs/dbraw/zinc/78/31/14/1056783114.db2.gz TXDVACFXQPWBAP-SFHVURJKSA-N 2 0 382.508 3.501 20 5 GHBDRP C[NH+](C)[C@@H]1CC[C@H]2C[N@H+](Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)C[C@H]2C1 ZINC001355372343 1057135647 /nfs/dbraw/zinc/13/56/47/1057135647.db2.gz BBLJRIAJQGPFQH-LZLYRXPVSA-N 2 0 386.521 3.880 20 5 GHBDRP C[NH+]1CCN(c2cc[nH+]cc2NCc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC001474097251 1074262606 /nfs/dbraw/zinc/26/26/06/1074262606.db2.gz BSJQLUMHBPVBPI-UHFFFAOYSA-N 2 0 393.447 3.614 20 5 GHBDRP O=[N+]([O-])c1ccn(C2CC[NH+](Cc3ccc(C[NH+]4CCCCC4)cc3)CC2)n1 ZINC000411658900 836270360 /nfs/dbraw/zinc/27/03/60/836270360.db2.gz XTXYFPNRTUVWDM-UHFFFAOYSA-N 2 0 383.496 3.614 20 5 GHBDRP CC(C)[C@@H](C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)N1CC[NH+](C)CC1 ZINC000180070187 837065579 /nfs/dbraw/zinc/06/55/79/837065579.db2.gz WYLHQAMOVOWSMS-DHIUTWEWSA-N 2 0 396.535 3.546 20 5 GHBDRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000160352755 838737411 /nfs/dbraw/zinc/73/74/11/838737411.db2.gz WVMHTDAWUPTZFS-IBGZPJMESA-N 2 0 396.535 3.892 20 5 GHBDRP C[C@@H]1C[C@@H]([NH2+]Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)CC[NH2+]1 ZINC000414957698 839006612 /nfs/dbraw/zinc/00/66/12/839006612.db2.gz WHYUEUFZTZSPOV-APWZRJJASA-N 2 0 391.475 3.678 20 5 GHBDRP COc1cc(C[NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000415012025 839056045 /nfs/dbraw/zinc/05/60/45/839056045.db2.gz WUTDCNSMNIZSBU-IEBWSBKVSA-N 2 0 399.491 3.790 20 5 GHBDRP [NH3+][C@H]1CCO[C@@H](C2CC[NH+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)CC2)C1 ZINC000415126943 839237428 /nfs/dbraw/zinc/23/74/28/839237428.db2.gz QMQQUDKSJASNNJ-LAUBAEHRSA-N 2 0 385.464 3.573 20 5 GHBDRP COc1cc(C[N@@H+]2CC[C@@H](C)[C@H](C[NH3+])C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000415123337 839242758 /nfs/dbraw/zinc/24/27/58/839242758.db2.gz JJXIBHABDGNORS-VQIMIIECSA-N 2 0 399.491 3.599 20 5 GHBDRP [NH3+][C@@H]1CCO[C@H](C2CC[NH+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)CC2)C1 ZINC000415123107 839243666 /nfs/dbraw/zinc/24/36/66/839243666.db2.gz KYLVHSCPOALKSI-UTKZUKDTSA-N 2 0 385.464 3.573 20 5 GHBDRP Cc1cc(NCc2ccccc2C[N@@H+]2CC[C@H](O)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302067415 861192251 /nfs/dbraw/zinc/19/22/51/861192251.db2.gz FOOPMGUDEDDEGJ-IBGZPJMESA-N 2 0 392.459 3.630 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ccccc1CN1CCOCC1)CCCC2 ZINC000417326284 840728588 /nfs/dbraw/zinc/72/85/88/840728588.db2.gz ROZVILDTJQHVCL-QHCPKHFHSA-N 2 0 395.503 3.984 20 5 GHBDRP Cc1cc(N2CC[C@H](OCC[NH+]3CCCCC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302087280 861201919 /nfs/dbraw/zinc/20/19/19/861201919.db2.gz NYJBLFIHTQGGMV-SFHVURJKSA-N 2 0 384.480 3.533 20 5 GHBDRP C[C@@H]([NH3+])[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)C1 ZINC000435374644 850422261 /nfs/dbraw/zinc/42/22/61/850422261.db2.gz JEPVPPBCGOQDHQ-NEPJUHHUSA-N 2 0 394.269 3.786 20 5 GHBDRP COc1cc(C[NH+]2CCC([C@H](C)[NH3+])CC2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000435394733 850461156 /nfs/dbraw/zinc/46/11/56/850461156.db2.gz LAXNAYXDJARAOT-INIZCTEOSA-N 2 0 399.491 3.742 20 5 GHBDRP O=[N+]([O-])c1ccccc1C[C@H]([NH2+]Cc1cccc(CN2CCOCC2)c1)C1CC1 ZINC000163689077 862522403 /nfs/dbraw/zinc/52/24/03/862522403.db2.gz HYIMJZBYZGOWNI-QFIPXVFZSA-N 2 0 395.503 3.538 20 5 GHBDRP Cc1ccc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)cc1[N+](=O)[O-] ZINC000248452512 856681683 /nfs/dbraw/zinc/68/16/83/856681683.db2.gz PVKAOLXDCZFAAU-UWJYYQICSA-N 2 0 383.492 3.711 20 5 GHBDRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH2+][C@@H]3CCc4c3cccc4[N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000594489924 858189411 /nfs/dbraw/zinc/18/94/11/858189411.db2.gz HUPRYBACTCZTAK-HYFFOGBASA-N 2 0 395.503 3.981 20 5 GHBDRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000160359769 858845455 /nfs/dbraw/zinc/84/54/55/858845455.db2.gz XWWVRPTVRNCRDT-GOSISDBHSA-N 2 0 382.508 3.583 20 5 GHBDRP [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C2)C1 ZINC000593314719 859380103 /nfs/dbraw/zinc/38/01/03/859380103.db2.gz GKWHSECLDRJTPJ-MRUHUIDDSA-N 2 0 385.464 3.573 20 5 GHBDRP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCCC[N@@H+]2Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000593323748 859406938 /nfs/dbraw/zinc/40/69/38/859406938.db2.gz WGYPKTRQAMNELW-PBEJRMEISA-N 2 0 385.464 3.716 20 5 GHBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1 ZINC000161187049 859679612 /nfs/dbraw/zinc/67/96/12/859679612.db2.gz BMOZZXVWBNUNDI-KRWDZBQOSA-N 2 0 383.492 3.711 20 5 GHBDRP CC[N@H+](C)Cc1cc(O[C@H]2CC[NH+]([C@H](C)c3ccccc3[N+](=O)[O-])C2)ccn1 ZINC000856593071 881566910 /nfs/dbraw/zinc/56/69/10/881566910.db2.gz ZIBRFOSCTRTZRQ-APWZRJJASA-N 2 0 384.480 3.656 20 5 GHBDRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000447531434 871789212 /nfs/dbraw/zinc/78/92/12/871789212.db2.gz RCFKDCBBQGFOJV-WOJBJXKFSA-N 2 0 385.512 3.907 20 5 GHBDRP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCCC[N@H+]3CCC[C@@H]3CO)s2)cc1 ZINC000111386081 879082438 /nfs/dbraw/zinc/08/24/38/879082438.db2.gz MCHVYGRXAMNMHG-GOSISDBHSA-N 2 0 389.521 3.650 20 5 GHBDRP C[NH+]1CCN(c2cc[nH+]c(NCc3cc(Cl)cc(Cl)c3[N+](=O)[O-])c2)CC1 ZINC001183282992 912427961 /nfs/dbraw/zinc/42/79/61/912427961.db2.gz YJLUPYNCHRELIR-UHFFFAOYSA-N 2 0 396.278 3.661 20 5 GHBDRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000876932549 893393298 /nfs/dbraw/zinc/39/32/98/893393298.db2.gz PBNZASUMJSASLM-PBPGXSGUSA-N 2 0 383.496 3.659 20 5 GHBDRP CCC(CC)[NH+]1CCC([NH2+][C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])CC1 ZINC001173182352 906263288 /nfs/dbraw/zinc/26/32/88/906263288.db2.gz SCWSVRGSKMYYJD-CQSZACIVSA-N 2 0 381.492 3.916 20 5 GHBDRP CC[NH+](CC)C1CCC([NH2+][C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])CC1 ZINC001173183288 906264812 /nfs/dbraw/zinc/26/48/12/906264812.db2.gz LUNYKQPNWLJNIT-FHERZECASA-N 2 0 381.492 3.916 20 5 GHBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCSCc1ccc(C[NH+](C)C)o1 ZINC001173210108 906326494 /nfs/dbraw/zinc/32/64/94/906326494.db2.gz IJRLQHFLCXONPN-HNNXBMFYSA-N 2 0 377.510 3.703 20 5 GHBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1 ZINC000271123870 910789071 /nfs/dbraw/zinc/78/90/71/910789071.db2.gz JZZXIZYHLZQJGQ-SJORKVTESA-N 2 0 393.553 3.556 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1C[C@@]3(CC[NH2+]C3)Oc3ccccc31)CCC2 ZINC000902501176 922242086 /nfs/dbraw/zinc/24/20/86/922242086.db2.gz IXUAOAQVEAZLGK-RZUBCFFCSA-N 2 0 379.460 3.818 20 5 GHBDRP Cc1cc2cc3cc(C)c(Nc4cnc(N5CC[NH2+]CC5)nc4)cc3[nH+]c2cc1N ZINC001160222342 1034905909 /nfs/dbraw/zinc/90/59/09/1034905909.db2.gz FWZAAYGVTDATJJ-UHFFFAOYSA-N 2 0 399.502 3.530 20 5 GHBDRP COc1ccc(C[C@H](C)[NH2+]CC2(Cc3ccccc3)CC[NH2+]CC2)c([N+](=O)[O-])c1 ZINC001246436871 1037400264 /nfs/dbraw/zinc/40/02/64/1037400264.db2.gz MNISDMHFAULEJC-SFHVURJKSA-N 2 0 397.519 3.737 20 5 GHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC1(Cc2ccccc2F)CC[NH2+]CC1 ZINC001246439149 1037402203 /nfs/dbraw/zinc/40/22/03/1037402203.db2.gz RXFPBFBAHSMCTI-QGZVFWFLSA-N 2 0 385.483 3.867 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CC[C@@]3(C[NH2+]C[C@@H]3c3ccccc3)C1)CC2 ZINC001246673069 1037537733 /nfs/dbraw/zinc/53/77/33/1037537733.db2.gz NVCLSWCAJFUCOC-QPTUXGOLSA-N 2 0 391.515 3.921 20 5 GHBDRP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc(F)cc2)[C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254586457 1040359640 /nfs/dbraw/zinc/35/96/40/1040359640.db2.gz JPRJRTPHUSPZSR-ONTIZHBOSA-N 2 0 383.467 3.973 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@@H+]1CC[C@H]3C[NH+](Cc4ccccc4)CC[C@H]3C1)C2 ZINC001254611112 1040383649 /nfs/dbraw/zinc/38/36/49/1040383649.db2.gz VTQKSDHLIOXPEI-AWRGLXIESA-N 2 0 391.515 3.906 20 5 GHBDRP COc1cc(N2CCC([NH2+]C[C@H](C)CC(C)(C)CC[NH3+])CC2)ccc1[N+](=O)[O-] ZINC001256101748 1041528284 /nfs/dbraw/zinc/52/82/84/1041528284.db2.gz PIFYZPRJEPXIAS-MRXNPFEDSA-N 2 0 392.544 3.563 20 5 GHBDRP CCC1(C[NH2+]CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)CCOCC1 ZINC001308768442 1050087948 /nfs/dbraw/zinc/08/79/48/1050087948.db2.gz XOEAEITVGWFTHW-UHFFFAOYSA-N 2 0 389.540 3.646 20 5 GHBDRP Cc1ccc([C@@H](C)[NH2+]CC2(O)CC[NH+](Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000414302169 836996756 /nfs/dbraw/zinc/99/67/56/836996756.db2.gz KEMBASFSYONIOX-GOSISDBHSA-N 2 0 383.492 3.581 20 5 GHBDRP C[C@H]1C[NH2+]CC[C@@H]1[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000414946583 839010713 /nfs/dbraw/zinc/01/07/13/839010713.db2.gz UCDDAIRWMBAAEY-KKSFZXQISA-N 2 0 391.475 3.535 20 5 GHBDRP C[C@@H]1C[NH2+]CC[C@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000414948477 839011467 /nfs/dbraw/zinc/01/14/67/839011467.db2.gz YNZCBOKNNQZXHZ-BDJLRTHQSA-N 2 0 394.269 3.705 20 5 GHBDRP COc1cc(C[N@@H+]2CCC[C@@H]([C@@H](C)[NH3+])C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000580311731 839229465 /nfs/dbraw/zinc/22/94/65/839229465.db2.gz OZSQZUAVOVBSJK-VQIMIIECSA-N 2 0 399.491 3.742 20 5 GHBDRP [NH3+][C@H]1CCCO[C@@H]1C1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000415135449 839251036 /nfs/dbraw/zinc/25/10/36/839251036.db2.gz WRNDLNPBQOTDTP-GHTZIAJQSA-N 2 0 385.464 3.573 20 5 GHBDRP C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(CC[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000426782152 852387262 /nfs/dbraw/zinc/38/72/62/852387262.db2.gz FWEZGMKGOLWBNB-KURKYZTESA-N 2 0 375.513 3.867 20 5 GHBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC(CCC[NH+]2CCOCC2)CC1 ZINC000506036954 853031261 /nfs/dbraw/zinc/03/12/61/853031261.db2.gz PIBZJCPXSWDQNA-SFHVURJKSA-N 2 0 375.513 3.789 20 5 GHBDRP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000482157291 862751714 /nfs/dbraw/zinc/75/17/14/862751714.db2.gz OCJPPQFZTUNDGD-FXAWDEMLSA-N 2 0 390.528 3.722 20 5 GHBDRP CC[NH+](CC)C[C@H]1CCCC[C@H]1[NH2+]CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000482161610 862757694 /nfs/dbraw/zinc/75/76/94/862757694.db2.gz DXRAYPHMLUEXSO-IEBWSBKVSA-N 2 0 390.528 3.722 20 5 GHBDRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000042640614 857417295 /nfs/dbraw/zinc/41/72/95/857417295.db2.gz GVPMZBZHXRMFJM-KRWDZBQOSA-N 2 0 398.507 3.862 20 5 GHBDRP C[NH+](C)CCC[C@@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCO1 ZINC000597248480 859392932 /nfs/dbraw/zinc/39/29/32/859392932.db2.gz XQUWZEOIZVSTOC-GOSISDBHSA-N 2 0 389.521 3.866 20 5 GHBDRP C[C@H]1C[NH+](CCCC[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H](C)O1 ZINC000608837116 865740581 /nfs/dbraw/zinc/74/05/81/865740581.db2.gz QNMPNYFBAWVWFC-IRXDYDNUSA-N 2 0 387.480 3.834 20 5 GHBDRP Cc1ccc(C[NH+]2CCC(CC[NH+]3C[C@H](C)O[C@@H](C)C3)CC2)cc1[N+](=O)[O-] ZINC000539861824 869913561 /nfs/dbraw/zinc/91/35/61/869913561.db2.gz LPAXTDNCARCIRO-ROUUACIJSA-N 2 0 375.513 3.615 20 5 GHBDRP COc1cc(C[NH2+]CC2=CC[N@H+](C)CC2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000271908723 875967139 /nfs/dbraw/zinc/96/71/39/875967139.db2.gz RPYHKRKSBWTCHD-UHFFFAOYSA-N 2 0 397.475 3.534 20 5 GHBDRP O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)c1 ZINC000814640092 893030190 /nfs/dbraw/zinc/03/01/90/893030190.db2.gz RHEXOFJPCDVQGU-QFIPXVFZSA-N 2 0 395.503 3.616 20 5 GHBDRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000877053941 893459806 /nfs/dbraw/zinc/45/98/06/893459806.db2.gz BJXXZBKACGVJRU-UHFFFAOYSA-N 2 0 395.463 3.510 20 5 GHBDRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3ccc(N)c([N+](=O)[O-])c3)CC2)cc1 ZINC000815572283 894040419 /nfs/dbraw/zinc/04/04/19/894040419.db2.gz ZGKMGNKQZVGHLH-INIZCTEOSA-N 2 0 398.507 3.748 20 5 GHBDRP O=[N+]([O-])c1cccc([C@H](O)C[NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)c1 ZINC000818984465 896302972 /nfs/dbraw/zinc/30/29/72/896302972.db2.gz IDJMNIYPSMQZPH-JOCHJYFZSA-N 2 0 383.492 3.794 20 5 GHBDRP O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)cc1 ZINC000818984641 896303194 /nfs/dbraw/zinc/30/31/94/896303194.db2.gz JVADEVYUXDKQCF-QFIPXVFZSA-N 2 0 383.492 3.794 20 5 GHBDRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)C2)CC1 ZINC000572167424 900085140 /nfs/dbraw/zinc/08/51/40/900085140.db2.gz FITOOAYZBKFCHX-QGZVFWFLSA-N 2 0 386.521 3.882 20 5 GHBDRP CCC[NH+](CCC)CCCN1CC[NH+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173231185 906316502 /nfs/dbraw/zinc/31/65/02/906316502.db2.gz KHRFXDHFVCRWTE-HXUWFJFHSA-N 2 0 390.572 3.656 20 5 GHBDRP C[NH+](C)CCOc1ccc(C[NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC001178326495 909018295 /nfs/dbraw/zinc/01/82/95/909018295.db2.gz LJQCNGZOJYGBJK-UHFFFAOYSA-N 2 0 377.872 3.521 20 5 GHBDRP O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[NH+]3CC(Cc4ccco4)C3)CC2)cc1 ZINC001182880231 912096356 /nfs/dbraw/zinc/09/63/56/912096356.db2.gz DCCKRJNQSKWUPK-UHFFFAOYSA-N 2 0 383.492 3.617 20 5 GHBDRP C[C@@H]([NH2+]CCCN1CC[N@H+](C)C[C@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000467837609 929488474 /nfs/dbraw/zinc/48/84/74/929488474.db2.gz DMJCALWIZDFXML-GCJKJVERSA-N 2 0 382.508 3.624 20 5 GHBDRP CCOc1ccc([N+](=O)[O-])cc1CNC[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001461119406 1069400113 /nfs/dbraw/zinc/40/01/13/1069400113.db2.gz FUTGMNDIXMKRDN-IBGZPJMESA-N 2 0 383.492 3.995 20 5 GHBDRP COc1cc(C[N@H+](C)C2CCC([NH3+])CC2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000843054800 1029789797 /nfs/dbraw/zinc/78/97/97/1029789797.db2.gz ILCDSKDSQHHCRH-UHFFFAOYSA-N 2 0 399.491 3.884 20 5 GHBDRP [NH2+]=c1ccc2nc3c(cc(NC(=O)CC4CC[NH2+]CC4)c4ccccc43)oc-2c1 ZINC001219369789 1031383428 /nfs/dbraw/zinc/38/34/28/1031383428.db2.gz PRDPLJRWLVASMX-UHFFFAOYSA-N 2 0 386.455 3.893 20 5 GHBDRP Cc1c(C)c(-n2cc(CC[NH+]3CCC([NH3+])CC3)c3ccccc32)ncc1[N+](=O)[O-] ZINC001159461218 1034605599 /nfs/dbraw/zinc/60/55/99/1034605599.db2.gz POAKCLPZCCPNFQ-UHFFFAOYSA-N 2 0 393.491 3.516 20 5 GHBDRP [NH3+]C1CC[NH+](CCc2cn(-c3cc(Cl)cc([N+](=O)[O-])n3)c3ccccc23)CC1 ZINC001159460249 1034605663 /nfs/dbraw/zinc/60/56/63/1034605663.db2.gz GRCVUOVYFUYCPJ-UHFFFAOYSA-N 2 0 399.882 3.553 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH2+][C@@H]1CC3(CC[NH2+]CC3)c3cc(F)ccc31)C2 ZINC001246186749 1037227926 /nfs/dbraw/zinc/22/79/26/1037227926.db2.gz YZTLJDCLIUQGGL-LAUBAEHRSA-N 2 0 381.451 3.557 20 5 GHBDRP COc1ccccc1C1([NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC[NH2+]CC1 ZINC001246376021 1037333225 /nfs/dbraw/zinc/33/32/25/1037333225.db2.gz JZKIBPTXMGSTKC-LJQANCHMSA-N 2 0 395.503 3.719 20 5 GHBDRP COc1cccc(C2([NH2+][C@@H]3CCc4ccc([N+](=O)[O-])cc4CC3)CC[NH2+]CC2)c1 ZINC001246415989 1037371051 /nfs/dbraw/zinc/37/10/51/1037371051.db2.gz OFVHHGJVKKGUNZ-HXUWFJFHSA-N 2 0 395.503 3.719 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH+]1CCC3(CC1)C[NH2+]Cc1ccccc13)CC2 ZINC001246636874 1037523565 /nfs/dbraw/zinc/52/35/65/1037523565.db2.gz GEKWYHJKXFRFCD-OAQYLSRUSA-N 2 0 391.515 3.979 20 5 GHBDRP CC[C@H](CSC)[N@H+](C)CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001462196852 1070073217 /nfs/dbraw/zinc/07/32/17/1070073217.db2.gz ADCYBVYNORMUOA-LJQANCHMSA-N 2 0 379.570 3.923 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1Cc3ccccc3C3(CC[NH2+]CC3)C1)CC2 ZINC001246861268 1037680999 /nfs/dbraw/zinc/68/09/99/1037680999.db2.gz OMNSIWDFMLXDOV-OAQYLSRUSA-N 2 0 391.515 3.979 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH2+]CC1CC[NH+](Cc3ccccc3F)CC1)C2 ZINC001254585792 1040359096 /nfs/dbraw/zinc/35/90/96/1040359096.db2.gz OIDDCDNZNWVQFU-FQEVSTJZSA-N 2 0 383.467 3.703 20 5 GHBDRP O=[N+]([O-])c1cccc(C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000176984528 837831483 /nfs/dbraw/zinc/83/14/83/837831483.db2.gz OIFSKGDIMSJIQO-UHFFFAOYSA-N 2 0 383.492 3.756 20 5 GHBDRP CC(C)[C@@H](C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)N1CC[NH+](C)CC1 ZINC000180070162 837065829 /nfs/dbraw/zinc/06/58/29/837065829.db2.gz WYLHQAMOVOWSMS-PKTZIBPZSA-N 2 0 396.535 3.546 20 5 GHBDRP COc1cc(C[NH2+]CC[C@@H]2CCC[NH2+]C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000414845347 838886453 /nfs/dbraw/zinc/88/64/53/838886453.db2.gz SLNBJIKQPOZSRV-KRWDZBQOSA-N 2 0 399.491 3.662 20 5 GHBDRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000414946582 839010199 /nfs/dbraw/zinc/01/01/99/839010199.db2.gz UCDDAIRWMBAAEY-IIBYNOLFSA-N 2 0 391.475 3.535 20 5 GHBDRP COc1cc(CN[C@H](C[NH3+])C(C)(C)C)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000415051609 839121925 /nfs/dbraw/zinc/12/19/25/839121925.db2.gz GLAVQTBGAPMBGH-HXUWFJFHSA-N 2 0 387.480 3.645 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)CCCC2 ZINC000417328571 840714659 /nfs/dbraw/zinc/71/46/59/840714659.db2.gz GTCUMZPPJISELG-JTHBVZDNSA-N 2 0 395.503 3.719 20 5 GHBDRP CCC[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000126706721 841878839 /nfs/dbraw/zinc/87/88/39/841878839.db2.gz JOVLSUPITNXPQT-HSZRJFAPSA-N 2 0 396.535 3.973 20 5 GHBDRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C[C@H](C)O1 ZINC000433147488 845500616 /nfs/dbraw/zinc/50/06/16/845500616.db2.gz OUAKNUCWCHARBG-GQIGUUNPSA-N 2 0 375.513 3.796 20 5 GHBDRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C[C@H](C)O1 ZINC000433147494 845501300 /nfs/dbraw/zinc/50/13/00/845501300.db2.gz OUAKNUCWCHARBG-YRNRMSPPSA-N 2 0 375.513 3.796 20 5 GHBDRP O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423039608 847951099 /nfs/dbraw/zinc/95/10/99/847951099.db2.gz FRVPGPLDAFWWKF-FXAWDEMLSA-N 2 0 387.867 3.636 20 5 GHBDRP CCC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)c1cccc([N+](=O)[O-])c1 ZINC000246455415 850762170 /nfs/dbraw/zinc/76/21/70/850762170.db2.gz PMRCRNRCKCJVBE-PWRODBHTSA-N 2 0 375.513 3.794 20 5 GHBDRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000042640615 857416831 /nfs/dbraw/zinc/41/68/31/857416831.db2.gz GVPMZBZHXRMFJM-QGZVFWFLSA-N 2 0 398.507 3.862 20 5 GHBDRP CCC1([NH+]2CCOCC2)CCN(c2cc(C)[nH+]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000599183481 860886016 /nfs/dbraw/zinc/88/60/16/860886016.db2.gz PDZSNBSAAPHDBT-UHFFFAOYSA-N 2 0 384.480 3.533 20 5 GHBDRP CC[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)Cc1ccc(C[NH+](C)C)cc1 ZINC000609029857 865905854 /nfs/dbraw/zinc/90/58/54/865905854.db2.gz TVPCTSLLKDKREI-UHFFFAOYSA-N 2 0 398.507 3.816 20 5 GHBDRP Cc1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000069833355 871598381 /nfs/dbraw/zinc/59/83/81/871598381.db2.gz ALYLGPWCBNRUCV-HDICACEKSA-N 2 0 383.492 3.802 20 5 GHBDRP C[NH+](C)CCOc1ccc(CC[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000447560935 871860292 /nfs/dbraw/zinc/86/02/92/871860292.db2.gz GGYLTDXGMTXNJZ-JOCHJYFZSA-N 2 0 383.492 3.745 20 5 GHBDRP CC[NH+](CC)CC1CC[NH+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000532478608 885789728 /nfs/dbraw/zinc/78/97/28/885789728.db2.gz LMSSNDGIPMCEHD-UHFFFAOYSA-N 2 0 386.496 3.846 20 5 GHBDRP C[C@H]1CCC[N@H+](Cc2ccccc2C[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)C1 ZINC000876932468 893393446 /nfs/dbraw/zinc/39/34/46/893393446.db2.gz MXLMCKYAQOYQAL-DZIBYMRMSA-N 2 0 383.496 3.517 20 5 GHBDRP C[C@H]([NH2+]CCc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815600983 894037097 /nfs/dbraw/zinc/03/70/97/894037097.db2.gz KKBGLQDXNVFKCK-KRWDZBQOSA-N 2 0 398.507 3.545 20 5 GHBDRP C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCC2(CC[NH+](C)CC2)CC1 ZINC000879249169 894930322 /nfs/dbraw/zinc/93/03/22/894930322.db2.gz HENMJVLEMWGFRO-HNNXBMFYSA-N 2 0 385.468 3.514 20 5 GHBDRP O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]Cc2ccccc2C[NH+]2CCCCCC2)c1 ZINC000819058482 896346500 /nfs/dbraw/zinc/34/65/00/896346500.db2.gz CRMNZXIHMCVHFZ-QFIPXVFZSA-N 2 0 383.492 3.794 20 5 GHBDRP Cc1c[nH+]ccc1N(C1CC[NH2+]CC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172911670 906020799 /nfs/dbraw/zinc/02/07/99/906020799.db2.gz DSXVYPQPWDUUEN-LJQANCHMSA-N 2 0 380.492 3.804 20 5 GHBDRP CC[NH+](CC)CCCC[NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173005942 906080063 /nfs/dbraw/zinc/08/00/63/906080063.db2.gz MBSZIOZVWKPGCM-UHFFFAOYSA-N 2 0 384.471 3.553 20 5 GHBDRP CCCC[NH+]1CCC(C[NH2+][C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])CC1 ZINC001173183310 906264290 /nfs/dbraw/zinc/26/42/90/906264290.db2.gz XQOBUFDVJLFJIC-HNNXBMFYSA-N 2 0 381.492 3.775 20 5 GHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)C[C@@H]2C1 ZINC001173233281 906317627 /nfs/dbraw/zinc/31/76/27/906317627.db2.gz VDMFDSXPARMPBE-STZQEDGTSA-N 2 0 379.504 3.980 20 5 GHBDRP COc1ccc(C[NH2+][C@H](CCCC[NH3+])c2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000902363190 922124468 /nfs/dbraw/zinc/12/44/68/922124468.db2.gz ZBRMQGBCGHHBPS-QGZVFWFLSA-N 2 0 379.407 3.842 20 5 GHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO ZINC000468597608 1015833595 /nfs/dbraw/zinc/83/35/95/1015833595.db2.gz DTADXDVGZJAGNL-SJQUQUAPSA-N 2 0 395.503 3.745 20 5 GHBDRP Cc1cccc(NC[C@@H]2C[N@H+](Cc3ccccc3)CC23CC[NH2+]CC3)c1[N+](=O)[O-] ZINC001162933511 1025971063 /nfs/dbraw/zinc/97/10/63/1025971063.db2.gz DBBTWEGRNJWFCJ-HXUWFJFHSA-N 2 0 394.519 3.817 20 5 GHBDRP CN(C)c1cc[nH+]cc1NC(=O)[C@@H]([NH3+])Cc1c2ccccc2cc2ccccc21 ZINC001218563403 1030987516 /nfs/dbraw/zinc/98/75/16/1030987516.db2.gz PJMWUGOSUHGUHI-NRFANRHFSA-N 2 0 384.483 3.963 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CC1(c3cccc(F)c3)CC[NH2+]CC1)CC2 ZINC001246394159 1037355027 /nfs/dbraw/zinc/35/50/27/1037355027.db2.gz LUAAYMRGHHUJCR-OAQYLSRUSA-N 2 0 397.494 3.892 20 5 GHBDRP COc1ccc(C[C@@H](C)N2CCC[C@]23C[NH2+]C[C@@H]3c2ccccc2)c([N+](=O)[O-])c1 ZINC001246670830 1037536486 /nfs/dbraw/zinc/53/64/86/1037536486.db2.gz GCYWEIVGNUBAOT-ODOSVJCGSA-N 2 0 395.503 3.756 20 5 GHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@]2(c3ccccc3)CC[NH2+]C[C@H]2C1 ZINC001246681867 1037545150 /nfs/dbraw/zinc/54/51/50/1037545150.db2.gz ABARJUKECPNDEC-RZFNWQHOSA-N 2 0 379.504 3.779 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH+]1CCC3(C[NH+](Cc4ccccc4)C3)CC1)C2 ZINC001254609818 1040381623 /nfs/dbraw/zinc/38/16/23/1040381623.db2.gz YUHWPPGWMGPRCT-JOCHJYFZSA-N 2 0 377.488 3.660 20 5 GHBDRP O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[N@@H+]3CC[C@H](c4ccccn4)C3)CC2)cc1 ZINC001308717712 1050070429 /nfs/dbraw/zinc/07/04/29/1050070429.db2.gz KUEVSPIBWZLANI-NRFANRHFSA-N 2 0 394.519 3.734 20 5 GHBDRP C[C@@H]1C[C@H]([NH2+]CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)CCS1 ZINC001474737941 1074539450 /nfs/dbraw/zinc/53/94/50/1074539450.db2.gz YMJKAZJZCFUDBZ-VQIMIIECSA-N 2 0 377.554 3.723 20 5 GHBDRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(OC)c(OCc3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000120795585 836523708 /nfs/dbraw/zinc/52/37/08/836523708.db2.gz ZCKICOIANRXUKA-LJQANCHMSA-N 2 0 399.491 3.614 20 5 GHBDRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000180441363 837258381 /nfs/dbraw/zinc/25/83/81/837258381.db2.gz OWKGYARLLKPQHC-WMZHIEFXSA-N 2 0 396.535 3.547 20 5 GHBDRP C[C@@H](CCC[NH3+])[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000415023714 839075558 /nfs/dbraw/zinc/07/55/58/839075558.db2.gz NKBTUDISHKVSAK-INIZCTEOSA-N 2 0 379.464 3.665 20 5 GHBDRP COc1cc(C[N@@H+]2CC[C@H](C)[C@H](C[NH3+])C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000415123333 839242925 /nfs/dbraw/zinc/24/29/25/839242925.db2.gz JJXIBHABDGNORS-QFBILLFUSA-N 2 0 399.491 3.599 20 5 GHBDRP [NH3+][C@H]1CCCO[C@H]1C1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000415135456 839251401 /nfs/dbraw/zinc/25/14/01/839251401.db2.gz WRNDLNPBQOTDTP-RXVVDRJESA-N 2 0 385.464 3.573 20 5 GHBDRP NC1(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC[NH+](Cc2ccccc2)CC1 ZINC000423576648 849986247 /nfs/dbraw/zinc/98/62/47/849986247.db2.gz RKCMAMKNZSGUBB-QFIPXVFZSA-N 2 0 394.519 3.555 20 5 GHBDRP C[C@H]1C[C@@H](C[NH3+])C[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000435372854 850421800 /nfs/dbraw/zinc/42/18/00/850421800.db2.gz LENVGPAWTJHCLN-RYUDHWBXSA-N 2 0 394.269 3.786 20 5 GHBDRP Cc1c(C[NH+]2CCC(CC[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)cccc1[N+](=O)[O-] ZINC000426827508 852442032 /nfs/dbraw/zinc/44/20/32/852442032.db2.gz SHLOVMHTSKGNOC-CALCHBBNSA-N 2 0 375.513 3.615 20 5 GHBDRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000173327152 856858710 /nfs/dbraw/zinc/85/87/10/856858710.db2.gz KXHHRBSZFMGVIK-SFHVURJKSA-N 2 0 382.508 3.583 20 5 GHBDRP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000595043157 858377528 /nfs/dbraw/zinc/37/75/28/858377528.db2.gz IHKJZXSOZKUKJC-MRXNPFEDSA-N 2 0 399.491 3.927 20 5 GHBDRP O=[N+]([O-])c1ccc(N2CCC([NH2+]Cc3ccccc3Cn3ccnc3)CC2)cc1 ZINC000764814442 859627693 /nfs/dbraw/zinc/62/76/93/859627693.db2.gz OJRVYIPCKDGVAJ-UHFFFAOYSA-N 2 0 391.475 3.598 20 5 GHBDRP COc1ccc(C[C@@H](C)[NH+]2CCC(C3CC[NH+](C)CC3)CC2)c([N+](=O)[O-])c1 ZINC001170344598 881454614 /nfs/dbraw/zinc/45/46/14/881454614.db2.gz CVCMDLATGIIRPN-MRXNPFEDSA-N 2 0 375.513 3.588 20 5 GHBDRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cn2ncc3ccc([N+](=O)[O-])cc32)CC1 ZINC000727423238 860088743 /nfs/dbraw/zinc/08/87/43/860088743.db2.gz NKDKKLFJLQFHOV-UHFFFAOYSA-N 2 0 393.491 3.746 20 5 GHBDRP CCN(Cc1ccc(C[NH+](C)C)cc1)Cn1nc(C)c2ccc([N+](=O)[O-])cc21 ZINC000761290467 860625489 /nfs/dbraw/zinc/62/54/89/860625489.db2.gz PAQIMYLLQCNKAF-UHFFFAOYSA-N 2 0 381.480 3.794 20 5 GHBDRP CCCC[N@H+](C)CC1CC[NH+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000738067796 865477317 /nfs/dbraw/zinc/47/73/17/865477317.db2.gz SOUWVJHBIRNBAI-UHFFFAOYSA-N 2 0 385.512 3.860 20 5 GHBDRP C[C@H](CC[NH2+][C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)[N@H+](C)Cc1ccccc1 ZINC000447529827 871762380 /nfs/dbraw/zinc/76/23/80/871762380.db2.gz LCBHDMGDPJOSMH-HOJAQTOUSA-N 2 0 385.512 3.775 20 5 GHBDRP COCC[N@H+](C)CCCC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000542041567 874805577 /nfs/dbraw/zinc/80/55/77/874805577.db2.gz LAMGPHWFWDBSBP-UHFFFAOYSA-N 2 0 383.920 3.819 20 5 GHBDRP CC(=O)Nc1ccc(CN2CCC([NH2+][C@H](C)c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000453327234 880799375 /nfs/dbraw/zinc/79/93/75/880799375.db2.gz OMDSJEWNSMQGTG-MRXNPFEDSA-N 2 0 396.491 3.868 20 5 GHBDRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000818960111 896267203 /nfs/dbraw/zinc/26/72/03/896267203.db2.gz XNFBMIZDEUTVIJ-VGSWGCGISA-N 2 0 383.492 3.650 20 5 GHBDRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000818959778 896296797 /nfs/dbraw/zinc/29/67/97/896296797.db2.gz SUDHSEYIDDNHIP-VGOFRKELSA-N 2 0 383.492 3.792 20 5 GHBDRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000818959279 896298993 /nfs/dbraw/zinc/29/89/93/896298993.db2.gz HIPZAFXJMRSWGT-VGOFRKELSA-N 2 0 383.492 3.650 20 5 GHBDRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819100956 896376636 /nfs/dbraw/zinc/37/66/36/896376636.db2.gz XMORMIFSAXWJMP-JOCHJYFZSA-N 2 0 395.459 3.643 20 5 GHBDRP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)n1 ZINC000578952495 904249804 /nfs/dbraw/zinc/24/98/04/904249804.db2.gz MWEUNHQKEPPQMN-VQTJNVASSA-N 2 0 383.496 3.661 20 5 GHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC2(CC[N@H+](Cc3cccnc3)C2)CC1 ZINC001173225373 906308082 /nfs/dbraw/zinc/30/80/82/906308082.db2.gz JODACEJFHHFPFY-LJQANCHMSA-N 2 0 394.519 3.909 20 5 GHBDRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]C[C@@H](O)c3cccc([N+](=O)[O-])c3)cc2)C1 ZINC000749675143 927230339 /nfs/dbraw/zinc/23/03/39/927230339.db2.gz IRQPWJPODSOUAG-HTAPYJJXSA-N 2 0 383.492 3.650 20 5 GHBDRP C[C@H]([NH2+]CCCN1CC[N@H+](C)C[C@@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000467837610 929488434 /nfs/dbraw/zinc/48/84/34/929488434.db2.gz DMJCALWIZDFXML-PGRDOPGGSA-N 2 0 382.508 3.624 20 5 GHBDRP O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cc1 ZINC000781423400 930840056 /nfs/dbraw/zinc/84/00/56/930840056.db2.gz PSQXXILWLZKXGY-MLDBQTBOSA-N 2 0 395.503 3.519 20 5 GHBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1 ZINC000468626961 1015856097 /nfs/dbraw/zinc/85/60/97/1015856097.db2.gz JZXFWMOHVSXJFJ-RGEXLXHISA-N 2 0 394.519 3.535 20 5 GHBDRP [NH2+]=c1ccc2nc3c(cc(NC(=O)C[C@@H]4CCC[NH2+]C4)c4ccccc43)oc-2c1 ZINC001219371912 1031385555 /nfs/dbraw/zinc/38/55/55/1031385555.db2.gz OLBSHADPMOUZER-AWEZNQCLSA-N 2 0 386.455 3.893 20 5 GHBDRP CN(C(=O)[C@@H]([NH3+])Cc1c2ccccc2cc2ccccc21)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001161063810 1035130510 /nfs/dbraw/zinc/13/05/10/1035130510.db2.gz NFRPNTTUIGSHGL-RJGXRXQPSA-N 2 0 375.516 3.591 20 5 GHBDRP COc1ccc(C[C@@H](C)[NH2+][C@@H](c2ccccc2)C2CC[NH2+]CC2)c([N+](=O)[O-])c1 ZINC001246252524 1037255762 /nfs/dbraw/zinc/25/57/62/1037255762.db2.gz RYJHMFKYZWEZJG-ZHRRBRCNSA-N 2 0 383.492 3.865 20 5 GHBDRP COc1cccc(CC2(C[NH2+][C@H](C)Cc3ccc([N+](=O)[O-])cc3)CC[NH2+]CC2)c1 ZINC001246383513 1037343025 /nfs/dbraw/zinc/34/30/25/1037343025.db2.gz GBXXMBJKBVUHKU-GOSISDBHSA-N 2 0 397.519 3.737 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH2+][C@H](CC1CC[NH2+]CC1)c1ccc(F)cc1)C2 ZINC001246454724 1037414389 /nfs/dbraw/zinc/41/43/89/1037414389.db2.gz WUILEXAXKIQQOW-RBBKRZOGSA-N 2 0 383.467 3.922 20 5 GHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@]2(c3ccccc3)CC[NH2+]C[C@H]2C1 ZINC001246681866 1037545984 /nfs/dbraw/zinc/54/59/84/1037545984.db2.gz ABARJUKECPNDEC-JZWVFAODSA-N 2 0 379.504 3.779 20 5 GHBDRP Cc1ccc(F)cc1C[N@H+]([C@@H]1Cc2ccc([N+](=O)[O-])cc2C1)C1CC[NH2+]CC1 ZINC001246953779 1037760967 /nfs/dbraw/zinc/76/09/67/1037760967.db2.gz CYTFREHMLCRDFP-JOCHJYFZSA-N 2 0 383.467 3.764 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@@H+]1CC[C@@H]3C[NH+](Cc4ccccc4)C[C@@H]3C1)C2 ZINC001254608258 1040380334 /nfs/dbraw/zinc/38/03/34/1040380334.db2.gz QBBHISUANQEGOE-KJXAQDMKSA-N 2 0 377.488 3.516 20 5 GHBDRP O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[NH2+]C3([C@@H]4CCCCO4)CC3)CC2)cc1 ZINC001462605179 1070408043 /nfs/dbraw/zinc/40/80/43/1070408043.db2.gz QCFFIPKJJYWWFF-NRFANRHFSA-N 2 0 387.524 3.541 20 5 GHBDRP Cc1ccc(C[N@H+](C)CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)nc1 ZINC001308734518 1050075633 /nfs/dbraw/zinc/07/56/33/1050075633.db2.gz BYVSPYOHJCMIRY-UHFFFAOYSA-N 2 0 382.508 3.685 20 5 GHBDRP O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[NH2+]CC3(C(F)(F)F)CC3)CC2)cc1 ZINC001308755643 1050083418 /nfs/dbraw/zinc/08/34/18/1050083418.db2.gz RLQVFBAYJIXWGL-UHFFFAOYSA-N 2 0 385.430 3.781 20 5 GHBDRP COCCC1CC[NH+](CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC001308872851 1050132450 /nfs/dbraw/zinc/13/24/50/1050132450.db2.gz CPALRRWOMVEUNU-UHFFFAOYSA-N 2 0 389.540 3.598 20 5 GHBDRP O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](C3CC[NH2+]CC3)C2)ccc1Br ZINC000849350858 1067816828 /nfs/dbraw/zinc/81/68/28/1067816828.db2.gz ZCFUDHMTPBIMQS-HNNXBMFYSA-N 2 0 382.302 3.569 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CC1(O)CC[NH+](Cc3ccccc3)CC1)CCC2 ZINC000414306621 837006978 /nfs/dbraw/zinc/00/69/78/837006978.db2.gz OMLVGZIQVUTQAF-QFIPXVFZSA-N 2 0 395.503 3.589 20 5 GHBDRP [NH3+][C@@H]1CCO[C@@H](C2CC[NH+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)CC2)C1 ZINC000415123105 839244504 /nfs/dbraw/zinc/24/45/04/839244504.db2.gz KYLVHSCPOALKSI-DYESRHJHSA-N 2 0 385.464 3.573 20 5 GHBDRP O=[N+]([O-])c1ccccc1-c1ccc(C[NH+]2CCC(CC[NH+]3CCOCC3)CC2)o1 ZINC000512462327 843879032 /nfs/dbraw/zinc/87/90/32/843879032.db2.gz JWPAHRWIZKEQFX-UHFFFAOYSA-N 2 0 399.491 3.789 20 5 GHBDRP O=[N+]([O-])c1cccc(-c2ccc(C[NH+]3CCC(CC[NH+]4CCOCC4)CC3)o2)c1 ZINC000512474157 843933571 /nfs/dbraw/zinc/93/35/71/843933571.db2.gz IJPJRWPCZKYRKL-UHFFFAOYSA-N 2 0 399.491 3.789 20 5 GHBDRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000025702777 861535576 /nfs/dbraw/zinc/53/55/76/861535576.db2.gz ONXXPDIUDWQHEL-MRXNPFEDSA-N 2 0 384.480 3.553 20 5 GHBDRP CC1([NH2+]Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)CC[NH2+]CC1 ZINC000414948695 852836887 /nfs/dbraw/zinc/83/68/87/852836887.db2.gz YRJXQKLUKPJNJV-UHFFFAOYSA-N 2 0 391.475 3.679 20 5 GHBDRP COc1cc(C[NH2+]C[C@@H]2CCC[N@H+](C)C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000108429134 853069271 /nfs/dbraw/zinc/06/92/71/853069271.db2.gz JYPCGWDYAXMABY-IBGZPJMESA-N 2 0 399.491 3.614 20 5 GHBDRP COc1ccc(C[NH2+]C[C@]2(C)CCC[NH2+]C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414903937 853104973 /nfs/dbraw/zinc/10/49/73/853104973.db2.gz JADZONYULGDUQI-JOCHJYFZSA-N 2 0 399.491 3.662 20 5 GHBDRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000025702389 853688301 /nfs/dbraw/zinc/68/83/01/853688301.db2.gz KXJGTQUHFZRYPZ-QGZVFWFLSA-N 2 0 396.491 3.698 20 5 GHBDRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000575059035 858508593 /nfs/dbraw/zinc/50/85/93/858508593.db2.gz CPEDDFFAMLLOJX-CVEARBPZSA-N 2 0 379.464 3.663 20 5 GHBDRP COc1ccc(C[C@H](C)[NH+]2CCC(C3CC[NH+](C)CC3)CC2)c([N+](=O)[O-])c1 ZINC001170344597 881458263 /nfs/dbraw/zinc/45/82/63/881458263.db2.gz CVCMDLATGIIRPN-INIZCTEOSA-N 2 0 375.513 3.588 20 5 GHBDRP CCC[C@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000124709550 860475049 /nfs/dbraw/zinc/47/50/49/860475049.db2.gz RVGIAFCHSUZQRL-NRFANRHFSA-N 2 0 388.556 3.976 20 5 GHBDRP CC[C@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000126721395 861132811 /nfs/dbraw/zinc/13/28/11/861132811.db2.gz JMLSIYQEIPOQQL-QFIPXVFZSA-N 2 0 382.508 3.583 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H]1CO)CCC2 ZINC000249001384 889072216 /nfs/dbraw/zinc/07/22/16/889072216.db2.gz QSGHIUQZSJKTJB-GMAHTHKFSA-N 2 0 395.503 3.719 20 5 GHBDRP O=C(CC[N@@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000533271190 890134704 /nfs/dbraw/zinc/13/47/04/890134704.db2.gz HMRONPPVTFSITO-GOSISDBHSA-N 2 0 388.512 3.511 20 5 GHBDRP C[C@@H]1C[NH+](CCCC[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@@H](C)O1 ZINC000237404305 891647720 /nfs/dbraw/zinc/64/77/20/891647720.db2.gz QLSUAGQBJYPEKO-IAGOWNOFSA-N 2 0 387.480 3.834 20 5 GHBDRP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815555880 893995287 /nfs/dbraw/zinc/99/52/87/893995287.db2.gz JNKHWWXAHSVBEA-IXDOHACOSA-N 2 0 398.507 3.637 20 5 GHBDRP C[C@H]1CCC[N@H+](Cc2ccccc2C[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000818959277 896298257 /nfs/dbraw/zinc/29/82/57/896298257.db2.gz HIPZAFXJMRSWGT-HTAPYJJXSA-N 2 0 383.492 3.650 20 5 GHBDRP O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)c1 ZINC000818987136 896306635 /nfs/dbraw/zinc/30/66/35/896306635.db2.gz TUVFDIUJDZVDND-QFIPXVFZSA-N 2 0 383.492 3.794 20 5 GHBDRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000819100976 896375558 /nfs/dbraw/zinc/37/55/58/896375558.db2.gz YCJTWJDKKXIAMD-JOCHJYFZSA-N 2 0 395.459 3.643 20 5 GHBDRP O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]C[C@H]2CCCC[N@H+](Cc3ccccc3)C2)c1 ZINC000819323714 896568323 /nfs/dbraw/zinc/56/83/23/896568323.db2.gz PJJKXZMTKFNWPO-KNQAVFIVSA-N 2 0 383.492 3.520 20 5 GHBDRP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]C2CCC([NH+]3CCCCC3)CC2)n1 ZINC000774217187 911532795 /nfs/dbraw/zinc/53/27/95/911532795.db2.gz LAEOFVIWQYQNQD-CSODTCANSA-N 2 0 375.517 3.662 20 5 GHBDRP CN(CCC1CC[NH+](C2CCN(C)CC2)CC1)c1ccc([N+](=O)[O-])cc1Cl ZINC000751111277 928034814 /nfs/dbraw/zinc/03/48/14/928034814.db2.gz OHZLXUDUBMEQLX-UHFFFAOYSA-N 2 0 394.947 3.881 20 5 GHBDRP C[C@]1(C[NH2+][C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)CC[N@H+](Cc2ccccc2)C1 ZINC000798934745 932824512 /nfs/dbraw/zinc/82/45/12/932824512.db2.gz HZSMDZNYJXSVQZ-TUNNFDKTSA-N 2 0 397.523 3.777 20 5 GHBDRP CCCC[N@H+](C)CC1CC[NH+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)CC1 ZINC000777955726 934372601 /nfs/dbraw/zinc/37/26/01/934372601.db2.gz REKIBCUNUDEUNK-UHFFFAOYSA-N 2 0 385.512 3.860 20 5 GHBDRP C[NH+]1CCC2(CCCN(Cc3cccc([N+](=O)[O-])c3Br)C2)CC1 ZINC000839590701 1026089303 /nfs/dbraw/zinc/08/93/03/1026089303.db2.gz AQBRQHGNSIXYTJ-UHFFFAOYSA-N 2 0 382.302 3.665 20 5 GHBDRP C[C@H]1C[NH+](CCOc2ccc(CC[NH2+]Cc3cccc([N+](=O)[O-])c3)cc2)C[C@@H]1C ZINC001461386899 1069529121 /nfs/dbraw/zinc/52/91/21/1069529121.db2.gz DIPDCPYXWMJMDD-OALUTQOASA-N 2 0 397.519 3.894 20 5 GHBDRP CN(Cc1c2ccccc2cc2ccccc21)C(=O)[C@H]1CCC2(CC[NH2+]CC2)[NH2+]1 ZINC001160739813 1035050305 /nfs/dbraw/zinc/05/03/05/1035050305.db2.gz WVPYSFLUWOSWSU-HSZRJFAPSA-N 2 0 387.527 3.826 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH2+][C@H](CC1CC[NH2+]CC1)c1ccccc1F)C2 ZINC001246442310 1037403873 /nfs/dbraw/zinc/40/38/73/1037403873.db2.gz JBDHCEXPNUBWAM-XMSQKQJNSA-N 2 0 383.467 3.922 20 5 GHBDRP C[NH2+]C1CCC([NH2+]CCCNC(=O)c2c3ccccc3nc3ccccc32)CC1 ZINC001246485517 1037432129 /nfs/dbraw/zinc/43/21/29/1037432129.db2.gz VDWGADJBMPDHTH-UHFFFAOYSA-N 2 0 390.531 3.628 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1C[C@H](c3ccccc3)C3(C[NH2+]C3)C1)CC2 ZINC001246619240 1037509391 /nfs/dbraw/zinc/50/93/91/1037509391.db2.gz JXFARIUFYVGSPR-IFMALSPDSA-N 2 0 377.488 3.531 20 5 GHBDRP COc1ccc(C[C@@H](C)[NH+]2CCC3(CC2)C[NH2+]Cc2ccccc23)c([N+](=O)[O-])c1 ZINC001246639080 1037524372 /nfs/dbraw/zinc/52/43/72/1037524372.db2.gz NEGBQTAGTVKUEO-QGZVFWFLSA-N 2 0 395.503 3.671 20 5 GHBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@]2(c3ccccc3)CC[NH2+]C[C@H]2C1 ZINC001246669858 1037536810 /nfs/dbraw/zinc/53/68/10/1037536810.db2.gz ACECSDBWEAJCAP-JZWVFAODSA-N 2 0 379.504 3.779 20 5 GHBDRP CC[C@@H]([NH2+]CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1)[C@@H]1CCCCO1 ZINC001462384958 1070217721 /nfs/dbraw/zinc/21/77/21/1070217721.db2.gz VHLZQDXBJPYEFB-YADHBBJMSA-N 2 0 389.540 3.787 20 5 GHBDRP O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[NH2+]CC3CCC(F)CC3)CC2)cc1 ZINC001462399837 1070228482 /nfs/dbraw/zinc/22/84/82/1070228482.db2.gz JFAOPLZMWGQKNO-UHFFFAOYSA-N 2 0 377.504 3.967 20 5 GHBDRP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001254479767 1040266879 /nfs/dbraw/zinc/26/68/79/1040266879.db2.gz KRTVSWPSKUHQHB-VXKWHMMOSA-N 2 0 386.540 3.902 20 5 GHBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCSCc1csc(CN(C)C)n1 ZINC001254537980 1040308313 /nfs/dbraw/zinc/30/83/13/1040308313.db2.gz LHIZDNAOUXRYMD-CQSZACIVSA-N 2 0 394.566 3.567 20 5 GHBDRP COc1cc(N2CCC([NH2+]C[C@@H](C)CC(C)(C)CC[NH3+])CC2)ccc1[N+](=O)[O-] ZINC001256101747 1041528976 /nfs/dbraw/zinc/52/89/76/1041528976.db2.gz PIFYZPRJEPXIAS-INIZCTEOSA-N 2 0 392.544 3.563 20 5 GHBDRP CCC[C@H]([NH2+]Cc1ccccc1N1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC001323991842 1057050713 /nfs/dbraw/zinc/05/07/13/1057050713.db2.gz NETVEQZQVLMJIE-NRFANRHFSA-N 2 0 382.508 3.978 20 5 GHBDRP C[NH+](C)Cc1cc(C[NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)ccc1F ZINC000120984309 837704525 /nfs/dbraw/zinc/70/45/25/837704525.db2.gz CNXIXLDUZCDDMU-UHFFFAOYSA-N 2 0 386.471 3.554 20 5 GHBDRP CCOc1ccc([C@@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1[N+](=O)[O-] ZINC000179469546 835733807 /nfs/dbraw/zinc/73/38/07/835733807.db2.gz RTRDHXHWUMBGRJ-MRXNPFEDSA-N 2 0 384.480 3.956 20 5 GHBDRP COc1ccc(-c2ccc(C[N@@H+]3CCC[C@@H]([C@H]4CC[NH2+]C4)C3)o2)c([N+](=O)[O-])c1 ZINC000584291285 835849359 /nfs/dbraw/zinc/84/93/59/835849359.db2.gz JBWMDGGYURHKNM-JKSUJKDBSA-N 2 0 385.464 3.685 20 5 GHBDRP O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]C[C@H]2CCC[NH2+]C2)cc1 ZINC000414827437 838875343 /nfs/dbraw/zinc/87/53/43/838875343.db2.gz KSVUTCWMENMNFA-KRWDZBQOSA-N 2 0 391.475 3.537 20 5 GHBDRP COc1cc(C[N@@H+]2C[C@@H](C)[C@](C)(C[NH3+])C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000415059749 839145814 /nfs/dbraw/zinc/14/58/14/839145814.db2.gz YUJWIDVSNJGGFI-OPAMFIHVSA-N 2 0 399.491 3.599 20 5 GHBDRP CCC[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1)c1cccc([N+](=O)[O-])c1 ZINC000159508384 862795090 /nfs/dbraw/zinc/79/50/90/862795090.db2.gz PXNXVESDKZBEDL-NRFANRHFSA-N 2 0 397.523 3.763 20 5 GHBDRP CC[N@H+](C)Cc1cc(O[C@@H]2CC[NH+]([C@@H](C)c3cccc([N+](=O)[O-])c3)C2)ccn1 ZINC000856594060 881566299 /nfs/dbraw/zinc/56/62/99/881566299.db2.gz XVRORTFCDNHYAY-HRAATJIYSA-N 2 0 384.480 3.656 20 5 GHBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000449311486 874718736 /nfs/dbraw/zinc/71/87/36/874718736.db2.gz MRKPVVVMJUBTMH-QGZVFWFLSA-N 2 0 383.492 3.789 20 5 GHBDRP C[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815555881 893995059 /nfs/dbraw/zinc/99/50/59/893995059.db2.gz JNKHWWXAHSVBEA-ZACQAIPSSA-N 2 0 398.507 3.637 20 5 GHBDRP C[C@@H]1C[C@@H](CC[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C[N@@H+]1Cc1ccccc1 ZINC000819189509 896458904 /nfs/dbraw/zinc/45/89/04/896458904.db2.gz HVJBHYVTCYFKIE-SFGWALBWSA-N 2 0 383.492 3.519 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CC1CC[NH+](Cc3ccncc3)CC1)CC2 ZINC001172906527 905933499 /nfs/dbraw/zinc/93/34/99/905933499.db2.gz XURLVRYJTGWQTN-JOCHJYFZSA-N 2 0 394.519 3.739 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH+]1C[C@H]3C[NH+](Cc4ccccc4)C[C@@H]3C1)CC2 ZINC001172916508 905988789 /nfs/dbraw/zinc/98/87/89/905988789.db2.gz SPVSCNCHVVJUKE-DNVJHFABSA-N 2 0 391.515 3.906 20 5 GHBDRP CC(C)C[NH+]1CCC([NH2+]C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC1 ZINC001173008634 906083618 /nfs/dbraw/zinc/08/36/18/906083618.db2.gz DBDHVBYSAOFSJM-UHFFFAOYSA-N 2 0 396.482 3.552 20 5 GHBDRP [NH3+]CCC[N@H+](C1CCCCC1)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173011595 906088453 /nfs/dbraw/zinc/08/84/53/906088453.db2.gz GXUHNGDOUBLSPU-UHFFFAOYSA-N 2 0 396.482 3.825 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]CC2CC[NH+](CC(C)C)CC2)c1F ZINC001173178331 906254527 /nfs/dbraw/zinc/25/45/27/906254527.db2.gz FYZHXSLZETYONL-OAHLLOKOSA-N 2 0 381.492 3.631 20 5 GHBDRP CCCC[NH+]1CCC(C[NH2+][C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])CC1 ZINC001173183311 906264964 /nfs/dbraw/zinc/26/49/64/906264964.db2.gz XQOBUFDVJLFJIC-OAHLLOKOSA-N 2 0 381.492 3.775 20 5 GHBDRP CC[N@H+](CCC1CC[NH+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1)CC(C)C ZINC000773736247 908970474 /nfs/dbraw/zinc/97/04/74/908970474.db2.gz VISWIOJNFQSFCT-OAQYLSRUSA-N 2 0 377.529 3.708 20 5 GHBDRP C[C@@H]([NH2+]CCCN1CC[N@H+](C)C[C@@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000467837611 929488126 /nfs/dbraw/zinc/48/81/26/929488126.db2.gz DMJCALWIZDFXML-XMSQKQJNSA-N 2 0 382.508 3.624 20 5 GHBDRP O=C1C[N@H+](Cc2c3ccccc3c3cc4ccccc4oc2-3)CC2(CC[NH2+]CC2)N1 ZINC001222515731 1030176749 /nfs/dbraw/zinc/17/67/49/1030176749.db2.gz ZIRFGFVRMKVRLZ-UHFFFAOYSA-N 2 0 399.494 3.745 20 5 GHBDRP [NH3+][C@@H]1CC[N@H+](Cc2c3[nH]c4ccccc4c3cc3[nH]c4ccccc4c32)C[C@H]1O ZINC001205953184 1033653613 /nfs/dbraw/zinc/65/36/13/1033653613.db2.gz MVFQCEOKOUCXBL-XMSQKQJNSA-N 2 0 384.483 3.850 20 5 GHBDRP C[C@H]([NH2+]CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1)[C@H](O)c1ccccc1 ZINC001206122806 1033727775 /nfs/dbraw/zinc/72/77/75/1033727775.db2.gz VUGNZFKIAYXDJA-MBSDFSHPSA-N 2 0 397.519 3.561 20 5 GHBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO ZINC001462000581 1069937991 /nfs/dbraw/zinc/93/79/91/1069937991.db2.gz WEZDFHQXEXITQR-GCJKJVERSA-N 2 0 397.519 3.662 20 5 GHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CC2(CC[NH2+]CC2)Oc2ccccc21 ZINC001246138546 1037211664 /nfs/dbraw/zinc/21/16/64/1037211664.db2.gz YQONFAHEZVECIG-OXQOHEQNSA-N 2 0 381.476 3.761 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH2+][C@H]1CC3(CC[NH2+]CC3)c3cc(F)ccc31)C2 ZINC001246186763 1037228387 /nfs/dbraw/zinc/22/83/87/1037228387.db2.gz YZTLJDCLIUQGGL-UWJYYQICSA-N 2 0 381.451 3.557 20 5 GHBDRP C[N@H+](Cc1ccc(-n2ccnc2)cc1)C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001254481520 1040267762 /nfs/dbraw/zinc/26/77/62/1040267762.db2.gz WYLPVNDHPOEFRJ-UHFFFAOYSA-N 2 0 391.475 3.881 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH2+][C@@H]1CC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]31)C2 ZINC001254581805 1040356679 /nfs/dbraw/zinc/35/66/79/1040356679.db2.gz MYUJIMMQZUMVMY-VOFXCDAESA-N 2 0 377.488 3.562 20 5 GHBDRP COc1cccc(C[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001254587960 1040360930 /nfs/dbraw/zinc/36/09/30/1040360930.db2.gz STFYZIYYHKKOGU-KCZVDYSFSA-N 2 0 395.503 3.843 20 5 GHBDRP O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[NH2+]C3([C@H]4CCCCO4)CC3)CC2)cc1 ZINC001462605184 1070408020 /nfs/dbraw/zinc/40/80/20/1070408020.db2.gz QCFFIPKJJYWWFF-OAQYLSRUSA-N 2 0 387.524 3.541 20 5 GHBDRP O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC001326597212 1057519663 /nfs/dbraw/zinc/51/96/63/1057519663.db2.gz SWQRZAONCZVBKI-VYTWWXLVSA-N 2 0 395.503 3.804 20 5 GHBDRP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]C[C@H]2CCC[N@@H+]2C2CCCCC2)n1 ZINC000436287980 851422195 /nfs/dbraw/zinc/42/21/95/851422195.db2.gz DKEBMRHDZIOESR-GUDVDZBRSA-N 2 0 375.517 3.662 20 5 GHBDRP COc1ccc(C[NH2+][C@@H]2CCC[C@@H]([NH3+])C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414928062 852336770 /nfs/dbraw/zinc/33/67/70/852336770.db2.gz PUXXYRBMRHCOEK-QZTJIDSGSA-N 2 0 385.464 3.542 20 5 GHBDRP COc1ccc(C[NH2+]C[C@H]2CCC[N@H+](C)C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000108428917 853072319 /nfs/dbraw/zinc/07/23/19/853072319.db2.gz QNHCDHQLVXNAPT-LJQANCHMSA-N 2 0 399.491 3.614 20 5 GHBDRP C[C@@H]1C[NH+](Cc2ccc(C[NH2+][C@H]3CCc4c3cccc4[N+](=O)[O-])cc2)C[C@@H](C)O1 ZINC000594489926 858189553 /nfs/dbraw/zinc/18/95/53/858189553.db2.gz HUPRYBACTCZTAK-YVHKJVDXSA-N 2 0 395.503 3.981 20 5 GHBDRP CC[N@H+](C)Cc1cc(O[C@H]2CC[NH+]([C@H](C)c3cccc([N+](=O)[O-])c3)C2)ccn1 ZINC000856594217 881566654 /nfs/dbraw/zinc/56/66/54/881566654.db2.gz XVRORTFCDNHYAY-IERDGZPVSA-N 2 0 384.480 3.656 20 5 GHBDRP Cc1cc(N2CCC(C[NH+]3C[C@@H](C)O[C@H](C)C3)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302171991 865747549 /nfs/dbraw/zinc/74/75/49/865747549.db2.gz MFFDWDAAKFBJCM-IAGOWNOFSA-N 2 0 398.507 3.777 20 5 GHBDRP C[C@H]([NH2+]CCc1ccc(OCC[NH+]2CCCC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000540395349 871165214 /nfs/dbraw/zinc/16/52/14/871165214.db2.gz SRZNOVBMDQLYHT-SFHVURJKSA-N 2 0 383.492 3.963 20 5 GHBDRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000447506773 871719062 /nfs/dbraw/zinc/71/90/62/871719062.db2.gz DZKFOAZREYSMAV-WOJBJXKFSA-N 2 0 385.512 3.907 20 5 GHBDRP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)n1 ZINC000618570491 871726577 /nfs/dbraw/zinc/72/65/77/871726577.db2.gz KCCPMSOZHFQCGS-NJDAHSKKSA-N 2 0 397.523 3.777 20 5 GHBDRP O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)n1 ZINC000447526780 871754941 /nfs/dbraw/zinc/75/49/41/871754941.db2.gz CPPYLMDJIGKULR-RTWAWAEBSA-N 2 0 397.523 3.777 20 5 GHBDRP CC[NH+](CC)CCO[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000536693158 893549106 /nfs/dbraw/zinc/54/91/06/893549106.db2.gz IZTXCEPRVDHOIQ-IBGZPJMESA-N 2 0 387.480 3.788 20 5 GHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]([C@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001173224774 906307017 /nfs/dbraw/zinc/30/70/17/906307017.db2.gz LCTQYPJYXWUAHT-VQIMIIECSA-N 2 0 375.513 3.537 20 5 GHBDRP C[NH+]1CCN(c2cc[nH+]c(NCc3ccc(-c4cccc([N+](=O)[O-])c4)o3)c2)CC1 ZINC001179338349 909495711 /nfs/dbraw/zinc/49/57/11/909495711.db2.gz FZGIHAZMTALSHB-UHFFFAOYSA-N 2 0 393.447 3.614 20 5 GHBDRP CC[N@H+](CCC1CC[NH+](Cc2ccc(O)c(OC)c2[N+](=O)[O-])CC1)CC(C)C ZINC001181515643 910838940 /nfs/dbraw/zinc/83/89/40/910838940.db2.gz VOQXTCAXNDFBIW-UHFFFAOYSA-N 2 0 393.528 3.889 20 5 GHBDRP CCOc1ccc([C@H](C)[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1[N+](=O)[O-] ZINC000902504035 922244031 /nfs/dbraw/zinc/24/40/31/922244031.db2.gz VQEIDLGKOOQBFP-REDKUUPNSA-N 2 0 397.475 3.900 20 5 GHBDRP C[NH+](C)CCN1CC[N@H+](Cc2c3ccccc3cc3ccccc32)CCC1=O ZINC001141728296 1026361615 /nfs/dbraw/zinc/36/16/15/1026361615.db2.gz PJAXYQYCQJSHQE-UHFFFAOYSA-N 2 0 375.516 3.589 20 5 GHBDRP C[C@H](c1ccccn1)[N@H+](C)CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001462068930 1069978226 /nfs/dbraw/zinc/97/82/26/1069978226.db2.gz CJTWZZJGPVZQNM-GOSISDBHSA-N 2 0 382.508 3.937 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH2+]CC1(Cc3ccccc3Cl)CC[NH2+]CC1)C2 ZINC001246370410 1037328804 /nfs/dbraw/zinc/32/88/04/1037328804.db2.gz KGNDGYRKBFANGN-LJQANCHMSA-N 2 0 399.922 3.918 20 5 GHBDRP COc1ccc(C[C@H](C)[N@@H+]2Cc3ccccc3C3(CC[NH2+]CC3)C2)c([N+](=O)[O-])c1 ZINC001246864554 1037683616 /nfs/dbraw/zinc/68/36/16/1037683616.db2.gz WHHAQOKNZHNHFS-KRWDZBQOSA-N 2 0 395.503 3.671 20 5 GHBDRP [NH3+]C1(Cc2ccccc2)CC[NH+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC001254469894 1040255682 /nfs/dbraw/zinc/25/56/82/1040255682.db2.gz BEWUTYWRXNDWPO-UHFFFAOYSA-N 2 0 394.519 3.600 20 5 GHBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH+]1CCC2(CC[N@H+](Cc3cccnc3)C2)CC1 ZINC001254558950 1040329706 /nfs/dbraw/zinc/32/97/06/1040329706.db2.gz WNUXMOCGJJQABC-IBGZPJMESA-N 2 0 394.519 3.909 20 5 GHBDRP CCC[NH+](CCC)CCCN1CCN([C@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC001254567975 1040344139 /nfs/dbraw/zinc/34/41/39/1040344139.db2.gz DMLSSNDKJSEECO-HXUWFJFHSA-N 2 0 390.572 3.656 20 5 GHBDRP O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC001474086881 1074259601 /nfs/dbraw/zinc/25/96/01/1074259601.db2.gz YIKYPWQKMDYEQS-UHFFFAOYSA-N 2 0 392.406 3.597 20 5 GHBDRP C[NH+](C)CCCOc1cnccc1C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000573242188 834576874 /nfs/dbraw/zinc/57/68/74/834576874.db2.gz DQSYNUOVVXWCIC-FQEVSTJZSA-N 2 0 398.507 3.833 20 5 GHBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1 ZINC000414304323 836990717 /nfs/dbraw/zinc/99/07/17/836990717.db2.gz MGJABMPLTUIJHR-IBGZPJMESA-N 2 0 397.519 3.533 20 5 GHBDRP COc1ccc(C[NH2+]CC2(C)CC[NH2+]CC2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414903826 838968306 /nfs/dbraw/zinc/96/83/06/838968306.db2.gz MHYLGURAZXOGMK-UHFFFAOYSA-N 2 0 399.491 3.662 20 5 GHBDRP [NH3+]C[C@@H]1CC[C@H]([NH2+]Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000415041847 839107098 /nfs/dbraw/zinc/10/70/98/839107098.db2.gz QFVKTNNQXUGWAQ-APWZRJJASA-N 2 0 391.475 3.665 20 5 GHBDRP COc1ccc(C[N@@H+]2CC[C@@H](C)[C@@H](C[NH3+])C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000415125533 839246865 /nfs/dbraw/zinc/24/68/65/839246865.db2.gz LLJQAVDODLNDDB-APWZRJJASA-N 2 0 399.491 3.599 20 5 GHBDRP CCC[C@H]([NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000126706475 841879179 /nfs/dbraw/zinc/87/91/79/841879179.db2.gz JOVLSUPITNXPQT-QHCPKHFHSA-N 2 0 396.535 3.973 20 5 GHBDRP C[C@@H]1CN(Cc2cccc(C[NH2+][C@H]3CCCc4ccc([N+](=O)[O-])cc43)c2)CCO1 ZINC000249050640 842708727 /nfs/dbraw/zinc/70/87/27/842708727.db2.gz XIAGCBYGCMCDTQ-HXOBKFHXSA-N 2 0 395.503 3.983 20 5 GHBDRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000599661301 861494469 /nfs/dbraw/zinc/49/44/69/861494469.db2.gz SOZSUFKSABVVSA-QGZVFWFLSA-N 2 0 398.507 3.814 20 5 GHBDRP C[C@H]1C[C@@H](C[NH3+])C[N@@H+]1Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000435374820 850421841 /nfs/dbraw/zinc/42/18/41/850421841.db2.gz YSJPSFPVNYTJNK-IRXDYDNUSA-N 2 0 391.475 3.617 20 5 GHBDRP C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(CC[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000426830308 852417616 /nfs/dbraw/zinc/41/76/16/852417616.db2.gz XFEQRRQIDFIGTJ-KZNAEPCWSA-N 2 0 375.513 3.867 20 5 GHBDRP COc1cc(C[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000594521117 858207564 /nfs/dbraw/zinc/20/75/64/858207564.db2.gz MBDZLCIWKJVOCE-PUZFROQSSA-N 2 0 399.491 3.612 20 5 GHBDRP COc1ccc(C[C@H](C)[NH2+]C2CC[NH+](C[C@H]3CC=CCC3)CC2)c([N+](=O)[O-])c1 ZINC001170327143 881364343 /nfs/dbraw/zinc/36/43/43/881364343.db2.gz FDONZMFPHFDTHC-ROUUACIJSA-N 2 0 387.524 3.945 20 5 GHBDRP [NH3+]CC1(CC[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)CC1 ZINC000593314734 859381713 /nfs/dbraw/zinc/38/17/13/859381713.db2.gz DHIMAQIPMKGUOX-UHFFFAOYSA-N 2 0 394.269 3.836 20 5 GHBDRP C[NH+](C)CCC[C@@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCO1 ZINC000597248306 859392805 /nfs/dbraw/zinc/39/28/05/859392805.db2.gz PTVKXEKGUOMIMP-MRXNPFEDSA-N 2 0 389.521 3.866 20 5 GHBDRP C[C@H]([NH2+]CC1CC[NH+](CCO)CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000151786826 864480796 /nfs/dbraw/zinc/48/07/96/864480796.db2.gz BLZDTUGPHXNSAT-HNNXBMFYSA-N 2 0 389.521 3.678 20 5 GHBDRP [NH3+]CCC[N@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)Cc1ccccc1 ZINC000479768684 868492469 /nfs/dbraw/zinc/49/24/69/868492469.db2.gz DBLFSGQOYDONFK-UHFFFAOYSA-N 2 0 380.448 3.643 20 5 GHBDRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)C1 ZINC000447543803 871814197 /nfs/dbraw/zinc/81/41/97/871814197.db2.gz MLLUDHDGFBPZKT-RDGPPVDQSA-N 2 0 377.533 3.623 20 5 GHBDRP C[NH+]1CCC2(CC1)CC[NH+](Cc1cc([N+](=O)[O-])ccc1Br)CC2 ZINC001196798711 873367252 /nfs/dbraw/zinc/36/72/52/873367252.db2.gz MFRUZMCIMDJPTH-UHFFFAOYSA-N 2 0 382.302 3.665 20 5 GHBDRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000237704675 877818844 /nfs/dbraw/zinc/81/88/44/877818844.db2.gz KIVCAIUDNVMBII-ROUUACIJSA-N 2 0 399.539 3.843 20 5 GHBDRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000537991202 878636178 /nfs/dbraw/zinc/63/61/78/878636178.db2.gz MDSFEKNEUXTNOU-IBGZPJMESA-N 2 0 382.508 3.848 20 5 GHBDRP COc1ccc(C[C@@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001170296674 881317698 /nfs/dbraw/zinc/31/76/98/881317698.db2.gz HMWATFKTFJGKCH-IEBWSBKVSA-N 2 0 383.492 3.646 20 5 GHBDRP CC1CC[NH+](Cc2ccc(C[NH2+]C3CC(n4cc([N+](=O)[O-])cn4)C3)cc2)CC1 ZINC000876913608 893385224 /nfs/dbraw/zinc/38/52/24/893385224.db2.gz RXTKJIGFKNQORT-UHFFFAOYSA-N 2 0 383.496 3.517 20 5 GHBDRP C[C@@H]1C[C@H](CC[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)C[N@@H+]1Cc1ccccc1 ZINC000819189507 896458527 /nfs/dbraw/zinc/45/85/27/896458527.db2.gz HVJBHYVTCYFKIE-LZNRXBQRSA-N 2 0 383.492 3.519 20 5 GHBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CCC1(O)CC[NH+](Cc2ccccc2)CC1 ZINC001179458624 909537477 /nfs/dbraw/zinc/53/74/77/909537477.db2.gz WWZVMDGGSMOGCL-UHFFFAOYSA-N 2 0 397.519 3.718 20 5 GHBDRP COc1ccc(C[NH2+][C@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)cc1[N+](=O)[O-] ZINC001179771660 909699428 /nfs/dbraw/zinc/69/94/28/909699428.db2.gz KKMHSBJRINYZHS-HKBOAZHASA-N 2 0 395.503 3.994 20 5 GHBDRP [NH3+]CCC[C@H]([NH2+]Cc1ccc(Br)cc1[N+](=O)[O-])c1ccccc1 ZINC000925762547 931896583 /nfs/dbraw/zinc/89/65/83/931896583.db2.gz LFLWPEYCORCOJD-INIZCTEOSA-N 2 0 378.270 3.927 20 5 GHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1 ZINC000468644033 1015868363 /nfs/dbraw/zinc/86/83/63/1015868363.db2.gz WYKHEJAGMHNSLR-QGOAFFKASA-N 2 0 395.503 3.745 20 5 GHBDRP C[NH+](C)CCOc1cc(N(CC[NH3+])c2cccc3ccccc32)ccc1[N+](=O)[O-] ZINC001162007721 1025535110 /nfs/dbraw/zinc/53/51/10/1025535110.db2.gz PAJKAVQUESUCDW-UHFFFAOYSA-N 2 0 394.475 3.785 20 5 GHBDRP CCC[NH+]1CCC(NC(=O)[C@@H]([NH3+])Cc2c3ccccc3cc3ccccc32)CC1 ZINC001219954871 1031716251 /nfs/dbraw/zinc/71/62/51/1031716251.db2.gz WBOSTLYDEROLHG-DEOSSOPVSA-N 2 0 389.543 3.853 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH+]2CCC(CC3CC[NH2+]CC3)CC2)c1F ZINC001246978254 1037802993 /nfs/dbraw/zinc/80/29/93/1037802993.db2.gz HDKCEAVVQVMPII-OAHLLOKOSA-N 2 0 393.503 3.775 20 5 GHBDRP CC[NH+](CC)CCCC1CC[NH+](Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])CC1 ZINC001459931102 1064281207 /nfs/dbraw/zinc/28/12/07/1064281207.db2.gz MDTWAAGSFRPEPG-UHFFFAOYSA-N 2 0 391.512 3.715 20 5 GHBDRP O=[N+]([O-])c1ccc(N2CCC([NH2+]Cc3cccc(C[NH+]4CCCC4)c3)CC2)cc1 ZINC000123082146 841391102 /nfs/dbraw/zinc/39/11/02/841391102.db2.gz ADFIWUOZNXLRLM-UHFFFAOYSA-N 2 0 394.519 3.949 20 5 GHBDRP Cc1c([C@H](C)[NH2+]Cc2ccc(CN3CC[NH+](C)CC3)cc2)cccc1[N+](=O)[O-] ZINC000126701321 841871300 /nfs/dbraw/zinc/87/13/00/841871300.db2.gz NTVBDIOFTFMFDB-SFHVURJKSA-N 2 0 382.508 3.501 20 5 GHBDRP CC[NH+](CC)C[C@H]1CCCC[C@@H]1[NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000482140549 842032176 /nfs/dbraw/zinc/03/21/76/842032176.db2.gz WPZYJNWCZJNVNC-MJGOQNOKSA-N 2 0 390.528 3.722 20 5 GHBDRP Cc1cc(NC[C@@H]2CC[N@H+](Cc3ccccc3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000893589534 843419034 /nfs/dbraw/zinc/41/90/34/843419034.db2.gz KBHOXJDXTNWUHI-SFHVURJKSA-N 2 0 376.460 3.807 20 5 GHBDRP Cc1ccc([C@@H](C)[NH2+]CC2(N)CC[NH+](Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000423540648 849974205 /nfs/dbraw/zinc/97/42/05/849974205.db2.gz AALKFLVQGMQQMM-GOSISDBHSA-N 2 0 382.508 3.547 20 5 GHBDRP COc1ccc(C[N@H+](C)[C@H]2CCC[NH2+]CC2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000435433167 850491564 /nfs/dbraw/zinc/49/15/64/850491564.db2.gz QNOKTGIRNLGXDB-IBGZPJMESA-N 2 0 399.491 3.756 20 5 GHBDRP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+]CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000482161612 862758117 /nfs/dbraw/zinc/75/81/17/862758117.db2.gz DXRAYPHMLUEXSO-PKOBYXMFSA-N 2 0 390.528 3.722 20 5 GHBDRP O=C(CC[NH2+]Cc1ccccc1C[NH+]1CCCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000591723118 856212979 /nfs/dbraw/zinc/21/29/79/856212979.db2.gz FCJKBVLWTLLUQC-UHFFFAOYSA-N 2 0 396.491 3.699 20 5 GHBDRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000591726549 856232779 /nfs/dbraw/zinc/23/27/79/856232779.db2.gz LRYAXUCJKJSMRR-UHFFFAOYSA-N 2 0 384.480 3.553 20 5 GHBDRP O=[N+]([O-])c1cccc([C@H]([NH2+]CCCC[N@H+]2CCC[C@H]2CO)c2ccccc2)c1 ZINC000245905998 857195610 /nfs/dbraw/zinc/19/56/10/857195610.db2.gz FHGDMUHASVDLIT-FCHUYYIVSA-N 2 0 383.492 3.511 20 5 GHBDRP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000595043155 858377584 /nfs/dbraw/zinc/37/75/84/858377584.db2.gz IHKJZXSOZKUKJC-INIZCTEOSA-N 2 0 399.491 3.927 20 5 GHBDRP CC[C@@H]([NH2+]Cc1ccc(CN2CC[NH+](CC)CC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000160321971 858810073 /nfs/dbraw/zinc/81/00/73/858810073.db2.gz ISAHDTIIMVFUKU-HSZRJFAPSA-N 2 0 396.535 3.973 20 5 GHBDRP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2)C1 ZINC000593316834 859394694 /nfs/dbraw/zinc/39/46/94/859394694.db2.gz YSKKCUQHZRSWDZ-LZJOCLMNSA-N 2 0 385.464 3.573 20 5 GHBDRP C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)CCCC[NH+]1CCCCC1 ZINC000603110690 860496209 /nfs/dbraw/zinc/49/62/09/860496209.db2.gz OZLVTTIWNDWSMF-MRXNPFEDSA-N 2 0 387.484 3.904 20 5 GHBDRP CN(c1ccccc1)c1ccc(C[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc1[N+](=O)[O-] ZINC000603633173 860952610 /nfs/dbraw/zinc/95/26/10/860952610.db2.gz IEFFSVJEDHKFEA-GOSISDBHSA-N 2 0 380.492 3.937 20 5 GHBDRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000447531431 871788974 /nfs/dbraw/zinc/78/89/74/871788974.db2.gz RCFKDCBBQGFOJV-PMACEKPBSA-N 2 0 385.512 3.907 20 5 GHBDRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000447564554 871871695 /nfs/dbraw/zinc/87/16/95/871871695.db2.gz XTQIOBSFGDUTEZ-PMACEKPBSA-N 2 0 385.512 3.905 20 5 GHBDRP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO)c1cccc([N+](=O)[O-])c1 ZINC000182250534 872104332 /nfs/dbraw/zinc/10/43/32/872104332.db2.gz MWPZELLFOPTYFS-FGZHOGPDSA-N 2 0 383.492 3.792 20 5 GHBDRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776276556 876149532 /nfs/dbraw/zinc/14/95/32/876149532.db2.gz KNXOLIXRYBPBRX-JTSKRJEESA-N 2 0 383.492 3.792 20 5 GHBDRP COc1ccc(C[C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c([N+](=O)[O-])c1 ZINC001170300410 881321625 /nfs/dbraw/zinc/32/16/25/881321625.db2.gz ZUVQODGPDVXSRK-QGZVFWFLSA-N 2 0 383.492 3.920 20 5 GHBDRP Cc1cccc(-n2cc(CC[NH+]3CCC([NH3+])CC3)c3ccccc32)c1[N+](=O)[O-] ZINC001170528139 885541057 /nfs/dbraw/zinc/54/10/57/885541057.db2.gz INQVMNHLFNJGQO-UHFFFAOYSA-N 2 0 378.476 3.813 20 5 GHBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]([C@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001173224769 906307159 /nfs/dbraw/zinc/30/71/59/906307159.db2.gz LCTQYPJYXWUAHT-QFBILLFUSA-N 2 0 375.513 3.537 20 5 GHBDRP CC1CC[NH+](CC[C@@H]2CCC[N@@H+]2CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC001175353021 907514969 /nfs/dbraw/zinc/51/49/69/907514969.db2.gz SQGYSENCTYEJAP-SFHVURJKSA-N 2 0 388.512 3.510 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)CCC2 ZINC000192933024 908835360 /nfs/dbraw/zinc/83/53/60/908835360.db2.gz CESRMHSDFDXXRB-HSZRJFAPSA-N 2 0 395.503 3.719 20 5 GHBDRP CC1(CC(F)F)C[NH+](CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001182556770 911847639 /nfs/dbraw/zinc/84/76/39/911847639.db2.gz ZHRARYXJJNODJA-UHFFFAOYSA-N 2 0 381.467 3.826 20 5 GHBDRP C[C@]1(C[NH2+][C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)CC[N@H+](Cc2ccccc2)C1 ZINC000798934742 932823266 /nfs/dbraw/zinc/82/32/66/932823266.db2.gz HZSMDZNYJXSVQZ-JAXLGGSGSA-N 2 0 397.523 3.777 20 5 GHBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1 ZINC000468734255 1015972080 /nfs/dbraw/zinc/97/20/80/1015972080.db2.gz PEKRTEVTMBHXDE-AQTBWJFISA-N 2 0 395.503 3.745 20 5 GHBDRP O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1 ZINC000559326108 1017427001 /nfs/dbraw/zinc/42/70/01/1017427001.db2.gz BOHHMZYGRGUCFH-OAQYLSRUSA-N 2 0 395.503 3.613 20 5 GHBDRP O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[NH2+]Cc3noc4c3CCCC4)CC2)cc1 ZINC001206127547 1033731275 /nfs/dbraw/zinc/73/12/75/1033731275.db2.gz IKDBVKLHXSOXSK-UHFFFAOYSA-N 2 0 398.507 3.506 20 5 GHBDRP Cc1cccc2c1C1(C[C@@H]2[NH2+][C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC[NH2+]CC1 ZINC001246248662 1037253388 /nfs/dbraw/zinc/25/33/88/1037253388.db2.gz OTATZWXGGAODCZ-RXVVDRJESA-N 2 0 377.488 3.726 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]C1(c3ccc(F)cc3)CC[NH2+]CC1)CC2 ZINC001246337010 1037301441 /nfs/dbraw/zinc/30/14/41/1037301441.db2.gz PUEBOCOYSDEUQF-HXUWFJFHSA-N 2 0 383.467 3.850 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]C1(Cc3ccccc3F)CC[NH2+]CC1)CC2 ZINC001246380983 1037338692 /nfs/dbraw/zinc/33/86/92/1037338692.db2.gz MAAYEHYLASXQBC-FQEVSTJZSA-N 2 0 397.494 3.936 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH2+]CC1(c3ccccc3Cl)CC[NH2+]CC1)C2 ZINC001246448975 1037410611 /nfs/dbraw/zinc/41/06/11/1037410611.db2.gz HAURRBZJIXWEJP-QGZVFWFLSA-N 2 0 385.895 3.626 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CCCC[C@@H]2C2CC[NH2+]CC2)c1F ZINC001246653646 1037528238 /nfs/dbraw/zinc/52/82/38/1037528238.db2.gz IPNAUNRJSZYSAS-WMLDXEAASA-N 2 0 379.476 3.528 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1Cc3ccccc3C13CC[NH2+]CC3)CC2 ZINC001247011425 1037836427 /nfs/dbraw/zinc/83/64/27/1037836427.db2.gz RYWURDPOHVTIFD-HXUWFJFHSA-N 2 0 377.488 3.937 20 5 GHBDRP CC[NH+](CC)C[C@@H](O)CNc1cc2oc3cc(=[NH2+])ccc-3nc2c2ccccc12 ZINC001253201992 1039472899 /nfs/dbraw/zinc/47/28/99/1039472899.db2.gz YOOSZTPVVHWNKL-INIZCTEOSA-N 2 0 390.487 3.680 20 5 GHBDRP CC1(C)C[C@H](C[NH2+]CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)CCO1 ZINC001474566176 1074465890 /nfs/dbraw/zinc/46/58/90/1074465890.db2.gz GCNCXXLRIFXXBQ-HXUWFJFHSA-N 2 0 389.540 3.644 20 5 GHBDRP COc1ccc(-c2ccc(C[N@@H+]3CCC[C@H]4C[NH+](C)CC[C@@H]43)o2)c([N+](=O)[O-])c1 ZINC000583532989 834586864 /nfs/dbraw/zinc/58/68/64/834586864.db2.gz ZOEYVWBRSZKRPP-KXBFYZLASA-N 2 0 385.464 3.780 20 5 GHBDRP C[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000610372538 838760448 /nfs/dbraw/zinc/76/04/48/838760448.db2.gz ZTNKAPCXJSIIFO-HXUWFJFHSA-N 2 0 383.492 3.818 20 5 GHBDRP O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]C[C@@H]2CCC[NH2+]C2)cc1 ZINC000414827835 838875070 /nfs/dbraw/zinc/87/50/70/838875070.db2.gz KSVUTCWMENMNFA-QGZVFWFLSA-N 2 0 391.475 3.537 20 5 GHBDRP O=[N+]([O-])c1ccccc1OCC[N@H+](Cc1ccsc1)[C@@H]1CC12CC[NH2+]CC2 ZINC000432674955 843421610 /nfs/dbraw/zinc/42/16/10/843421610.db2.gz GSPJDHXLDAKWFH-LJQANCHMSA-N 2 0 387.505 3.679 20 5 GHBDRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000120495926 843857312 /nfs/dbraw/zinc/85/73/12/843857312.db2.gz MJJZORZCUJNVKG-INIZCTEOSA-N 2 0 384.480 3.553 20 5 GHBDRP CC1(C)C[C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)c2cc([N+](=O)[O-])ccc21 ZINC000433240211 843890054 /nfs/dbraw/zinc/89/00/54/843890054.db2.gz NMDQVTAZIBGSFY-SIKLNZKXSA-N 2 0 395.503 3.674 20 5 GHBDRP CC1(C)C[C@H]([NH2+]Cc2cccc(CN3CCOCC3)c2)c2cc([N+](=O)[O-])ccc21 ZINC000433138497 845479071 /nfs/dbraw/zinc/47/90/71/845479071.db2.gz YFNXKRVBHRVLNN-QFIPXVFZSA-N 2 0 395.503 3.939 20 5 GHBDRP COc1ccc(C[NH+]2CCC([C@H](C)[NH3+])CC2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000435396792 850463514 /nfs/dbraw/zinc/46/35/14/850463514.db2.gz YPLJFCKSIWFEQG-INIZCTEOSA-N 2 0 399.491 3.742 20 5 GHBDRP COc1ccc(C[N@H+](C)CC(C)(C)C[NH3+])cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000592427922 857403216 /nfs/dbraw/zinc/40/32/16/857403216.db2.gz YTMYHUSBKJEHMF-UHFFFAOYSA-N 2 0 387.480 3.599 20 5 GHBDRP COc1ccc(C[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000594519901 858207953 /nfs/dbraw/zinc/20/79/53/858207953.db2.gz HACGFRDHVIQLML-PUZFROQSSA-N 2 0 399.491 3.612 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C[N@H+]3CC[C@@H](O)C3)cc1)CCCC2 ZINC000595066102 858369343 /nfs/dbraw/zinc/36/93/43/858369343.db2.gz BYGIPOOQYQWPQF-FYYLOGMGSA-N 2 0 395.503 3.719 20 5 GHBDRP COc1ccc(C[C@H](C)[N@H+](Cc2ccncc2)[C@H]2CC[C@H]([NH3+])CC2)c([N+](=O)[O-])c1 ZINC001170329246 881367345 /nfs/dbraw/zinc/36/73/45/881367345.db2.gz YFYYLNGZLQCZOO-VDGAXYAQSA-N 2 0 398.507 3.702 20 5 GHBDRP COc1cc([C@@H](C)[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)cc([N+](=O)[O-])c1 ZINC000903167519 859525064 /nfs/dbraw/zinc/52/50/64/859525064.db2.gz ZSAGSFSVFGEMPT-MRXNPFEDSA-N 2 0 399.491 3.927 20 5 GHBDRP COc1ccc(C[C@@H](C)[N@@H+]2CCCC[C@H]2C[C@@H]2CCC[NH+]2C)c([N+](=O)[O-])c1 ZINC001170351673 881498132 /nfs/dbraw/zinc/49/81/32/881498132.db2.gz HETDSXLYDGQXPF-NEWSRXKRSA-N 2 0 375.513 3.873 20 5 GHBDRP C[C@@H]1C[NH+](CCCC[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H](C)O1 ZINC000171051814 863364166 /nfs/dbraw/zinc/36/41/66/863364166.db2.gz CMVCXRSDJHFWEL-IAGOWNOFSA-N 2 0 387.480 3.834 20 5 GHBDRP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)n1 ZINC000618570494 871725829 /nfs/dbraw/zinc/72/58/29/871725829.db2.gz KCCPMSOZHFQCGS-QHAWAJNXSA-N 2 0 397.523 3.777 20 5 GHBDRP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1[NH2+]CCOc1ccccc1[N+](=O)[O-] ZINC000460355514 872929835 /nfs/dbraw/zinc/92/98/35/872929835.db2.gz XNMRYWZFMPAQFG-ROUUACIJSA-N 2 0 383.492 3.720 20 5 GHBDRP C[C@@H]1C[N@@H+](CCC2CC[NH+](C/C=C/c3ccccc3[N+](=O)[O-])CC2)C[C@H](C)O1 ZINC000537659562 883006571 /nfs/dbraw/zinc/00/65/71/883006571.db2.gz YJYANOWGHMLXCC-QCHNEIPXSA-N 2 0 387.524 3.819 20 5 GHBDRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000776585901 878235182 /nfs/dbraw/zinc/23/51/82/878235182.db2.gz CSGYDZBEAAKOEL-UTKZUKDTSA-N 2 0 375.513 3.605 20 5 GHBDRP Cc1ccc([C@H](C)[NH2+]C[C@@H](c2cccs2)N2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000531677699 880309154 /nfs/dbraw/zinc/30/91/54/880309154.db2.gz POEFGNHMAXHHIN-LPHOPBHVSA-N 2 0 388.537 3.604 20 5 GHBDRP CC(=O)Nc1ccc(CN2CCC([NH2+][C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000453327231 880799599 /nfs/dbraw/zinc/79/95/99/880799599.db2.gz OMDSJEWNSMQGTG-INIZCTEOSA-N 2 0 396.491 3.868 20 5 GHBDRP [NH3+]C1CC[NH+](CCc2cn(-c3cnc(Cl)cc3[N+](=O)[O-])c3ccccc23)CC1 ZINC001170524578 885470239 /nfs/dbraw/zinc/47/02/39/885470239.db2.gz DASVZHZGMWDXMK-UHFFFAOYSA-N 2 0 399.882 3.553 20 5 GHBDRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000495439878 885808695 /nfs/dbraw/zinc/80/86/95/885808695.db2.gz OHEBYJSILKLTFX-YJBOKZPZSA-N 2 0 383.920 3.517 20 5 GHBDRP CCc1ccc([C@H](NC[C@@H]2CC3(CO2)CC[NH2+]CC3)c2ccc([N+](=O)[O-])cc2)o1 ZINC000873293950 891562946 /nfs/dbraw/zinc/56/29/46/891562946.db2.gz RSEVWCIRFHNHRQ-PZJWPPBQSA-N 2 0 399.491 3.588 20 5 GHBDRP COc1ccc(-c2ccc(CN3CCC([NH2+]CC4CC4)CC3)o2)c([N+](=O)[O-])c1 ZINC000564655254 895158884 /nfs/dbraw/zinc/15/88/84/895158884.db2.gz IETLFDFCZNDPMW-UHFFFAOYSA-N 2 0 385.464 3.827 20 5 GHBDRP O=[N+]([O-])c1cccc([C@H](O)C[NH2+]Cc2ccccc2C[NH+]2CCCCCC2)c1 ZINC000819058481 896346375 /nfs/dbraw/zinc/34/63/75/896346375.db2.gz CRMNZXIHMCVHFZ-JOCHJYFZSA-N 2 0 383.492 3.794 20 5 GHBDRP O=[N+]([O-])c1ccc([C@H](O)C[NH2+]C[C@H]2CCCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000819323607 896568062 /nfs/dbraw/zinc/56/80/62/896568062.db2.gz NMSCPUDHDKTVLB-DENIHFKCSA-N 2 0 383.492 3.520 20 5 GHBDRP CC[C@H](C)COc1cc([N+](=O)[O-])c(C[NH+]2CCC(C[NH+](C)C)CC2)cc1OC ZINC000543843524 928490020 /nfs/dbraw/zinc/49/00/20/928490020.db2.gz TYLIEDGEMCMYPY-INIZCTEOSA-N 2 0 393.528 3.802 20 5 GHBDRP C[NH+](C)CCOc1cc(NC[C@@H](c2ccccc2)[NH+]2CCCC2)ccc1[N+](=O)[O-] ZINC001166911389 1027149762 /nfs/dbraw/zinc/14/97/62/1027149762.db2.gz UUUKUNKOBPVQSQ-NRFANRHFSA-N 2 0 398.507 3.784 20 5 GHBDRP [NH3+]C1CCC([NH2+]Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000843105317 1029812035 /nfs/dbraw/zinc/81/20/35/1029812035.db2.gz TZVPZRMBMHPOAI-UHFFFAOYSA-N 2 0 391.475 3.807 20 5 GHBDRP CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)C[C@@H]([NH3+])C(C)(C)C ZINC001219005265 1031207809 /nfs/dbraw/zinc/20/78/09/1031207809.db2.gz ITTNMWYKZWMDKD-LJQANCHMSA-N 2 0 380.492 3.659 20 5 GHBDRP C[NH+](C)CCN(C(=O)c1c2ccccc2cc2ccccc21)[C@H]1CCC[NH2+]C1 ZINC001161452996 1035233748 /nfs/dbraw/zinc/23/37/48/1035233748.db2.gz VVMSVZSEJAUJLM-FQEVSTJZSA-N 2 0 375.516 3.749 20 5 GHBDRP COc1ccc(C[C@@H](C)[N@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c([N+](=O)[O-])c1 ZINC001246936757 1037742122 /nfs/dbraw/zinc/74/21/22/1037742122.db2.gz JNIKNDPZRPLXAV-IAGOWNOFSA-N 2 0 375.513 3.779 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c1F ZINC001246936769 1037744037 /nfs/dbraw/zinc/74/40/37/1037744037.db2.gz JOUQOLLBFMWSAW-HZPDHXFCSA-N 2 0 393.503 3.918 20 5 GHBDRP Cc1cnc(CC[NH2+]CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)c(C)c1 ZINC001462383070 1070215058 /nfs/dbraw/zinc/21/50/58/1070215058.db2.gz MGPAGTMBSJCMKQ-UHFFFAOYSA-N 2 0 396.535 3.693 20 5 GHBDRP C[C@H](C[NH3+])C[N@H+](Cc1ccccc1)C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001254469984 1040257233 /nfs/dbraw/zinc/25/72/33/1040257233.db2.gz LANOQTLCCNOOQV-GOSISDBHSA-N 2 0 382.508 3.661 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH2+][C@@H]1CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]13)C2 ZINC001254581804 1040356292 /nfs/dbraw/zinc/35/62/92/1040356292.db2.gz MYUJIMMQZUMVMY-KPUOSGPGSA-N 2 0 377.488 3.562 20 5 GHBDRP CCc1ccc([C@@H](C[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)N(CC)CC)cc1 ZINC001474552172 1074459984 /nfs/dbraw/zinc/45/99/84/1074459984.db2.gz BITGAPSEVXLPAP-GZNCHQMQSA-N 2 0 385.512 3.730 20 5 GHBDRP C[C@H](CCC[NH3+])[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000415026132 839078113 /nfs/dbraw/zinc/07/81/13/839078113.db2.gz SNXOOBAQSANATR-LLVKDONJSA-N 2 0 382.258 3.834 20 5 GHBDRP [NH3+][C@H]1CCO[C@H](C2CC[NH+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)CC2)C1 ZINC000415129985 839256616 /nfs/dbraw/zinc/25/66/16/839256616.db2.gz WAKBNIKZWWDAMF-KKSFZXQISA-N 2 0 385.464 3.573 20 5 GHBDRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000599660935 861493446 /nfs/dbraw/zinc/49/34/46/861493446.db2.gz QNKFLEUONRXRTL-INIZCTEOSA-N 2 0 384.480 3.506 20 5 GHBDRP COc1ccc(C[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000513500103 845554212 /nfs/dbraw/zinc/55/42/12/845554212.db2.gz KOHOHUPCSFOWPY-YLJYHZDGSA-N 2 0 383.492 3.994 20 5 GHBDRP CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501056239 846587557 /nfs/dbraw/zinc/58/75/57/846587557.db2.gz YCHYWLQWDJXHHX-UHFFFAOYSA-N 2 0 384.480 3.737 20 5 GHBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000594968472 858349400 /nfs/dbraw/zinc/34/94/00/858349400.db2.gz HELHSGNJDFWNTQ-AQTBWJFISA-N 2 0 380.492 3.895 20 5 GHBDRP COc1ccc(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCC3)cc1[N+](=O)[O-] ZINC000595000167 858362803 /nfs/dbraw/zinc/36/28/03/858362803.db2.gz JPVQLUYAGZESEN-FQEVSTJZSA-N 2 0 395.503 3.995 20 5 GHBDRP CC[N@H+](C)Cc1cc(O[C@@H]2CC[NH+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)ccn1 ZINC000856585368 881556906 /nfs/dbraw/zinc/55/69/06/881556906.db2.gz CSIIUGMQCQLRHL-DYESRHJHSA-N 2 0 398.507 3.964 20 5 GHBDRP Cc1c(C[NH+]2CC[C@H](Oc3ccnc(C[N@@H+](C)C(C)C)c3)C2)cccc1[N+](=O)[O-] ZINC000856598329 881572226 /nfs/dbraw/zinc/57/22/26/881572226.db2.gz HOYMWNXTRPBPMC-NRFANRHFSA-N 2 0 398.507 3.792 20 5 GHBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1(SC)CC[NH+](C)CC1 ZINC000555003043 865319291 /nfs/dbraw/zinc/31/92/91/865319291.db2.gz RAKOMBKUXPHCCD-HNNXBMFYSA-N 2 0 383.583 3.883 20 5 GHBDRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000447506769 871718859 /nfs/dbraw/zinc/71/88/59/871718859.db2.gz DZKFOAZREYSMAV-PMACEKPBSA-N 2 0 385.512 3.907 20 5 GHBDRP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)n1 ZINC000447526778 871755793 /nfs/dbraw/zinc/75/57/93/871755793.db2.gz CPPYLMDJIGKULR-LEWJYISDSA-N 2 0 397.523 3.777 20 5 GHBDRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+]C[C@@H](O)c3ccc([N+](=O)[O-])cc3)cc2)C1 ZINC000776275678 876142586 /nfs/dbraw/zinc/14/25/86/876142586.db2.gz GUMRKYQUYHTNJI-IEGUWTFLSA-N 2 0 397.519 3.896 20 5 GHBDRP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000237721791 877879751 /nfs/dbraw/zinc/87/97/51/877879751.db2.gz GQRZOCJQWWROJN-UHFFFAOYSA-N 2 0 382.508 3.595 20 5 GHBDRP C[NH+](C)[C@H]1C[C@@H](C(=O)Nc2cc3oc4cc(=[NH2+])ccc-4nc3c3ccccc23)C1 ZINC001183376977 912490140 /nfs/dbraw/zinc/49/01/40/912490140.db2.gz ZATSTFVEYNFLDP-OTVXOJSOSA-N 2 0 386.455 3.844 20 5 GHBDRP COc1ccc(C[C@@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001170296676 881317235 /nfs/dbraw/zinc/31/72/35/881317235.db2.gz HMWATFKTFJGKCH-MJGOQNOKSA-N 2 0 383.492 3.646 20 5 GHBDRP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000237721648 884825809 /nfs/dbraw/zinc/82/58/09/884825809.db2.gz GOVKRBMNPYRHFQ-UHFFFAOYSA-N 2 0 382.508 3.595 20 5 GHBDRP Cc1ccc(C[NH2+]CCCC[NH+]2CCN(Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000237766400 884850228 /nfs/dbraw/zinc/85/02/28/884850228.db2.gz HMNGIAJMVZAPBS-UHFFFAOYSA-N 2 0 396.535 3.591 20 5 GHBDRP CCOc1ccc([C@H](C)[NH2+]CCCC[NH+]2C[C@@H](C)O[C@H](C)C2)cc1[N+](=O)[O-] ZINC000153323162 887653210 /nfs/dbraw/zinc/65/32/10/887653210.db2.gz RYYWDYXAZGXSRK-ZACQAIPSSA-N 2 0 379.501 3.534 20 5 GHBDRP CC(C)[N@H+](C)CC1CC[NH+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000533408697 890479976 /nfs/dbraw/zinc/47/99/76/890479976.db2.gz HELDTECARUWGPU-HNNXBMFYSA-N 2 0 387.484 3.758 20 5 GHBDRP [NH3+]CCC[C@@H]1CCCC[N@@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173014581 906092577 /nfs/dbraw/zinc/09/25/77/906092577.db2.gz STIIZWBQFUTQLF-HNNXBMFYSA-N 2 0 396.482 3.683 20 5 GHBDRP O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cc1 ZINC000781423394 930840533 /nfs/dbraw/zinc/84/05/33/930840533.db2.gz PSQXXILWLZKXGY-CWKRKGSWSA-N 2 0 395.503 3.519 20 5 GHBDRP CC[C@@H]1C[N@H+](CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)CCS1 ZINC001204769015 1033081073 /nfs/dbraw/zinc/08/10/73/1033081073.db2.gz PHXPHZCBFHNRSV-HXUWFJFHSA-N 2 0 377.554 3.677 20 5 GHBDRP Cc1cccc(NC[C@H]2C[N@H+](Cc3ccccc3)CC23CC[NH2+]CC3)c1[N+](=O)[O-] ZINC001162933510 1025971383 /nfs/dbraw/zinc/97/13/83/1025971383.db2.gz DBBTWEGRNJWFCJ-FQEVSTJZSA-N 2 0 394.519 3.817 20 5 GHBDRP CN(C(=O)[C@@H]([NH3+])Cc1c2ccccc2cc2ccccc21)[C@@H]1CCCC[C@H]1[NH3+] ZINC001161063813 1035130653 /nfs/dbraw/zinc/13/06/53/1035130653.db2.gz NFRPNTTUIGSHGL-XPWALMASSA-N 2 0 375.516 3.591 20 5 GHBDRP COc1ccc(C[C@@H](C)[N@@H+]2CCCC[C@]3(CCCC[NH2+]C3)C2)c([N+](=O)[O-])c1 ZINC001246601010 1037499145 /nfs/dbraw/zinc/49/91/45/1037499145.db2.gz FTLVCFPUGFIGSS-UTKZUKDTSA-N 2 0 375.513 3.780 20 5 GHBDRP CC(C)(C)C[NH+]1CCC(C[NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC001254469829 1040254826 /nfs/dbraw/zinc/25/48/26/1040254826.db2.gz HJVLXIHKXMPKRB-UHFFFAOYSA-N 2 0 388.556 3.911 20 5 GHBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCSCc1ccc(C[NH+](C)C)o1 ZINC001254532325 1040304202 /nfs/dbraw/zinc/30/42/02/1040304202.db2.gz MVEFEROVYSEZFF-OAHLLOKOSA-N 2 0 377.510 3.703 20 5 GHBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO ZINC000540988370 837509239 /nfs/dbraw/zinc/50/92/39/837509239.db2.gz KILNUELEASIVDD-UWJYYQICSA-N 2 0 383.492 3.711 20 5 GHBDRP C[N@H+](CCOc1ccccc1[N+](=O)[O-])CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000179390131 835669303 /nfs/dbraw/zinc/66/93/03/835669303.db2.gz GNXNQZKPQRKCIM-UHFFFAOYSA-N 2 0 384.480 3.607 20 5 GHBDRP C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000376389337 836915550 /nfs/dbraw/zinc/91/55/50/836915550.db2.gz VZXJTDXHQLOOPM-HNNXBMFYSA-N 2 0 385.468 3.514 20 5 GHBDRP C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000377992065 838259644 /nfs/dbraw/zinc/25/96/44/838259644.db2.gz BZCYMMPPRGIGHG-GOSISDBHSA-N 2 0 388.556 3.784 20 5 GHBDRP COc1ccc(C[NH2+]C[C@H]2CCC[C@@H]([NH3+])C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414993789 839040156 /nfs/dbraw/zinc/04/01/56/839040156.db2.gz CQMVSGFSJBBMPD-PKOBYXMFSA-N 2 0 399.491 3.790 20 5 GHBDRP [NH3+][C@@H]1CCO[C@@H](C2CC[NH+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)CC2)C1 ZINC000415129984 839257012 /nfs/dbraw/zinc/25/70/12/839257012.db2.gz WAKBNIKZWWDAMF-IIBYNOLFSA-N 2 0 385.464 3.573 20 5 GHBDRP CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[NH+]2CCC(C[NH+](C)C)CC2)cc1OC ZINC000543843525 839313049 /nfs/dbraw/zinc/31/30/49/839313049.db2.gz TYLIEDGEMCMYPY-MRXNPFEDSA-N 2 0 393.528 3.802 20 5 GHBDRP CC[NH+](CC)C[C@H]1CCCC[C@H]1[NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000482140548 842031728 /nfs/dbraw/zinc/03/17/28/842031728.db2.gz WPZYJNWCZJNVNC-IEBWSBKVSA-N 2 0 390.528 3.722 20 5 GHBDRP COc1cccc([C@@H](CNc2cc(C)[nH+]c3ccc([N+](=O)[O-])cc23)[NH+](C)C)c1 ZINC000891502413 842211231 /nfs/dbraw/zinc/21/12/31/842211231.db2.gz WMIGYOLMLBPEPZ-OAQYLSRUSA-N 2 0 380.448 3.597 20 5 GHBDRP Cc1ccc([C@H](C)[NH2+]CC2(N)CC[NH+](Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000423540649 849974351 /nfs/dbraw/zinc/97/43/51/849974351.db2.gz AALKFLVQGMQQMM-SFHVURJKSA-N 2 0 382.508 3.547 20 5 GHBDRP C[C@H]([NH3+])[C@@H]1CC[N@H+](Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000435381040 850446680 /nfs/dbraw/zinc/44/66/80/850446680.db2.gz UTMRAXUWASILQJ-FUHWJXTLSA-N 2 0 391.475 3.617 20 5 GHBDRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000025702571 853689277 /nfs/dbraw/zinc/68/92/77/853689277.db2.gz UVHHQUADGXZZGM-MRXNPFEDSA-N 2 0 384.480 3.553 20 5 GHBDRP O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2C[NH2+][C@H]2CCC[NH2+]CC2)cc1 ZINC000591278626 855880140 /nfs/dbraw/zinc/88/01/40/855880140.db2.gz ZYZXCDNFWZMXFO-IBGZPJMESA-N 2 0 391.475 3.679 20 5 GHBDRP COc1ccc(C[N@@H+]2CCC[C@@H]([C@H](C)[NH3+])C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000592427683 857403490 /nfs/dbraw/zinc/40/34/90/857403490.db2.gz PVVWXYAEQXLWNC-QFBILLFUSA-N 2 0 399.491 3.742 20 5 GHBDRP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CC3CC[NH+](C4CCOCC4)CC3)o2)cc1 ZINC000594953836 858344279 /nfs/dbraw/zinc/34/42/79/858344279.db2.gz IQOCBIYSUQSNJE-UHFFFAOYSA-N 2 0 399.491 3.835 20 5 GHBDRP CC[C@@H]([NH2+]Cc1ccccc1CN1CC[NH+](CC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000160353968 858828806 /nfs/dbraw/zinc/82/88/06/858828806.db2.gz XAVKFPUFIVRHQV-HSZRJFAPSA-N 2 0 396.535 3.973 20 5 GHBDRP C[NH+](C)CCC[C@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCO1 ZINC000597248481 859392370 /nfs/dbraw/zinc/39/23/70/859392370.db2.gz XQUWZEOIZVSTOC-SFHVURJKSA-N 2 0 389.521 3.866 20 5 GHBDRP COc1ccc(C[C@@H](C)[N@@H+]2CCCC[C@@H]2C[C@@H]2CCC[NH+]2C)c([N+](=O)[O-])c1 ZINC001170351674 881495483 /nfs/dbraw/zinc/49/54/83/881495483.db2.gz HETDSXLYDGQXPF-NZSAHSFTSA-N 2 0 375.513 3.873 20 5 GHBDRP COc1cc(CN[C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)c([N+](=O)[O-])cc1F ZINC000481188149 865966523 /nfs/dbraw/zinc/96/65/23/865966523.db2.gz HNWSJKXHRCOLBQ-BEFAXECRSA-N 2 0 387.455 3.743 20 5 GHBDRP O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)n1 ZINC000447526781 871755693 /nfs/dbraw/zinc/75/56/93/871755693.db2.gz CPPYLMDJIGKULR-SFTDATJTSA-N 2 0 397.523 3.777 20 5 GHBDRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776276562 876149257 /nfs/dbraw/zinc/14/92/57/876149257.db2.gz KNXOLIXRYBPBRX-VGSWGCGISA-N 2 0 383.492 3.792 20 5 GHBDRP O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCCC[N@H+]2CCC[C@@H]2CO)s1 ZINC000111386074 879081503 /nfs/dbraw/zinc/08/15/03/879081503.db2.gz RSMHEVZHBLGAAL-MRXNPFEDSA-N 2 0 389.521 3.650 20 5 GHBDRP COc1ccc(C[C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c([N+](=O)[O-])c1 ZINC001170300407 881321127 /nfs/dbraw/zinc/32/11/27/881321127.db2.gz ZUVQODGPDVXSRK-KRWDZBQOSA-N 2 0 383.492 3.920 20 5 GHBDRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000495439876 885809028 /nfs/dbraw/zinc/80/90/28/885809028.db2.gz OHEBYJSILKLTFX-MAUKXSAKSA-N 2 0 383.920 3.517 20 5 GHBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cccc(CN2CCO[C@H](C)C2)c1 ZINC000153481010 885817667 /nfs/dbraw/zinc/81/76/67/885817667.db2.gz RTCGHNFORIFUGY-QZTJIDSGSA-N 2 0 383.492 3.975 20 5 GHBDRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]C3CC(n4cc([N+](=O)[O-])cn4)C3)cc2)C1 ZINC000876930917 893393720 /nfs/dbraw/zinc/39/37/20/893393720.db2.gz GYFZFONGLOGTSF-DZIBYMRMSA-N 2 0 383.496 3.517 20 5 GHBDRP [NH3+]C[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC12CCOCC2 ZINC000563135594 893397306 /nfs/dbraw/zinc/39/73/06/893397306.db2.gz RJWJJZVCJMVWRA-INIZCTEOSA-N 2 0 387.505 3.511 20 5 GHBDRP O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)c1 ZINC000819323716 896567873 /nfs/dbraw/zinc/56/78/73/896567873.db2.gz PJJKXZMTKFNWPO-UGKGYDQZSA-N 2 0 383.492 3.520 20 5 GHBDRP O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000567367237 897096183 /nfs/dbraw/zinc/09/61/83/897096183.db2.gz YXGZDHSDZWXUAI-NRFANRHFSA-N 2 0 381.476 3.847 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]CCC[N@H+]2C[C@H](C)C[C@H](C)C2)c1F ZINC001173176057 906252262 /nfs/dbraw/zinc/25/22/62/906252262.db2.gz GGGVLSQCBDAEDA-OWCLPIDISA-N 2 0 381.492 3.631 20 5 GHBDRP CSC[C@@H]1CCC[N@H+](CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001182043965 911146290 /nfs/dbraw/zinc/14/62/90/911146290.db2.gz RCJGAVRKPJIEIT-HXUWFJFHSA-N 2 0 391.581 3.924 20 5 GHBDRP CCOc1ccc([C@H](C)[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1[N+](=O)[O-] ZINC000902504033 922244687 /nfs/dbraw/zinc/24/46/87/922244687.db2.gz VQEIDLGKOOQBFP-QXATTWAWSA-N 2 0 397.475 3.900 20 5 GHBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(C[NH+]2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000470185968 930440064 /nfs/dbraw/zinc/44/00/64/930440064.db2.gz NLXDRUGNGGJODM-XLTVWXTISA-N 2 0 387.524 3.819 20 5 GHBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1 ZINC000468628544 1015858402 /nfs/dbraw/zinc/85/84/02/1015858402.db2.gz REYUWFNQGHDDJZ-CYVLTUHYSA-N 2 0 386.540 3.538 20 5 GHBDRP CCOc1ccc([N+](=O)[O-])cc1CNC[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001461119410 1069399505 /nfs/dbraw/zinc/39/95/05/1069399505.db2.gz FUTGMNDIXMKRDN-LJQANCHMSA-N 2 0 383.492 3.995 20 5 GHBDRP O=[N+]([O-])c1ccc(N2CCC([NH2+][C@H](c3ccccc3)C3CC[NH2+]CC3)CC2)cc1 ZINC001246249211 1037253978 /nfs/dbraw/zinc/25/39/78/1037253978.db2.gz HSVBJJZTYAZXCK-HSZRJFAPSA-N 2 0 394.519 3.894 20 5 GHBDRP COc1ccccc1CC1(C[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])CC[NH2+]CC1 ZINC001246419639 1037375711 /nfs/dbraw/zinc/37/57/11/1037375711.db2.gz HORBNUSHOGGLDJ-SFHVURJKSA-N 2 0 397.519 3.737 20 5 GHBDRP CC[C@@H]1C[C@H]([NH2+]CCCNC(=O)c2c3ccccc3nc3ccccc32)CC[NH2+]1 ZINC001246485483 1037432077 /nfs/dbraw/zinc/43/20/77/1037432077.db2.gz UUZGAYUHSKYKRD-QZTJIDSGSA-N 2 0 390.531 3.628 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@H+](Cc1ccc(Cl)cc1)C1CC[NH2+]CC1)C2 ZINC001246945061 1037749635 /nfs/dbraw/zinc/74/96/35/1037749635.db2.gz FKDCXVGPALILMM-NRFANRHFSA-N 2 0 385.895 3.970 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH2+]CCC1CC[NH+](Cc3ccccc3)CC1)C2 ZINC001254565714 1040341643 /nfs/dbraw/zinc/34/16/43/1040341643.db2.gz FYPTZCLTMNCLQM-JOCHJYFZSA-N 2 0 379.504 3.954 20 5 GHBDRP [NH3+][C@@H]1CCCO[C@H]1C1CC[NH+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000415133188 839261329 /nfs/dbraw/zinc/26/13/29/839261329.db2.gz UYGSRQATBCJPAS-CTNGQTDRSA-N 2 0 385.464 3.573 20 5 GHBDRP O=[N+]([O-])c1ccc(OCCC[NH+]2CCC(C[NH+]3CCCCCC3)CC2)cc1 ZINC000604012296 861574987 /nfs/dbraw/zinc/57/49/87/861574987.db2.gz TUIGWVMKSREQOY-UHFFFAOYSA-N 2 0 375.513 3.952 20 5 GHBDRP C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000538946586 845749577 /nfs/dbraw/zinc/74/95/77/845749577.db2.gz BRTXNFAJGARCQR-UHFFFAOYSA-N 2 0 384.480 3.607 20 5 GHBDRP COc1cc(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000489186525 852099358 /nfs/dbraw/zinc/09/93/58/852099358.db2.gz TWPXFEVKXRJCPA-UHFFFAOYSA-N 2 0 383.492 3.947 20 5 GHBDRP COc1cc(C[NH2+]C[C@H]2CCC[N@H+](C)C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000108429130 853065420 /nfs/dbraw/zinc/06/54/20/853065420.db2.gz JYPCGWDYAXMABY-LJQANCHMSA-N 2 0 399.491 3.614 20 5 GHBDRP COc1ccc(-c2ccc(C[NH+]3CCC([C@H]4CCC[NH2+]4)CC3)o2)c([N+](=O)[O-])c1 ZINC000573801718 856485473 /nfs/dbraw/zinc/48/54/73/856485473.db2.gz KMHMETJFQRCLHY-LJQANCHMSA-N 2 0 385.464 3.827 20 5 GHBDRP CCC[C@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000595068526 858370842 /nfs/dbraw/zinc/37/08/42/858370842.db2.gz IKQGWYFAAARDJG-YADHBBJMSA-N 2 0 383.492 3.792 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CC1CC[NH+](C3CCOCC3)CC1)CCCC2 ZINC000595048274 858379123 /nfs/dbraw/zinc/37/91/23/858379123.db2.gz JESHFQKYRGNPSH-JOCHJYFZSA-N 2 0 387.524 3.843 20 5 GHBDRP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCCC[N@@H+]2Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000593323746 859406968 /nfs/dbraw/zinc/40/69/68/859406968.db2.gz WGYPKTRQAMNELW-LKUPVBHCSA-N 2 0 385.464 3.716 20 5 GHBDRP COc1cc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c([N+](=O)[O-])cc1OC ZINC000093769316 860344954 /nfs/dbraw/zinc/34/49/54/860344954.db2.gz ISHZOUYFVUKPLY-UHFFFAOYSA-N 2 0 391.512 3.700 20 5 GHBDRP COc1cc(CN[C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)c([N+](=O)[O-])cc1F ZINC000481188155 865965954 /nfs/dbraw/zinc/96/59/54/865965954.db2.gz HNWSJKXHRCOLBQ-KXBFYZLASA-N 2 0 387.455 3.743 20 5 GHBDRP COc1cc(CN[C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)c([N+](=O)[O-])cc1F ZINC000481188151 865966106 /nfs/dbraw/zinc/96/61/06/865966106.db2.gz HNWSJKXHRCOLBQ-DNVCBOLYSA-N 2 0 387.455 3.743 20 5 GHBDRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000447531432 871788805 /nfs/dbraw/zinc/78/88/05/871788805.db2.gz RCFKDCBBQGFOJV-UXHICEINSA-N 2 0 385.512 3.907 20 5 GHBDRP CC1CC[NH+](C[C@H]2CCC[N@H+](CCCOc3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000498894304 886042441 /nfs/dbraw/zinc/04/24/41/886042441.db2.gz ULQUSZQIEOPXMZ-IBGZPJMESA-N 2 0 375.513 3.808 20 5 GHBDRP O=[N+]([O-])c1cnn(C2CC([NH2+]Cc3ccccc3C[NH+]3CCCCCC3)C2)c1 ZINC000877035640 893450577 /nfs/dbraw/zinc/45/05/77/893450577.db2.gz JLEWZXRUZNQCJP-UHFFFAOYSA-N 2 0 383.496 3.661 20 5 GHBDRP CC(C)c1ccc(C[NH+]2CCC(C)(C[NH+]3CCN(C)CC3)CC2)cc1[N+](=O)[O-] ZINC000332135197 899425456 /nfs/dbraw/zinc/42/54/56/899425456.db2.gz PLNJNHRRHLOZGG-UHFFFAOYSA-N 2 0 388.556 3.568 20 5 GHBDRP CC[NH+](CC)CCC[C@@H](C)[NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173009751 906084532 /nfs/dbraw/zinc/08/45/32/906084532.db2.gz BHCZQCCHAAYQEI-OAHLLOKOSA-N 2 0 398.498 3.942 20 5 GHBDRP C[NH+]1CCC(CCC[NH2+]C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC1 ZINC001173009150 906084616 /nfs/dbraw/zinc/08/46/16/906084616.db2.gz TVJDFYHGIPRCKQ-UHFFFAOYSA-N 2 0 396.482 3.553 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]C2CC[NH+](CC(C)(C)C)CC2)c1F ZINC001173178468 906257179 /nfs/dbraw/zinc/25/71/79/906257179.db2.gz HRQIGJISAFBPEK-CQSZACIVSA-N 2 0 381.492 3.774 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)c1F ZINC001173180878 906259931 /nfs/dbraw/zinc/25/99/31/906259931.db2.gz YVOOKBICEOQMFX-AWEZNQCLSA-N 2 0 375.444 3.525 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+](CC(C)C)[C@H]2CC[C@H]([NH3+])CC2)c1F ZINC001173181454 906261562 /nfs/dbraw/zinc/26/15/62/906261562.db2.gz WMEWNSBCNFSXAF-BZUAXINKSA-N 2 0 381.492 3.901 20 5 GHBDRP COc1cccc(CC2([NH3+])CC[NH+]([C@H](C)Cc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC001173220555 906297919 /nfs/dbraw/zinc/29/79/19/906297919.db2.gz CWZRMXOTHJXOQG-QGZVFWFLSA-N 2 0 383.492 3.570 20 5 GHBDRP CSC[C@H]1CCC[N@H+](CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001182043963 911145882 /nfs/dbraw/zinc/14/58/82/911145882.db2.gz RCJGAVRKPJIEIT-FQEVSTJZSA-N 2 0 391.581 3.924 20 5 GHBDRP C[C@@H]([NH2+]CCCC[NH+]1CCN(Cc2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000467835851 929485807 /nfs/dbraw/zinc/48/58/07/929485807.db2.gz AELHYDHKXUZALP-HXUWFJFHSA-N 2 0 396.535 3.843 20 5 GHBDRP C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C1CCC(C)([NH+]2CCCC2)CC1 ZINC001207581510 1034462761 /nfs/dbraw/zinc/46/27/61/1034462761.db2.gz OQROTNZRBWYILV-AFJQURTJSA-N 2 0 388.512 3.699 20 5 GHBDRP CC1(C)CCC[C@H](C[NH2+]CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)O1 ZINC001207735460 1034547610 /nfs/dbraw/zinc/54/76/10/1034547610.db2.gz GOXGCKCZKIFXAY-OAQYLSRUSA-N 2 0 389.540 3.787 20 5 GHBDRP CSCC[C@@H](C)[N@H+](C)CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001461905922 1069865788 /nfs/dbraw/zinc/86/57/88/1069865788.db2.gz UEQHKNBNPMCTTJ-QGZVFWFLSA-N 2 0 379.570 3.923 20 5 GHBDRP Cc1cc(Nc2ccc3cc4ccc(N)cc4[nH+]c3c2)cnc1N1CC[NH2+]CC1 ZINC001159700125 1034716442 /nfs/dbraw/zinc/71/64/42/1034716442.db2.gz FFBHWTUTQWXFCG-UHFFFAOYSA-N 2 0 384.487 3.827 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]C1(Cc3ccccc3F)CC[NH2+]CC1)CC2 ZINC001246380984 1037338436 /nfs/dbraw/zinc/33/84/36/1037338436.db2.gz MAAYEHYLASXQBC-HXUWFJFHSA-N 2 0 397.494 3.936 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH2+]CC1(Cc3ccc(Cl)cc3)CC[NH2+]CC1)C2 ZINC001246418018 1037374724 /nfs/dbraw/zinc/37/47/24/1037374724.db2.gz YLZHBAODJBPJCE-FQEVSTJZSA-N 2 0 399.922 3.918 20 5 GHBDRP CC[C@H]([NH2+]CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1)[C@H]1CCCCO1 ZINC001462384944 1070217139 /nfs/dbraw/zinc/21/71/39/1070217139.db2.gz VHLZQDXBJPYEFB-FCHUYYIVSA-N 2 0 389.540 3.787 20 5 GHBDRP CC[C@H]([NH2+]CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1)[C@@H]1CCCCO1 ZINC001462384953 1070217532 /nfs/dbraw/zinc/21/75/32/1070217532.db2.gz VHLZQDXBJPYEFB-VXKWHMMOSA-N 2 0 389.540 3.787 20 5 GHBDRP CCOc1ccc([C@@H](C)[NH2+]Cc2ccccc2N2CC[NH+](C)CC2)cc1[N+](=O)[O-] ZINC001253957153 1039922248 /nfs/dbraw/zinc/92/22/48/1039922248.db2.gz WBROAUPVVZYPHO-QGZVFWFLSA-N 2 0 398.507 3.596 20 5 GHBDRP O=[N+]([O-])c1ccc(N2CCC([NH2+]C3CC[NH+](C[C@@H]4CC=CCC4)CC3)CC2)cc1 ZINC001254476637 1040264438 /nfs/dbraw/zinc/26/44/38/1040264438.db2.gz VADAZQZYKSSIMB-LJQANCHMSA-N 2 0 398.551 3.974 20 5 GHBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]([C@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001254561838 1040334035 /nfs/dbraw/zinc/33/40/35/1040334035.db2.gz MIRNBCRAIPXNBC-FUHWJXTLSA-N 2 0 375.513 3.537 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH+]1CCC3(C[NH+](Cc4ccccc4)C3)CC1)C2 ZINC001254609819 1040382024 /nfs/dbraw/zinc/38/20/24/1040382024.db2.gz YUHWPPGWMGPRCT-QFIPXVFZSA-N 2 0 377.488 3.660 20 5 GHBDRP O=[N+]([O-])c1cccc([C@H](O)C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC001326597213 1057519948 /nfs/dbraw/zinc/51/99/48/1057519948.db2.gz SWQRZAONCZVBKI-ZYJGPIPZSA-N 2 0 395.503 3.804 20 5 GHBDRP CC[C@H]([NH2+]CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1)[C@H]1CCCOC1 ZINC001474681875 1074511676 /nfs/dbraw/zinc/51/16/76/1074511676.db2.gz DTVNLPVBRHUJFL-UNMCSNQZSA-N 2 0 389.540 3.644 20 5 GHBDRP O=[N+]([O-])c1ccccc1C[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000176984732 837831575 /nfs/dbraw/zinc/83/15/75/837831575.db2.gz GVLLTBSFKPTNCP-UHFFFAOYSA-N 2 0 383.492 3.756 20 5 GHBDRP C[C@H]1C[C@@H]([NH2+]Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)CC[NH2+]1 ZINC000414957700 839006300 /nfs/dbraw/zinc/00/63/00/839006300.db2.gz WHYUEUFZTZSPOV-LPHOPBHVSA-N 2 0 391.475 3.678 20 5 GHBDRP C[C@H]1C[C@H]([NH2+]Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)CC[NH2+]1 ZINC000414957702 839006700 /nfs/dbraw/zinc/00/67/00/839006700.db2.gz WHYUEUFZTZSPOV-QFBILLFUSA-N 2 0 391.475 3.678 20 5 GHBDRP COc1ccc(C[N@@H+]2CC[C@H](C)[C@H](C[NH3+])C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000415125847 839235125 /nfs/dbraw/zinc/23/51/25/839235125.db2.gz LLJQAVDODLNDDB-QFBILLFUSA-N 2 0 399.491 3.599 20 5 GHBDRP CC(C)CC[NH+]1CCC(C[NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000175990727 842686567 /nfs/dbraw/zinc/68/65/67/842686567.db2.gz UUIZZKXGHRERNC-UHFFFAOYSA-N 2 0 399.539 3.843 20 5 GHBDRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1ccccc1O2 ZINC000540495184 846770852 /nfs/dbraw/zinc/77/08/52/846770852.db2.gz JPWCNMATLXSSBK-HXUWFJFHSA-N 2 0 397.475 3.551 20 5 GHBDRP CC[N+](C)(C)Cc1ccccc1NC1(C(=O)OC(C)(C)C)CCC([NH3+])CC1 ZINC001167643149 848790098 /nfs/dbraw/zinc/79/00/98/848790098.db2.gz ONQGGEHPDOOWMP-UHFFFAOYSA-N 2 0 376.565 3.677 20 5 GHBDRP CC[C@H]([NH2+]CC1(N)CC[NH+](Cc2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000423580925 849987890 /nfs/dbraw/zinc/98/78/90/849987890.db2.gz YNFHVFMCIQKFKI-NRFANRHFSA-N 2 0 382.508 3.629 20 5 GHBDRP C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(CC[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000426782153 852387504 /nfs/dbraw/zinc/38/75/04/852387504.db2.gz FWEZGMKGOLWBNB-KZNAEPCWSA-N 2 0 375.513 3.867 20 5 GHBDRP Cc1c(C[NH+]2CCC(CC[NH+]3C[C@H](C)O[C@@H](C)C3)CC2)cccc1[N+](=O)[O-] ZINC000426827510 852442297 /nfs/dbraw/zinc/44/22/97/852442297.db2.gz SHLOVMHTSKGNOC-IRXDYDNUSA-N 2 0 375.513 3.615 20 5 GHBDRP CCC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1cccc([N+](=O)[O-])c1 ZINC000248432677 856173835 /nfs/dbraw/zinc/17/38/35/856173835.db2.gz CPDKOLPGKHKOKJ-FGZHOGPDSA-N 2 0 383.492 3.792 20 5 GHBDRP Cn1cc(C[NH2+]CCCCC[NH+]2CCCCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000113344024 857439328 /nfs/dbraw/zinc/43/93/28/857439328.db2.gz DNQCYVPAHZRTBO-UHFFFAOYSA-N 2 0 385.512 3.741 20 5 GHBDRP CCC[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000595068524 858370577 /nfs/dbraw/zinc/37/05/77/858370577.db2.gz IKQGWYFAAARDJG-FGZHOGPDSA-N 2 0 383.492 3.792 20 5 GHBDRP COc1ccc(C[C@@H](C)[N@H+](Cc2cccnc2)[C@H]2CC[C@H]([NH3+])CC2)c([N+](=O)[O-])c1 ZINC001170322386 881358936 /nfs/dbraw/zinc/35/89/36/881358936.db2.gz FNAJXJBYFGINMB-NSISKUIASA-N 2 0 398.507 3.702 20 5 GHBDRP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCCC[N@@H+]2Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000593316307 859388911 /nfs/dbraw/zinc/38/89/11/859388911.db2.gz BQDCKWGVZDPCSI-LKUPVBHCSA-N 2 0 385.464 3.716 20 5 GHBDRP C[C@@H]([NH2+]CCCC[NH+]1CCN(Cc2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000481322298 861091285 /nfs/dbraw/zinc/09/12/85/861091285.db2.gz ZTCBBMFXARQVRP-HXUWFJFHSA-N 2 0 396.535 3.843 20 5 GHBDRP COc1cc(C[NH2+]CC2=CC[N@H+](C)CC2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000539548307 869328163 /nfs/dbraw/zinc/32/81/63/869328163.db2.gz YGCXSPNKGBYWOE-UHFFFAOYSA-N 2 0 397.475 3.534 20 5 GHBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO ZINC000540988368 872683006 /nfs/dbraw/zinc/68/30/06/872683006.db2.gz KILNUELEASIVDD-UTKZUKDTSA-N 2 0 383.492 3.711 20 5 GHBDRP CC[N@H+](CCC1CC[NH+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1)CC(C)C ZINC000776606137 878478651 /nfs/dbraw/zinc/47/86/51/878478651.db2.gz SCBRPVQZFFWKTH-OAQYLSRUSA-N 2 0 377.529 3.708 20 5 GHBDRP O=[N+]([O-])c1ccc([C@H](O)C[NH2+]Cc2ccccc2C[NH+]2CCCCCC2)cc1 ZINC000819059207 896346351 /nfs/dbraw/zinc/34/63/51/896346351.db2.gz JBHCKAOFNHCIBD-JOCHJYFZSA-N 2 0 383.492 3.794 20 5 GHBDRP O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000819323614 896568196 /nfs/dbraw/zinc/56/81/96/896568196.db2.gz NMSCPUDHDKTVLB-UGKGYDQZSA-N 2 0 383.492 3.520 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+](Cc2ccccc2)C[C@H](C)C[NH3+])c1F ZINC001173181504 906261111 /nfs/dbraw/zinc/26/11/11/906261111.db2.gz FDCIDBGQDLDMTM-CVEARBPZSA-N 2 0 389.471 3.771 20 5 GHBDRP COc1cccc(CC2([NH3+])CC[NH+]([C@@H](C)Cc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC001173220549 906297507 /nfs/dbraw/zinc/29/75/07/906297507.db2.gz CWZRMXOTHJXOQG-KRWDZBQOSA-N 2 0 383.492 3.570 20 5 GHBDRP Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)cc1[N+](=O)[O-] ZINC000182228669 907164059 /nfs/dbraw/zinc/16/40/59/907164059.db2.gz PVKAOLXDCZFAAU-DYESRHJHSA-N 2 0 383.492 3.711 20 5 GHBDRP C[C@]1(CC[NH2+]CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)CC1(F)F ZINC001182940974 912146824 /nfs/dbraw/zinc/14/68/24/912146824.db2.gz GIEFHKYSGQNPRP-IBGZPJMESA-N 2 0 381.467 3.874 20 5 GHBDRP Cc1cccc(C[N@H+](C)CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC001206299848 1033786735 /nfs/dbraw/zinc/78/67/35/1033786735.db2.gz HAZPAFDQSLRTFO-UHFFFAOYSA-N 2 0 382.508 3.685 20 5 GHBDRP Cc1cc(C)c([N+](=O)[O-])c(-n2cc(CC[NH+]3CCC([NH3+])CC3)c3ccccc32)n1 ZINC001159461707 1034608020 /nfs/dbraw/zinc/60/80/20/1034608020.db2.gz ZBMHXBPWBGIXDC-UHFFFAOYSA-N 2 0 393.491 3.516 20 5 GHBDRP COc1ccc2c(c1)C1(C[C@@H]2[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])CC[NH2+]CC1 ZINC001246131302 1037208052 /nfs/dbraw/zinc/20/80/52/1037208052.db2.gz XHXZYMKWKXPHSI-IERDGZPVSA-N 2 0 395.503 3.890 20 5 GHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CC2(CC[NH2+]CC2)Oc2ccccc21 ZINC001246138548 1037211603 /nfs/dbraw/zinc/21/16/03/1037211603.db2.gz YQONFAHEZVECIG-UZLBHIALSA-N 2 0 381.476 3.761 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]C2CCC3(CC[NH2+]CC3)CC2)c1F ZINC001246255401 1037256291 /nfs/dbraw/zinc/25/62/91/1037256291.db2.gz JRJUFFCQDBEDLZ-CQSZACIVSA-N 2 0 379.476 3.576 20 5 GHBDRP COc1ccc(C[C@@H](C)[NH2+][C@H]2CC3(CC[NH2+]CC3)c3ccccc32)c([N+](=O)[O-])c1 ZINC001246259110 1037258984 /nfs/dbraw/zinc/25/89/84/1037258984.db2.gz ZFRNSKGRCWPLED-IERDGZPVSA-N 2 0 395.503 3.890 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH2+]CC1(Cc3cccc(Cl)c3)CC[NH2+]CC1)C2 ZINC001246424690 1037382099 /nfs/dbraw/zinc/38/20/99/1037382099.db2.gz HJGHEPHRBBPTRS-HXUWFJFHSA-N 2 0 399.922 3.918 20 5 GHBDRP CC(C)[N@H+](C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1)[C@@H]1CCC[NH2+]CC1 ZINC001246592605 1037491646 /nfs/dbraw/zinc/49/16/46/1037491646.db2.gz KQNYRIPCWHUYDK-OAHLLOKOSA-N 2 0 396.482 3.694 20 5 GHBDRP Cc1ccc(F)cc1C[N@H+]([C@H]1Cc2ccc([N+](=O)[O-])cc2C1)C1CC[NH2+]CC1 ZINC001246953780 1037761974 /nfs/dbraw/zinc/76/19/74/1037761974.db2.gz CYTFREHMLCRDFP-QFIPXVFZSA-N 2 0 383.467 3.764 20 5 GHBDRP COc1cccc2c1C[N@H+](CC1CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC1)C2 ZINC001462509731 1070312851 /nfs/dbraw/zinc/31/28/51/1070312851.db2.gz PVKFKXAILTXCAA-UHFFFAOYSA-N 2 0 395.503 3.874 20 5 GHBDRP O=[N+]([O-])c1cccc(N2CC[NH+](Cc3ccc(C[NH+]4CCCCC4)cc3)CC2)c1 ZINC001307415378 1049255531 /nfs/dbraw/zinc/25/55/31/1049255531.db2.gz NKPLZQGIXFPGIE-UHFFFAOYSA-N 2 0 394.519 3.903 20 5 GHBDRP CC1(C)CO[C@@H](CC[NH2+]CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001308937624 1050198227 /nfs/dbraw/zinc/19/82/27/1050198227.db2.gz TYSAMUJLBQPCFS-NRFANRHFSA-N 2 0 389.540 3.644 20 5 GHBDRP C[C@H]([NH2+]CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1)c1cccc(O)c1 ZINC001474480323 1074425634 /nfs/dbraw/zinc/42/56/34/1074425634.db2.gz GHZAAMJZJWUNLG-KRWDZBQOSA-N 2 0 383.492 3.906 20 5 GHBDRP CC(C)c1ccc(C[NH2+]CC2(O)CC[NH+](Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000414554395 838622816 /nfs/dbraw/zinc/62/28/16/838622816.db2.gz VELMPZURLOCQPI-UHFFFAOYSA-N 2 0 397.519 3.835 20 5 GHBDRP O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]CCC[NH2+]C2CC2)cc1 ZINC000415064874 839142617 /nfs/dbraw/zinc/14/26/17/839142617.db2.gz FBPZJAJLQFKZMC-UHFFFAOYSA-N 2 0 391.475 3.679 20 5 GHBDRP CC[N@H+](C)Cc1cccc(C[NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000124009538 840599451 /nfs/dbraw/zinc/59/94/51/840599451.db2.gz HFRCRMOTRMUJDQ-UHFFFAOYSA-N 2 0 382.508 3.805 20 5 GHBDRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000105449166 841267260 /nfs/dbraw/zinc/26/72/60/841267260.db2.gz XTGFVDGBDKVXOG-UHFFFAOYSA-N 2 0 393.491 3.737 20 5 GHBDRP CSC1(C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CC[NH+](C)CC1 ZINC000582815082 848456068 /nfs/dbraw/zinc/45/60/68/848456068.db2.gz AEFCYQPTJBAASG-WMZOPIPTSA-N 2 0 377.554 3.723 20 5 GHBDRP C[C@H]1C[C@H](C[NH3+])C[N@@H+]1Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000435374818 850421774 /nfs/dbraw/zinc/42/17/74/850421774.db2.gz YSJPSFPVNYTJNK-DLBZAZTESA-N 2 0 391.475 3.617 20 5 GHBDRP C[C@@H]1C[C@@H](C[NH3+])C[N@@H+]1Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000435374821 850422148 /nfs/dbraw/zinc/42/21/48/850422148.db2.gz YSJPSFPVNYTJNK-SJORKVTESA-N 2 0 391.475 3.617 20 5 GHBDRP C[NH2+]CC1CC[NH+](Cc2ccc(OCc3ccc([N+](=O)[O-])cc3)c(OC)c2)CC1 ZINC000435384403 850449354 /nfs/dbraw/zinc/44/93/54/850449354.db2.gz MPQARBABNGNKQK-UHFFFAOYSA-N 2 0 399.491 3.614 20 5 GHBDRP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]C[C@@H]2CCC[N@@H+]2C2CCCCC2)n1 ZINC000436287981 851421674 /nfs/dbraw/zinc/42/16/74/851421674.db2.gz DKEBMRHDZIOESR-IPMKNSEASA-N 2 0 375.517 3.662 20 5 GHBDRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000173327167 856858844 /nfs/dbraw/zinc/85/88/44/856858844.db2.gz KXHHRBSZFMGVIK-GOSISDBHSA-N 2 0 382.508 3.583 20 5 GHBDRP C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000173389284 856902042 /nfs/dbraw/zinc/90/20/42/856902042.db2.gz NCYIXRQJHYZPJE-JKSUJKDBSA-N 2 0 386.471 3.898 20 5 GHBDRP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000595019533 858352314 /nfs/dbraw/zinc/35/23/14/858352314.db2.gz QOCJOHOKOJSENK-KRWDZBQOSA-N 2 0 399.491 3.929 20 5 GHBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000595066683 858369322 /nfs/dbraw/zinc/36/93/22/858369322.db2.gz LYGIYIRGYGODQX-GOSISDBHSA-N 2 0 382.508 3.813 20 5 GHBDRP CC1(C)C[C@@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)c2cc([N+](=O)[O-])ccc21 ZINC000595048366 858379428 /nfs/dbraw/zinc/37/94/28/858379428.db2.gz KNVBGBFQXOOCGM-OAQYLSRUSA-N 2 0 387.524 3.798 20 5 GHBDRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000447531433 871789059 /nfs/dbraw/zinc/78/90/59/871789059.db2.gz RCFKDCBBQGFOJV-VQTJNVASSA-N 2 0 385.512 3.907 20 5 GHBDRP CC1CC[NH+](Cc2ccc(C[NH2+]C[C@H](O)c3ccc([N+](=O)[O-])cc3)cc2)CC1 ZINC000776278247 876161742 /nfs/dbraw/zinc/16/17/42/876161742.db2.gz SQDWDRMMDVVDIB-QFIPXVFZSA-N 2 0 383.492 3.650 20 5 GHBDRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000776585902 878234733 /nfs/dbraw/zinc/23/47/33/878234733.db2.gz CSGYDZBEAAKOEL-UWJYYQICSA-N 2 0 375.513 3.605 20 5 GHBDRP CC(C)[N@H+](C)CC1CC[NH+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000533408698 890480498 /nfs/dbraw/zinc/48/04/98/890480498.db2.gz HELDTECARUWGPU-OAHLLOKOSA-N 2 0 387.484 3.758 20 5 GHBDRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccccc1O2 ZINC000537205756 894595289 /nfs/dbraw/zinc/59/52/89/894595289.db2.gz RBTOPKFOTRDOGJ-HXUWFJFHSA-N 2 0 381.476 3.715 20 5 GHBDRP C[C@@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000567915312 897485917 /nfs/dbraw/zinc/48/59/17/897485917.db2.gz NMCVTCYITUZUIP-QRWLVFNGSA-N 2 0 398.482 3.824 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CC1CC[NH+](Cc3cccnc3)CC1)CC2 ZINC001172906634 905934217 /nfs/dbraw/zinc/93/42/17/905934217.db2.gz YVOITSPYTLFWHN-QFIPXVFZSA-N 2 0 394.519 3.739 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH+]2CCC(C3CC[NH+](C)CC3)CC2)c1F ZINC001173189852 906271306 /nfs/dbraw/zinc/27/13/06/906271306.db2.gz NGMOJEBMJCLIQG-OAHLLOKOSA-N 2 0 393.503 3.727 20 5 GHBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]([C@@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001173224765 906307995 /nfs/dbraw/zinc/30/79/95/906307995.db2.gz LCTQYPJYXWUAHT-LPHOPBHVSA-N 2 0 375.513 3.537 20 5 GHBDRP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]C2CC[NH+](CC3CCCCC3)CC2)n1 ZINC000774159861 911459307 /nfs/dbraw/zinc/45/93/07/911459307.db2.gz QNWFGMMUKZSPBF-VQTJNVASSA-N 2 0 389.544 3.909 20 5 GHBDRP COc1ccc(C[C@H](C)[NH2+][C@H](c2ccccc2)C2CC[NH2+]CC2)c([N+](=O)[O-])c1 ZINC001246252522 1037255175 /nfs/dbraw/zinc/25/51/75/1037255175.db2.gz RYJHMFKYZWEZJG-KSFYIVLOSA-N 2 0 383.492 3.865 20 5 GHBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC1(Cc2cccc(F)c2)CC[NH2+]CC1 ZINC001246377954 1037335339 /nfs/dbraw/zinc/33/53/39/1037335339.db2.gz TVHOLRUEZXVONE-QGZVFWFLSA-N 2 0 385.483 3.867 20 5 GHBDRP COc1ccc(CC2(C[NH2+][C@@H](C)Cc3ccccc3[N+](=O)[O-])CC[NH2+]CC2)cc1 ZINC001246386555 1037347177 /nfs/dbraw/zinc/34/71/77/1037347177.db2.gz IBQJGSHKHIJSGE-SFHVURJKSA-N 2 0 397.519 3.737 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1C[C@H](c3ccccc3)C3(C[NH2+]C3)C1)CC2 ZINC001246619243 1037508684 /nfs/dbraw/zinc/50/86/84/1037508684.db2.gz JXFARIUFYVGSPR-RBBKRZOGSA-N 2 0 377.488 3.531 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@@H+]1CC[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C1)C2 ZINC001254608256 1040380951 /nfs/dbraw/zinc/38/09/51/1040380951.db2.gz QBBHISUANQEGOE-IEIRFRATSA-N 2 0 377.488 3.516 20 5 GHBDRP CC[NH+]1CCN(C[C@H](C)C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000180441346 837258095 /nfs/dbraw/zinc/25/80/95/837258095.db2.gz OWKGYARLLKPQHC-XXBNENTESA-N 2 0 396.535 3.547 20 5 GHBDRP C[C@]1(C[NH3+])CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)C1 ZINC000261696577 839580412 /nfs/dbraw/zinc/58/04/12/839580412.db2.gz HUWNFQSAYOPURR-QGZVFWFLSA-N 2 0 394.269 3.788 20 5 GHBDRP C[N@H+](CCOc1cccc([N+](=O)[O-])c1)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000537842685 840387352 /nfs/dbraw/zinc/38/73/52/840387352.db2.gz BCSLTSRUVXLWDQ-UHFFFAOYSA-N 2 0 384.480 3.607 20 5 GHBDRP C[NH+](C)CCCOc1cnccc1C[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417349836 840748301 /nfs/dbraw/zinc/74/83/01/840748301.db2.gz MVFLBGRWKLOBID-NRFANRHFSA-N 2 0 398.507 3.878 20 5 GHBDRP O=[N+]([O-])c1cccc(OCC[N@H+](Cc2ccsc2)[C@H]2CC23CC[NH2+]CC3)c1 ZINC000432668836 843382482 /nfs/dbraw/zinc/38/24/82/843382482.db2.gz KVLSAHRYWHOCMH-IBGZPJMESA-N 2 0 387.505 3.679 20 5 GHBDRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000056184955 861448046 /nfs/dbraw/zinc/44/80/46/861448046.db2.gz QUKSADUXKBLEHQ-MRXNPFEDSA-N 2 0 384.480 3.553 20 5 GHBDRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000025702773 861535395 /nfs/dbraw/zinc/53/53/95/861535395.db2.gz ONXXPDIUDWQHEL-INIZCTEOSA-N 2 0 384.480 3.553 20 5 GHBDRP O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CCC[C@@H]([C@H]4CCC[NH2+]C4)C3)cs2)c1 ZINC000592433545 857439967 /nfs/dbraw/zinc/43/99/67/857439967.db2.gz APZXDVPHXISNHM-DLBZAZTESA-N 2 0 386.521 3.930 20 5 GHBDRP CCOc1ccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1[N+](=O)[O-] ZINC000595067376 858369873 /nfs/dbraw/zinc/36/98/73/858369873.db2.gz PCXWDBGHQRYVNL-QGZVFWFLSA-N 2 0 398.507 3.951 20 5 GHBDRP COc1cc(C[N@@H+]2CCC[C@@H](C)[C@H]2CCC[NH3+])c([N+](=O)[O-])cc1OC(F)F ZINC000595904554 858712270 /nfs/dbraw/zinc/71/22/70/858712270.db2.gz FZHJHKQBLWYTJI-TZMCWYRMSA-N 2 0 387.427 3.544 20 5 GHBDRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)cc2)CC1 ZINC000160315541 858792436 /nfs/dbraw/zinc/79/24/36/858792436.db2.gz DJQWAHRKOWCNQK-IBGZPJMESA-N 2 0 396.535 3.892 20 5 GHBDRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000160348724 858828753 /nfs/dbraw/zinc/82/87/53/858828753.db2.gz VDQQPHRKVOCXBK-IBGZPJMESA-N 2 0 396.535 3.892 20 5 GHBDRP CN(c1ccccc1)c1ccc(C[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc1[N+](=O)[O-] ZINC000603633174 860952693 /nfs/dbraw/zinc/95/26/93/860952693.db2.gz IEFFSVJEDHKFEA-SFHVURJKSA-N 2 0 380.492 3.937 20 5 GHBDRP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)n1 ZINC000618570492 871726407 /nfs/dbraw/zinc/72/64/07/871726407.db2.gz KCCPMSOZHFQCGS-PCCBWWKXSA-N 2 0 397.523 3.777 20 5 GHBDRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000447554184 871843665 /nfs/dbraw/zinc/84/36/65/871843665.db2.gz ZGALIIACANFJQE-WOJBJXKFSA-N 2 0 385.512 3.905 20 5 GHBDRP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCCC[NH+]3CCOCC3)s2)cc1 ZINC000102422749 873056822 /nfs/dbraw/zinc/05/68/22/873056822.db2.gz CULBREMQYSSFGF-UHFFFAOYSA-N 2 0 375.494 3.525 20 5 GHBDRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000449499522 874961290 /nfs/dbraw/zinc/96/12/90/874961290.db2.gz MFPYBMNDXQAIAP-SFHVURJKSA-N 2 0 377.448 3.864 20 5 GHBDRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000105464815 875299991 /nfs/dbraw/zinc/29/99/91/875299991.db2.gz JUJWDPIURPYYIP-INIZCTEOSA-N 2 0 386.471 3.727 20 5 GHBDRP C[C@H](C[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)C[NH+](C)C ZINC000491591525 875824811 /nfs/dbraw/zinc/82/48/11/875824811.db2.gz MCBRZTFNWJPFLJ-QGZVFWFLSA-N 2 0 393.491 3.735 20 5 GHBDRP O=[N+]([O-])c1cccc([C@H](O)C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCC3)c1 ZINC000853120658 878827119 /nfs/dbraw/zinc/82/71/19/878827119.db2.gz NWOZGNHTPQVNOT-IFMALSPDSA-N 2 0 395.503 3.520 20 5 GHBDRP CC1CC[NH+](C[C@@H]2CCC[N@H+](CCCOc3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000498894307 886043531 /nfs/dbraw/zinc/04/35/31/886043531.db2.gz ULQUSZQIEOPXMZ-LJQANCHMSA-N 2 0 375.513 3.808 20 5 GHBDRP Cc1c([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)cccc1[N+](=O)[O-] ZINC000132698588 903297992 /nfs/dbraw/zinc/29/79/92/903297992.db2.gz XZOANNQKMFADLX-KRWDZBQOSA-N 2 0 383.492 3.711 20 5 GHBDRP C[C@H](C[NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1)CC(C)(C)CC[NH3+] ZINC001173010096 906087369 /nfs/dbraw/zinc/08/73/69/906087369.db2.gz RNMKSVMJHWNTPT-AWEZNQCLSA-N 2 0 398.498 3.833 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]C2CC[NH+](CC3CCC3)CC2)c1F ZINC001173181147 906260446 /nfs/dbraw/zinc/26/04/46/906260446.db2.gz NZLBOJOBXCUHGW-AWEZNQCLSA-N 2 0 379.476 3.528 20 5 GHBDRP C[NH+]1CCC2(CC1)CC[NH+](Cc1cccc([N+](=O)[O-])c1Br)CC2 ZINC001175220550 907439426 /nfs/dbraw/zinc/43/94/26/907439426.db2.gz VWADOMWGWMADNG-UHFFFAOYSA-N 2 0 382.302 3.665 20 5 GHBDRP O=[N+]([O-])c1cc2c(cc1N[C@@H]1CC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]31)C[NH2+]C2 ZINC001164492928 1026531013 /nfs/dbraw/zinc/53/10/13/1026531013.db2.gz PEFHPEKJYXWLQE-FFZOFVMBSA-N 2 0 378.476 3.521 20 5 GHBDRP C[C@H]1[NH2+]CCC[C@@H]1C(=O)Nc1cc2oc3cc(=[NH2+])ccc-3nc2c2ccccc12 ZINC001219369249 1031383366 /nfs/dbraw/zinc/38/33/66/1031383366.db2.gz ARPFBYUEPHDVHV-HIFRSBDPSA-N 2 0 386.455 3.892 20 5 GHBDRP [NH3+]C1CC[NH+](CCc2cn(-c3cc(Cl)ncc3[N+](=O)[O-])c3ccccc23)CC1 ZINC001159460009 1034605958 /nfs/dbraw/zinc/60/59/58/1034605958.db2.gz KKAAMMJKYQJKGC-UHFFFAOYSA-N 2 0 399.882 3.553 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH2+]C1(Cc3ccc(Cl)cc3)CC[NH2+]CC1)C2 ZINC001246395090 1037354283 /nfs/dbraw/zinc/35/42/83/1037354283.db2.gz VZEMXLJHXDYWSW-IBGZPJMESA-N 2 0 385.895 3.670 20 5 GHBDRP COc1ccc(C[N@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C2CC[NH2+]CC2)cc1 ZINC001246955330 1037766292 /nfs/dbraw/zinc/76/62/92/1037766292.db2.gz RZPCGOMBURLFLT-KRWDZBQOSA-N 2 0 383.492 3.789 20 5 GHBDRP C[C@@H](C[NH3+])C[N@H+](Cc1ccccc1)C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001254469986 1040256180 /nfs/dbraw/zinc/25/61/80/1040256180.db2.gz LANOQTLCCNOOQV-SFHVURJKSA-N 2 0 382.508 3.661 20 5 GHBDRP O=[N+]([O-])c1ccc(N2CCC([NH+]3CCC4(CCC[N@@H+]4CC4CC4)CC3)CC2)cc1 ZINC001254474237 1040260550 /nfs/dbraw/zinc/26/05/50/1040260550.db2.gz IHGGQHMKCOCMIR-UHFFFAOYSA-N 2 0 398.551 3.904 20 5 GHBDRP C[N@H+](CC1CC[NH+](Cc2ccccc2)CC1)[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254603775 1040375585 /nfs/dbraw/zinc/37/55/85/1040375585.db2.gz QQZGSNSHRZLMLU-HSZRJFAPSA-N 2 0 379.504 3.906 20 5 GHBDRP Cc1c(C[NH2+]Cc2ccccc2N(C)C2CC[NH+](C)CC2)cccc1[N+](=O)[O-] ZINC000480475216 834857498 /nfs/dbraw/zinc/85/74/98/834857498.db2.gz MVGZISSVRLCDTJ-UHFFFAOYSA-N 2 0 382.508 3.723 20 5 GHBDRP CC[C@@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000414297559 836964637 /nfs/dbraw/zinc/96/46/37/836964637.db2.gz GHWQDSLCROJTQG-OAQYLSRUSA-N 2 0 383.492 3.663 20 5 GHBDRP COc1ccc(C[NH2+][C@H](C)[C@@H]2CCC[NH2+]C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414858104 838898320 /nfs/dbraw/zinc/89/83/20/838898320.db2.gz QUBRFRSSCZBSGM-VQIMIIECSA-N 2 0 399.491 3.660 20 5 GHBDRP C[C@@H]1C[NH2+]CC[C@@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000414948478 839011144 /nfs/dbraw/zinc/01/11/44/839011144.db2.gz YNZCBOKNNQZXHZ-BZNIZROVSA-N 2 0 394.269 3.705 20 5 GHBDRP C[C@@]1(C[NH3+])CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)C1 ZINC000261696575 839580172 /nfs/dbraw/zinc/58/01/72/839580172.db2.gz HUWNFQSAYOPURR-KRWDZBQOSA-N 2 0 394.269 3.788 20 5 GHBDRP O=C(CC[NH+]1CCC(C[NH+]2CCCCCC2)CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000603875909 861308920 /nfs/dbraw/zinc/30/89/20/861308920.db2.gz ZEIJUZUYAZAOIQ-UHFFFAOYSA-N 2 0 388.512 3.511 20 5 GHBDRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000056184759 861448148 /nfs/dbraw/zinc/44/81/48/861448148.db2.gz AFXZNEZQJGIIDE-KRWDZBQOSA-N 2 0 398.507 3.862 20 5 GHBDRP C[C@@H]1C[NH+](CCCC[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000513786499 847576473 /nfs/dbraw/zinc/57/64/73/847576473.db2.gz IATSJNSAVPBHIE-WERVVEIQSA-N 2 0 389.540 3.785 20 5 GHBDRP [NH3+]CCCOC1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000435371729 850439661 /nfs/dbraw/zinc/43/96/61/850439661.db2.gz OEBRQRKKZDLYJR-UHFFFAOYSA-N 2 0 375.494 3.653 20 5 GHBDRP C[NH2+]CC1CC[NH+](Cc2ccc(OC)c(OCc3ccc([N+](=O)[O-])cc3)c2)CC1 ZINC000435386889 850454209 /nfs/dbraw/zinc/45/42/09/850454209.db2.gz VZMGZTXPPYOZIQ-UHFFFAOYSA-N 2 0 399.491 3.614 20 5 GHBDRP COc1cc(C[NH2+]CC[C@@H]2CCC[NH2+]C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414846644 851186710 /nfs/dbraw/zinc/18/67/10/851186710.db2.gz URJKATVFYWMKGD-KRWDZBQOSA-N 2 0 399.491 3.662 20 5 GHBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC(C[NH+]2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000489143241 852045454 /nfs/dbraw/zinc/04/54/54/852045454.db2.gz XVLXWPWNNDMAEM-BZSNNMDCSA-N 2 0 375.513 3.785 20 5 GHBDRP [NH3+][C@@H]1CCC[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)C1 ZINC000414925372 852158376 /nfs/dbraw/zinc/15/83/76/852158376.db2.gz LSTZJNYRKOYSQL-NEPJUHHUSA-N 2 0 394.269 3.977 20 5 GHBDRP C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(CC[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000426830305 852443554 /nfs/dbraw/zinc/44/35/54/852443554.db2.gz XFEQRRQIDFIGTJ-FGTMMUONSA-N 2 0 375.513 3.867 20 5 GHBDRP CC1(C)C[C@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)c2cc([N+](=O)[O-])ccc21 ZINC000595048363 858379086 /nfs/dbraw/zinc/37/90/86/858379086.db2.gz KNVBGBFQXOOCGM-NRFANRHFSA-N 2 0 387.524 3.798 20 5 GHBDRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H](C)c3cccc([N+](=O)[O-])c3C)cc2)CC1 ZINC000160320213 858809560 /nfs/dbraw/zinc/80/95/60/858809560.db2.gz WPZFTNQPGPEVRU-IBGZPJMESA-N 2 0 396.535 3.892 20 5 GHBDRP COc1ccc(C[C@H](C)[NH2+]C2CC[NH+](CC3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC001170316981 881347843 /nfs/dbraw/zinc/34/78/43/881347843.db2.gz AYWXTRJSIUGDFV-INIZCTEOSA-N 2 0 375.513 3.779 20 5 GHBDRP CC[N@H+](C)Cc1cc(O[C@@H]2CC[NH+]([C@@H](C)c3ccccc3[N+](=O)[O-])C2)ccn1 ZINC000856593077 881565883 /nfs/dbraw/zinc/56/58/83/881565883.db2.gz ZIBRFOSCTRTZRQ-QFBILLFUSA-N 2 0 384.480 3.656 20 5 GHBDRP C[NH+]1CCC(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)(N2CCCCC2)CC1 ZINC000192906872 861016418 /nfs/dbraw/zinc/01/64/18/861016418.db2.gz BMPSALKPTCOUHN-OAQYLSRUSA-N 2 0 386.540 3.512 20 5 GHBDRP O=[N+]([O-])C[C@H]1CC[C@@H]([NH+]2CCC3(CC[NH+](Cc4cccs4)CC3)CC2)C1 ZINC001169020484 871122740 /nfs/dbraw/zinc/12/27/40/871122740.db2.gz JFFQKOSIUNNTGA-ZWKOTPCHSA-N 2 0 377.554 3.872 20 5 GHBDRP O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)n1 ZINC000447512381 871774972 /nfs/dbraw/zinc/77/49/72/871774972.db2.gz YEIIZXKPOIINGN-UXHICEINSA-N 2 0 383.496 3.661 20 5 GHBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@H](CN1CC[NH+](C)CC1)c1ccccc1 ZINC000526063453 872065295 /nfs/dbraw/zinc/06/52/95/872065295.db2.gz LHRMECWXUIIBRH-VPULJAIHSA-N 2 0 394.519 3.576 20 5 GHBDRP [NH3+]C1CC[NH+](CCc2cn(-c3nc(Cl)ccc3[N+](=O)[O-])c3ccccc23)CC1 ZINC001170528384 885553650 /nfs/dbraw/zinc/55/36/50/885553650.db2.gz OQXZCZHMONQQTL-UHFFFAOYSA-N 2 0 399.882 3.553 20 5 GHBDRP CC1CC[NH+](Cc2ccccc2C[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000818956755 896293054 /nfs/dbraw/zinc/29/30/54/896293054.db2.gz ONMKCNIACAOXGP-QFIPXVFZSA-N 2 0 383.492 3.650 20 5 GHBDRP C[C@@H]1C[C@@H](CC[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)C[N@@H+]1Cc1ccccc1 ZINC000819190177 896460024 /nfs/dbraw/zinc/46/00/24/896460024.db2.gz MQHAVGLAZSGKOK-SFGWALBWSA-N 2 0 383.492 3.519 20 5 GHBDRP CCC[N@H+](CCC[NH+](C)C)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173017352 906093619 /nfs/dbraw/zinc/09/36/19/906093619.db2.gz CJKKWAMBGUBUAI-UHFFFAOYSA-N 2 0 384.471 3.506 20 5 GHBDRP O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[NH2+]CCC[C@H]3CCCCO3)CC2)cc1 ZINC001180631567 910276694 /nfs/dbraw/zinc/27/66/94/910276694.db2.gz DHGFWVZNUONLTP-JOCHJYFZSA-N 2 0 389.540 3.788 20 5 GHBDRP O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]C2CCC([NH+]3CCCCC3)CC2)n1 ZINC000774217191 911532007 /nfs/dbraw/zinc/53/20/07/911532007.db2.gz LAEOFVIWQYQNQD-GMNCBBECSA-N 2 0 375.517 3.662 20 5 GHBDRP COc1cc(C[N@@H+]2CCCC3(CC[NH+](C)CC3)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000798957533 932839883 /nfs/dbraw/zinc/83/98/83/932839883.db2.gz ZPDAEQRTBRMPCC-UHFFFAOYSA-N 2 0 399.438 3.513 20 5 GHBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC001461196801 1069437148 /nfs/dbraw/zinc/43/71/48/1069437148.db2.gz TWLYQERZGUCOSI-UHFFFAOYSA-N 2 0 383.492 3.976 20 5 GHBDRP C[C@H]1C[N@H+](CCOc2ccc(CC[NH2+]Cc3cccc([N+](=O)[O-])c3)cc2)C[C@H]1C ZINC001461386897 1069528977 /nfs/dbraw/zinc/52/89/77/1069528977.db2.gz DIPDCPYXWMJMDD-KDURUIRLSA-N 2 0 397.519 3.894 20 5 GHBDRP COc1ccc(C[NH2+]C2CCC([NH3+])CC2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000843105160 1029810700 /nfs/dbraw/zinc/81/07/00/1029810700.db2.gz RFHPYVQBDBFUAU-UHFFFAOYSA-N 2 0 385.464 3.542 20 5 GHBDRP COc1cc(C[NH2+]C2CCC([NH3+])CC2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000843105303 1029811948 /nfs/dbraw/zinc/81/19/48/1029811948.db2.gz SXSCGSUZHNEVJR-UHFFFAOYSA-N 2 0 385.464 3.542 20 5 GHBDRP O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)ccc1Br ZINC000843127006 1029817864 /nfs/dbraw/zinc/81/78/64/1029817864.db2.gz NVOORRHTPRWNJW-HUUCEWRRSA-N 2 0 382.302 3.569 20 5 GHBDRP [NH2+]=c1ccc2nc3c(cc(NC(=O)[C@@H]4C[C@@H](F)CC[NH2+]4)c4ccccc43)oc-2c1 ZINC001219369543 1031383940 /nfs/dbraw/zinc/38/39/40/1031383940.db2.gz HNNYJLQMBDGUCB-SGTLLEGYSA-N 2 0 390.418 3.594 20 5 GHBDRP Cc1cccc2c1C1(C[C@H]2[NH2+][C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC[NH2+]CC1 ZINC001246248669 1037254105 /nfs/dbraw/zinc/25/41/05/1037254105.db2.gz OTATZWXGGAODCZ-WIYYLYMNSA-N 2 0 377.488 3.726 20 5 GHBDRP COc1ccccc1CC1(C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC[NH2+]CC1 ZINC001246421619 1037378156 /nfs/dbraw/zinc/37/81/56/1037378156.db2.gz SDFKJLAQRYPSCA-GOSISDBHSA-N 2 0 397.519 3.737 20 5 GHBDRP CC(C)[N@H+](C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1)[C@H]1CCC[NH2+]CC1 ZINC001246592600 1037493398 /nfs/dbraw/zinc/49/33/98/1037493398.db2.gz KQNYRIPCWHUYDK-HNNXBMFYSA-N 2 0 396.482 3.694 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+](Cc1ccc(F)c(F)c1)C1CC[NH2+]CC1)C2 ZINC001246959718 1037777988 /nfs/dbraw/zinc/77/79/88/1037777988.db2.gz XULKGOBWZCYMFO-LJQANCHMSA-N 2 0 387.430 3.594 20 5 GHBDRP COc1ccc(C[C@@H](C)[NH+]2CCC(CC3CC[NH2+]CC3)CC2)c([N+](=O)[O-])c1 ZINC001246981835 1037805703 /nfs/dbraw/zinc/80/57/03/1037805703.db2.gz YPWBPLXKHYRRIV-MRXNPFEDSA-N 2 0 375.513 3.636 20 5 GHBDRP CC1CC[NH+](CCCC[NH2+]Cc2c(Br)cccc2[N+](=O)[O-])CC1 ZINC001308204631 1049911956 /nfs/dbraw/zinc/91/19/56/1049911956.db2.gz WYAJVPXHEYKDST-UHFFFAOYSA-N 2 0 384.318 3.959 20 5 GHBDRP C[C@@H](C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccccc1[N+](=O)[O-] ZINC001308536355 1050001867 /nfs/dbraw/zinc/00/18/67/1050001867.db2.gz WZLSULYUSLXZQV-SFHVURJKSA-N 2 0 383.492 3.963 20 5 GHBDRP O=[N+]([O-])c1ccn(C2CC[NH+](Cc3cccc(C[NH+]4CCCCC4)c3)CC2)n1 ZINC000411654413 836268945 /nfs/dbraw/zinc/26/89/45/836268945.db2.gz HFPQOKBMXXWCHP-UHFFFAOYSA-N 2 0 383.496 3.614 20 5 GHBDRP O=[N+]([O-])c1cccc(-c2ccc(C[NH+]3CCC(OCC[NH+]4CCCC4)CC3)o2)c1 ZINC000179988186 836533511 /nfs/dbraw/zinc/53/35/11/836533511.db2.gz VRXKBDPMRBGPSQ-UHFFFAOYSA-N 2 0 399.491 3.932 20 5 GHBDRP CC[C@H]([NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000414297556 836964450 /nfs/dbraw/zinc/96/44/50/836964450.db2.gz GHWQDSLCROJTQG-NRFANRHFSA-N 2 0 383.492 3.663 20 5 GHBDRP Cc1c([C@@H](C)[NH2+]CC2(O)CC[NH+](Cc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000414310001 837034188 /nfs/dbraw/zinc/03/41/88/837034188.db2.gz SNUWNZOODWKQMY-GOSISDBHSA-N 2 0 383.492 3.581 20 5 GHBDRP [NH3+][C@@H]1CCC[C@H]([NH2+]Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000414922440 838988112 /nfs/dbraw/zinc/98/81/12/838988112.db2.gz GSUTWQQPQFIPCW-MOPGFXCFSA-N 2 0 391.475 3.807 20 5 GHBDRP [NH3+]C[C@H]1CC[C@H]([NH2+]Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000415041850 839106928 /nfs/dbraw/zinc/10/69/28/839106928.db2.gz QFVKTNNQXUGWAQ-LPHOPBHVSA-N 2 0 391.475 3.665 20 5 GHBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1 ZINC000132696844 861397528 /nfs/dbraw/zinc/39/75/28/861397528.db2.gz VCZAKIITVLFVNM-QGZVFWFLSA-N 2 0 383.492 3.711 20 5 GHBDRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000056184953 861448428 /nfs/dbraw/zinc/44/84/28/861448428.db2.gz QUKSADUXKBLEHQ-INIZCTEOSA-N 2 0 384.480 3.553 20 5 GHBDRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000025702392 861485117 /nfs/dbraw/zinc/48/51/17/861485117.db2.gz KXJGTQUHFZRYPZ-KRWDZBQOSA-N 2 0 396.491 3.698 20 5 GHBDRP COc1ccc(C[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000513500099 845554048 /nfs/dbraw/zinc/55/40/48/845554048.db2.gz KOHOHUPCSFOWPY-PXNSSMCTSA-N 2 0 383.492 3.994 20 5 GHBDRP Cc1c([C@@H](C)[NH2+]CC2(N)CC[NH+](Cc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000423581158 849988148 /nfs/dbraw/zinc/98/81/48/849988148.db2.gz YVKIBDDZEPMGCK-GOSISDBHSA-N 2 0 382.508 3.547 20 5 GHBDRP CC(C)CC[NH+]1CCC(C[NH2+][C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)CC1 ZINC000515767342 851447538 /nfs/dbraw/zinc/44/75/38/851447538.db2.gz ASQCYHIIUHKOQN-MOPGFXCFSA-N 2 0 377.533 3.623 20 5 GHBDRP C[C@H]([NH2+]CCCN1CC[N@H+](C)C[C@H]1c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000480797709 865290685 /nfs/dbraw/zinc/29/06/85/865290685.db2.gz QJLZIKPNZCCLTB-AVRDEDQJSA-N 2 0 382.508 3.624 20 5 GHBDRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000540188063 870676626 /nfs/dbraw/zinc/67/66/26/870676626.db2.gz GKNOOFHYLJMULU-IBGZPJMESA-N 2 0 382.508 3.848 20 5 GHBDRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]C[C@H](O)c3ccc([N+](=O)[O-])cc3)cc2)C1 ZINC000776276914 876146932 /nfs/dbraw/zinc/14/69/32/876146932.db2.gz LRYDQGKGTQHSKT-VGSWGCGISA-N 2 0 383.492 3.650 20 5 GHBDRP C[C@H]([NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788633837 878225319 /nfs/dbraw/zinc/22/53/19/878225319.db2.gz VGMCZMUCRXGWIK-DVSDUFGPSA-N 2 0 382.508 3.984 20 5 GHBDRP COc1ccc(C[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)cc1[N+](=O)[O-] ZINC000537843858 878379071 /nfs/dbraw/zinc/37/90/71/878379071.db2.gz XQAJUMOMQMANNQ-UHFFFAOYSA-N 2 0 384.480 3.737 20 5 GHBDRP O=[N+]([O-])c1ccc([C@H](O)C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCC3)cc1 ZINC000853120779 878829626 /nfs/dbraw/zinc/82/96/26/878829626.db2.gz QFWMMWYUEFYWSA-RBBKRZOGSA-N 2 0 395.503 3.520 20 5 GHBDRP C[C@@H]1C[C@H](CC[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)C[N@@H+]1Cc1ccccc1 ZINC000819190176 896460312 /nfs/dbraw/zinc/46/03/12/896460312.db2.gz MQHAVGLAZSGKOK-LZNRXBQRSA-N 2 0 383.492 3.519 20 5 GHBDRP COc1cc[nH+]c(N(C2CC[NH2+]CC2)[C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c1 ZINC001172913896 905983822 /nfs/dbraw/zinc/98/38/22/905983822.db2.gz VOPYETCGYRVREJ-GOSISDBHSA-N 2 0 396.491 3.504 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@H]2CC(C)(C)C[C@@](C)(C[NH3+])C2)c1F ZINC001173190183 906271677 /nfs/dbraw/zinc/27/16/77/906271677.db2.gz VFGYHQXOWIOKQU-YRVVQQKDSA-N 2 0 381.492 3.807 20 5 GHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]([C@@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001173224761 906307816 /nfs/dbraw/zinc/30/78/16/906307816.db2.gz LCTQYPJYXWUAHT-APWZRJJASA-N 2 0 375.513 3.537 20 5 GHBDRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+]C[C@@H](O)c3cccc([N+](=O)[O-])c3)cc2)C1 ZINC000749678403 927231623 /nfs/dbraw/zinc/23/16/23/927231623.db2.gz RTBOJLFJQNWLNA-IEGUWTFLSA-N 2 0 397.519 3.896 20 5 GHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1 ZINC000468734256 1015971941 /nfs/dbraw/zinc/97/19/41/1015971941.db2.gz PEKRTEVTMBHXDE-QGOAFFKASA-N 2 0 395.503 3.745 20 5 GHBDRP C[C@@H]1CC[NH2+][C@@H](C(=O)Nc2cc3oc4cc(=[NH2+])ccc-4nc3c3ccccc23)C1 ZINC001219369299 1031383977 /nfs/dbraw/zinc/38/39/77/1031383977.db2.gz CHJVOMLCUFDSLQ-BFUOFWGJSA-N 2 0 386.455 3.892 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH2+]CC1(c3ccccc3Cl)CC[NH2+]CC1)C2 ZINC001246448974 1037410211 /nfs/dbraw/zinc/41/02/11/1037410211.db2.gz HAURRBZJIXWEJP-KRWDZBQOSA-N 2 0 385.895 3.626 20 5 GHBDRP COc1ccc(C[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001246964739 1037786376 /nfs/dbraw/zinc/78/63/76/1037786376.db2.gz NAGMAJXHIPEJPU-KCZVDYSFSA-N 2 0 395.503 3.843 20 5 GHBDRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000583630663 834784946 /nfs/dbraw/zinc/78/49/46/834784946.db2.gz NHTPKURLTIMVLO-WDEREUQCSA-N 2 0 382.258 3.833 20 5 GHBDRP CC[NH+]1CCN(C[C@@H](C)C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000180441327 837257825 /nfs/dbraw/zinc/25/78/25/837257825.db2.gz OWKGYARLLKPQHC-CVDCTZTESA-N 2 0 396.535 3.547 20 5 GHBDRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000070870156 838770043 /nfs/dbraw/zinc/77/00/43/838770043.db2.gz ZUTSUFFAXLMWSY-INIZCTEOSA-N 2 0 384.480 3.553 20 5 GHBDRP COc1cc(C[NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000415005526 839060793 /nfs/dbraw/zinc/06/07/93/839060793.db2.gz PCVUVVJBHXQWIX-IEBWSBKVSA-N 2 0 399.491 3.790 20 5 GHBDRP COc1cc(C[NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000415005528 839061170 /nfs/dbraw/zinc/06/11/70/839061170.db2.gz PCVUVVJBHXQWIX-MJGOQNOKSA-N 2 0 399.491 3.790 20 5 GHBDRP CSC1(C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC[NH+](C)CC1 ZINC000580781209 840171434 /nfs/dbraw/zinc/17/14/34/840171434.db2.gz YYYIPGSNDRTOPL-UHFFFAOYSA-N 2 0 392.550 3.635 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)CCCC2 ZINC000417328566 840714747 /nfs/dbraw/zinc/71/47/47/840714747.db2.gz GTCUMZPPJISELG-FYYLOGMGSA-N 2 0 395.503 3.719 20 5 GHBDRP COc1ccc(C[N@H+](Cc2ccsc2)[C@H]2CC23CC[NH2+]CC3)cc1[N+](=O)[O-] ZINC000435428807 850511068 /nfs/dbraw/zinc/51/10/68/850511068.db2.gz SVXNRYSPMBBBPA-IBGZPJMESA-N 2 0 387.505 3.809 20 5 GHBDRP C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(CC[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000426782150 852387712 /nfs/dbraw/zinc/38/77/12/852387712.db2.gz FWEZGMKGOLWBNB-FGTMMUONSA-N 2 0 375.513 3.867 20 5 GHBDRP C[NH+]1CCC2(CC1)C[N@H+](Cc1ccc(-c3ccccc3[N+](=O)[O-])s1)CCO2 ZINC000592526034 857672615 /nfs/dbraw/zinc/67/26/15/857672615.db2.gz FYHOJHHISLLANF-UHFFFAOYSA-N 2 0 387.505 3.620 20 5 GHBDRP O=[N+]([O-])C[C@@H]1CC[C@@H]([NH+]2CCC3(CC[NH+](Cc4cccs4)CC3)CC2)C1 ZINC001169020476 871122156 /nfs/dbraw/zinc/12/21/56/871122156.db2.gz JFFQKOSIUNNTGA-QZTJIDSGSA-N 2 0 377.554 3.872 20 5 GHBDRP CC[NH+]1CCC([NH2+]CCCNC(=O)c2c3ccccc3nc3ccccc32)CC1 ZINC001169242100 871340601 /nfs/dbraw/zinc/34/06/01/871340601.db2.gz WATZWRYTTLDOPQ-UHFFFAOYSA-N 2 0 390.531 3.582 20 5 GHBDRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)C1 ZINC000447543804 871814427 /nfs/dbraw/zinc/81/44/27/871814427.db2.gz MLLUDHDGFBPZKT-ZSYWTGECSA-N 2 0 377.533 3.623 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H]1CO)CCC2 ZINC000193277332 885198494 /nfs/dbraw/zinc/19/84/94/885198494.db2.gz QSGHIUQZSJKTJB-FYYLOGMGSA-N 2 0 395.503 3.719 20 5 GHBDRP CC1CC[NH+](Cc2ccccc2C[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000818958188 896295532 /nfs/dbraw/zinc/29/55/32/896295532.db2.gz YYPXZLCDAWEUSU-QFIPXVFZSA-N 2 0 383.492 3.650 20 5 GHBDRP O=[N+]([O-])c1cccc([C@H](O)C[NH2+]C[C@H]2CCCC[N@H+](Cc3ccccc3)C2)c1 ZINC000819323713 896568144 /nfs/dbraw/zinc/56/81/44/896568144.db2.gz PJJKXZMTKFNWPO-DENIHFKCSA-N 2 0 383.492 3.520 20 5 GHBDRP Cc1ccc2c(C[C@H](C)[NH3+])cn(-c3ccc([N+](=O)[O-])c(OCC[NH+](C)C)c3)c2c1 ZINC001171169241 901937406 /nfs/dbraw/zinc/93/74/06/901937406.db2.gz ORSOQIPDGXVHMB-INIZCTEOSA-N 2 0 396.491 3.677 20 5 GHBDRP C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000123653041 901958677 /nfs/dbraw/zinc/95/86/77/901958677.db2.gz ODOOBLNPTISAPO-OAHLLOKOSA-N 2 0 387.484 3.760 20 5 GHBDRP CCC[C@@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)c1cccc([N+](=O)[O-])c1 ZINC000271574532 910968090 /nfs/dbraw/zinc/96/80/90/910968090.db2.gz ZOPHVLDKLFGFLV-OAQYLSRUSA-N 2 0 398.507 3.517 20 5 GHBDRP COc1cc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc([N+](=O)[O-])c1 ZINC000903201058 922848263 /nfs/dbraw/zinc/84/82/63/922848263.db2.gz WLGCWFBOEUQFQW-INIZCTEOSA-N 2 0 384.480 3.561 20 5 GHBDRP Cc1nn(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c2ccc([N+](=O)[O-])cc12 ZINC000752803538 929030364 /nfs/dbraw/zinc/03/03/64/929030364.db2.gz NNRFTZVOIQPNAR-UHFFFAOYSA-N 2 0 385.512 3.798 20 5 GHBDRP O=[N+]([O-])c1cccc(C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)c1 ZINC000559326570 932602255 /nfs/dbraw/zinc/60/22/55/932602255.db2.gz OLMYCQHLPHUPNB-OAQYLSRUSA-N 2 0 395.503 3.613 20 5 GHBDRP O=[N+]([O-])c1ccc(C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCOCC3)cc1 ZINC000559326103 1017426700 /nfs/dbraw/zinc/42/67/00/1017426700.db2.gz BOHHMZYGRGUCFH-NRFANRHFSA-N 2 0 395.503 3.613 20 5 GHBDRP [NH3+][C@@H](Cc1c2ccccc2cc2ccccc21)C(=O)N1CCC[C@@]12CCC[NH2+]C2 ZINC001158161861 1033944591 /nfs/dbraw/zinc/94/45/91/1033944591.db2.gz ROEIHSBQMLPZSO-UKILVPOCSA-N 2 0 387.527 3.607 20 5 GHBDRP Cc1ccc2c(c1)[C@H]([NH2+][C@H]1Cc3ccc([N+](=O)[O-])cc3C1)CC21CC[NH2+]CC1 ZINC001246133652 1037209946 /nfs/dbraw/zinc/20/99/46/1037209946.db2.gz KZFFVLPRYSLMPD-PGRDOPGGSA-N 2 0 377.488 3.726 20 5 GHBDRP COc1ccc(C[C@@H](C)[N@@H+]2CC[C@]3(C[NH2+]C[C@@H]3c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001246685378 1037547623 /nfs/dbraw/zinc/54/76/23/1037547623.db2.gz OMNDWOYTJFPZBI-OAOOKAIFSA-N 2 0 395.503 3.614 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH2+][C@@H]1C[C@H]3CC[C@@H](C1)[N@H+]3Cc1ccccc1)C2 ZINC001254577883 1040353604 /nfs/dbraw/zinc/35/36/04/1040353604.db2.gz HHRCLWZIAJXCJU-YSFYHYPLSA-N 2 0 377.488 3.847 20 5 GHBDRP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccccc2F)[C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254584875 1040357616 /nfs/dbraw/zinc/35/76/16/1040357616.db2.gz AUGSUPZFHJEPMF-ZJOUEHCJSA-N 2 0 383.467 3.973 20 5 GHBDRP CC[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1ccc(C[NH+](C)C)cc1 ZINC001307976978 1049735769 /nfs/dbraw/zinc/73/57/69/1049735769.db2.gz ZZVSGTXRTSLDQU-UHFFFAOYSA-N 2 0 384.480 3.507 20 5 GHBDRP O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[N@@H+]3CCCC(F)(F)CC3)CC2)cc1 ZINC001308863809 1050128985 /nfs/dbraw/zinc/12/89/85/1050128985.db2.gz NJZTUPXFBVBBMN-UHFFFAOYSA-N 2 0 381.467 3.971 20 5 GHBDRP C[NH+]1CCN(c2ccccc2C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC001320958466 1056033196 /nfs/dbraw/zinc/03/31/96/1056033196.db2.gz JUFDESWYNIUNKH-OAQYLSRUSA-N 2 0 394.519 3.859 20 5 GHBDRP COc1cccc(C[N@H+](C)CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC001474403716 1074389722 /nfs/dbraw/zinc/38/97/22/1074389722.db2.gz PYKIETGQFSGPRQ-UHFFFAOYSA-N 2 0 397.519 3.990 20 5 GHBDRP CC[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)Cc1ccc(C[NH+](C)C)cc1 ZINC000609029830 835754465 /nfs/dbraw/zinc/75/44/65/835754465.db2.gz NMBFFVUXNLXDFR-UHFFFAOYSA-N 2 0 398.507 3.816 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CC1(O)CC[NH+](Cc3ccccc3)CC1)CCC2 ZINC000414306617 837006690 /nfs/dbraw/zinc/00/66/90/837006690.db2.gz OMLVGZIQVUTQAF-JOCHJYFZSA-N 2 0 395.503 3.589 20 5 GHBDRP COc1cc(C[NH2+]C[C@H]2CCC[C@H]([NH3+])C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000415012022 839055905 /nfs/dbraw/zinc/05/59/05/839055905.db2.gz WUTDCNSMNIZSBU-HKUYNNGSSA-N 2 0 399.491 3.790 20 5 GHBDRP COc1ccc(C[N@@H+]2C[C@@H](C)[C@](C)(C[NH3+])C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000415052536 839121568 /nfs/dbraw/zinc/12/15/68/839121568.db2.gz IHGZXHMRWMSUJQ-OPAMFIHVSA-N 2 0 399.491 3.599 20 5 GHBDRP C[C@@H]([NH2+]C[C@H](C)N1CC[NH+](C)CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000127315471 842252630 /nfs/dbraw/zinc/25/26/30/842252630.db2.gz XFTDQYZUBFXUTQ-JKSUJKDBSA-N 2 0 388.537 3.610 20 5 GHBDRP C[C@H]1CN(Cc2cccc(C[NH2+][C@H]3CCCc4ccc([N+](=O)[O-])cc43)c2)CCO1 ZINC000249050644 842708593 /nfs/dbraw/zinc/70/85/93/842708593.db2.gz XIAGCBYGCMCDTQ-SBUREZEXSA-N 2 0 395.503 3.983 20 5 GHBDRP C[C@H]([NH2+]CCCN1CC[NH+](C)CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000162478273 849084706 /nfs/dbraw/zinc/08/47/06/849084706.db2.gz XVOXEHPAUQFRCZ-INIZCTEOSA-N 2 0 388.537 3.611 20 5 GHBDRP C[C@@H]([NH3+])[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)C1 ZINC000435374647 850422118 /nfs/dbraw/zinc/42/21/18/850422118.db2.gz JEPVPPBCGOQDHQ-VXGBXAGGSA-N 2 0 394.269 3.786 20 5 GHBDRP CC(C)CC[NH+]1CCC(C[NH2+][C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)CC1 ZINC000515767343 851447005 /nfs/dbraw/zinc/44/70/05/851447005.db2.gz ASQCYHIIUHKOQN-OALUTQOASA-N 2 0 377.533 3.623 20 5 GHBDRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000025702567 853689685 /nfs/dbraw/zinc/68/96/85/853689685.db2.gz UVHHQUADGXZZGM-INIZCTEOSA-N 2 0 384.480 3.553 20 5 GHBDRP C[C@H]1C[NH+](CC2CCN(Cc3ccc([N+](=O)[O-])cc3Cl)CC2)C[C@H](C)O1 ZINC000542924173 856838941 /nfs/dbraw/zinc/83/89/41/856838941.db2.gz GNRZMLAWZWIJNB-GJZGRUSLSA-N 2 0 381.904 3.569 20 5 GHBDRP COc1ccc(C[C@@H](C)[NH2+]CC2CC[NH+](CC3CCC3)CC2)c([N+](=O)[O-])c1 ZINC001170317975 881351181 /nfs/dbraw/zinc/35/11/81/881351181.db2.gz NFYUWTKGEWSMIY-MRXNPFEDSA-N 2 0 375.513 3.636 20 5 GHBDRP COc1ccc(C[C@@H](C)[N@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001170352914 881387830 /nfs/dbraw/zinc/38/78/30/881387830.db2.gz UDTMFWLXPNTFIC-UYAOXDASSA-N 2 0 397.519 3.988 20 5 GHBDRP CC(C)[N@H+](C)Cc1cc(O[C@@H]2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)C2)ccn1 ZINC000856600566 881575002 /nfs/dbraw/zinc/57/50/02/881575002.db2.gz VCBMJHVMLPZFIN-JOCHJYFZSA-N 2 0 398.507 3.526 20 5 GHBDRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792878289 881765977 /nfs/dbraw/zinc/76/59/77/881765977.db2.gz UKERFLCFQRIZFI-KXBFYZLASA-N 2 0 384.436 3.503 20 5 GHBDRP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]C2CC[NH+](C3CCCCC3)CC2)n1 ZINC000447563088 871870814 /nfs/dbraw/zinc/87/08/14/871870814.db2.gz OBDQJQCTKMABMV-RBUKOAKNSA-N 2 0 375.517 3.662 20 5 GHBDRP C[NH+](C)CCOc1cc(NC2CC(C)(C)[NH+](C)C(C)(C)C2)ccc1[N+](=O)[O-] ZINC001170450964 882856849 /nfs/dbraw/zinc/85/68/49/882856849.db2.gz FJMYHYHLTRGWSS-UHFFFAOYSA-N 2 0 378.517 3.599 20 5 GHBDRP COc1cc(C[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414803715 875266046 /nfs/dbraw/zinc/26/60/46/875266046.db2.gz NVKQRLRVUSXGNP-UYAOXDASSA-N 2 0 399.491 3.790 20 5 GHBDRP COc1cccc(-n2cc(CC[NH+]3CCC([NH3+])CC3)c3ccccc32)c1[N+](=O)[O-] ZINC001170528762 885577431 /nfs/dbraw/zinc/57/74/31/885577431.db2.gz VPDOQPSTOZSQCG-UHFFFAOYSA-N 2 0 394.475 3.513 20 5 GHBDRP Cc1c(F)cc([N+](=O)[O-])cc1-n1cc(CC[NH+]2CCC([NH3+])CC2)c2ccccc21 ZINC001170531952 885704539 /nfs/dbraw/zinc/70/45/39/885704539.db2.gz XEJRNUJDTZBCKK-UHFFFAOYSA-N 2 0 396.466 3.952 20 5 GHBDRP O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)cc1 ZINC000813371415 891555973 /nfs/dbraw/zinc/55/59/73/891555973.db2.gz ZATJTBJSTSYVKR-JOCHJYFZSA-N 2 0 395.503 3.616 20 5 GHBDRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000154459532 892318172 /nfs/dbraw/zinc/31/81/72/892318172.db2.gz OZYOKDRJIIUIFJ-UTKZUKDTSA-N 2 0 375.513 3.605 20 5 GHBDRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000818959392 896295812 /nfs/dbraw/zinc/29/58/12/896295812.db2.gz JFDWODLRWPGMSU-VGOFRKELSA-N 2 0 383.492 3.792 20 5 GHBDRP Cc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(O)CC3)cc2)cc1[N+](=O)[O-] ZINC000132677666 903294639 /nfs/dbraw/zinc/29/46/39/903294639.db2.gz MTFCGPVEEKWTRD-KRWDZBQOSA-N 2 0 383.492 3.711 20 5 GHBDRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]C[C@H](O)c3cccc([N+](=O)[O-])c3)cc2)C1 ZINC000749675147 927230208 /nfs/dbraw/zinc/23/02/08/927230208.db2.gz IRQPWJPODSOUAG-JTSKRJEESA-N 2 0 383.492 3.650 20 5 GHBDRP O=[N+]([O-])c1ccc(N2CCC([NH2+]C[C@@H]3CCC[N@@H+]3C3CCCCC3)CC2)cc1 ZINC000798002373 932486593 /nfs/dbraw/zinc/48/65/93/932486593.db2.gz FVXFDBONVNXLFB-QFIPXVFZSA-N 2 0 386.540 3.950 20 5 GHBDRP O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[NH2+]Cc3nc4ccccc4o3)CC2)cc1 ZINC001207610522 1034486672 /nfs/dbraw/zinc/48/66/72/1034486672.db2.gz BMPMAGNWPKUEHG-UHFFFAOYSA-N 2 0 394.475 3.780 20 5 GHBDRP CC1(C)CCC[C@@H](C[NH2+]CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)O1 ZINC001207735459 1034547998 /nfs/dbraw/zinc/54/79/98/1034547998.db2.gz GOXGCKCZKIFXAY-NRFANRHFSA-N 2 0 389.540 3.787 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]C2CCC3(CC[NH2+]CC3)CC2)c1F ZINC001246255400 1037257279 /nfs/dbraw/zinc/25/72/79/1037257279.db2.gz JRJUFFCQDBEDLZ-AWEZNQCLSA-N 2 0 379.476 3.576 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]CC2(CC3CCC3)CC[NH2+]CC2)c1F ZINC001246422292 1037379019 /nfs/dbraw/zinc/37/90/19/1037379019.db2.gz BZYLKNFKEULGNC-OAHLLOKOSA-N 2 0 393.503 3.823 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH+]2CCC([C@@H]3CCCC[NH2+]3)CC2)c1F ZINC001246663412 1037533112 /nfs/dbraw/zinc/53/31/12/1037533112.db2.gz JZZICYBYZHFYMC-YOEHRIQHSA-N 2 0 379.476 3.528 20 5 GHBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@]2(c3ccccc3)CC[NH2+]C[C@H]2C1 ZINC001246669859 1037537537 /nfs/dbraw/zinc/53/75/37/1037537537.db2.gz ACECSDBWEAJCAP-RZFNWQHOSA-N 2 0 379.504 3.779 20 5 GHBDRP O=[N+]([O-])c1ccc(N2CCC([N@@H+]3CCCC[C@@H]3CC[NH+]3CCCC3)CC2)cc1 ZINC001254479454 1040265901 /nfs/dbraw/zinc/26/59/01/1040265901.db2.gz ZWEJNJSTOWPVHG-HXUWFJFHSA-N 2 0 386.540 3.904 20 5 GHBDRP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cccc(F)c2)[C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254588006 1040360875 /nfs/dbraw/zinc/36/08/75/1040360875.db2.gz UQHOJCZKZVBVBU-KCZVDYSFSA-N 2 0 383.467 3.973 20 5 GHBDRP O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[N@@H+]3CC[C@@H](c4ccccn4)C3)CC2)cc1 ZINC001308717713 1050070145 /nfs/dbraw/zinc/07/01/45/1050070145.db2.gz KUEVSPIBWZLANI-OAQYLSRUSA-N 2 0 394.519 3.734 20 5 GHBDRP O=[N+]([O-])c1ccc(OCCC[N@@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)cc1 ZINC001473466612 1073979267 /nfs/dbraw/zinc/97/92/67/1073979267.db2.gz JMWKVSORJDXHQK-QHCPKHFHSA-N 2 0 395.503 3.962 20 5 GHBDRP CC[NH+](CC)CCCC1CC[NH+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1 ZINC000611983999 835312672 /nfs/dbraw/zinc/31/26/72/835312672.db2.gz HHSBCDTYWPUFQL-UHFFFAOYSA-N 2 0 391.512 3.700 20 5 GHBDRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(OCc3ccc([N+](=O)[O-])cc3)c(OC)c2)C1 ZINC000120796562 836539721 /nfs/dbraw/zinc/53/97/21/836539721.db2.gz KFZJURZBLJJQTB-LJQANCHMSA-N 2 0 399.491 3.614 20 5 GHBDRP CN(C)CC[NH+]1CCC(C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000180452934 837267864 /nfs/dbraw/zinc/26/78/64/837267864.db2.gz UDHXUIOYHJUTIA-HSZRJFAPSA-N 2 0 396.535 3.547 20 5 GHBDRP COc1ccc(C[NH2+][C@@H](C)[C@@H]2CCC[NH2+]C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414858103 838898226 /nfs/dbraw/zinc/89/82/26/838898226.db2.gz QUBRFRSSCZBSGM-QFBILLFUSA-N 2 0 399.491 3.660 20 5 GHBDRP C[C@H]1C[NH2+]CC[C@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000414948679 839011450 /nfs/dbraw/zinc/01/14/50/839011450.db2.gz YNZCBOKNNQZXHZ-MEDUHNTESA-N 2 0 394.269 3.705 20 5 GHBDRP COc1cc(C[N@@H+]2CCC[C@@H]([C@H](C)[NH3+])C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000580311730 839229082 /nfs/dbraw/zinc/22/90/82/839229082.db2.gz OZSQZUAVOVBSJK-QFBILLFUSA-N 2 0 399.491 3.742 20 5 GHBDRP C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000126743375 842014330 /nfs/dbraw/zinc/01/43/30/842014330.db2.gz SHXFWOPIMAEKIE-JKSUJKDBSA-N 2 0 386.471 3.898 20 5 GHBDRP CCCn1ccnc1CCC[N@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000277126722 844709862 /nfs/dbraw/zinc/70/98/62/844709862.db2.gz IFEFMGDDTCHIBM-UHFFFAOYSA-N 2 0 397.479 3.963 20 5 GHBDRP [NH3+]C[C@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)C1 ZINC000435386937 850453937 /nfs/dbraw/zinc/45/39/37/850453937.db2.gz ZCQRTPRTFRIYTF-GFCCVEGCSA-N 2 0 394.269 3.788 20 5 GHBDRP Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)cc1[N+](=O)[O-] ZINC000248452511 856653589 /nfs/dbraw/zinc/65/35/89/856653589.db2.gz PVKAOLXDCZFAAU-UTKZUKDTSA-N 2 0 383.492 3.711 20 5 GHBDRP COc1ccc(C[C@H](C)[N@H+](Cc2ccccn2)[C@H]2CC[C@H]([NH3+])CC2)c([N+](=O)[O-])c1 ZINC001170326069 881362775 /nfs/dbraw/zinc/36/27/75/881362775.db2.gz CZGJYVFYIHFEMT-QRFRQXIXSA-N 2 0 398.507 3.702 20 5 GHBDRP Cc1c([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)cccc1[N+](=O)[O-] ZINC000161187434 859679059 /nfs/dbraw/zinc/67/90/59/859679059.db2.gz GAECXGBIHVLOKZ-QGZVFWFLSA-N 2 0 383.492 3.711 20 5 GHBDRP Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)cc1[N+](=O)[O-] ZINC000161180674 859679668 /nfs/dbraw/zinc/67/96/68/859679668.db2.gz QEYNFQCQXDPIEE-QGZVFWFLSA-N 2 0 383.492 3.711 20 5 GHBDRP CC[C@@H]([NH2+]C[C@@H]1CN(Cc2ccccc2)CCCO1)c1cccc([N+](=O)[O-])c1 ZINC000617584282 870466276 /nfs/dbraw/zinc/46/62/76/870466276.db2.gz BMTRUIMWFMKHML-FGZHOGPDSA-N 2 0 383.492 3.927 20 5 GHBDRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000539072270 871261112 /nfs/dbraw/zinc/26/11/12/871261112.db2.gz PFDCUFHUDAAKBH-KRWDZBQOSA-N 2 0 398.507 3.942 20 5 GHBDRP C[NH+](C)CCOc1ccc(CC[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000447560937 871860065 /nfs/dbraw/zinc/86/00/65/871860065.db2.gz GGYLTDXGMTXNJZ-QFIPXVFZSA-N 2 0 383.492 3.745 20 5 GHBDRP O=[N+]([O-])c1cccc(OCC[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)c1 ZINC001194692614 871891461 /nfs/dbraw/zinc/89/14/61/871891461.db2.gz QFJSMHRULRALQM-UHFFFAOYSA-N 2 0 395.503 3.962 20 5 GHBDRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000179915348 878211468 /nfs/dbraw/zinc/21/14/68/878211468.db2.gz DONBEDCHTMIJMZ-UHFFFAOYSA-N 2 0 394.479 3.536 20 5 GHBDRP O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCC3)c1 ZINC000853120659 878828969 /nfs/dbraw/zinc/82/89/69/878828969.db2.gz NWOZGNHTPQVNOT-IRLDBZIGSA-N 2 0 395.503 3.520 20 5 GHBDRP Cc1ccc([C@H](C)[NH2+]C[C@H](c2cccs2)N2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000531677700 880308940 /nfs/dbraw/zinc/30/89/40/880308940.db2.gz POEFGNHMAXHHIN-QFBILLFUSA-N 2 0 388.537 3.604 20 5 GHBDRP COc1ccc(C2([NH3+])CC[NH+]([C@H]3CCc4ccc([N+](=O)[O-])cc4CC3)CC2)cc1 ZINC001172906689 905932997 /nfs/dbraw/zinc/93/29/97/905932997.db2.gz OHXMKJLZHCHIRQ-FQEVSTJZSA-N 2 0 395.503 3.801 20 5 GHBDRP CC(C)[N@@H+]1CC[C@@H]([NH2+]C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)[C@H](C)C1 ZINC001173014557 906092663 /nfs/dbraw/zinc/09/26/63/906092663.db2.gz SEKJEPWOVRFYEQ-AUUYWEPGSA-N 2 0 396.482 3.550 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]CCC[NH+]2C[C@@H](C)C[C@H](C)C2)c1F ZINC001173176055 906251291 /nfs/dbraw/zinc/25/12/91/906251291.db2.gz GGGVLSQCBDAEDA-JYJNAYRXSA-N 2 0 381.492 3.631 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]CC2CC[NH+](CC(C)C)CC2)c1F ZINC001173178330 906254983 /nfs/dbraw/zinc/25/49/83/906254983.db2.gz FYZHXSLZETYONL-HNNXBMFYSA-N 2 0 381.492 3.631 20 5 GHBDRP Cc1ccc(C[NH+]2C[C@@H]3C[NH+]([C@@H](C)Cc4ccc([N+](=O)[O-])cc4)C[C@H]3C2)cc1 ZINC001173223669 906304943 /nfs/dbraw/zinc/30/49/43/906304943.db2.gz GMCAQLPFJNDCBE-VLCRHTCISA-N 2 0 379.504 3.898 20 5 GHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCCP(CCC[NH3+])c1ccccc1 ZINC001173229268 906312932 /nfs/dbraw/zinc/31/29/32/906312932.db2.gz MBLOTRZVYGKSOY-XZATXCMXSA-N 2 0 387.464 3.662 20 5 GHBDRP Cc1c([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)cccc1[N+](=O)[O-] ZINC000182227892 907161219 /nfs/dbraw/zinc/16/12/19/907161219.db2.gz KJDPDVZSPSZENT-FXAWDEMLSA-N 2 0 383.492 3.711 20 5 GHBDRP CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)[C@@H]([NH3+])C1CCCCC1 ZINC001219005449 1031207520 /nfs/dbraw/zinc/20/75/20/1031207520.db2.gz OEKUFFFSRXTCKR-NRFANRHFSA-N 2 0 392.503 3.803 20 5 GHBDRP [NH2+]=c1ccc2nc3c(cc(NC(=O)C4CC5(C[NH2+]C5)C4)c4ccccc43)oc-2c1 ZINC001219372003 1031385052 /nfs/dbraw/zinc/38/50/52/1031385052.db2.gz SXHRQDUZPGNNHM-UHFFFAOYSA-N 2 0 384.439 3.503 20 5 GHBDRP C[NH+](C)[C@H]1CCCC[C@@H]1NC(=O)[C@@H]([NH3+])Cc1c2ccccc2cc2ccccc21 ZINC001220221219 1031844216 /nfs/dbraw/zinc/84/42/16/1031844216.db2.gz VNBMABBCYHCKKM-HJOGWXRNSA-N 2 0 389.543 3.852 20 5 GHBDRP COc1ccc(C[C@@H](C)[NH2+][C@H](c2ccccc2)C2CC[NH2+]CC2)c([N+](=O)[O-])c1 ZINC001246252523 1037255739 /nfs/dbraw/zinc/25/57/39/1037255739.db2.gz RYJHMFKYZWEZJG-OPAMFIHVSA-N 2 0 383.492 3.865 20 5 GHBDRP COc1ccc(C[C@H](C)[NH2+]CC2(CC3CCC3)CC[NH2+]CC2)c([N+](=O)[O-])c1 ZINC001246423415 1037381259 /nfs/dbraw/zinc/38/12/59/1037381259.db2.gz JJUWEBPGZQTCGP-INIZCTEOSA-N 2 0 375.513 3.684 20 5 GHBDRP COc1ccc(C[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001246964741 1037788243 /nfs/dbraw/zinc/78/82/43/1037788243.db2.gz NAGMAJXHIPEJPU-ONTIZHBOSA-N 2 0 395.503 3.843 20 5 GHBDRP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001254479766 1040265456 /nfs/dbraw/zinc/26/54/56/1040265456.db2.gz KRTVSWPSKUHQHB-FCHUYYIVSA-N 2 0 386.540 3.902 20 5 GHBDRP COCC1(C[NH2+]CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)CCCC1 ZINC001308820278 1050106981 /nfs/dbraw/zinc/10/69/81/1050106981.db2.gz PBTAEUWTEQEHFZ-UHFFFAOYSA-N 2 0 389.540 3.646 20 5 GHBDRP C[NH+]1CCC2(CCC[N@H+](Cc3ccc([N+](=O)[O-])cc3Br)C2)CC1 ZINC001339862406 1059523562 /nfs/dbraw/zinc/52/35/62/1059523562.db2.gz QFALALSKXNVDKH-UHFFFAOYSA-N 2 0 382.302 3.665 20 5 GHBDRP [NH3+][C@@H]1CCO[C@H](C2CC[NH+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)CC2)C1 ZINC000415129983 839257061 /nfs/dbraw/zinc/25/70/61/839257061.db2.gz WAKBNIKZWWDAMF-IERDGZPVSA-N 2 0 385.464 3.573 20 5 GHBDRP Cc1cc(N2CCC(OCC[NH+]3CCCC3)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302196736 861235218 /nfs/dbraw/zinc/23/52/18/861235218.db2.gz SWEFBCMKKMMILX-UHFFFAOYSA-N 2 0 384.480 3.533 20 5 GHBDRP C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000430956285 843252253 /nfs/dbraw/zinc/25/22/53/843252253.db2.gz NYKZDSUSZVZRQI-SFHVURJKSA-N 2 0 388.556 3.784 20 5 GHBDRP COc1cc(C[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c([N+](=O)[O-])cc1O ZINC000513499026 845553126 /nfs/dbraw/zinc/55/31/26/845553126.db2.gz DBGCYYNCUSBPIM-FUHWJXTLSA-N 2 0 399.491 3.699 20 5 GHBDRP O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CCC[C@@H]([NH+]4CCCC4)CC3)o2)c1 ZINC000157089707 845846525 /nfs/dbraw/zinc/84/65/25/845846525.db2.gz LRTFOHWXCOXGPA-GOSISDBHSA-N 2 0 384.480 3.743 20 5 GHBDRP CSC1(C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CC[NH+](C)CC1 ZINC000582815080 848455975 /nfs/dbraw/zinc/45/59/75/848455975.db2.gz AEFCYQPTJBAASG-FUHWJXTLSA-N 2 0 377.554 3.723 20 5 GHBDRP COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000489673742 852523426 /nfs/dbraw/zinc/52/34/26/852523426.db2.gz BEEHFTGNIQLYDJ-UHFFFAOYSA-N 2 0 383.492 3.947 20 5 GHBDRP COc1ccc(C[C@@H](C)[NH2+]C2CC[NH+](CC3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC001170316982 881347415 /nfs/dbraw/zinc/34/74/15/881347415.db2.gz AYWXTRJSIUGDFV-MRXNPFEDSA-N 2 0 375.513 3.779 20 5 GHBDRP CC[NH+](CC)Cc1ccccc1C[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602514243 860085244 /nfs/dbraw/zinc/08/52/44/860085244.db2.gz RRTLUWOIFXRBEJ-UHFFFAOYSA-N 2 0 397.523 3.590 20 5 GHBDRP CC[NH+](CC)CCO[C@@H]1CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000538749589 870559479 /nfs/dbraw/zinc/55/94/79/870559479.db2.gz VRGKXIYQUKCEKJ-LJQANCHMSA-N 2 0 387.480 3.788 20 5 GHBDRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)[C@@H](C)C1 ZINC000248872533 912506344 /nfs/dbraw/zinc/50/63/44/912506344.db2.gz IGIDIJQEQVPYSV-ORYQWCPZSA-N 2 0 375.513 3.699 20 5 GHBDRP O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)cc1 ZINC000813371416 891555839 /nfs/dbraw/zinc/55/58/39/891555839.db2.gz ZATJTBJSTSYVKR-QFIPXVFZSA-N 2 0 395.503 3.616 20 5 GHBDRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000818959280 896298419 /nfs/dbraw/zinc/29/84/19/896298419.db2.gz HIPZAFXJMRSWGT-VGSWGCGISA-N 2 0 383.492 3.650 20 5 GHBDRP O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)c1 ZINC000818984466 896302668 /nfs/dbraw/zinc/30/26/68/896302668.db2.gz IDJMNIYPSMQZPH-QFIPXVFZSA-N 2 0 383.492 3.794 20 5 GHBDRP CC1CC[NH+](Cc2cccc(C[NH2+]C[C@@H](O)c3ccc([N+](=O)[O-])cc3)c2)CC1 ZINC000818996855 896313909 /nfs/dbraw/zinc/31/39/09/896313909.db2.gz XPKVFUANKBRHFN-JOCHJYFZSA-N 2 0 383.492 3.650 20 5 GHBDRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819100957 896377130 /nfs/dbraw/zinc/37/71/30/896377130.db2.gz XMORMIFSAXWJMP-QFIPXVFZSA-N 2 0 395.459 3.643 20 5 GHBDRP O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)n1 ZINC000578952494 904249557 /nfs/dbraw/zinc/24/95/57/904249557.db2.gz MWEUNHQKEPPQMN-UXHICEINSA-N 2 0 383.496 3.661 20 5 GHBDRP CC(C)c1ccc(C[NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)cc1[N+](=O)[O-] ZINC001177939052 908825593 /nfs/dbraw/zinc/82/55/93/908825593.db2.gz VFACZKADCSZBQP-UHFFFAOYSA-N 2 0 397.519 3.965 20 5 GHBDRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000749678433 927232110 /nfs/dbraw/zinc/23/21/10/927232110.db2.gz SAAKJXCASKGTBY-HTAPYJJXSA-N 2 0 383.492 3.792 20 5 GHBDRP Cc1ccc2c(c1)[C@@H](Nc1cc3c(cc1[N+](=O)[O-])C[NH2+]C3)CC21CC[NH2+]CC1 ZINC001163034829 1026017212 /nfs/dbraw/zinc/01/72/12/1026017212.db2.gz WQALWSFAXIASKN-FQEVSTJZSA-N 2 0 378.476 3.685 20 5 GHBDRP CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)[C@](C)([NH3+])CC(C)C ZINC001219005116 1031207844 /nfs/dbraw/zinc/20/78/44/1031207844.db2.gz CEEAXVUGHQPDHU-JOCHJYFZSA-N 2 0 380.492 3.659 20 5 GHBDRP C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C1CCC(C)([NH+]2CCCC2)CC1 ZINC001207581511 1034463293 /nfs/dbraw/zinc/46/32/93/1034463293.db2.gz OQROTNZRBWYILV-SRWJYRBRSA-N 2 0 388.512 3.699 20 5 GHBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CC2(CC[NH2+]CC2)Oc2ccccc21 ZINC001246138543 1037210916 /nfs/dbraw/zinc/21/09/16/1037210916.db2.gz YQONFAHEZVECIG-OXJNMPFZSA-N 2 0 381.476 3.761 20 5 GHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC1(Cc2cccc(F)c2)CC[NH2+]CC1 ZINC001246380454 1037338766 /nfs/dbraw/zinc/33/87/66/1037338766.db2.gz VTKZRHIPKHRDQC-QGZVFWFLSA-N 2 0 385.483 3.867 20 5 GHBDRP COc1cccc(CC2(C[NH2+][C@H](C)Cc3ccccc3[N+](=O)[O-])CC[NH2+]CC2)c1 ZINC001246381908 1037340658 /nfs/dbraw/zinc/34/06/58/1037340658.db2.gz VPNLFDJLLGWLBZ-GOSISDBHSA-N 2 0 397.519 3.737 20 5 GHBDRP COc1c(C)cccc1C[NH2+]CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001462383850 1070216534 /nfs/dbraw/zinc/21/65/34/1070216534.db2.gz QLRDVXTYVFDBFQ-UHFFFAOYSA-N 2 0 397.519 3.956 20 5 GHBDRP CC[C@@H]([NH2+]CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1)[C@@H]1CCCOC1 ZINC001474681872 1074511606 /nfs/dbraw/zinc/51/16/06/1074511606.db2.gz DTVNLPVBRHUJFL-IFMALSPDSA-N 2 0 389.540 3.644 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)CCCC2 ZINC000417328569 840715055 /nfs/dbraw/zinc/71/50/55/840715055.db2.gz GTCUMZPPJISELG-GGAORHGYSA-N 2 0 395.503 3.719 20 5 GHBDRP O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CCC[C@@H]([C@@H]4CCC[NH2+]C4)C3)cs2)c1 ZINC000592433548 857439761 /nfs/dbraw/zinc/43/97/61/857439761.db2.gz APZXDVPHXISNHM-IAGOWNOFSA-N 2 0 386.521 3.930 20 5 GHBDRP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000595019534 858353107 /nfs/dbraw/zinc/35/31/07/858353107.db2.gz QOCJOHOKOJSENK-QGZVFWFLSA-N 2 0 399.491 3.929 20 5 GHBDRP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCCC[N@@H+]2Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000593316233 859388713 /nfs/dbraw/zinc/38/87/13/859388713.db2.gz BFXQDOJVQLVGEZ-JJXUHFIVSA-N 2 0 385.464 3.716 20 5 GHBDRP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2)C1 ZINC000593316831 859394465 /nfs/dbraw/zinc/39/44/65/859394465.db2.gz YSKKCUQHZRSWDZ-CBGDNZLLSA-N 2 0 385.464 3.573 20 5 GHBDRP Cc1c([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)cccc1[N+](=O)[O-] ZINC000161187562 859691828 /nfs/dbraw/zinc/69/18/28/859691828.db2.gz GAECXGBIHVLOKZ-KRWDZBQOSA-N 2 0 383.492 3.711 20 5 GHBDRP Cc1ccc([C@@H](C)[NH2+]C[C@H](c2cccs2)N2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000531677701 880309444 /nfs/dbraw/zinc/30/94/44/880309444.db2.gz POEFGNHMAXHHIN-VQIMIIECSA-N 2 0 388.537 3.604 20 5 GHBDRP O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[NH2+]Cc3ncc(Cl)s3)CC2)cc1 ZINC001183674814 912719921 /nfs/dbraw/zinc/71/99/21/912719921.db2.gz ZXCCWLUMXIYOCS-UHFFFAOYSA-N 2 0 394.928 3.749 20 5 GHBDRP C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000123652824 901958856 /nfs/dbraw/zinc/95/88/56/901958856.db2.gz ODOOBLNPTISAPO-HNNXBMFYSA-N 2 0 387.484 3.760 20 5 GHBDRP CC[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000132753292 903304467 /nfs/dbraw/zinc/30/44/67/903304467.db2.gz AIJQKVJGYJSQDC-JOCHJYFZSA-N 2 0 383.492 3.792 20 5 GHBDRP CC(C)[N@@H+]1CC[C@@H]([NH2+]C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)[C@@H](C)C1 ZINC001173014558 906091610 /nfs/dbraw/zinc/09/16/10/906091610.db2.gz SEKJEPWOVRFYEQ-IFXJQAMLSA-N 2 0 396.482 3.550 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)c1F ZINC001173181200 906259507 /nfs/dbraw/zinc/25/95/07/906259507.db2.gz OELPPDYTHDKWEM-BPUTZDHNSA-N 2 0 379.476 3.655 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)CCC2 ZINC000192933040 908835399 /nfs/dbraw/zinc/83/53/99/908835399.db2.gz CESRMHSDFDXXRB-QHCPKHFHSA-N 2 0 395.503 3.719 20 5 GHBDRP C[N@@H+]1CCC[C@H](CCNC(=O)[C@@H]([NH3+])Cc2c3ccccc3cc3ccccc32)C1 ZINC001219980902 1031729102 /nfs/dbraw/zinc/72/91/02/1031729102.db2.gz QOFGDSBGNMKEEV-KOSHJBKYSA-N 2 0 389.543 3.711 20 5 GHBDRP [NH3+]CCCCCCCC[NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001246080797 1037187939 /nfs/dbraw/zinc/18/79/39/1037187939.db2.gz OOTFJYGJEBCJOR-UHFFFAOYSA-N 2 0 384.471 3.731 20 5 GHBDRP CC1(C)C[C@H]([NH2+]CCCNC(=O)c2c3ccccc3nc3ccccc32)CC[NH2+]1 ZINC001246483781 1037430249 /nfs/dbraw/zinc/43/02/49/1037430249.db2.gz OJOPJEAGHLLIOV-QGZVFWFLSA-N 2 0 390.531 3.628 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@@H]2CC[NH2+]C3(CCCCC3)C2)c1F ZINC001246511438 1037450148 /nfs/dbraw/zinc/45/01/48/1037450148.db2.gz IYHHIFLSNNIEDO-LSDHHAIUSA-N 2 0 379.476 3.718 20 5 GHBDRP [NH3+]C1(c2ccccc2)CC[NH+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC001254470733 1040256670 /nfs/dbraw/zinc/25/66/70/1040256670.db2.gz RTMJSTRCVDSOCG-UHFFFAOYSA-N 2 0 380.492 3.514 20 5 GHBDRP C[NH+](C)[C@@H]1CC[C@@H]2C[N@H+](Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)C[C@H]2C1 ZINC001355372340 1057135782 /nfs/dbraw/zinc/13/57/82/1057135782.db2.gz BBLJRIAJQGPFQH-JFIYKMOQSA-N 2 0 386.521 3.880 20 5 GHBDRP CCc1ccc([C@H](C[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)N(CC)CC)cc1 ZINC001474552171 1074460080 /nfs/dbraw/zinc/46/00/80/1074460080.db2.gz BITGAPSEVXLPAP-GRERDSQWSA-N 2 0 385.512 3.730 20 5 GHBDRP C[C@H]1C[C@@H]([NH2+]CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)CCS1 ZINC001474737936 1074539437 /nfs/dbraw/zinc/53/94/37/1074539437.db2.gz YMJKAZJZCFUDBZ-LPHOPBHVSA-N 2 0 377.554 3.723 20 5 GHBDRP C[C@H]1C[C@H]([NH2+]CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)CCS1 ZINC001474737939 1074539851 /nfs/dbraw/zinc/53/98/51/1074539851.db2.gz YMJKAZJZCFUDBZ-QFBILLFUSA-N 2 0 377.554 3.723 20 5 GHBDRP O=[N+]([O-])c1cc(C[N@H+]2CC[C@H]3C[NH2+]C[C@H]3CC2)ccc1Oc1ccc(F)cc1 ZINC000581884654 837740953 /nfs/dbraw/zinc/74/09/53/837740953.db2.gz RLIOCGNRAUHMCX-CALCHBBNSA-N 2 0 385.439 3.958 20 5 GHBDRP C[C@@]1(C[NH3+])CC[N@H+](Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000261916978 839874604 /nfs/dbraw/zinc/87/46/04/839874604.db2.gz YGAQCUCIBYVXPF-QFIPXVFZSA-N 2 0 391.475 3.618 20 5 GHBDRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000056184973 861447952 /nfs/dbraw/zinc/44/79/52/861447952.db2.gz RIVIKIRLVWVHND-INIZCTEOSA-N 2 0 384.480 3.553 20 5 GHBDRP C[C@@H]1C[NH+](CCCC[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C[C@@H](C)O1 ZINC000433147490 845501084 /nfs/dbraw/zinc/50/10/84/845501084.db2.gz OUAKNUCWCHARBG-JXXFODFXSA-N 2 0 375.513 3.796 20 5 GHBDRP Cc1ccc(C[N@@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)cc1[N+](=O)[O-] ZINC000538724070 845585082 /nfs/dbraw/zinc/58/50/82/845585082.db2.gz QDJHHCHYORESEF-UHFFFAOYSA-N 2 0 388.556 3.531 20 5 GHBDRP COc1cc(C[NH+]2CCC([C@@H](C)[NH3+])CC2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000435372873 850422061 /nfs/dbraw/zinc/42/20/61/850422061.db2.gz SUYLBEMGIJOUBX-MRXNPFEDSA-N 2 0 399.491 3.742 20 5 GHBDRP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]C[C@H]2CCC[N@@H+]2C2CCCCC2)n1 ZINC000436287977 851422217 /nfs/dbraw/zinc/42/22/17/851422217.db2.gz DKEBMRHDZIOESR-CEXWTWQISA-N 2 0 375.517 3.662 20 5 GHBDRP C[C@H]1C[NH+](CCCC[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H](C)O1 ZINC000171051808 862567536 /nfs/dbraw/zinc/56/75/36/862567536.db2.gz CMVCXRSDJHFWEL-IRXDYDNUSA-N 2 0 387.480 3.834 20 5 GHBDRP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000482140550 862726001 /nfs/dbraw/zinc/72/60/01/862726001.db2.gz WPZYJNWCZJNVNC-PKOBYXMFSA-N 2 0 390.528 3.722 20 5 GHBDRP [NH3+][C@@H]1CCO[C@H]1C1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000573802017 856485883 /nfs/dbraw/zinc/48/58/83/856485883.db2.gz YIWRCPNDSYTFGE-XLIONFOSSA-N 2 0 387.505 3.652 20 5 GHBDRP C[C@@H]1C[NH+](CC2CCN(Cc3ccc([N+](=O)[O-])cc3Cl)CC2)C[C@@H](C)O1 ZINC000542924174 856838542 /nfs/dbraw/zinc/83/85/42/856838542.db2.gz GNRZMLAWZWIJNB-HUUCEWRRSA-N 2 0 381.904 3.569 20 5 GHBDRP CCCC[N@H+](C)CC1CC[NH+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000114197093 857935851 /nfs/dbraw/zinc/93/58/51/857935851.db2.gz CPWXMMBYUFRMJZ-UHFFFAOYSA-N 2 0 390.528 3.676 20 5 GHBDRP COc1ccc(C[C@@H](C)[NH2+]C2CC[NH+](C[C@H]3CC=CCC3)CC2)c([N+](=O)[O-])c1 ZINC001170327140 881363812 /nfs/dbraw/zinc/36/38/12/881363812.db2.gz FDONZMFPHFDTHC-MSOLQXFVSA-N 2 0 387.524 3.945 20 5 GHBDRP CC[N@H+](C)Cc1cc(O[C@@H]2CC[NH+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)ccn1 ZINC000856585369 881557947 /nfs/dbraw/zinc/55/79/47/881557947.db2.gz CSIIUGMQCQLRHL-LAUBAEHRSA-N 2 0 398.507 3.964 20 5 GHBDRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(C[NH2+]C[C@H](O)c3ccc([N+](=O)[O-])cc3)cc2)C1 ZINC000776275687 876141802 /nfs/dbraw/zinc/14/18/02/876141802.db2.gz GUMRKYQUYHTNJI-PNCHPQGNSA-N 2 0 397.519 3.896 20 5 GHBDRP O=[N+]([O-])c1cccc([C@H](O)C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCC3)c1 ZINC000853120660 878829572 /nfs/dbraw/zinc/82/95/72/878829572.db2.gz NWOZGNHTPQVNOT-RBBKRZOGSA-N 2 0 395.503 3.520 20 5 GHBDRP Cc1ccc([C@@H](C)[NH2+]C[C@@H](c2cccs2)N2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000531677698 880309238 /nfs/dbraw/zinc/30/92/38/880309238.db2.gz POEFGNHMAXHHIN-APWZRJJASA-N 2 0 388.537 3.604 20 5 GHBDRP C[C@H]1CCCC[N@@H+]1CCCCN[C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272504912 887604627 /nfs/dbraw/zinc/60/46/27/887604627.db2.gz HYNGRZIZTBBQRQ-FXAWDEMLSA-N 2 0 385.512 3.662 20 5 GHBDRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000876930939 893392555 /nfs/dbraw/zinc/39/25/55/893392555.db2.gz HNGYAHGLADCNEU-PBPGXSGUSA-N 2 0 383.496 3.659 20 5 GHBDRP COc1ccc(C[NH+]2CCC(CC[NH3+])CC2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000566316786 896232800 /nfs/dbraw/zinc/23/28/00/896232800.db2.gz PHNWGWDQEGUJTH-UHFFFAOYSA-N 2 0 399.491 3.743 20 5 GHBDRP C[NH+]1CCC2(CCCN(Cc3ccc(Br)cc3[N+](=O)[O-])C2)CC1 ZINC000823015941 898771217 /nfs/dbraw/zinc/77/12/17/898771217.db2.gz MLVIECYBKVQDOM-UHFFFAOYSA-N 2 0 382.302 3.665 20 5 GHBDRP CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)C1CC[NH+](CC)CC1 ZINC001146786754 903603611 /nfs/dbraw/zinc/60/36/11/903603611.db2.gz NDCNBFKOSQUJGD-UHFFFAOYSA-N 2 0 392.503 3.627 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH+]1C[C@@H]3C[NH+](Cc4ccccc4)C[C@H]3C1)CC2 ZINC001172916509 905988063 /nfs/dbraw/zinc/98/80/63/905988063.db2.gz SPVSCNCHVVJUKE-RJGXRXQPSA-N 2 0 391.515 3.906 20 5 GHBDRP CC[NH+]1CCN(Cc2ccccc2C[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)CC1 ZINC001177294638 908498994 /nfs/dbraw/zinc/49/89/94/908498994.db2.gz NYCIBMFVQOPRFU-UHFFFAOYSA-N 2 0 396.535 3.639 20 5 GHBDRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]C[C@@H](O)c3cccc([N+](=O)[O-])c3)cc2)C1 ZINC000749675150 927230482 /nfs/dbraw/zinc/23/04/82/927230482.db2.gz IRQPWJPODSOUAG-VGOFRKELSA-N 2 0 383.492 3.650 20 5 GHBDRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000469760919 1016616625 /nfs/dbraw/zinc/61/66/25/1016616625.db2.gz ORQITFLWOYZRIW-QZTJIDSGSA-N 2 0 383.492 3.720 20 5 GHBDRP O=[N+]([O-])c1cc2c(cc1N[C@@H]1CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]13)C[NH2+]C2 ZINC001164492930 1026530296 /nfs/dbraw/zinc/53/02/96/1026530296.db2.gz PEFHPEKJYXWLQE-NSISKUIASA-N 2 0 378.476 3.521 20 5 GHBDRP O=[N+]([O-])c1cc2c(cc1N[C@@H]1CC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]31)C[NH2+]C2 ZINC001164492931 1026531080 /nfs/dbraw/zinc/53/10/80/1026531080.db2.gz PEFHPEKJYXWLQE-PWIZWCRZSA-N 2 0 378.476 3.521 20 5 GHBDRP CC(C)c1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)cc1[N+](=O)[O-] ZINC001461432715 1069547067 /nfs/dbraw/zinc/54/70/67/1069547067.db2.gz RVGILWJEHRIAPD-FQEVSTJZSA-N 2 0 383.492 3.575 20 5 GHBDRP O=[N+]([O-])c1ccc(N2CCC([N@@H+]3CCCC[C@@]4(CCCC[NH2+]C4)C3)CC2)cc1 ZINC001246613897 1037505908 /nfs/dbraw/zinc/50/59/08/1037505908.db2.gz ZPFJXPGPMSIDBH-JOCHJYFZSA-N 2 0 386.540 3.809 20 5 GHBDRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CCC2)C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC001246969371 1037792448 /nfs/dbraw/zinc/79/24/48/1037792448.db2.gz KQOOFHPIPQZGET-KESTWPANSA-N 2 0 386.540 3.936 20 5 GHBDRP O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[NH2+]C[C@@H]3CCCC3(F)F)CC2)cc1 ZINC001462245030 1070115843 /nfs/dbraw/zinc/11/58/43/1070115843.db2.gz CLZOFGPHHMHUDT-SFHVURJKSA-N 2 0 381.467 3.874 20 5 GHBDRP CCC[C@@H]([NH2+]Cc1ccccc1N1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC001323991844 1057050857 /nfs/dbraw/zinc/05/08/57/1057050857.db2.gz NETVEQZQVLMJIE-OAQYLSRUSA-N 2 0 382.508 3.978 20 5 GHBDRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH+](C)CCc3ccc([N+](=O)[O-])cc3)cc2)C[C@H](C)O1 ZINC001473598171 1074039232 /nfs/dbraw/zinc/03/92/32/1074039232.db2.gz NGTQRXUSDQHAGO-KDURUIRLSA-N 2 0 397.519 3.879 20 5 GHBDRP CC1(C)C[C@@H](C[NH2+]CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)CCO1 ZINC001474566174 1074465699 /nfs/dbraw/zinc/46/56/99/1074465699.db2.gz GCNCXXLRIFXXBQ-FQEVSTJZSA-N 2 0 389.540 3.644 20 5 GHBDRP C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000376389338 836915055 /nfs/dbraw/zinc/91/50/55/836915055.db2.gz VZXJTDXHQLOOPM-OAHLLOKOSA-N 2 0 385.468 3.514 20 5 GHBDRP O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]CC[C@@H]2CC[NH2+]C2)cc1 ZINC000414833776 838870330 /nfs/dbraw/zinc/87/03/30/838870330.db2.gz QDJDABZRJWAUEI-KRWDZBQOSA-N 2 0 391.475 3.537 20 5 GHBDRP COc1cc(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414930158 838986672 /nfs/dbraw/zinc/98/66/72/838986672.db2.gz SNLJHFXUCNTAOQ-ROUUACIJSA-N 2 0 385.464 3.542 20 5 GHBDRP [NH3+][C@H]1CCC[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)C1 ZINC000414925374 838990245 /nfs/dbraw/zinc/99/02/45/838990245.db2.gz LSTZJNYRKOYSQL-NWDGAFQWSA-N 2 0 394.269 3.977 20 5 GHBDRP COCC1(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[NH2+]CC1 ZINC000414966063 839018897 /nfs/dbraw/zinc/01/88/97/839018897.db2.gz BMOMDAUBWDZBGR-UHFFFAOYSA-N 2 0 393.871 3.614 20 5 GHBDRP COc1cc(CN[C@@H](C[NH3+])C(C)(C)C)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000415051608 839122373 /nfs/dbraw/zinc/12/23/73/839122373.db2.gz GLAVQTBGAPMBGH-FQEVSTJZSA-N 2 0 387.480 3.645 20 5 GHBDRP Cc1cc(N2CCC(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302171982 861230660 /nfs/dbraw/zinc/23/06/60/861230660.db2.gz MFFDWDAAKFBJCM-CALCHBBNSA-N 2 0 398.507 3.777 20 5 GHBDRP COc1cc(C[NH2+][C@H](C)[C@H]2CCC[NH2+]C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414863175 849995995 /nfs/dbraw/zinc/99/59/95/849995995.db2.gz YARZWPQITSNRTJ-APWZRJJASA-N 2 0 399.491 3.660 20 5 GHBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1 ZINC000126700834 853242029 /nfs/dbraw/zinc/24/20/29/853242029.db2.gz BEZNHTLGGXIMED-SFHVURJKSA-N 2 0 382.508 3.501 20 5 GHBDRP CCC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1)c1cccc([N+](=O)[O-])c1 ZINC000159508541 862794656 /nfs/dbraw/zinc/79/46/56/862794656.db2.gz PXNXVESDKZBEDL-OAQYLSRUSA-N 2 0 397.523 3.763 20 5 GHBDRP Cc1cc(NCC2CC[NH+](Cc3ccncc3)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000596439465 858897150 /nfs/dbraw/zinc/89/71/50/858897150.db2.gz BZVSMGQRANAHFP-UHFFFAOYSA-N 2 0 391.475 3.592 20 5 GHBDRP CC[NH+](CC)CCO[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000538751831 870572410 /nfs/dbraw/zinc/57/24/10/870572410.db2.gz QUVIZVQRNCPXFP-KRWDZBQOSA-N 2 0 387.480 3.788 20 5 GHBDRP O=[N+]([O-])C[C@H]1CC[C@H]([NH+]2CCC3(CC[NH+](Cc4cccs4)CC3)CC2)C1 ZINC001169020479 871122849 /nfs/dbraw/zinc/12/28/49/871122849.db2.gz JFFQKOSIUNNTGA-ROUUACIJSA-N 2 0 377.554 3.872 20 5 GHBDRP COc1ccc(C[NH2+]CC2CC[NH+](C)CC2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000105459141 888719988 /nfs/dbraw/zinc/71/99/88/888719988.db2.gz NIQCRLUKVMWJSC-UHFFFAOYSA-N 2 0 399.491 3.614 20 5 GHBDRP [NH3+]C[C@@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC12CCOCC2 ZINC000570682729 899504553 /nfs/dbraw/zinc/50/45/53/899504553.db2.gz NJEKTCGUMPOKTP-OAHLLOKOSA-N 2 0 387.505 3.511 20 5 GHBDRP CCn1ccc(C[N@H+](C)CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC001462097703 1069993205 /nfs/dbraw/zinc/99/32/05/1069993205.db2.gz QRSKYJMDXZIMEZ-UHFFFAOYSA-N 2 0 384.524 3.803 20 5 GHBDRP Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)CC21CC[NH2+]CC1 ZINC001246133655 1037210185 /nfs/dbraw/zinc/21/01/85/1037210185.db2.gz KZFFVLPRYSLMPD-XMSQKQJNSA-N 2 0 377.488 3.726 20 5 GHBDRP Cc1ccc2c(c1)C1(C[C@H]2[NH2+][C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC[NH2+]CC1 ZINC001246169472 1037223002 /nfs/dbraw/zinc/22/30/02/1037223002.db2.gz HAZVYEXLWKBFNT-PGRDOPGGSA-N 2 0 377.488 3.726 20 5 GHBDRP COc1ccc(C[C@@H](C)[NH2+]CC2(Cc3ccccc3)CC[NH2+]CC2)c([N+](=O)[O-])c1 ZINC001246436867 1037399120 /nfs/dbraw/zinc/39/91/20/1037399120.db2.gz MNISDMHFAULEJC-GOSISDBHSA-N 2 0 397.519 3.737 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH2+][C@H](CC1CC[NH2+]CC1)c1cccc(F)c1)C2 ZINC001246446062 1037407447 /nfs/dbraw/zinc/40/74/47/1037407447.db2.gz BLEFYWDUSKLMDE-IFMALSPDSA-N 2 0 383.467 3.922 20 5 GHBDRP C[C@@H]1C[C@@H]([NH2+]CCCNC(=O)c2c3ccccc3nc3ccccc32)C[C@H](C)[NH2+]1 ZINC001246484854 1037430513 /nfs/dbraw/zinc/43/05/13/1037430513.db2.gz RYTDUGPWKUZQOD-BCDXTJNWSA-N 2 0 390.531 3.627 20 5 GHBDRP COc1ccc(C[C@H](C)[N@@H+]2CC[C@]3(C[NH2+]C[C@@H]3c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001246685372 1037547558 /nfs/dbraw/zinc/54/75/58/1037547558.db2.gz OMNDWOYTJFPZBI-LXBDKUERSA-N 2 0 395.503 3.614 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@@H+](Cc1ccc(F)cc1)CC1CC[NH2+]CC1)C2 ZINC001246934865 1037737758 /nfs/dbraw/zinc/73/77/58/1037737758.db2.gz CIYULJZSFWXHEY-QFIPXVFZSA-N 2 0 383.467 3.703 20 5 GHBDRP CCC[C@H]([NH2+]Cc1cccc(CN2CC[NH+](C)CC2)c1)c1cccc([N+](=O)[O-])c1 ZINC001253103844 1039426361 /nfs/dbraw/zinc/42/63/61/1039426361.db2.gz MNVHCXHEMVCPOD-QHCPKHFHSA-N 2 0 396.535 3.973 20 5 GHBDRP Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](CC(C)C)CC1CC[NH+](C)CC1 ZINC001460671140 1069075179 /nfs/dbraw/zinc/07/51/79/1069075179.db2.gz MFZQVDZWFZSDRO-UHFFFAOYSA-N 2 0 390.528 3.532 20 5 GHBDRP O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)C1CC1 ZINC000179469857 835733940 /nfs/dbraw/zinc/73/39/40/835733940.db2.gz SCXBBZOVLUJKKM-OAQYLSRUSA-N 2 0 380.492 3.817 20 5 GHBDRP COc1cc(C[NH2+][C@@H]2CCCC[C@H]2C[NH3+])ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414803412 838846762 /nfs/dbraw/zinc/84/67/62/838846762.db2.gz NVKQRLRVUSXGNP-AZUAARDMSA-N 2 0 399.491 3.790 20 5 GHBDRP C[C@H]1C[NH2+]CC[C@H]1[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000414946580 839010473 /nfs/dbraw/zinc/01/04/73/839010473.db2.gz UCDDAIRWMBAAEY-HRAATJIYSA-N 2 0 391.475 3.535 20 5 GHBDRP COc1ccc(C[N@@H+]2CC[C@@H](C)[C@H](C[NH3+])C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000415125849 839235190 /nfs/dbraw/zinc/23/51/90/839235190.db2.gz LLJQAVDODLNDDB-VQIMIIECSA-N 2 0 399.491 3.599 20 5 GHBDRP C[C@H](C[NH2+][C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1)N1CC[NH+](C)CC1 ZINC000127315305 842252845 /nfs/dbraw/zinc/25/28/45/842252845.db2.gz XFTDQYZUBFXUTQ-CVEARBPZSA-N 2 0 388.537 3.610 20 5 GHBDRP [NH3+]C[C@H]1CCC[N@H+](Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000435391156 850459006 /nfs/dbraw/zinc/45/90/06/850459006.db2.gz VMVQUIWOZWFRDL-QGZVFWFLSA-N 2 0 391.475 3.618 20 5 GHBDRP CCC[C@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000595068525 858370949 /nfs/dbraw/zinc/37/09/49/858370949.db2.gz IKQGWYFAAARDJG-VXKWHMMOSA-N 2 0 383.492 3.792 20 5 GHBDRP C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(c2cc(C3CC[NH2+]CC3)[nH]n2)CC1 ZINC000595908656 858715092 /nfs/dbraw/zinc/71/50/92/858715092.db2.gz OLFYAKNRTWENTQ-HNNXBMFYSA-N 2 0 383.496 3.726 20 5 GHBDRP CN(c1ccccc1C[N@H+](C)CCc1cccc([N+](=O)[O-])c1)C1CC[NH+](C)CC1 ZINC000555340359 865931619 /nfs/dbraw/zinc/93/16/19/865931619.db2.gz YHQMTOKSIBVTGQ-UHFFFAOYSA-N 2 0 396.535 3.800 20 5 GHBDRP O=[N+]([O-])c1cc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c2c(c1)COCO2 ZINC000121576344 868565681 /nfs/dbraw/zinc/56/56/81/868565681.db2.gz MNORTFHRFAAMGA-UHFFFAOYSA-N 2 0 389.496 3.549 20 5 GHBDRP C[N@H+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[NH+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C[C@@H]21 ZINC001169021993 871124789 /nfs/dbraw/zinc/12/47/89/871124789.db2.gz MBBJRYCPHMFYMG-WUOIFLIFSA-N 2 0 377.554 3.726 20 5 GHBDRP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)n1 ZINC000447526779 871755403 /nfs/dbraw/zinc/75/54/03/871755403.db2.gz CPPYLMDJIGKULR-NHCUHLMSSA-N 2 0 397.523 3.777 20 5 GHBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO ZINC000540988365 872683076 /nfs/dbraw/zinc/68/30/76/872683076.db2.gz KILNUELEASIVDD-LAUBAEHRSA-N 2 0 383.492 3.711 20 5 GHBDRP O=C(CC[NH+]1CCC(CCC[NH+]2CCCC2)CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000443601392 874297915 /nfs/dbraw/zinc/29/79/15/874297915.db2.gz HBODAEYQRKPZIS-UHFFFAOYSA-N 2 0 388.512 3.511 20 5 GHBDRP O=[N+]([O-])c1ccc([C@H](O)C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCC3)cc1 ZINC000853120777 878829354 /nfs/dbraw/zinc/82/93/54/878829354.db2.gz QFWMMWYUEFYWSA-IFMALSPDSA-N 2 0 395.503 3.520 20 5 GHBDRP [NH3+][C@@H]1CCCO[C@@H]1C1CC[NH+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000415133200 880612363 /nfs/dbraw/zinc/61/23/63/880612363.db2.gz UYGSRQATBCJPAS-TZIWHRDSSA-N 2 0 385.464 3.573 20 5 GHBDRP COc1ccc(C[C@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001170296678 881316864 /nfs/dbraw/zinc/31/68/64/881316864.db2.gz HMWATFKTFJGKCH-PKOBYXMFSA-N 2 0 383.492 3.646 20 5 GHBDRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000495439877 885808452 /nfs/dbraw/zinc/80/84/52/885808452.db2.gz OHEBYJSILKLTFX-QAPCUYQASA-N 2 0 383.920 3.517 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ccccc1C[N@H+]1CCC[C@H]1CO)CCC2 ZINC000249001388 889071641 /nfs/dbraw/zinc/07/16/41/889071641.db2.gz QSGHIUQZSJKTJB-JTHBVZDNSA-N 2 0 395.503 3.719 20 5 GHBDRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000154459652 892317887 /nfs/dbraw/zinc/31/78/87/892317887.db2.gz OZYOKDRJIIUIFJ-UWJYYQICSA-N 2 0 375.513 3.605 20 5 GHBDRP [NH3+]C[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC12CCOCC2 ZINC000563135595 893397709 /nfs/dbraw/zinc/39/77/09/893397709.db2.gz RJWJJZVCJMVWRA-MRXNPFEDSA-N 2 0 387.505 3.511 20 5 GHBDRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000818959777 896296418 /nfs/dbraw/zinc/29/64/18/896296418.db2.gz SUDHSEYIDDNHIP-JTSKRJEESA-N 2 0 383.492 3.792 20 5 GHBDRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000818959776 896296960 /nfs/dbraw/zinc/29/69/60/896296960.db2.gz SUDHSEYIDDNHIP-HTAPYJJXSA-N 2 0 383.492 3.792 20 5 GHBDRP CC1CC[NH+](Cc2cccc(C[NH2+]C[C@H](O)c3cccc([N+](=O)[O-])c3)c2)CC1 ZINC000818996219 896312095 /nfs/dbraw/zinc/31/20/95/896312095.db2.gz MTSUUYIIABBCDB-QFIPXVFZSA-N 2 0 383.492 3.650 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc3ccccc3)C1)CC2 ZINC001172900672 905921430 /nfs/dbraw/zinc/92/14/30/905921430.db2.gz XTPNPUDRMZNOBM-SIKLNZKXSA-N 2 0 379.504 3.954 20 5 GHBDRP [NH3+]C1(Cc2ccccc2)CC[NH+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172900008 905921792 /nfs/dbraw/zinc/92/17/92/905921792.db2.gz BAWGYVCTVGYMIG-NRFANRHFSA-N 2 0 379.504 3.878 20 5 GHBDRP C[NH+](C)CCOc1ccccc1C[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172901296 905923253 /nfs/dbraw/zinc/92/32/53/905923253.db2.gz HBPPEFZTIOVYTN-HXUWFJFHSA-N 2 0 383.492 3.572 20 5 GHBDRP Cc1ccc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)cc1[N+](=O)[O-] ZINC000182228687 907164019 /nfs/dbraw/zinc/16/40/19/907164019.db2.gz PVKAOLXDCZFAAU-LAUBAEHRSA-N 2 0 383.492 3.711 20 5 GHBDRP C[C@H]([NH2+]CCCC[NH+]1CCN(Cc2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000467835850 929485072 /nfs/dbraw/zinc/48/50/72/929485072.db2.gz AELHYDHKXUZALP-FQEVSTJZSA-N 2 0 396.535 3.843 20 5 GHBDRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000559935036 932971053 /nfs/dbraw/zinc/97/10/53/932971053.db2.gz LPFRQPAMKWVHGP-UHFFFAOYSA-N 2 0 383.492 3.818 20 5 GHBDRP C[NH+]1CCN(c2ccccc2C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC001118026273 934080237 /nfs/dbraw/zinc/08/02/37/934080237.db2.gz DJRBPBWCLWKKMO-JOCHJYFZSA-N 2 0 394.519 3.904 20 5 GHBDRP [NH3+]C1CC[NH+](CCc2cn(-c3ncc([N+](=O)[O-])cc3Cl)c3ccccc23)CC1 ZINC001159459784 1034603852 /nfs/dbraw/zinc/60/38/52/1034603852.db2.gz FKBSMFMCZDWWHZ-UHFFFAOYSA-N 2 0 399.882 3.553 20 5 GHBDRP [NH3+]C1CC[NH+](CCc2cn(-c3ncc(Cl)cc3[N+](=O)[O-])c3ccccc23)CC1 ZINC001159460006 1034605709 /nfs/dbraw/zinc/60/57/09/1034605709.db2.gz KDPPOCAALGBJLT-UHFFFAOYSA-N 2 0 399.882 3.553 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH+]2CCC([C@H]3CCCC[NH2+]3)CC2)c1F ZINC001246663410 1037533746 /nfs/dbraw/zinc/53/37/46/1037533746.db2.gz JZZICYBYZHFYMC-WMLDXEAASA-N 2 0 379.476 3.528 20 5 GHBDRP COc1ccc(C[C@@H](C)[N@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c([N+](=O)[O-])c1 ZINC001246936759 1037741391 /nfs/dbraw/zinc/74/13/91/1037741391.db2.gz JNIKNDPZRPLXAV-SJORKVTESA-N 2 0 375.513 3.779 20 5 GHBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCSCc1csc(CN(C)C)n1 ZINC001254537979 1040308779 /nfs/dbraw/zinc/30/87/79/1040308779.db2.gz LHIZDNAOUXRYMD-AWEZNQCLSA-N 2 0 394.566 3.567 20 5 GHBDRP COc1ccccc1C[N@H+]([C@@H]1Cc2ccc([N+](=O)[O-])cc2C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001254586960 1040361070 /nfs/dbraw/zinc/36/10/70/1040361070.db2.gz NNZVGNDERGIKMS-KCZVDYSFSA-N 2 0 395.503 3.843 20 5 GHBDRP COc1cc(N2CCC([N@H+](CCC[NH3+])C3CCCCC3)CC2)ccc1[N+](=O)[O-] ZINC001256084457 1041514920 /nfs/dbraw/zinc/51/49/20/1041514920.db2.gz DIYHNSZDEVIYTE-UHFFFAOYSA-N 2 0 390.528 3.556 20 5 GHBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cccc(CN2CC[NH+](C)CC2)c1 ZINC001322643749 1056783038 /nfs/dbraw/zinc/78/30/38/1056783038.db2.gz TXDVACFXQPWBAP-GOSISDBHSA-N 2 0 382.508 3.501 20 5 GHBDRP O=[N+]([O-])c1ccc(OCCC[N@@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)cc1 ZINC001473466611 1073979154 /nfs/dbraw/zinc/97/91/54/1073979154.db2.gz JMWKVSORJDXHQK-HSZRJFAPSA-N 2 0 395.503 3.962 20 5 GHBDRP CC1CC[NH+](C2CCC([NH2+][C@@H]3CCCC[C@@H]3n3ccc([N+](=O)[O-])n3)CC2)CC1 ZINC000573015319 835348559 /nfs/dbraw/zinc/34/85/59/835348559.db2.gz DJYXPRJIDHIZSE-TUNPWDSISA-N 2 0 389.544 3.908 20 5 GHBDRP COc1ccc(-c2ccc(C[N@@H+]3CCC[C@H]([C@H]4CC[NH2+]C4)C3)o2)c([N+](=O)[O-])c1 ZINC000584291283 835849224 /nfs/dbraw/zinc/84/92/24/835849224.db2.gz JBWMDGGYURHKNM-HOTGVXAUSA-N 2 0 385.464 3.685 20 5 GHBDRP COc1ccc(C[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414792605 838843211 /nfs/dbraw/zinc/84/32/11/838843211.db2.gz CLKDDDQUJNSREI-UYAOXDASSA-N 2 0 399.491 3.790 20 5 GHBDRP COc1cc(C[NH2+]CC[C@H]2CCC[NH2+]C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000414845348 838887086 /nfs/dbraw/zinc/88/70/86/838887086.db2.gz SLNBJIKQPOZSRV-QGZVFWFLSA-N 2 0 399.491 3.662 20 5 GHBDRP [NH3+][C@@H]1CCO[C@H](C2CC[NH+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)CC2)C1 ZINC000415126945 839236986 /nfs/dbraw/zinc/23/69/86/839236986.db2.gz QMQQUDKSJASNNJ-UTKZUKDTSA-N 2 0 385.464 3.573 20 5 GHBDRP COc1ccc(C[N@@H+]2CCC[C@@H](CC[NH3+])C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000442921897 858245246 /nfs/dbraw/zinc/24/52/46/858245246.db2.gz NUYZDTOIMPKOBU-KRWDZBQOSA-N 2 0 399.491 3.743 20 5 GHBDRP CC(C)c1ccc(C[NH2+]Cc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)cc1[N+](=O)[O-] ZINC000594973532 858336230 /nfs/dbraw/zinc/33/62/30/858336230.db2.gz FDORDHLQCFCIOF-FQEVSTJZSA-N 2 0 383.492 3.575 20 5 GHBDRP CC(C)c1ccc(C[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1[N+](=O)[O-] ZINC000594953027 858344014 /nfs/dbraw/zinc/34/40/14/858344014.db2.gz GRUPWVYVIQKXMW-UHFFFAOYSA-N 2 0 375.513 3.699 20 5 GHBDRP O=[N+]([O-])c1cc(C(F)F)ccc1NCCC[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC000596097048 858764138 /nfs/dbraw/zinc/76/41/38/858764138.db2.gz DHTKOPPTELQXMX-UHFFFAOYSA-N 2 0 391.422 3.552 20 5 GHBDRP CC[NH+](CC)CCO[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000538751832 870572122 /nfs/dbraw/zinc/57/21/22/870572122.db2.gz QUVIZVQRNCPXFP-QGZVFWFLSA-N 2 0 387.480 3.788 20 5 GHBDRP O=[N+]([O-])c1ccc(OCCC[NH+]2CCN(c3cc[nH+]c4ccccc43)CC2)cc1 ZINC001194203616 871553852 /nfs/dbraw/zinc/55/38/52/871553852.db2.gz HZNNVOHQOGAQKM-UHFFFAOYSA-N 2 0 392.459 3.734 20 5 GHBDRP CC(C)c1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H]2CO)cc1[N+](=O)[O-] ZINC001201626840 875801655 /nfs/dbraw/zinc/80/16/55/875801655.db2.gz QEPCOERMNUZHNW-NRFANRHFSA-N 2 0 397.519 3.965 20 5 GHBDRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+]C[C@H](O)c3ccc([N+](=O)[O-])cc3)cc2)C1 ZINC000776275681 876141724 /nfs/dbraw/zinc/14/17/24/876141724.db2.gz GUMRKYQUYHTNJI-IXFSTUDKSA-N 2 0 397.519 3.896 20 5 GHBDRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000537991203 878635877 /nfs/dbraw/zinc/63/58/77/878635877.db2.gz MDSFEKNEUXTNOU-LJQANCHMSA-N 2 0 382.508 3.848 20 5 GHBDRP C[NH+](C)CCOc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cc1 ZINC000618731759 881020560 /nfs/dbraw/zinc/02/05/60/881020560.db2.gz HDTYTUGEHMDDGC-UHFFFAOYSA-N 2 0 397.397 3.844 20 5 GHBDRP C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000866388673 888853522 /nfs/dbraw/zinc/85/35/22/888853522.db2.gz MBDFDPPDSHUTBJ-INIZCTEOSA-N 2 0 386.471 3.562 20 5 GHBDRP COc1cc(CNC[C@H]2CCCC[N@H+](Cc3ccccc3)C2)c([N+](=O)[O-])cc1O ZINC000564498410 895037607 /nfs/dbraw/zinc/03/76/07/895037607.db2.gz SBGTZIOYQSHGPU-GOSISDBHSA-N 2 0 399.491 3.701 20 5 GHBDRP C[C@H]1CCC[N@H+](Cc2ccccc2C[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000818960109 896266796 /nfs/dbraw/zinc/26/67/96/896266796.db2.gz XNFBMIZDEUTVIJ-JTSKRJEESA-N 2 0 383.492 3.650 20 5 GHBDRP [NH3+][C@H]1CC[C@H]([N@H+](C2CCOCC2)[C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172906803 905934440 /nfs/dbraw/zinc/93/44/40/905934440.db2.gz OWTNTVUWGCPNIG-UFYCRDLUSA-N 2 0 387.524 3.593 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]CCC[NH+]2C[C@H](C)C[C@@H](C)C2)c1F ZINC001173176056 906251545 /nfs/dbraw/zinc/25/15/45/906251545.db2.gz GGGVLSQCBDAEDA-OAGGEKHMSA-N 2 0 381.492 3.631 20 5 GHBDRP CC[NH+](CC)[C@H]1CC[C@@H]([NH2+][C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])CC1 ZINC001173184183 906266395 /nfs/dbraw/zinc/26/63/95/906266395.db2.gz LUNYKQPNWLJNIT-HRCADAONSA-N 2 0 381.492 3.916 20 5 GHBDRP Cc1ccc(C[NH+]2C[C@@H]3C[N@H+]([C@H](C)Cc4ccc([N+](=O)[O-])cc4)C[C@@H]3C2)cc1 ZINC001173223665 906305588 /nfs/dbraw/zinc/30/55/88/906305588.db2.gz GMCAQLPFJNDCBE-QIJUGHKUSA-N 2 0 379.504 3.898 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C[NH+]3CCC(O)CC3)cc1)CCC2 ZINC000192834353 908828967 /nfs/dbraw/zinc/82/89/67/908828967.db2.gz VPHGNKQFPFWMCQ-QHCPKHFHSA-N 2 0 395.503 3.719 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CC1(c3cccc(F)c3)CC[NH2+]CC1)CC2 ZINC001246394152 1037354106 /nfs/dbraw/zinc/35/41/06/1037354106.db2.gz LUAAYMRGHHUJCR-NRFANRHFSA-N 2 0 397.494 3.892 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@H]2CC[NH2+]C3(CCCCC3)C2)c1F ZINC001246511435 1037450349 /nfs/dbraw/zinc/45/03/49/1037450349.db2.gz IYHHIFLSNNIEDO-CABCVRRESA-N 2 0 379.476 3.718 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1Cc3ccccc3C3(CC[NH2+]CC3)C1)CC2 ZINC001246861260 1037679634 /nfs/dbraw/zinc/67/96/34/1037679634.db2.gz OMNSIWDFMLXDOV-NRFANRHFSA-N 2 0 391.515 3.979 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c1F ZINC001246936767 1037742837 /nfs/dbraw/zinc/74/28/37/1037742837.db2.gz JOUQOLLBFMWSAW-CVEARBPZSA-N 2 0 393.503 3.918 20 5 GHBDRP Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC[C@H](O)C[NH2+]C(C)(C)C ZINC001253400733 1039601946 /nfs/dbraw/zinc/60/19/46/1039601946.db2.gz NBFLZGFLTPQSRB-IBGZPJMESA-N 2 0 380.536 3.923 20 5 GHBDRP C[NH+](C)[C@@H]1CC[C@@H]2C[N@H+](Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)C[C@@H]2C1 ZINC001355372346 1057136042 /nfs/dbraw/zinc/13/60/42/1057136042.db2.gz BBLJRIAJQGPFQH-SOLBZPMBSA-N 2 0 386.521 3.880 20 5 GHBDRP O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC001325856168 1057374484 /nfs/dbraw/zinc/37/44/84/1057374484.db2.gz XWLLVFUEISFVKU-MWWJCJHHSA-N 2 0 395.503 3.804 20 5 GHBDRP C[C@@]12CSC[C@@H]1C[N@H+](CC1CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC1)C2 ZINC001474741726 1074542178 /nfs/dbraw/zinc/54/21/78/1074542178.db2.gz WUCQLPHETWHSBA-PZJWPPBQSA-N 2 0 389.565 3.534 20 5 GHBDRP COc1ccc(-c2ccc(C[N@@H+]3CCC[C@@H]4C[NH+](C)CC[C@@H]43)o2)c([N+](=O)[O-])c1 ZINC000583532986 834587073 /nfs/dbraw/zinc/58/70/73/834587073.db2.gz ZOEYVWBRSZKRPP-BEFAXECRSA-N 2 0 385.464 3.780 20 5 GHBDRP C[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000610372537 838759889 /nfs/dbraw/zinc/75/98/89/838759889.db2.gz ZTNKAPCXJSIIFO-FQEVSTJZSA-N 2 0 383.492 3.818 20 5 GHBDRP COc1cc(C[N@@H+]2CCC[C@H]([C@H](C)[NH3+])C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000580311729 839229013 /nfs/dbraw/zinc/22/90/13/839229013.db2.gz OZSQZUAVOVBSJK-LPHOPBHVSA-N 2 0 399.491 3.742 20 5 GHBDRP [NH3+][C@H]1CCO[C@@H](C2CC[NH+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)CC2)C1 ZINC000415129982 839256535 /nfs/dbraw/zinc/25/65/35/839256535.db2.gz WAKBNIKZWWDAMF-HRAATJIYSA-N 2 0 385.464 3.573 20 5 GHBDRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@@H]3CCc4c3cccc4[N+](=O)[O-])cc2)CC1 ZINC000584730803 840696525 /nfs/dbraw/zinc/69/65/25/840696525.db2.gz PXGGCOTYWPVAJV-OAQYLSRUSA-N 2 0 381.476 3.845 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)CCCC2 ZINC000417328570 840714949 /nfs/dbraw/zinc/71/49/49/840714949.db2.gz GTCUMZPPJISELG-GMAHTHKFSA-N 2 0 395.503 3.719 20 5 GHBDRP O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000433053767 845097171 /nfs/dbraw/zinc/09/71/71/845097171.db2.gz RRZOCKDUYRBQBZ-UHFFFAOYSA-N 2 0 395.503 3.962 20 5 GHBDRP COc1cc(C[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c([N+](=O)[O-])cc1O ZINC000513499027 845553266 /nfs/dbraw/zinc/55/32/66/845553266.db2.gz DBGCYYNCUSBPIM-SJLPKXTDSA-N 2 0 399.491 3.699 20 5 GHBDRP COc1ccc(C[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000513500101 845553719 /nfs/dbraw/zinc/55/37/19/845553719.db2.gz KOHOHUPCSFOWPY-XLIONFOSSA-N 2 0 383.492 3.994 20 5 GHBDRP CCC[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)c1cccc([N+](=O)[O-])c1 ZINC000246455404 850762478 /nfs/dbraw/zinc/76/24/78/850762478.db2.gz PMRCRNRCKCJVBE-PCCBWWKXSA-N 2 0 375.513 3.794 20 5 GHBDRP CCCC[N@H+](C)CC1CC[NH+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])CC1 ZINC000134161536 862868458 /nfs/dbraw/zinc/86/84/58/862868458.db2.gz OUSXRMZNYBQPHZ-UHFFFAOYSA-N 2 0 379.501 3.556 20 5 GHBDRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H]3CCc4c3cccc4[N+](=O)[O-])cc2)CC1 ZINC000594493345 858191094 /nfs/dbraw/zinc/19/10/94/858191094.db2.gz CWGIFEHESYXXTD-JOCHJYFZSA-N 2 0 394.519 3.509 20 5 GHBDRP CCC[C@@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000595051976 858381076 /nfs/dbraw/zinc/38/10/76/858381076.db2.gz ZJGVFFXGLPGQRQ-OAQYLSRUSA-N 2 0 375.513 3.917 20 5 GHBDRP COc1ccc(C[C@@H](C)[NH2+]C2CC[NH+](C[C@@H]3CC=CCC3)CC2)c([N+](=O)[O-])c1 ZINC001170327142 881365075 /nfs/dbraw/zinc/36/50/75/881365075.db2.gz FDONZMFPHFDTHC-QZTJIDSGSA-N 2 0 387.524 3.945 20 5 GHBDRP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C2)C1 ZINC000593314670 859380172 /nfs/dbraw/zinc/38/01/72/859380172.db2.gz DZSUCKQAYAFVIL-CSODHUTKSA-N 2 0 385.464 3.573 20 5 GHBDRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000447506771 871718460 /nfs/dbraw/zinc/71/84/60/871718460.db2.gz DZKFOAZREYSMAV-UXHICEINSA-N 2 0 385.512 3.907 20 5 GHBDRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000447522911 871746757 /nfs/dbraw/zinc/74/67/57/871746757.db2.gz ZUPSDJMKJFYRPN-PMACEKPBSA-N 2 0 385.512 3.907 20 5 GHBDRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000447522914 871746993 /nfs/dbraw/zinc/74/69/93/871746993.db2.gz ZUPSDJMKJFYRPN-WOJBJXKFSA-N 2 0 385.512 3.907 20 5 GHBDRP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)n1 ZINC000447512384 871775797 /nfs/dbraw/zinc/77/57/97/871775797.db2.gz YEIIZXKPOIINGN-WOJBJXKFSA-N 2 0 383.496 3.661 20 5 GHBDRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)[C@H](C)C1 ZINC000248872526 912505504 /nfs/dbraw/zinc/50/55/04/912505504.db2.gz IGIDIJQEQVPYSV-CZAAIQMYSA-N 2 0 375.513 3.699 20 5 GHBDRP CC1CC[NH+](Cc2cccc(C[NH2+]C[C@@H](O)c3cccc([N+](=O)[O-])c3)c2)CC1 ZINC000818996218 896312707 /nfs/dbraw/zinc/31/27/07/896312707.db2.gz MTSUUYIIABBCDB-JOCHJYFZSA-N 2 0 383.492 3.650 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH+]1CCC([NH+]3CCC(F)CC3)CC1)CC2 ZINC001172916847 905988178 /nfs/dbraw/zinc/98/81/78/905988178.db2.gz UFPGKIPKAVHRTJ-IBGZPJMESA-N 2 0 375.488 3.741 20 5 GHBDRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000749678438 927231284 /nfs/dbraw/zinc/23/12/84/927231284.db2.gz SAAKJXCASKGTBY-VGOFRKELSA-N 2 0 383.492 3.792 20 5 GHBDRP C[C@H]1[NH2+]CCC[C@H]1C(=O)Nc1cc2oc3cc(=[NH2+])ccc-3nc2c2ccccc12 ZINC001219369250 1031383461 /nfs/dbraw/zinc/38/34/61/1031383461.db2.gz ARPFBYUEPHDVHV-UKRRQHHQSA-N 2 0 386.455 3.892 20 5 GHBDRP C[C@@H]([NH2+]CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1)[C@H](O)c1ccccc1 ZINC001206122805 1033727955 /nfs/dbraw/zinc/72/79/55/1033727955.db2.gz VUGNZFKIAYXDJA-JPYJTQIMSA-N 2 0 397.519 3.561 20 5 GHBDRP C[C@H]([NH2+]CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1)[C@@H](O)c1ccccc1 ZINC001206122804 1033728548 /nfs/dbraw/zinc/72/85/48/1033728548.db2.gz VUGNZFKIAYXDJA-FDDCHVKYSA-N 2 0 397.519 3.561 20 5 GHBDRP CN(Cc1ccccc1)C1(C[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)CCCCC1 ZINC001207459580 1034380248 /nfs/dbraw/zinc/38/02/48/1034380248.db2.gz LHTOUZFOEHBSKK-UHFFFAOYSA-N 2 0 397.523 3.919 20 5 GHBDRP COc1ccc(C[C@H](C)[NH2+][C@@H](c2ccccc2)C2CC[NH2+]CC2)c([N+](=O)[O-])c1 ZINC001246252520 1037255269 /nfs/dbraw/zinc/25/52/69/1037255269.db2.gz RYJHMFKYZWEZJG-AOMKIAJQSA-N 2 0 383.492 3.865 20 5 GHBDRP COc1ccc(C[C@H](C)[NH2+][C@@H]2CC3(CC[NH2+]CC3)c3ccccc32)c([N+](=O)[O-])c1 ZINC001246259108 1037259996 /nfs/dbraw/zinc/25/99/96/1037259996.db2.gz ZFRNSKGRCWPLED-HRAATJIYSA-N 2 0 395.503 3.890 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]C1(Cc3ccc(F)cc3)CC[NH2+]CC1)CC2 ZINC001246393044 1037355147 /nfs/dbraw/zinc/35/51/47/1037355147.db2.gz STQBBZHBWCUBDQ-NRFANRHFSA-N 2 0 397.494 3.936 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]C1(Cc3ccccc3)CC[NH2+]CC1)CC2 ZINC001246470926 1037422839 /nfs/dbraw/zinc/42/28/39/1037422839.db2.gz ZVSVKXWGDQCBNE-OAQYLSRUSA-N 2 0 379.504 3.797 20 5 GHBDRP COc1ccc(C[C@H](C)[NH+]2CCC(C[NH3+])(c3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC001246588870 1037492873 /nfs/dbraw/zinc/49/28/73/1037492873.db2.gz LMRYJGHYMOBYTR-KRWDZBQOSA-N 2 0 383.492 3.527 20 5 GHBDRP COc1ccc(C[C@@H](C)[N@@H+]2CC[C@@]3(C[NH2+]C[C@@H]3c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001246682874 1037544820 /nfs/dbraw/zinc/54/48/20/1037544820.db2.gz OMNDWOYTJFPZBI-ODOSVJCGSA-N 2 0 395.503 3.614 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+](C[C@H]2CCC[NH2+]C2)C2CCCC2)c1F ZINC001246936768 1037741993 /nfs/dbraw/zinc/74/19/93/1037741993.db2.gz JOUQOLLBFMWSAW-HOTGVXAUSA-N 2 0 393.503 3.918 20 5 GHBDRP C[NH2+][C@H](C)CC[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC001325624409 1057347124 /nfs/dbraw/zinc/34/71/24/1057347124.db2.gz DROZXIVIZWYEAX-MRXNPFEDSA-N 2 0 379.464 3.535 20 5 GHBDRP Cn1ccnc1C[C@H]1CCCN(Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC001339997059 1059605210 /nfs/dbraw/zinc/60/52/10/1059605210.db2.gz AXVDARALWSTSPN-CYBMUJFWSA-N 2 0 393.285 3.546 20 5 GHBDRP O=[N+]([O-])c1ccc(C[NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000176985206 837831746 /nfs/dbraw/zinc/83/17/46/837831746.db2.gz IHAWWVNATKCQGI-UHFFFAOYSA-N 2 0 383.492 3.756 20 5 GHBDRP COc1ccc(C[NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414993787 839040419 /nfs/dbraw/zinc/04/04/19/839040419.db2.gz CQMVSGFSJBBMPD-IEBWSBKVSA-N 2 0 399.491 3.790 20 5 GHBDRP COc1ccc(C[NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414993788 839040546 /nfs/dbraw/zinc/04/05/46/839040546.db2.gz CQMVSGFSJBBMPD-MJGOQNOKSA-N 2 0 399.491 3.790 20 5 GHBDRP COc1ccc(C[NH2+]C[C@H]2CCC[C@H]([NH3+])C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414993786 839040850 /nfs/dbraw/zinc/04/08/50/839040850.db2.gz CQMVSGFSJBBMPD-HKUYNNGSSA-N 2 0 399.491 3.790 20 5 GHBDRP COc1cc(C[NH2+]C[C@H]2CCC[C@H]([NH3+])C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000415005524 839061489 /nfs/dbraw/zinc/06/14/89/839061489.db2.gz PCVUVVJBHXQWIX-HKUYNNGSSA-N 2 0 399.491 3.790 20 5 GHBDRP [NH3+][C@H]1CCCO[C@@H]1C1CC[NH+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000415133197 839260900 /nfs/dbraw/zinc/26/09/00/839260900.db2.gz UYGSRQATBCJPAS-PZJWPPBQSA-N 2 0 385.464 3.573 20 5 GHBDRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@H]3CCc4c3cccc4[N+](=O)[O-])cc2)CC1 ZINC000584730802 842699318 /nfs/dbraw/zinc/69/93/18/842699318.db2.gz PXGGCOTYWPVAJV-NRFANRHFSA-N 2 0 381.476 3.845 20 5 GHBDRP CC1(C)C[C@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@H](O)C2)c2cc([N+](=O)[O-])ccc21 ZINC000433240212 843889867 /nfs/dbraw/zinc/88/98/67/843889867.db2.gz NMDQVTAZIBGSFY-UGKGYDQZSA-N 2 0 395.503 3.674 20 5 GHBDRP COc1ccc(-c2ccc(C[N@@H+]3CC4(C[C@@H]3C)CC[NH2+]CC4)o2)c([N+](=O)[O-])c1 ZINC000424379772 850418110 /nfs/dbraw/zinc/41/81/10/850418110.db2.gz PBSKCIZQGMJMRU-HNNXBMFYSA-N 2 0 385.464 3.827 20 5 GHBDRP [NH3+]C[C@@H]1CCC[N@H+](Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000435391153 850459316 /nfs/dbraw/zinc/45/93/16/850459316.db2.gz VMVQUIWOZWFRDL-KRWDZBQOSA-N 2 0 391.475 3.618 20 5 GHBDRP COc1ccc(C[N@@H+]2CCC[C@@H]([C@@H](C)[NH3+])C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000592427684 857403372 /nfs/dbraw/zinc/40/33/72/857403372.db2.gz PVVWXYAEQXLWNC-VQIMIIECSA-N 2 0 399.491 3.742 20 5 GHBDRP CCCC[N@H+](C)CC1CC[NH+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000114197086 857935472 /nfs/dbraw/zinc/93/54/72/857935472.db2.gz ZRBHFIDDKDCPTC-UHFFFAOYSA-N 2 0 390.528 3.676 20 5 GHBDRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH2+][C@H]3CCc4c3cccc4[N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000594489925 858189640 /nfs/dbraw/zinc/18/96/40/858189640.db2.gz HUPRYBACTCZTAK-JKSBSHDWSA-N 2 0 395.503 3.981 20 5 GHBDRP COc1ccc(C[C@@H](C)[N@H+](Cc2ccccn2)[C@H]2CC[C@H]([NH3+])CC2)c([N+](=O)[O-])c1 ZINC001170326070 881362843 /nfs/dbraw/zinc/36/28/43/881362843.db2.gz CZGJYVFYIHFEMT-YVWKXTFCSA-N 2 0 398.507 3.702 20 5 GHBDRP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C2)C1 ZINC000593314720 859380614 /nfs/dbraw/zinc/38/06/14/859380614.db2.gz GKWHSECLDRJTPJ-WHSLLNHNSA-N 2 0 385.464 3.573 20 5 GHBDRP [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2)C1 ZINC000593316833 859394525 /nfs/dbraw/zinc/39/45/25/859394525.db2.gz YSKKCUQHZRSWDZ-FVJLSDCUSA-N 2 0 385.464 3.573 20 5 GHBDRP COc1ccc(C[C@H](C)[N@@H+]2CCCC[C@H]2C[C@@H]2CCC[NH+]2C)c([N+](=O)[O-])c1 ZINC001170351722 881497487 /nfs/dbraw/zinc/49/74/87/881497487.db2.gz HETDSXLYDGQXPF-WDSOQIARSA-N 2 0 375.513 3.873 20 5 GHBDRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]C2CCN(c3ccc([N+](=O)[O-])nc3)CC2)c1 ZINC000602532192 860100014 /nfs/dbraw/zinc/10/00/14/860100014.db2.gz DUMFXZNNDVBKKK-UHFFFAOYSA-N 2 0 397.523 3.589 20 5 GHBDRP C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)CCCC[NH+]1CCCCC1 ZINC000603110688 860496071 /nfs/dbraw/zinc/49/60/71/860496071.db2.gz OZLVTTIWNDWSMF-INIZCTEOSA-N 2 0 387.484 3.904 20 5 GHBDRP COc1ccc(-c2ccc(C[NH2+]C3C[C@H]4CCC[C@@H](C3)[N@H+]4C)o2)c([N+](=O)[O-])c1 ZINC000525695411 871253932 /nfs/dbraw/zinc/25/39/32/871253932.db2.gz ZZPKHPIKWINYGJ-MQVJKMGUSA-N 2 0 385.464 3.968 20 5 GHBDRP O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)n1 ZINC000447512379 871774092 /nfs/dbraw/zinc/77/40/92/871774092.db2.gz YEIIZXKPOIINGN-PMACEKPBSA-N 2 0 383.496 3.661 20 5 GHBDRP CC[NH+](CC)CCCC1CC[NH+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000182777752 872767860 /nfs/dbraw/zinc/76/78/60/872767860.db2.gz UXJBYCYHLWBYAA-UHFFFAOYSA-N 2 0 391.512 3.795 20 5 GHBDRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]CCOc1ccccc1[N+](=O)[O-] ZINC000460355513 872929756 /nfs/dbraw/zinc/92/97/56/872929756.db2.gz XNMRYWZFMPAQFG-QZTJIDSGSA-N 2 0 383.492 3.720 20 5 GHBDRP C[C@@H]1C[N@@H+](CCCC[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@H](C)O1 ZINC000237609665 877705702 /nfs/dbraw/zinc/70/57/02/877705702.db2.gz QLSUAGQBJYPEKO-CALCHBBNSA-N 2 0 387.480 3.834 20 5 GHBDRP Cc1c([N+](=O)[O-])cc(F)cc1-n1cc(CC[NH+]2CCC([NH3+])CC2)c2ccccc21 ZINC001170527791 885563910 /nfs/dbraw/zinc/56/39/10/885563910.db2.gz CHWYYBOURWSMBW-UHFFFAOYSA-N 2 0 396.466 3.952 20 5 GHBDRP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000872085227 891147829 /nfs/dbraw/zinc/14/78/29/891147829.db2.gz NWYBGCFUORYUGM-HNNXBMFYSA-N 2 0 393.553 3.858 20 5 GHBDRP CCC1(C[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)CC[NH+](Cc2ccccc2)CC1 ZINC000819189473 896458922 /nfs/dbraw/zinc/45/89/22/896458922.db2.gz HBWXPTYNDAXKRI-QFIPXVFZSA-N 2 0 397.519 3.910 20 5 GHBDRP O=C(CC[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)Nc1ccccc1[N+](=O)[O-] ZINC000566689531 896495720 /nfs/dbraw/zinc/49/57/20/896495720.db2.gz QMENWAHEUKWWIY-UHFFFAOYSA-N 2 0 396.491 3.699 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]C[C@H]1CC[N@H+](Cc3ccccc3)C1)CC2 ZINC001172900670 905922045 /nfs/dbraw/zinc/92/20/45/905922045.db2.gz XTPNPUDRMZNOBM-DENIHFKCSA-N 2 0 379.504 3.954 20 5 GHBDRP CC[NH+](CC)CCC[C@H](C)[NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173009750 906084922 /nfs/dbraw/zinc/08/49/22/906084922.db2.gz BHCZQCCHAAYQEI-HNNXBMFYSA-N 2 0 398.498 3.942 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]CCC[N@H+]2C[C@H](C)C[C@H](C)C2)c1F ZINC001173176058 906251472 /nfs/dbraw/zinc/25/14/72/906251472.db2.gz GGGVLSQCBDAEDA-XHSDSOJGSA-N 2 0 381.492 3.631 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C[NH+]3CCC(O)CC3)cc1)CCC2 ZINC000192834339 908828472 /nfs/dbraw/zinc/82/84/72/908828472.db2.gz VPHGNKQFPFWMCQ-HSZRJFAPSA-N 2 0 395.503 3.719 20 5 GHBDRP CCN(Cc1ccc(C[NH+](C)C)cc1)Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000777956420 934382719 /nfs/dbraw/zinc/38/27/19/934382719.db2.gz KIMAKTPZDXEMEW-UHFFFAOYSA-N 2 0 393.491 4.000 20 5 GHBDRP C[NH+]1CCC(Oc2ccc(C[NH2+]C/C=C/c3ccccc3[N+](=O)[O-])cc2)CC1 ZINC000579384202 1020410320 /nfs/dbraw/zinc/41/03/20/1020410320.db2.gz FVDHAHIIJZQGFZ-GQCTYLIASA-N 2 0 381.476 3.871 20 5 GHBDRP C[N@@H+]1CCC[C@@H](CCNC(=O)[C@@H]([NH3+])Cc2c3ccccc3cc3ccccc32)C1 ZINC001219980903 1031728406 /nfs/dbraw/zinc/72/84/06/1031728406.db2.gz QOFGDSBGNMKEEV-UUOWRZLLSA-N 2 0 389.543 3.711 20 5 GHBDRP CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2-c1cccc2c1CC[NH2+]C2 ZINC001159785034 1034741671 /nfs/dbraw/zinc/74/16/71/1034741671.db2.gz WDZWDMDMVBMMMI-UHFFFAOYSA-N 2 0 384.483 3.890 20 5 GHBDRP Cc1cc([C@H]2CCC[N@@H+]2CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)on1 ZINC001461972725 1069923681 /nfs/dbraw/zinc/92/36/81/1069923681.db2.gz XUIKETZNRIWUCF-OAQYLSRUSA-N 2 0 398.507 3.983 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CC1(c3ccc(F)cc3)CC[NH2+]CC1)CC2 ZINC001246211813 1037240381 /nfs/dbraw/zinc/24/03/81/1037240381.db2.gz NRJNFDUIIZFORI-NRFANRHFSA-N 2 0 397.494 3.892 20 5 GHBDRP C[C@@H]1CC([NH2+]CCCNC(=O)c2c3ccccc3nc3ccccc32)C[C@@H](C)[NH2+]1 ZINC001246484856 1037430187 /nfs/dbraw/zinc/43/01/87/1037430187.db2.gz RYTDUGPWKUZQOD-IAGOWNOFSA-N 2 0 390.531 3.627 20 5 GHBDRP COc1ccc(C[C@@H](C)[N@@H+]2Cc3ccccc3C3(CC[NH2+]CC3)C2)c([N+](=O)[O-])c1 ZINC001246864555 1037683093 /nfs/dbraw/zinc/68/30/93/1037683093.db2.gz WHHAQOKNZHNHFS-QGZVFWFLSA-N 2 0 395.503 3.671 20 5 GHBDRP Cc1ncsc1C[N@H+](C)CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001308619733 1050035448 /nfs/dbraw/zinc/03/54/48/1050035448.db2.gz PWZJLWFQFOUXQT-UHFFFAOYSA-N 2 0 388.537 3.746 20 5 GHBDRP Cc1c(C[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](C)CC2)cccc1[N+](=O)[O-] ZINC001473988407 1074227146 /nfs/dbraw/zinc/22/71/46/1074227146.db2.gz CZEIIJHJMDTRAM-MRXNPFEDSA-N 2 0 386.471 3.645 20 5 GHBDRP O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)C1CC1 ZINC000179469845 835734381 /nfs/dbraw/zinc/73/43/81/835734381.db2.gz SCXBBZOVLUJKKM-NRFANRHFSA-N 2 0 380.492 3.817 20 5 GHBDRP C[C@@H](CCC[NH3+])[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000415026133 839078425 /nfs/dbraw/zinc/07/84/25/839078425.db2.gz SNXOOBAQSANATR-NSHDSACASA-N 2 0 382.258 3.834 20 5 GHBDRP C[NH2+]C[C@@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)C1 ZINC000435376656 850425137 /nfs/dbraw/zinc/42/51/37/850425137.db2.gz SMSYINSTZCBDOI-LBPRGKRZSA-N 2 0 394.269 3.659 20 5 GHBDRP CC[NH+](CC)CC1CC[NH+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000506927463 852331525 /nfs/dbraw/zinc/33/15/25/852331525.db2.gz MKZUOFPFQYIZKF-UHFFFAOYSA-N 2 0 385.512 3.549 20 5 GHBDRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000489658995 852512437 /nfs/dbraw/zinc/51/24/37/852512437.db2.gz MUXKMBNFWUKBNJ-UHFFFAOYSA-N 2 0 383.492 3.818 20 5 GHBDRP COc1cc(C[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000594510609 858205344 /nfs/dbraw/zinc/20/53/44/858205344.db2.gz AAKNXVFIAHJSDX-IZAXUBKRSA-N 2 0 399.491 3.612 20 5 GHBDRP O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)C1CC1 ZINC000595065071 858369288 /nfs/dbraw/zinc/36/92/88/858369288.db2.gz BWZZAOORQSDQHX-JOCHJYFZSA-N 2 0 394.519 3.813 20 5 GHBDRP CCC[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000595068523 858370671 /nfs/dbraw/zinc/37/06/71/858370671.db2.gz IKQGWYFAAARDJG-FCHUYYIVSA-N 2 0 383.492 3.792 20 5 GHBDRP COc1ccc(C[C@H](C)[NH2+]CC2CC[NH+](CC3CCC3)CC2)c([N+](=O)[O-])c1 ZINC001170317974 881349911 /nfs/dbraw/zinc/34/99/11/881349911.db2.gz NFYUWTKGEWSMIY-INIZCTEOSA-N 2 0 375.513 3.636 20 5 GHBDRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1ccccc1O2 ZINC000540495183 871419601 /nfs/dbraw/zinc/41/96/01/871419601.db2.gz JPWCNMATLXSSBK-FQEVSTJZSA-N 2 0 397.475 3.551 20 5 GHBDRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CCOc1cccc([N+](=O)[O-])c1 ZINC000460355207 872928286 /nfs/dbraw/zinc/92/82/86/872928286.db2.gz WLXZGWHGNFEUIF-OEWRPIJISA-N 2 0 383.492 3.720 20 5 GHBDRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000237668297 877757421 /nfs/dbraw/zinc/75/74/21/877757421.db2.gz UKSOOHAINPKYQD-KRWDZBQOSA-N 2 0 385.512 3.597 20 5 GHBDRP CC1CC[NH+](Cc2cccc(C[NH2+]C3CC(n4cc([N+](=O)[O-])cn4)C3)c2)CC1 ZINC000877020841 893440351 /nfs/dbraw/zinc/44/03/51/893440351.db2.gz FTAPNNFTUVBYGD-UHFFFAOYSA-N 2 0 383.496 3.517 20 5 GHBDRP CC1CC[NH+](Cc2ccccc2C[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)CC1 ZINC000877145514 893507351 /nfs/dbraw/zinc/50/73/51/893507351.db2.gz IGHJZOMFCCGQBT-UHFFFAOYSA-N 2 0 383.496 3.517 20 5 GHBDRP CC[NH+](CC)CCO[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000536693159 893549921 /nfs/dbraw/zinc/54/99/21/893549921.db2.gz IZTXCEPRVDHOIQ-LJQANCHMSA-N 2 0 387.480 3.788 20 5 GHBDRP C[C@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000567915311 897486009 /nfs/dbraw/zinc/48/60/09/897486009.db2.gz NMCVTCYITUZUIP-MGPUTAFESA-N 2 0 398.482 3.824 20 5 GHBDRP [NH3+]CCC[C@H]1CCCC[N@@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173014582 906092220 /nfs/dbraw/zinc/09/22/20/906092220.db2.gz STIIZWBQFUTQLF-OAHLLOKOSA-N 2 0 396.482 3.683 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+](C)CC2CC[NH+](C(C)C)CC2)c1F ZINC001173188835 906269285 /nfs/dbraw/zinc/26/92/85/906269285.db2.gz HGHODPCDAFNOGI-OAHLLOKOSA-N 2 0 381.492 3.726 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@@H]2CC(C)(C)C[C@@](C)(C[NH3+])C2)c1F ZINC001173190181 906271358 /nfs/dbraw/zinc/27/13/58/906271358.db2.gz VFGYHQXOWIOKQU-MNVSYLFESA-N 2 0 381.492 3.807 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)c1F ZINC001173191433 906273150 /nfs/dbraw/zinc/27/31/50/906273150.db2.gz LCSJBFFDORCXAQ-ZDUSSCGKSA-N 2 0 381.492 3.915 20 5 GHBDRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000246294021 910219185 /nfs/dbraw/zinc/21/91/85/910219185.db2.gz OZYOKDRJIIUIFJ-DYESRHJHSA-N 2 0 375.513 3.605 20 5 GHBDRP O=[N+]([O-])c1cccc(-c2cnc(CC[NH+]3CCC(C[NH+]4CCCC4)CC3)o2)c1 ZINC000371557063 924666785 /nfs/dbraw/zinc/66/67/85/924666785.db2.gz NNNDFDULIQBKSG-UHFFFAOYSA-N 2 0 384.480 3.600 20 5 GHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(C[NH+]2C[C@H](C)O[C@@H](C)C2)CC1 ZINC000470185965 930440115 /nfs/dbraw/zinc/44/01/15/930440115.db2.gz NLXDRUGNGGJODM-GFLCFMILSA-N 2 0 387.524 3.819 20 5 GHBDRP COc1cc(C[N@H+](C)CC(C)(C)C[NH3+])ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000564973499 1019133664 /nfs/dbraw/zinc/13/36/64/1019133664.db2.gz DYKGKRJLTWTXFE-UHFFFAOYSA-N 2 0 387.480 3.599 20 5 GHBDRP C[C@@H]1C[NH+](CCOc2ccc(CC[NH2+]Cc3cccc([N+](=O)[O-])c3)cc2)C[C@H]1C ZINC001461386901 1069528858 /nfs/dbraw/zinc/52/88/58/1069528858.db2.gz DIPDCPYXWMJMDD-RTBURBONSA-N 2 0 397.519 3.894 20 5 GHBDRP [NH3+]C1CC[NH+](CCc2cn(-c3nccc(Cl)c3[N+](=O)[O-])c3ccccc23)CC1 ZINC001159459679 1034603929 /nfs/dbraw/zinc/60/39/29/1034603929.db2.gz AMXVHWGQJHDKRX-UHFFFAOYSA-N 2 0 399.882 3.553 20 5 GHBDRP Cc1ccc2c(c1)C1(C[C@@H]2[NH2+][C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC[NH2+]CC1 ZINC001246169465 1037222637 /nfs/dbraw/zinc/22/26/37/1037222637.db2.gz HAZVYEXLWKBFNT-AVRDEDQJSA-N 2 0 377.488 3.726 20 5 GHBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC1(Cc2cccc(F)c2)CC[NH2+]CC1 ZINC001246380453 1037338191 /nfs/dbraw/zinc/33/81/91/1037338191.db2.gz VTKZRHIPKHRDQC-KRWDZBQOSA-N 2 0 385.483 3.867 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1C[C@@H](c3ccccc3)C3(C[NH2+]C3)C1)CC2 ZINC001246619241 1037510770 /nfs/dbraw/zinc/51/07/70/1037510770.db2.gz JXFARIUFYVGSPR-IRLDBZIGSA-N 2 0 377.488 3.531 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+](Cc1ccc(Cl)cc1)C1CC[NH2+]CC1)C2 ZINC001246945069 1037750583 /nfs/dbraw/zinc/75/05/83/1037750583.db2.gz FKDCXVGPALILMM-OAQYLSRUSA-N 2 0 385.895 3.970 20 5 GHBDRP C[C@@]12CC3([NH3+])CC([NH2+]C4CCN(c5ccc([N+](=O)[O-])cc5)CC4)(C1)C[C@](C)(C3)C2 ZINC001254470000 1040256735 /nfs/dbraw/zinc/25/67/35/1040256735.db2.gz LPOMPKVISPRVGP-OIRDZHBESA-N 2 0 398.551 3.984 20 5 GHBDRP CC[C@@H]([NH2+]Cc1cccc(CN2CC[NH+](C)CC2)c1)c1cccc([N+](=O)[O-])c1 ZINC001319764188 1055451891 /nfs/dbraw/zinc/45/18/91/1055451891.db2.gz YWROEWSVUCELSY-JOCHJYFZSA-N 2 0 382.508 3.583 20 5 GHBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH+]1CCC(CCC[NH+]2CCOCC2)CC1 ZINC001474392312 1074382034 /nfs/dbraw/zinc/38/20/34/1074382034.db2.gz RDPWLEGCNJNAJA-UHFFFAOYSA-N 2 0 375.513 3.536 20 5 GHBDRP CC[NH+]1CCN(CCCC[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000180110878 837392130 /nfs/dbraw/zinc/39/21/30/837392130.db2.gz PBPKUURAAKSDTA-HSZRJFAPSA-N 2 0 396.535 3.692 20 5 GHBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1 ZINC000414304326 836991198 /nfs/dbraw/zinc/99/11/98/836991198.db2.gz MGJABMPLTUIJHR-LJQANCHMSA-N 2 0 397.519 3.533 20 5 GHBDRP [NH3+][C@H]1CCCO[C@H]1C1CC[NH+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000415133192 839261022 /nfs/dbraw/zinc/26/10/22/839261022.db2.gz UYGSRQATBCJPAS-FPOVZHCZSA-N 2 0 385.464 3.573 20 5 GHBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1 ZINC000432413943 842423184 /nfs/dbraw/zinc/42/31/84/842423184.db2.gz PDKUGWQGHPGHDT-DLBZAZTESA-N 2 0 381.542 3.556 20 5 GHBDRP CSC1(C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC[NH+](C)CC1 ZINC000582815079 848455798 /nfs/dbraw/zinc/45/57/98/848455798.db2.gz AEFCYQPTJBAASG-AEFFLSMTSA-N 2 0 377.554 3.723 20 5 GHBDRP COc1cc(C[NH+]2CCC([C@@H](C)[NH3+])CC2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000435394736 850461408 /nfs/dbraw/zinc/46/14/08/850461408.db2.gz LAXNAYXDJARAOT-MRXNPFEDSA-N 2 0 399.491 3.742 20 5 GHBDRP COc1cc(C[NH2+]CC2(C)CC[NH2+]CC2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414898501 852752555 /nfs/dbraw/zinc/75/25/55/852752555.db2.gz GDRVYBWJFMQJBT-UHFFFAOYSA-N 2 0 399.491 3.662 20 5 GHBDRP CCC[C@@H]([NH2+]CCCN1CCN(c2cc[nH+]cc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000482116848 862699913 /nfs/dbraw/zinc/69/99/13/862699913.db2.gz XYAITBFNCRCCFW-JOCHJYFZSA-N 2 0 397.523 3.633 20 5 GHBDRP O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CCC[C@H]([C@@H]4CCC[NH2+]C4)C3)cs2)c1 ZINC000592433550 857440151 /nfs/dbraw/zinc/44/01/51/857440151.db2.gz APZXDVPHXISNHM-SJORKVTESA-N 2 0 386.521 3.930 20 5 GHBDRP COc1ccc(OCC[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC000443600294 859035930 /nfs/dbraw/zinc/03/59/30/859035930.db2.gz IJFMTJJKAFHZRQ-UHFFFAOYSA-N 2 0 391.512 3.570 20 5 GHBDRP CSC1(C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[NH+](C)CC1 ZINC000602666778 860200712 /nfs/dbraw/zinc/20/07/12/860200712.db2.gz JZLDAVYZOPQFDR-UHFFFAOYSA-N 2 0 377.432 3.531 20 5 GHBDRP CC[N@H+](C)Cc1cc(O[C@H]2CC[NH+]([C@@H](C)c3cccc([N+](=O)[O-])c3)C2)ccn1 ZINC000856594222 881566797 /nfs/dbraw/zinc/56/67/97/881566797.db2.gz XVRORTFCDNHYAY-KKSFZXQISA-N 2 0 384.480 3.656 20 5 GHBDRP O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCC3)cc1 ZINC000853120780 878829437 /nfs/dbraw/zinc/82/94/37/878829437.db2.gz QFWMMWYUEFYWSA-UNMCSNQZSA-N 2 0 395.503 3.520 20 5 GHBDRP CC(C)[N@H+](C)CC1CC[NH+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000533272508 890141217 /nfs/dbraw/zinc/14/12/17/890141217.db2.gz CFUBOAMYVWKPQQ-UHFFFAOYSA-N 2 0 386.496 3.845 20 5 GHBDRP CCc1ccc([C@H](NC[C@H]2CC3(CO2)CC[NH2+]CC3)c2ccc([N+](=O)[O-])cc2)o1 ZINC000873293953 891562787 /nfs/dbraw/zinc/56/27/87/891562787.db2.gz RSEVWCIRFHNHRQ-TZIWHRDSSA-N 2 0 399.491 3.588 20 5 GHBDRP C[N@@H+]1CCC[C@H](C(=O)Nc2cc3oc4cc(=[NH2+])ccc-4nc3c3ccccc23)C1 ZINC001186362980 914476042 /nfs/dbraw/zinc/47/60/42/914476042.db2.gz YNRYRPWBXOZHOX-AWEZNQCLSA-N 2 0 386.455 3.846 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CC1CC[NH+](Cc3ccccn3)CC1)CC2 ZINC001172903080 905925317 /nfs/dbraw/zinc/92/53/17/905925317.db2.gz DSFOXRDETJMJKL-NRFANRHFSA-N 2 0 394.519 3.739 20 5 GHBDRP COc1cc[nH+]c(N(C2CC[NH2+]CC2)[C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c1 ZINC001172913897 905984266 /nfs/dbraw/zinc/98/42/66/905984266.db2.gz VOPYETCGYRVREJ-SFHVURJKSA-N 2 0 396.491 3.504 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]C2CC[NH+](C3CCCC3)CC2)c1F ZINC001173184951 906266410 /nfs/dbraw/zinc/26/64/10/906266410.db2.gz SXUUDEOTPQWLEP-CQSZACIVSA-N 2 0 379.476 3.670 20 5 GHBDRP C[C@@H](C(=O)Nc1cc2oc3cc(=[NH2+])ccc-3nc2c2ccccc12)[NH+]1CCCC1 ZINC001180581673 910228631 /nfs/dbraw/zinc/22/86/31/910228631.db2.gz BJNXDADUZHIQPO-AWEZNQCLSA-N 2 0 386.455 3.988 20 5 GHBDRP COc1cc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc([N+](=O)[O-])c1 ZINC000903201059 922848841 /nfs/dbraw/zinc/84/88/41/922848841.db2.gz WLGCWFBOEUQFQW-MRXNPFEDSA-N 2 0 384.480 3.561 20 5 GHBDRP O=[N+]([O-])c1ccc(N2CCC([NH2+]C[C@H]3CCC[N@@H+]3C3CCCCC3)CC2)cc1 ZINC000798002372 932486728 /nfs/dbraw/zinc/48/67/28/932486728.db2.gz FVXFDBONVNXLFB-JOCHJYFZSA-N 2 0 386.540 3.950 20 5 GHBDRP [NH3+][C@@H](Cc1c2ccccc2cc2ccccc21)C(=O)N1CCC2(CC([NH3+])C2)CC1 ZINC001158081710 1033904594 /nfs/dbraw/zinc/90/45/94/1033904594.db2.gz HRQOJYGPPLDHQU-QHCPKHFHSA-N 2 0 387.527 3.593 20 5 GHBDRP CC(C)(C)[NH+]1CCN(C(=O)[C@@H]([NH3+])Cc2c3ccccc3cc3ccccc32)CC1 ZINC001160577667 1035007648 /nfs/dbraw/zinc/00/76/48/1035007648.db2.gz PPQHRBUKBODIRM-QHCPKHFHSA-N 2 0 389.543 3.806 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]C1(c3ccc(F)cc3)CC[NH2+]CC1)CC2 ZINC001246337009 1037301684 /nfs/dbraw/zinc/30/16/84/1037301684.db2.gz PUEBOCOYSDEUQF-FQEVSTJZSA-N 2 0 383.467 3.850 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CC1(c3ccccc3)CC[NH2+]CC1)CC2 ZINC001246376598 1037332529 /nfs/dbraw/zinc/33/25/29/1037332529.db2.gz WGTRWGYAQMMHHT-NRFANRHFSA-N 2 0 379.504 3.753 20 5 GHBDRP COc1ccc(CC2(C[NH2+][C@@H](C)Cc3ccc([N+](=O)[O-])cc3)CC[NH2+]CC2)cc1 ZINC001246391967 1037353087 /nfs/dbraw/zinc/35/30/87/1037353087.db2.gz WGDWKVQCGDMWHK-SFHVURJKSA-N 2 0 397.519 3.737 20 5 GHBDRP COc1cccc(C2([NH2+][C@H]3CCc4ccc([N+](=O)[O-])cc4CC3)CC[NH2+]CC2)c1 ZINC001246415987 1037370813 /nfs/dbraw/zinc/37/08/13/1037370813.db2.gz OFVHHGJVKKGUNZ-FQEVSTJZSA-N 2 0 395.503 3.719 20 5 GHBDRP [NH3+]CC1(c2ccccc2)CC[NH+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001246588247 1037490841 /nfs/dbraw/zinc/49/08/41/1037490841.db2.gz LAGKXXAEBXCXHD-NRFANRHFSA-N 2 0 379.504 3.835 20 5 GHBDRP COc1ccc(C[C@@H](C)[NH+]2CCC(C[NH3+])(c3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC001246588872 1037492488 /nfs/dbraw/zinc/49/24/88/1037492488.db2.gz LMRYJGHYMOBYTR-QGZVFWFLSA-N 2 0 383.492 3.527 20 5 GHBDRP COc1ccc(C[C@H](C)[N@@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)c([N+](=O)[O-])c1 ZINC001246601009 1037495575 /nfs/dbraw/zinc/49/55/75/1037495575.db2.gz FTLVCFPUGFIGSS-LAUBAEHRSA-N 2 0 375.513 3.780 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1C[C@@H](c3ccccc3)C3(C[NH2+]C3)C1)CC2 ZINC001246619244 1037509215 /nfs/dbraw/zinc/50/92/15/1037509215.db2.gz JXFARIUFYVGSPR-UNMCSNQZSA-N 2 0 377.488 3.531 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CCCC[C@H]2C2CC[NH2+]CC2)c1F ZINC001246653650 1037529504 /nfs/dbraw/zinc/52/95/04/1037529504.db2.gz IPNAUNRJSZYSAS-YOEHRIQHSA-N 2 0 379.476 3.528 20 5 GHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@]2(c3ccccc3)CC[NH2+]C[C@@H]2C1 ZINC001246681864 1037545622 /nfs/dbraw/zinc/54/56/22/1037545622.db2.gz ABARJUKECPNDEC-JMUQELJHSA-N 2 0 379.504 3.779 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+](CC(C)(C)C)C2CC[NH2+]CC2)c1F ZINC001246950024 1037753856 /nfs/dbraw/zinc/75/38/56/1037753856.db2.gz OMBMAWIIIUWEOZ-AWEZNQCLSA-N 2 0 381.492 3.774 20 5 GHBDRP Cc1cc(F)ccc1C[N@H+]([C@@H]1Cc2ccc([N+](=O)[O-])cc2C1)C1CC[NH2+]CC1 ZINC001246963040 1037785092 /nfs/dbraw/zinc/78/50/92/1037785092.db2.gz WOKLDKIJXUWQJC-JOCHJYFZSA-N 2 0 383.467 3.764 20 5 GHBDRP C[NH+](C)CC[C@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 ZINC001254465733 1040253028 /nfs/dbraw/zinc/25/30/28/1040253028.db2.gz IWAKLNXCIMRWGL-QFIPXVFZSA-N 2 0 382.508 3.846 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH2+][C@@H]1CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]13)C2 ZINC001254581806 1040356920 /nfs/dbraw/zinc/35/69/20/1040356920.db2.gz MYUJIMMQZUMVMY-WENLIBGGSA-N 2 0 377.488 3.562 20 5 GHBDRP C[C@@H]1C[C@@H]([NH2+]CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)CCS1 ZINC001474737932 1074539671 /nfs/dbraw/zinc/53/96/71/1074539671.db2.gz YMJKAZJZCFUDBZ-APWZRJJASA-N 2 0 377.554 3.723 20 5 GHBDRP COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000430212632 835149160 /nfs/dbraw/zinc/14/91/60/835149160.db2.gz OVNRMTKELJWUIP-UHFFFAOYSA-N 2 0 383.492 3.947 20 5 GHBDRP CC[N@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)Cc1ccc(C[NH+](C)C)cc1 ZINC000609029868 835761699 /nfs/dbraw/zinc/76/16/99/835761699.db2.gz YJMNAXBYOYJNCV-UHFFFAOYSA-N 2 0 398.507 3.816 20 5 GHBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1 ZINC000414524150 838602114 /nfs/dbraw/zinc/60/21/14/838602114.db2.gz JMELVDJOVPDFFI-RGEXLXHISA-N 2 0 395.503 3.615 20 5 GHBDRP COc1cc(C[NH2+][C@H](C)[C@@H]2CCC[NH2+]C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414863181 838909548 /nfs/dbraw/zinc/90/95/48/838909548.db2.gz YARZWPQITSNRTJ-VQIMIIECSA-N 2 0 399.491 3.660 20 5 GHBDRP C[C@H](CCC[NH3+])[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000415023716 839075422 /nfs/dbraw/zinc/07/54/22/839075422.db2.gz NKBTUDISHKVSAK-MRXNPFEDSA-N 2 0 379.464 3.665 20 5 GHBDRP O=[N+]([O-])c1ccccc1OCC[N@H+](Cc1ccsc1)[C@H]1CC12CC[NH2+]CC2 ZINC000432674954 843421210 /nfs/dbraw/zinc/42/12/10/843421210.db2.gz GSPJDHXLDAKWFH-IBGZPJMESA-N 2 0 387.505 3.679 20 5 GHBDRP COc1ccc(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000489681504 852529261 /nfs/dbraw/zinc/52/92/61/852529261.db2.gz USPVUGKYIOMJPU-UHFFFAOYSA-N 2 0 383.492 3.947 20 5 GHBDRP C[C@@H]1C[N@@H+](CCCC[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H](C)O1 ZINC000171051803 862567175 /nfs/dbraw/zinc/56/71/75/862567175.db2.gz CMVCXRSDJHFWEL-CALCHBBNSA-N 2 0 387.480 3.834 20 5 GHBDRP CC[NH+](CC)CC1CC[NH+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000057847357 855763234 /nfs/dbraw/zinc/76/32/34/855763234.db2.gz ZQESPIIZMPDOHN-HNNXBMFYSA-N 2 0 387.484 3.760 20 5 GHBDRP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+]CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000482161608 862758215 /nfs/dbraw/zinc/75/82/15/862758215.db2.gz DXRAYPHMLUEXSO-HKUYNNGSSA-N 2 0 390.528 3.722 20 5 GHBDRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@@H](C)c3cccc([N+](=O)[O-])c3)cc2)CC1 ZINC000173327046 856858790 /nfs/dbraw/zinc/85/87/90/856858790.db2.gz XVQNMZOCVHGQOK-SFHVURJKSA-N 2 0 382.508 3.583 20 5 GHBDRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H](C)c3ccc(C)c([N+](=O)[O-])c3)cc2)CC1 ZINC000160315647 858792219 /nfs/dbraw/zinc/79/22/19/858792219.db2.gz DJQWAHRKOWCNQK-LJQANCHMSA-N 2 0 396.535 3.892 20 5 GHBDRP CC[N@H+](C)Cc1cc(O[C@@H]2CC[NH+](C/C=C/c3ccccc3[N+](=O)[O-])C2)ccn1 ZINC000856552959 881379098 /nfs/dbraw/zinc/37/90/98/881379098.db2.gz IZWMEJULVIYVLB-HSTAZWAASA-N 2 0 396.491 3.608 20 5 GHBDRP C[N@H+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[NH+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C[C@H]21 ZINC001169021986 871122559 /nfs/dbraw/zinc/12/25/59/871122559.db2.gz MBBJRYCPHMFYMG-AZNNDXHDSA-N 2 0 377.554 3.726 20 5 GHBDRP CC(C)c1ccc(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)cc1[N+](=O)[O-] ZINC000093735068 872371530 /nfs/dbraw/zinc/37/15/30/872371530.db2.gz LUSJROIXARZOOM-UHFFFAOYSA-N 2 0 375.513 3.795 20 5 GHBDRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]CCOc1cccc([N+](=O)[O-])c1 ZINC000460355208 872952745 /nfs/dbraw/zinc/95/27/45/872952745.db2.gz WLXZGWHGNFEUIF-QZTJIDSGSA-N 2 0 383.492 3.720 20 5 GHBDRP C[NH+]1CCN(Cc2ccc(C[NH2+][C@H]3CCCc4ccc([N+](=O)[O-])cc43)cc2)CC1 ZINC000192706055 883802459 /nfs/dbraw/zinc/80/24/59/883802459.db2.gz BPERETRXBTWORX-QHCPKHFHSA-N 2 0 394.519 3.509 20 5 GHBDRP CCC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1cccc([N+](=O)[O-])c1 ZINC000090522330 885437882 /nfs/dbraw/zinc/43/78/82/885437882.db2.gz PMRCRNRCKCJVBE-HBMCJLEFSA-N 2 0 375.513 3.794 20 5 GHBDRP [NH3+]C1CC[NH+](CCc2cn(-c3c(Cl)cncc3[N+](=O)[O-])c3ccccc23)CC1 ZINC001170528529 885591564 /nfs/dbraw/zinc/59/15/64/885591564.db2.gz RKZUYQNVPLVNAM-UHFFFAOYSA-N 2 0 399.882 3.553 20 5 GHBDRP CCC1(C[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)CC[NH+](Cc2ccccc2)CC1 ZINC000877121205 893497225 /nfs/dbraw/zinc/49/72/25/893497225.db2.gz QFUDFXAVYUYIJT-UHFFFAOYSA-N 2 0 397.523 3.777 20 5 GHBDRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815555879 893995153 /nfs/dbraw/zinc/99/51/53/893995153.db2.gz JNKHWWXAHSVBEA-BRWVUGGUSA-N 2 0 398.507 3.637 20 5 GHBDRP O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]C[C@H]2CCCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000819323609 896568587 /nfs/dbraw/zinc/56/85/87/896568587.db2.gz NMSCPUDHDKTVLB-KNQAVFIVSA-N 2 0 383.492 3.520 20 5 GHBDRP C[C@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000567915313 897486182 /nfs/dbraw/zinc/48/61/82/897486182.db2.gz NMCVTCYITUZUIP-YWZLYKJASA-N 2 0 398.482 3.824 20 5 GHBDRP C[C@@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])c1cc(F)ccc1N1CC[NH+](C)CC1 ZINC000567915310 897486407 /nfs/dbraw/zinc/48/64/07/897486407.db2.gz NMCVTCYITUZUIP-FOIQADDNSA-N 2 0 398.482 3.824 20 5 GHBDRP Cc1ccc(C[NH2+]CCc2ccc(OCC[NH+]3CCCC3)cc2)cc1[N+](=O)[O-] ZINC001178344163 909007726 /nfs/dbraw/zinc/00/77/26/909007726.db2.gz YDXQDKSOQUDQSM-UHFFFAOYSA-N 2 0 383.492 3.710 20 5 GHBDRP COc1ccc(C[NH2+][C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)cc1[N+](=O)[O-] ZINC001179771662 909699677 /nfs/dbraw/zinc/69/96/77/909699677.db2.gz KKMHSBJRINYZHS-QHAWAJNXSA-N 2 0 395.503 3.994 20 5 GHBDRP O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[NH2+]C[C@H]3CCCSC3)CC2)cc1 ZINC001182159812 911215858 /nfs/dbraw/zinc/21/58/58/911215858.db2.gz BVWVXENPWLLREP-LJQANCHMSA-N 2 0 377.554 3.582 20 5 GHBDRP C[NH+](C)CCNC(=O)C1CC[NH+](Cc2c3ccccc3cc3ccccc32)CC1 ZINC000092615722 911654501 /nfs/dbraw/zinc/65/45/01/911654501.db2.gz ASXPTOSRBGLAGQ-UHFFFAOYSA-N 2 0 389.543 3.883 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1C[C@@]3(CC[NH2+]C3)Oc3ccccc31)CCC2 ZINC000902501174 922241508 /nfs/dbraw/zinc/24/15/08/922241508.db2.gz IXUAOAQVEAZLGK-KCZVDYSFSA-N 2 0 379.460 3.818 20 5 GHBDRP CC1CC[NH+](Cc2ccc(C[NH2+]C[C@H](O)c3cccc([N+](=O)[O-])c3)cc2)CC1 ZINC000749671383 927229515 /nfs/dbraw/zinc/22/95/15/927229515.db2.gz NUYMVXCQJGDFQK-QFIPXVFZSA-N 2 0 383.492 3.650 20 5 GHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000470185966 930440334 /nfs/dbraw/zinc/44/03/34/930440334.db2.gz NLXDRUGNGGJODM-ONLGVJTGSA-N 2 0 387.524 3.819 20 5 GHBDRP [NH3+]C[C@]1(F)CCCN(C(=O)[C@@H]([NH3+])Cc2c3ccccc3cc3ccccc32)CC1 ZINC001157742302 1033748775 /nfs/dbraw/zinc/74/87/75/1033748775.db2.gz BGZPWDXDPZLVNW-UPVQGACJSA-N 2 0 393.506 3.542 20 5 GHBDRP Cc1ccc2c(c1)[C@@H]([NH2+][C@H]1Cc3ccc([N+](=O)[O-])cc3C1)CC21CC[NH2+]CC1 ZINC001246133647 1037209246 /nfs/dbraw/zinc/20/92/46/1037209246.db2.gz KZFFVLPRYSLMPD-AVRDEDQJSA-N 2 0 377.488 3.726 20 5 GHBDRP Cc1ccc2c(c1)[C@@H]([NH2+][C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)CC21CC[NH2+]CC1 ZINC001246133650 1037209859 /nfs/dbraw/zinc/20/98/59/1037209859.db2.gz KZFFVLPRYSLMPD-GCJKJVERSA-N 2 0 377.488 3.726 20 5 GHBDRP Cc1cccc2c1C1(C[C@H]2[NH2+][C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC[NH2+]CC1 ZINC001246248544 1037253309 /nfs/dbraw/zinc/25/33/09/1037253309.db2.gz OTATZWXGGAODCZ-GHTZIAJQSA-N 2 0 377.488 3.726 20 5 GHBDRP CC[C@H]1C[C@@H]([NH2+]CCCNC(=O)c2c3ccccc3nc3ccccc32)CC[NH2+]1 ZINC001246485488 1037432959 /nfs/dbraw/zinc/43/29/59/1037432959.db2.gz UUZGAYUHSKYKRD-ROUUACIJSA-N 2 0 390.531 3.628 20 5 GHBDRP O=[N+]([O-])c1ccc(N2CCC([N@@H+]3CCCC[C@]4(CCCC[NH2+]C4)C3)CC2)cc1 ZINC001246613899 1037506122 /nfs/dbraw/zinc/50/61/22/1037506122.db2.gz ZPFJXPGPMSIDBH-QFIPXVFZSA-N 2 0 386.540 3.809 20 5 GHBDRP O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[N@@H+]3CCC[C@]4(CC4(F)F)C3)CC2)cc1 ZINC001462395539 1070224920 /nfs/dbraw/zinc/22/49/20/1070224920.db2.gz NCTXTHBGBAJBIH-FQEVSTJZSA-N 2 0 393.478 3.971 20 5 GHBDRP [NH3+]C1(Cc2ccccc2Cl)CC[NH+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254585114 1040359170 /nfs/dbraw/zinc/35/91/70/1040359170.db2.gz KFGFFHBEHZCKTR-LJQANCHMSA-N 2 0 385.895 3.751 20 5 GHBDRP O=[N+]([O-])c1cccc([C@@H](O)CN2CCC(c3ccccc3)([NH+]3CCCC3)CC2)c1 ZINC001460851565 1069220279 /nfs/dbraw/zinc/22/02/79/1069220279.db2.gz UXJJYPCKOJRQQW-QFIPXVFZSA-N 2 0 395.503 3.715 20 5 GHBDRP CC(C)[C@H]1C[N@H+](CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)CCS1 ZINC001474360082 1074363333 /nfs/dbraw/zinc/36/33/33/1074363333.db2.gz JHDLIUFJRVJCNK-OAQYLSRUSA-N 2 0 391.581 3.923 20 5 GHBDRP COc1ccc(C[NH2+][C@@H](C)[C@H]2CCC[NH2+]C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414858101 838897894 /nfs/dbraw/zinc/89/78/94/838897894.db2.gz QUBRFRSSCZBSGM-LPHOPBHVSA-N 2 0 399.491 3.660 20 5 GHBDRP COc1cc(C[NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000415012027 839055374 /nfs/dbraw/zinc/05/53/74/839055374.db2.gz WUTDCNSMNIZSBU-MJGOQNOKSA-N 2 0 399.491 3.790 20 5 GHBDRP CC1(C)C[C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c2cc([N+](=O)[O-])ccc21 ZINC000433240209 843890216 /nfs/dbraw/zinc/89/02/16/843890216.db2.gz NMDQVTAZIBGSFY-DENIHFKCSA-N 2 0 395.503 3.674 20 5 GHBDRP COCC1(C[NH2+][C@@H](C)c2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[NH2+]CC1 ZINC000423381921 849893734 /nfs/dbraw/zinc/89/37/34/849893734.db2.gz FUQGDUUJMBFDMW-HNNXBMFYSA-N 2 0 389.521 3.990 20 5 GHBDRP COc1ccc(C[NH2+][C@H]2CCCC[C@@H]2C[NH3+])cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414792603 850496305 /nfs/dbraw/zinc/49/63/05/850496305.db2.gz CLKDDDQUJNSREI-QUCCMNQESA-N 2 0 399.491 3.790 20 5 GHBDRP COc1cc(C[N@H+](C)[C@@H]2CCC[NH2+]CC2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000435430915 850514631 /nfs/dbraw/zinc/51/46/31/850514631.db2.gz FXQJDFZEJNULJB-LJQANCHMSA-N 2 0 399.491 3.756 20 5 GHBDRP CC[NH+](CC)C[C@H]1CCCC[C@H]1[NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000482157294 862751339 /nfs/dbraw/zinc/75/13/39/862751339.db2.gz OCJPPQFZTUNDGD-YLJYHZDGSA-N 2 0 390.528 3.722 20 5 GHBDRP COc1ccc(C[N@@H+]2CCC[C@H](CC[NH3+])C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000442921899 858245476 /nfs/dbraw/zinc/24/54/76/858245476.db2.gz NUYZDTOIMPKOBU-QGZVFWFLSA-N 2 0 399.491 3.743 20 5 GHBDRP O=[N+]([O-])c1cccc(-c2nc(C[NH+]3CCC([C@H]4CCC[NH2+]C4)CC3)cs2)c1 ZINC000594736784 858269682 /nfs/dbraw/zinc/26/96/82/858269682.db2.gz UYLAKJWQMUIQGN-KRWDZBQOSA-N 2 0 386.521 3.930 20 5 GHBDRP COc1ccc(C[C@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)c([N+](=O)[O-])c1 ZINC001170319658 881353122 /nfs/dbraw/zinc/35/31/22/881353122.db2.gz XYUOWUGLNXEHCE-INIZCTEOSA-N 2 0 375.513 3.921 20 5 GHBDRP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCCC[N@@H+]2Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000593316236 859388875 /nfs/dbraw/zinc/38/88/75/859388875.db2.gz BFXQDOJVQLVGEZ-QFIXIFRTSA-N 2 0 385.464 3.716 20 5 GHBDRP Cc1ccc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCC(O)CC2)cc1[N+](=O)[O-] ZINC000161180786 859680788 /nfs/dbraw/zinc/68/07/88/859680788.db2.gz QEYNFQCQXDPIEE-KRWDZBQOSA-N 2 0 383.492 3.711 20 5 GHBDRP CC[N@H+](C)Cc1cc(O[C@H]2CC[NH+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)ccn1 ZINC000856585370 881557839 /nfs/dbraw/zinc/55/78/39/881557839.db2.gz CSIIUGMQCQLRHL-UTKZUKDTSA-N 2 0 398.507 3.964 20 5 GHBDRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792878286 881766701 /nfs/dbraw/zinc/76/67/01/881766701.db2.gz UKERFLCFQRIZFI-DNVCBOLYSA-N 2 0 384.436 3.503 20 5 GHBDRP COc1ccc(CNC2CC[NH+]([C@H](C)Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000449104337 874476000 /nfs/dbraw/zinc/47/60/00/874476000.db2.gz VGSINSVSMKOPEI-QGZVFWFLSA-N 2 0 383.492 3.789 20 5 GHBDRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]C[C@@H](O)c3ccc([N+](=O)[O-])cc3)cc2)C1 ZINC000776276912 876146665 /nfs/dbraw/zinc/14/66/65/876146665.db2.gz LRYDQGKGTQHSKT-VGOFRKELSA-N 2 0 383.492 3.650 20 5 GHBDRP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCCC[N@H+]3CCC[C@H]3CO)s2)cc1 ZINC000111386082 879082197 /nfs/dbraw/zinc/08/21/97/879082197.db2.gz MCHVYGRXAMNMHG-SFHVURJKSA-N 2 0 389.521 3.650 20 5 GHBDRP O=[N+]([O-])c1cnn(C2CC([NH2+]Cc3ccc(C[NH+]4CCCCCC4)cc3)C2)c1 ZINC000876988127 893420925 /nfs/dbraw/zinc/42/09/25/893420925.db2.gz BJRRIDPRLHOZCI-UHFFFAOYSA-N 2 0 383.496 3.661 20 5 GHBDRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccccc1O2 ZINC000537205755 894595148 /nfs/dbraw/zinc/59/51/48/894595148.db2.gz RBTOPKFOTRDOGJ-FQEVSTJZSA-N 2 0 381.476 3.715 20 5 GHBDRP C[C@@H]1C[C@@H](CC[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)C[N@@H+]1Cc1ccccc1 ZINC000819189504 896458637 /nfs/dbraw/zinc/45/86/37/896458637.db2.gz HVJBHYVTCYFKIE-JUXOCIIHSA-N 2 0 383.492 3.519 20 5 GHBDRP C[C@@H]1C[C@@H](CC[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)C[N@@H+]1Cc1ccccc1 ZINC000819190174 896460171 /nfs/dbraw/zinc/46/01/71/896460171.db2.gz MQHAVGLAZSGKOK-JUXOCIIHSA-N 2 0 383.492 3.519 20 5 GHBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1 ZINC000570497641 899344845 /nfs/dbraw/zinc/34/48/45/899344845.db2.gz VGCBRFASSUGWOT-SFHVURJKSA-N 2 0 383.492 3.581 20 5 GHBDRP CC(C)[N@@H+]1CC[C@H]([NH2+]C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)[C@H](C)C1 ZINC001173014559 906092114 /nfs/dbraw/zinc/09/21/14/906092114.db2.gz SEKJEPWOVRFYEQ-KUHUBIRLSA-N 2 0 396.482 3.550 20 5 GHBDRP CCC(CC)[NH+]1CCC([NH2+][C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])CC1 ZINC001173182351 906263597 /nfs/dbraw/zinc/26/35/97/906263597.db2.gz SCWSVRGSKMYYJD-AWEZNQCLSA-N 2 0 381.492 3.916 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]CCc2ccc(C[NH+](C)C)cc2)c1F ZINC001173192083 906275909 /nfs/dbraw/zinc/27/59/09/906275909.db2.gz OSHCKPRVAVVJNW-OAHLLOKOSA-N 2 0 389.471 3.567 20 5 GHBDRP COc1ccccc1CC1([NH3+])CC[NH+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173223319 906304039 /nfs/dbraw/zinc/30/40/39/906304039.db2.gz ICRNMOADOHUUBE-KRWDZBQOSA-N 2 0 383.492 3.570 20 5 GHBDRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC001177299267 908501364 /nfs/dbraw/zinc/50/13/64/908501364.db2.gz MXXATQSZSMNANE-CQSZACIVSA-N 2 0 384.318 3.959 20 5 GHBDRP CCC[C@H]([NH2+]Cc1ccc(C(=O)NCC[NH+](C)C)cc1)c1cccc([N+](=O)[O-])c1 ZINC000271574530 910966315 /nfs/dbraw/zinc/96/63/15/910966315.db2.gz ZOPHVLDKLFGFLV-NRFANRHFSA-N 2 0 398.507 3.517 20 5 GHBDRP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]C2CC[NH+](CC3CCCCC3)CC2)n1 ZINC000774159867 911459647 /nfs/dbraw/zinc/45/96/47/911459647.db2.gz QNWFGMMUKZSPBF-WOJBJXKFSA-N 2 0 389.544 3.909 20 5 GHBDRP O=[N+]([O-])c1ccc(N2CCC([NH2+][C@@H](c3ccccc3)C3CC[NH2+]CC3)CC2)cc1 ZINC001246249212 1037253714 /nfs/dbraw/zinc/25/37/14/1037253714.db2.gz HSVBJJZTYAZXCK-QHCPKHFHSA-N 2 0 394.519 3.894 20 5 GHBDRP CC1(C)C[C@@H]([NH2+]CCCNC(=O)c2c3ccccc3nc3ccccc32)CC[NH2+]1 ZINC001246483777 1037430726 /nfs/dbraw/zinc/43/07/26/1037430726.db2.gz OJOPJEAGHLLIOV-KRWDZBQOSA-N 2 0 390.531 3.628 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH2+][C@@H]1CC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]31)C2 ZINC001254581803 1040356165 /nfs/dbraw/zinc/35/61/65/1040356165.db2.gz MYUJIMMQZUMVMY-CVNLYIMZSA-N 2 0 377.488 3.562 20 5 GHBDRP COc1ccc(-c2ccc(C[N@@H+]3CCC[C@@H]([C@@H]4CC[NH2+]C4)C3)o2)c([N+](=O)[O-])c1 ZINC000584291284 835849274 /nfs/dbraw/zinc/84/92/74/835849274.db2.gz JBWMDGGYURHKNM-HZPDHXFCSA-N 2 0 385.464 3.685 20 5 GHBDRP COc1ccc(C[NH2+]CC[C@H]2CCC[NH2+]C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414844943 838885486 /nfs/dbraw/zinc/88/54/86/838885486.db2.gz RWDLTVPOIWJNPJ-QGZVFWFLSA-N 2 0 399.491 3.662 20 5 GHBDRP [NH3+][C@H]1CCCO[C@@H]1C1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000415101479 839204873 /nfs/dbraw/zinc/20/48/73/839204873.db2.gz BNDDJRYVJNGYQW-PZJWPPBQSA-N 2 0 385.464 3.573 20 5 GHBDRP C[C@@H]([NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000126743650 842014603 /nfs/dbraw/zinc/01/46/03/842014603.db2.gz SHXFWOPIMAEKIE-HZPDHXFCSA-N 2 0 386.471 3.898 20 5 GHBDRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000599659193 861490179 /nfs/dbraw/zinc/49/01/79/861490179.db2.gz FHPHMDQDKSEPQH-INIZCTEOSA-N 2 0 384.480 3.506 20 5 GHBDRP [NH3+]C1CC[NH+](CCCC(=O)Nc2cccc(Oc3ccc([N+](=O)[O-])cc3)c2)CC1 ZINC000433164398 845548787 /nfs/dbraw/zinc/54/87/87/845548787.db2.gz RCHBYJWZZSRCEK-UHFFFAOYSA-N 2 0 398.463 3.529 20 5 GHBDRP O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423039611 847951169 /nfs/dbraw/zinc/95/11/69/847951169.db2.gz FRVPGPLDAFWWKF-YLJYHZDGSA-N 2 0 387.867 3.636 20 5 GHBDRP C[C@H]([NH3+])[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)C1 ZINC000435374645 850421963 /nfs/dbraw/zinc/42/19/63/850421963.db2.gz JEPVPPBCGOQDHQ-NWDGAFQWSA-N 2 0 394.269 3.786 20 5 GHBDRP CC(C)CC[NH+]1CCC(C[NH2+][C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)CC1 ZINC000515767344 851447126 /nfs/dbraw/zinc/44/71/26/851447126.db2.gz ASQCYHIIUHKOQN-RBUKOAKNSA-N 2 0 377.533 3.623 20 5 GHBDRP O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2C[NH2+][C@@H]2CCC[NH2+]CC2)cc1 ZINC000591278627 855880018 /nfs/dbraw/zinc/88/00/18/855880018.db2.gz ZYZXCDNFWZMXFO-LJQANCHMSA-N 2 0 391.475 3.679 20 5 GHBDRP CCC[C@@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000124709751 860474952 /nfs/dbraw/zinc/47/49/52/860474952.db2.gz RVGIAFCHSUZQRL-OAQYLSRUSA-N 2 0 388.556 3.976 20 5 GHBDRP CC[N@H+](C)Cc1cc(O[C@H]2CC[NH+]([C@@H](C)c3ccccc3[N+](=O)[O-])C2)ccn1 ZINC000856593073 881566680 /nfs/dbraw/zinc/56/66/80/881566680.db2.gz ZIBRFOSCTRTZRQ-LPHOPBHVSA-N 2 0 384.480 3.656 20 5 GHBDRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1NCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792878059 881766556 /nfs/dbraw/zinc/76/65/56/881766556.db2.gz RTGNOWYNZACFGU-JIPZTSHUSA-N 2 0 398.463 3.749 20 5 GHBDRP CC[C@H]([NH2+]C[C@@H]1CN(Cc2ccccc2)CCCO1)c1cccc([N+](=O)[O-])c1 ZINC000617584284 870466587 /nfs/dbraw/zinc/46/65/87/870466587.db2.gz BMTRUIMWFMKHML-YADHBBJMSA-N 2 0 383.492 3.927 20 5 GHBDRP C[C@H](CC[NH2+][C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)[N@H+](C)Cc1ccccc1 ZINC000447529833 871762103 /nfs/dbraw/zinc/76/21/03/871762103.db2.gz LCBHDMGDPJOSMH-YZGWKJHDSA-N 2 0 385.512 3.775 20 5 GHBDRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(C[NH2+]C[C@@H](O)c3ccc([N+](=O)[O-])cc3)cc2)C1 ZINC000776275685 876141747 /nfs/dbraw/zinc/14/17/47/876141747.db2.gz GUMRKYQUYHTNJI-PMAPCBKXSA-N 2 0 397.519 3.896 20 5 GHBDRP Cc1ccc(C[NH2+]Cc2ccccc2C[NH+]2C[C@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000069833357 893925631 /nfs/dbraw/zinc/92/56/31/893925631.db2.gz ALYLGPWCBNRUCV-ROUUACIJSA-N 2 0 383.492 3.802 20 5 GHBDRP Cc1ccc2c(C[C@@H](C)[NH3+])cn(-c3ccc([N+](=O)[O-])c4c3CC[N@H+](C)C4)c2c1 ZINC001171169121 901935651 /nfs/dbraw/zinc/93/56/51/901935651.db2.gz YUPKPKIZHWVKMY-OAHLLOKOSA-N 2 0 378.476 3.725 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CC1CC[NH+](Cc3ccccn3)CC1)CC2 ZINC001172903085 905925055 /nfs/dbraw/zinc/92/50/55/905925055.db2.gz DSFOXRDETJMJKL-OAQYLSRUSA-N 2 0 394.519 3.739 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+](Cc2ccccc2)C[C@@H](C)C[NH3+])c1F ZINC001173181505 906261664 /nfs/dbraw/zinc/26/16/64/906261664.db2.gz FDCIDBGQDLDMTM-HOTGVXAUSA-N 2 0 389.471 3.771 20 5 GHBDRP CC[NH+](CC)[C@H]1CC[C@H]([NH2+][C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])CC1 ZINC001173184181 906266051 /nfs/dbraw/zinc/26/60/51/906266051.db2.gz LUNYKQPNWLJNIT-BZUAXINKSA-N 2 0 381.492 3.916 20 5 GHBDRP Cc1cccc([N+](=O)[O-])c1NC[C@@H]1C[N@H+](Cc2ccccc2)CC12CC[NH2+]CC2 ZINC001162935527 1025972223 /nfs/dbraw/zinc/97/22/23/1025972223.db2.gz RUBFXGSNFALUTL-HXUWFJFHSA-N 2 0 394.519 3.817 20 5 GHBDRP [NH3+]C[C@@]1(F)CCCN(C(=O)[C@@H]([NH3+])Cc2c3ccccc3cc3ccccc32)CC1 ZINC001157742300 1033749443 /nfs/dbraw/zinc/74/94/43/1033749443.db2.gz BGZPWDXDPZLVNW-LADGPHEKSA-N 2 0 393.506 3.542 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH2+][C@@H](CC1CC[NH2+]CC1)c1cccc(F)c1)C2 ZINC001246446066 1037408055 /nfs/dbraw/zinc/40/80/55/1037408055.db2.gz BLEFYWDUSKLMDE-IRLDBZIGSA-N 2 0 383.467 3.922 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2CCCC[C@H]2C2CC[NH2+]CC2)c1F ZINC001246653639 1037529344 /nfs/dbraw/zinc/52/93/44/1037529344.db2.gz IPNAUNRJSZYSAS-PBHICJAKSA-N 2 0 379.476 3.528 20 5 GHBDRP CCOC1(C)CC[NH+](CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC001462282309 1070141736 /nfs/dbraw/zinc/14/17/36/1070141736.db2.gz HVFRPKDWKJNEFA-UHFFFAOYSA-N 2 0 389.540 3.740 20 5 GHBDRP O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[N@@H+]3CCC[C@@]4(CC4(F)F)C3)CC2)cc1 ZINC001462395549 1070225041 /nfs/dbraw/zinc/22/50/41/1070225041.db2.gz NCTXTHBGBAJBIH-HXUWFJFHSA-N 2 0 393.478 3.971 20 5 GHBDRP C[C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C[NH2+][C@@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254588417 1040362983 /nfs/dbraw/zinc/36/29/83/1040362983.db2.gz FUNFBZXXPKMION-VOQZNFBZSA-N 2 0 379.504 3.810 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@@H+]1CC[C@H]3C[NH+](Cc4ccccc4)C[C@@H]3C1)C2 ZINC001254608260 1040380451 /nfs/dbraw/zinc/38/04/51/1040380451.db2.gz QBBHISUANQEGOE-XKCSPQBFSA-N 2 0 377.488 3.516 20 5 GHBDRP CC[C@H]([NH2+]CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1)[C@@H]1CCCOC1 ZINC001474681873 1074512132 /nfs/dbraw/zinc/51/21/32/1074512132.db2.gz DTVNLPVBRHUJFL-IRLDBZIGSA-N 2 0 389.540 3.644 20 5 GHBDRP [NH3+][C@H]1CCCO[C@H]1C1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000415101470 839205052 /nfs/dbraw/zinc/20/50/52/839205052.db2.gz BNDDJRYVJNGYQW-FPOVZHCZSA-N 2 0 385.464 3.573 20 5 GHBDRP [NH3+][C@@H]1CCCO[C@@H]1C1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000415135459 839250879 /nfs/dbraw/zinc/25/08/79/839250879.db2.gz WRNDLNPBQOTDTP-WIYYLYMNSA-N 2 0 385.464 3.573 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ccccc1CN1CCOCC1)CCCC2 ZINC000417326283 840728724 /nfs/dbraw/zinc/72/87/24/840728724.db2.gz ROZVILDTJQHVCL-HSZRJFAPSA-N 2 0 395.503 3.984 20 5 GHBDRP CCC[C@H]([NH2+]CCCN1CCN(c2cc[nH+]cc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000482116949 841999070 /nfs/dbraw/zinc/99/90/70/841999070.db2.gz XYAITBFNCRCCFW-QFIPXVFZSA-N 2 0 397.523 3.633 20 5 GHBDRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000599659194 861490157 /nfs/dbraw/zinc/49/01/57/861490157.db2.gz FHPHMDQDKSEPQH-MRXNPFEDSA-N 2 0 384.480 3.506 20 5 GHBDRP COCC1(C[NH2+][C@H](C)c2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[NH2+]CC1 ZINC000423381927 849894143 /nfs/dbraw/zinc/89/41/43/849894143.db2.gz FUQGDUUJMBFDMW-OAHLLOKOSA-N 2 0 389.521 3.990 20 5 GHBDRP C[C@@H]([NH3+])[C@H]1CC[N@H+](Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000435381039 850446513 /nfs/dbraw/zinc/44/65/13/850446513.db2.gz UTMRAXUWASILQJ-AEFFLSMTSA-N 2 0 391.475 3.617 20 5 GHBDRP COc1ccc(-c2ccc(C[NH+]3CCC([C@@H]4CCC[NH2+]4)CC3)o2)c([N+](=O)[O-])c1 ZINC000573801717 856486766 /nfs/dbraw/zinc/48/67/66/856486766.db2.gz KMHMETJFQRCLHY-IBGZPJMESA-N 2 0 385.464 3.827 20 5 GHBDRP CCOc1ccc([C@H](C)[NH2+]CCCC[NH+]2C[C@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000245508469 856905135 /nfs/dbraw/zinc/90/51/35/856905135.db2.gz RYYWDYXAZGXSRK-ULQDDVLXSA-N 2 0 379.501 3.534 20 5 GHBDRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H]3CCc4c3cccc4[N+](=O)[O-])cc2)CC1 ZINC000594493346 858191172 /nfs/dbraw/zinc/19/11/72/858191172.db2.gz CWGIFEHESYXXTD-QFIPXVFZSA-N 2 0 394.519 3.509 20 5 GHBDRP COc1ccc(C[C@@H](C)[N@H+](Cc2ccncc2)[C@H]2CC[C@H]([NH3+])CC2)c([N+](=O)[O-])c1 ZINC001170329245 881367672 /nfs/dbraw/zinc/36/76/72/881367672.db2.gz YFYYLNGZLQCZOO-NSISKUIASA-N 2 0 398.507 3.702 20 5 GHBDRP O=[N+]([O-])c1cc2c(cc1N[C@@H]1C[C@H]3CC[C@@H](C1)[N@H+]3Cc1ccccc1)C[NH2+]C2 ZINC001170333668 881378906 /nfs/dbraw/zinc/37/89/06/881378906.db2.gz QZMVHXMCYDAKPA-OWZKRDHZSA-N 2 0 378.476 3.806 20 5 GHBDRP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C2)C1 ZINC000593314672 859380783 /nfs/dbraw/zinc/38/07/83/859380783.db2.gz DZSUCKQAYAFVIL-LZJOCLMNSA-N 2 0 385.464 3.573 20 5 GHBDRP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2)C1 ZINC000593316832 859394326 /nfs/dbraw/zinc/39/43/26/859394326.db2.gz YSKKCUQHZRSWDZ-CSODHUTKSA-N 2 0 385.464 3.573 20 5 GHBDRP C[NH+]1CCC(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)(N2CCCCC2)CC1 ZINC000192906889 861016094 /nfs/dbraw/zinc/01/60/94/861016094.db2.gz BMPSALKPTCOUHN-NRFANRHFSA-N 2 0 386.540 3.512 20 5 GHBDRP C[C@@H]([NH2+]CC1CC[NH+](CCO)CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000151786912 864481243 /nfs/dbraw/zinc/48/12/43/864481243.db2.gz BLZDTUGPHXNSAT-OAHLLOKOSA-N 2 0 389.521 3.678 20 5 GHBDRP COc1ccc(-c2ccc(C[NH2+]CC3CC[NH+](C4CC4)CC3)o2)c([N+](=O)[O-])c1 ZINC000446882921 870627030 /nfs/dbraw/zinc/62/70/30/870627030.db2.gz CMNDEFCRZSZORM-UHFFFAOYSA-N 2 0 385.464 3.827 20 5 GHBDRP Cc1cccc([N+](=O)[O-])c1-n1cc(CC[NH+]2CCC([NH3+])CC2)c2ccccc21 ZINC001170528956 885580674 /nfs/dbraw/zinc/58/06/74/885580674.db2.gz YEUDUBSYSMWKJG-UHFFFAOYSA-N 2 0 378.476 3.813 20 5 GHBDRP C[C@H]([NH2+]CCc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000537095944 894333989 /nfs/dbraw/zinc/33/39/89/894333989.db2.gz YZOJJCWUQCBFRD-SFHVURJKSA-N 2 0 383.492 3.963 20 5 GHBDRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)C2)CC1 ZINC000572167423 900085179 /nfs/dbraw/zinc/08/51/79/900085179.db2.gz FITOOAYZBKFCHX-KRWDZBQOSA-N 2 0 386.521 3.882 20 5 GHBDRP CC[NH+]1CCN(Cc2ccc(C[NH2+]Cc3c(C)ccc([N+](=O)[O-])c3C)cc2)CC1 ZINC001177295175 908500200 /nfs/dbraw/zinc/50/02/00/908500200.db2.gz YQPKXXDXTCRCIE-UHFFFAOYSA-N 2 0 396.535 3.639 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1C[C@]3(CC[NH2+]C3)Oc3ccccc31)CCC2 ZINC000902501182 922241850 /nfs/dbraw/zinc/24/18/50/922241850.db2.gz IXUAOAQVEAZLGK-URVUXULASA-N 2 0 379.460 3.818 20 5 GHBDRP CCOc1ccc([C@H](C)[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1[N+](=O)[O-] ZINC000902504036 922244515 /nfs/dbraw/zinc/24/45/15/922244515.db2.gz VQEIDLGKOOQBFP-VPKVUBIPSA-N 2 0 397.475 3.900 20 5 GHBDRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]C[C@H](O)c3cccc([N+](=O)[O-])c3)cc2)C1 ZINC000749675154 927230129 /nfs/dbraw/zinc/23/01/29/927230129.db2.gz IRQPWJPODSOUAG-VGSWGCGISA-N 2 0 383.492 3.650 20 5 GHBDRP C[C@@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000781424788 930840165 /nfs/dbraw/zinc/84/01/65/930840165.db2.gz DFORYHOVZJSMGB-MSOLQXFVSA-N 2 0 386.540 3.806 20 5 GHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H]1CO ZINC000468597605 1015833587 /nfs/dbraw/zinc/83/35/87/1015833587.db2.gz DTADXDVGZJAGNL-FUAYJARZSA-N 2 0 395.503 3.745 20 5 GHBDRP CC(C)[N@H+](C)[C@H]1CCN(C(=O)[C@@H]([NH3+])Cc2c3ccccc3cc3ccccc32)C1 ZINC001161049912 1035126112 /nfs/dbraw/zinc/12/61/12/1035126112.db2.gz JINSRZGHARTRPA-RDPSFJRHSA-N 2 0 389.543 3.804 20 5 GHBDRP COc1ccccc1C1([NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC[NH2+]CC1 ZINC001246376020 1037332201 /nfs/dbraw/zinc/33/22/01/1037332201.db2.gz JZKIBPTXMGSTKC-IBGZPJMESA-N 2 0 395.503 3.719 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH2+]C1(Cc3cccc(Cl)c3)CC[NH2+]CC1)C2 ZINC001246431463 1037393296 /nfs/dbraw/zinc/39/32/96/1037393296.db2.gz ZHPFHBIYSLGYRA-LJQANCHMSA-N 2 0 385.895 3.670 20 5 GHBDRP COc1ccc(C[N@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])C2CC[NH2+]CC2)cc1 ZINC001246968712 1037791917 /nfs/dbraw/zinc/79/19/17/1037791917.db2.gz XDHALPYZBKTCIX-QGZVFWFLSA-N 2 0 383.492 3.789 20 5 GHBDRP COc1ccc(C[C@H](C)[NH+]2CCC(CC3CC[NH2+]CC3)CC2)c([N+](=O)[O-])c1 ZINC001246981834 1037806309 /nfs/dbraw/zinc/80/63/09/1037806309.db2.gz YPWBPLXKHYRRIV-INIZCTEOSA-N 2 0 375.513 3.636 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1Cc3ccccc3C13CC[NH2+]CC3)CC2 ZINC001247011424 1037834805 /nfs/dbraw/zinc/83/48/05/1037834805.db2.gz RYWURDPOHVTIFD-FQEVSTJZSA-N 2 0 377.488 3.937 20 5 GHBDRP C[N@@H+]1CCC[C@@H]([NH2+]CCCNC(=O)c2c3ccccc3nc3ccccc32)CC1 ZINC001254514597 1040289468 /nfs/dbraw/zinc/28/94/68/1040289468.db2.gz MWUQTGVHHVFNCR-GOSISDBHSA-N 2 0 390.531 3.582 20 5 GHBDRP [NH3+]C1(Cc2ccccc2Cl)CC[NH+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254585113 1040359344 /nfs/dbraw/zinc/35/93/44/1040359344.db2.gz KFGFFHBEHZCKTR-IBGZPJMESA-N 2 0 385.895 3.751 20 5 GHBDRP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc(F)cc2)[C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254586456 1040360054 /nfs/dbraw/zinc/36/00/54/1040360054.db2.gz JPRJRTPHUSPZSR-KCZVDYSFSA-N 2 0 383.467 3.973 20 5 GHBDRP C[C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C[NH2+][C@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254588418 1040362130 /nfs/dbraw/zinc/36/21/30/1040362130.db2.gz FUNFBZXXPKMION-WTNAPCKOSA-N 2 0 379.504 3.810 20 5 GHBDRP [NH3+]C1(Cc2cccc(Cl)c2)CC[NH+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254588451 1040362633 /nfs/dbraw/zinc/36/26/33/1040362633.db2.gz YVFFGXVBQBNBNB-FQEVSTJZSA-N 2 0 385.895 3.751 20 5 GHBDRP COC(=O)[C@H]1C[N@H+](Cc2c3ccccc3c(Cl)c3ccccc32)CC[C@@H]1[NH3+] ZINC001236414677 1041706538 /nfs/dbraw/zinc/70/65/38/1041706538.db2.gz LWJPZFKWMVQDDH-PMACEKPBSA-N 2 0 382.891 3.969 20 5 GHBDRP C[C@H](C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccccc1[N+](=O)[O-] ZINC001308536354 1050002013 /nfs/dbraw/zinc/00/20/13/1050002013.db2.gz WZLSULYUSLXZQV-GOSISDBHSA-N 2 0 383.492 3.963 20 5 GHBDRP O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[N@@H+]3CCSC[C@H]3C3CC3)CC2)cc1 ZINC001308775170 1050089568 /nfs/dbraw/zinc/08/95/68/1050089568.db2.gz MKMKHDRPTXZWMT-NRFANRHFSA-N 2 0 389.565 3.677 20 5 GHBDRP O=[N+]([O-])c1cccc(Br)c1C[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000849349802 1067815992 /nfs/dbraw/zinc/81/59/92/1067815992.db2.gz HFSHVORVHACRFT-CQSZACIVSA-N 2 0 382.302 3.569 20 5 GHBDRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000513786498 847576176 /nfs/dbraw/zinc/57/61/76/847576176.db2.gz IATSJNSAVPBHIE-RCLSDMTESA-N 2 0 389.540 3.785 20 5 GHBDRP CC[C@@H]([NH2+]CC1(N)CC[NH+](Cc2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000423580938 849988101 /nfs/dbraw/zinc/98/81/01/849988101.db2.gz YNFHVFMCIQKFKI-OAQYLSRUSA-N 2 0 382.508 3.629 20 5 GHBDRP COc1cc(C[NH2+][C@@H]2CCC[C@H]([NH3+])C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414930161 852403641 /nfs/dbraw/zinc/40/36/41/852403641.db2.gz SNLJHFXUCNTAOQ-ZWKOTPCHSA-N 2 0 385.464 3.542 20 5 GHBDRP COc1cc(C[NH2+]C[C@]2(C)CCC[NH2+]C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414899249 852840744 /nfs/dbraw/zinc/84/07/44/852840744.db2.gz CIWLAAGZEAGPKW-JOCHJYFZSA-N 2 0 399.491 3.662 20 5 GHBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccc(CN2CC[NH+](C)CC2)cc1 ZINC000126700610 853242158 /nfs/dbraw/zinc/24/21/58/853242158.db2.gz BEZNHTLGGXIMED-GOSISDBHSA-N 2 0 382.508 3.501 20 5 GHBDRP O=[N+]([O-])c1cccc([C@@H]([NH2+]CCCC[N@H+]2CCC[C@H]2CO)c2ccccc2)c1 ZINC000245906002 857195714 /nfs/dbraw/zinc/19/57/14/857195714.db2.gz FHGDMUHASVDLIT-VXKWHMMOSA-N 2 0 383.492 3.511 20 5 GHBDRP COc1cc(C[N@@H+]2CCC[C@H](CC[NH3+])C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000442925684 858234111 /nfs/dbraw/zinc/23/41/11/858234111.db2.gz WDRBCVOQYSCMLD-QGZVFWFLSA-N 2 0 399.491 3.743 20 5 GHBDRP O=[N+]([O-])c1cccc(-c2nc(C[NH2+]CC3CC[NH+](CC4CC4)CC3)cs2)c1 ZINC000595001360 858362972 /nfs/dbraw/zinc/36/29/72/858362972.db2.gz VAGPMIVHMUQNDP-UHFFFAOYSA-N 2 0 386.521 3.930 20 5 GHBDRP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000595071040 858371622 /nfs/dbraw/zinc/37/16/22/858371622.db2.gz XPZUTNTZXXGYDL-MRXNPFEDSA-N 2 0 384.480 3.561 20 5 GHBDRP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCCC[N@@H+]2Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000593316311 859389620 /nfs/dbraw/zinc/38/96/20/859389620.db2.gz BQDCKWGVZDPCSI-PBEJRMEISA-N 2 0 385.464 3.716 20 5 GHBDRP O=[N+]([O-])c1cccc(-c2nc(C[NH+]3CCC([C@@H]4CCC[NH2+]C4)CC3)cs2)c1 ZINC000594736785 868419630 /nfs/dbraw/zinc/41/96/30/868419630.db2.gz UYLAKJWQMUIQGN-QGZVFWFLSA-N 2 0 386.521 3.930 20 5 GHBDRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000447522913 871746944 /nfs/dbraw/zinc/74/69/44/871746944.db2.gz ZUPSDJMKJFYRPN-VQTJNVASSA-N 2 0 385.512 3.907 20 5 GHBDRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000105464811 875300506 /nfs/dbraw/zinc/30/05/06/875300506.db2.gz JUJWDPIURPYYIP-MRXNPFEDSA-N 2 0 386.471 3.727 20 5 GHBDRP COc1ccc(-c2ccc(C[N@@H+]3CCCC34CC[NH+](C)CC4)o2)c([N+](=O)[O-])c1 ZINC000616141628 878575532 /nfs/dbraw/zinc/57/55/32/878575532.db2.gz CUIBUXBKPDQKLC-UHFFFAOYSA-N 2 0 385.464 3.924 20 5 GHBDRP C[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815555878 893994838 /nfs/dbraw/zinc/99/48/38/893994838.db2.gz JNKHWWXAHSVBEA-BBWFWOEESA-N 2 0 398.507 3.637 20 5 GHBDRP CC1CC[NH+](Cc2ccccc2C[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000818956754 896293523 /nfs/dbraw/zinc/29/35/23/896293523.db2.gz ONMKCNIACAOXGP-JOCHJYFZSA-N 2 0 383.492 3.650 20 5 GHBDRP CC(C)[N@@H+]1CC[C@H]([NH2+]C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)[C@@H](C)C1 ZINC001173014560 906091649 /nfs/dbraw/zinc/09/16/49/906091649.db2.gz SEKJEPWOVRFYEQ-LIRRHRJNSA-N 2 0 396.482 3.550 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]C2CC[NH+](CC(C)(C)C)CC2)c1F ZINC001173178461 906256769 /nfs/dbraw/zinc/25/67/69/906256769.db2.gz HRQIGJISAFBPEK-AWEZNQCLSA-N 2 0 381.492 3.774 20 5 GHBDRP O=[N+]([O-])c1cc(C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc(C(F)(F)F)c1 ZINC000297296503 919214439 /nfs/dbraw/zinc/21/44/39/919214439.db2.gz AESFHDMEYWREFB-UHFFFAOYSA-N 2 0 380.370 3.767 20 5 GHBDRP Cc1cc2cc3ccc(N(C)C)cc3nc2cc1NC(=O)C[C@@H]([NH3+])CCCC[NH3+] ZINC001219209854 1031306954 /nfs/dbraw/zinc/30/69/54/1031306954.db2.gz BLDOEZWEJYRLHX-SFHVURJKSA-N 2 0 393.535 3.547 20 5 GHBDRP CC(C)[N@H+](C)[C@@H]1CCN(C(=O)[C@@H]([NH3+])Cc2c3ccccc3cc3ccccc32)C1 ZINC001161049913 1035125833 /nfs/dbraw/zinc/12/58/33/1035125833.db2.gz JINSRZGHARTRPA-YKSBVNFPSA-N 2 0 389.543 3.804 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH2+][C@H]1C[C@H]3CC[C@@H](C1)[N@H+]3Cc1ccccc1)C2 ZINC001254572055 1040347600 /nfs/dbraw/zinc/34/76/00/1040347600.db2.gz HHRCLWZIAJXCJU-YUMYIRISSA-N 2 0 377.488 3.847 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH2+][C@H]1C[C@H]3CC[C@@H](C1)[N@H+]3Cc1ccccc1)C2 ZINC001254572054 1040348931 /nfs/dbraw/zinc/34/89/31/1040348931.db2.gz HHRCLWZIAJXCJU-KJJMTIBFSA-N 2 0 377.488 3.847 20 5 GHBDRP COc1cccc(C[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001254587961 1040361480 /nfs/dbraw/zinc/36/14/80/1040361480.db2.gz STFYZIYYHKKOGU-ONTIZHBOSA-N 2 0 395.503 3.843 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@@H+]1CC[C@H]3C[NH+](Cc4ccccc4)CC[C@@H]3C1)C2 ZINC001254611114 1040384268 /nfs/dbraw/zinc/38/42/68/1040384268.db2.gz VTQKSDHLIOXPEI-YZUZCNPQSA-N 2 0 391.515 3.906 20 5 GHBDRP CC[C@@H]([NH2+]CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1)[C@H]1CCCOC1 ZINC001474681874 1074512002 /nfs/dbraw/zinc/51/20/02/1074512002.db2.gz DTVNLPVBRHUJFL-RBBKRZOGSA-N 2 0 389.540 3.644 20 5 GHBDRP CC[N@H+](CCC1CC[NH+](Cc2ccc(OC)c([N+](=O)[O-])c2)CC1)CC1CC1 ZINC000536141010 835112661 /nfs/dbraw/zinc/11/26/61/835112661.db2.gz MRBDJLAOPYPJNI-UHFFFAOYSA-N 2 0 375.513 3.937 20 5 GHBDRP COc1cc(C[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)c([N+](=O)[O-])cc1OCC(F)F ZINC000414806051 838849287 /nfs/dbraw/zinc/84/92/87/838849287.db2.gz GZFNRPHDYOVKEM-GFCCVEGCSA-N 2 0 395.406 3.557 20 5 GHBDRP [NH3+][C@H]1CCC[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)C1 ZINC000414925376 838989919 /nfs/dbraw/zinc/98/99/19/838989919.db2.gz LSTZJNYRKOYSQL-RYUDHWBXSA-N 2 0 394.269 3.977 20 5 GHBDRP [NH3+]CC1CC[NH+](Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000435387767 850452149 /nfs/dbraw/zinc/45/21/49/850452149.db2.gz BLZQLULJSIWWNC-UHFFFAOYSA-N 2 0 391.475 3.618 20 5 GHBDRP COc1ccc(C[N@@H+]2CCC[C@H]([C@H](C)[NH3+])C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000592427682 857402962 /nfs/dbraw/zinc/40/29/62/857402962.db2.gz PVVWXYAEQXLWNC-LPHOPBHVSA-N 2 0 399.491 3.742 20 5 GHBDRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000575059037 858508862 /nfs/dbraw/zinc/50/88/62/858508862.db2.gz CPEDDFFAMLLOJX-HZPDHXFCSA-N 2 0 379.464 3.663 20 5 GHBDRP O=[N+]([O-])c1ccc(C[NH+]2CCC(CCC[NH+]3CCOCC3)CC2)c(Cl)c1 ZINC000543903184 858863678 /nfs/dbraw/zinc/86/36/78/858863678.db2.gz BJVMEBWJNWSQCL-UHFFFAOYSA-N 2 0 381.904 3.573 20 5 GHBDRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444684955 867060869 /nfs/dbraw/zinc/06/08/69/867060869.db2.gz OVUHCDOJYQHHKB-UHFFFAOYSA-N 2 0 394.479 3.605 20 5 GHBDRP C[NH+](C)CCOC1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000538732561 870465236 /nfs/dbraw/zinc/46/52/36/870465236.db2.gz YIAUFIRNBSXWQO-UHFFFAOYSA-N 2 0 389.521 3.866 20 5 GHBDRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000539072272 871260785 /nfs/dbraw/zinc/26/07/85/871260785.db2.gz PFDCUFHUDAAKBH-QGZVFWFLSA-N 2 0 398.507 3.942 20 5 GHBDRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000447554179 871843629 /nfs/dbraw/zinc/84/36/29/871843629.db2.gz ZGALIIACANFJQE-PMACEKPBSA-N 2 0 385.512 3.905 20 5 GHBDRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000447564557 871872126 /nfs/dbraw/zinc/87/21/26/871872126.db2.gz XTQIOBSFGDUTEZ-WOJBJXKFSA-N 2 0 385.512 3.905 20 5 GHBDRP COc1ccc(CNC2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000449104336 874475751 /nfs/dbraw/zinc/47/57/51/874475751.db2.gz VGSINSVSMKOPEI-KRWDZBQOSA-N 2 0 383.492 3.789 20 5 GHBDRP CC1CC[NH+](Cc2ccc(C[NH2+]C[C@@H](O)c3ccc([N+](=O)[O-])cc3)cc2)CC1 ZINC000776278244 876161661 /nfs/dbraw/zinc/16/16/61/876161661.db2.gz SQDWDRMMDVVDIB-JOCHJYFZSA-N 2 0 383.492 3.650 20 5 GHBDRP C[C@@H]1C[N@@H+](CCC2CC[NH+](C/C=C\c3ccccc3[N+](=O)[O-])CC2)C[C@H](C)O1 ZINC000537659561 883006073 /nfs/dbraw/zinc/00/60/73/883006073.db2.gz YJYANOWGHMLXCC-MMHDITDQSA-N 2 0 387.524 3.819 20 5 GHBDRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000237680153 877789293 /nfs/dbraw/zinc/78/92/93/877789293.db2.gz KIVCAIUDNVMBII-HDICACEKSA-N 2 0 399.539 3.843 20 5 GHBDRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]C3CC(n4cc([N+](=O)[O-])cn4)C3)cc2)C1 ZINC000876930918 893392383 /nfs/dbraw/zinc/39/23/83/893392383.db2.gz GYFZFONGLOGTSF-PBPGXSGUSA-N 2 0 383.496 3.517 20 5 GHBDRP Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(CC[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000565389352 895585948 /nfs/dbraw/zinc/58/59/48/895585948.db2.gz BKVLJPCLWFNLLH-QZTJIDSGSA-N 2 0 375.513 3.615 20 5 GHBDRP C[C@H]1CCC[N@H+](Cc2ccccc2C[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000818960108 896267265 /nfs/dbraw/zinc/26/72/65/896267265.db2.gz XNFBMIZDEUTVIJ-HTAPYJJXSA-N 2 0 383.492 3.650 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@H]2CC(C)(C)C[C@](C)(C[NH3+])C2)c1F ZINC001173190182 906270954 /nfs/dbraw/zinc/27/09/54/906270954.db2.gz VFGYHQXOWIOKQU-PJSUUKDQSA-N 2 0 381.492 3.807 20 5 GHBDRP COC[C@@H](CC(C)(C)C)[NH2+]CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001182605762 911920898 /nfs/dbraw/zinc/92/08/98/911920898.db2.gz WNEMRRIKUFKRPX-HXUWFJFHSA-N 2 0 391.556 3.890 20 5 GHBDRP Cn1cc(C[NH2+]C2CCC([NH+]3CCCCC3)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000751152814 928051106 /nfs/dbraw/zinc/05/11/06/928051106.db2.gz PWKCBPWTNWBWNT-UHFFFAOYSA-N 2 0 397.523 3.882 20 5 GHBDRP CSC1CC[NH+](CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC001207082443 1034084469 /nfs/dbraw/zinc/08/44/69/1034084469.db2.gz DRCFWXPCCUJBIT-UHFFFAOYSA-N 2 0 377.554 3.677 20 5 GHBDRP C[NH+](C)CCN(C(=O)c1c2ccccc2cc2ccccc21)[C@@H]1CCC[NH2+]C1 ZINC001161452997 1035233413 /nfs/dbraw/zinc/23/34/13/1035233413.db2.gz VVMSVZSEJAUJLM-HXUWFJFHSA-N 2 0 375.516 3.749 20 5 GHBDRP C[C@H]1SCC[N@H+](CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)[C@@H]1C ZINC001461961623 1069916816 /nfs/dbraw/zinc/91/68/16/1069916816.db2.gz SSLJHDQTHCWUGG-IAGOWNOFSA-N 2 0 377.554 3.675 20 5 GHBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC1(Cc2ccc(F)cc2)CC[NH2+]CC1 ZINC001246383067 1037342385 /nfs/dbraw/zinc/34/23/85/1037342385.db2.gz CQTNMNRYYIABSP-QGZVFWFLSA-N 2 0 385.483 3.867 20 5 GHBDRP COc1cccc(CC2(C[NH2+][C@@H](C)Cc3ccc([N+](=O)[O-])cc3)CC[NH2+]CC2)c1 ZINC001246383514 1037343146 /nfs/dbraw/zinc/34/31/46/1037343146.db2.gz GBXXMBJKBVUHKU-SFHVURJKSA-N 2 0 397.519 3.737 20 5 GHBDRP COc1ccccc1CC1(C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC[NH2+]CC1 ZINC001246421620 1037379340 /nfs/dbraw/zinc/37/93/40/1037379340.db2.gz SDFKJLAQRYPSCA-SFHVURJKSA-N 2 0 397.519 3.737 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]C1(Cc3ccccc3)CC[NH2+]CC1)CC2 ZINC001246470925 1037423024 /nfs/dbraw/zinc/42/30/24/1037423024.db2.gz ZVSVKXWGDQCBNE-NRFANRHFSA-N 2 0 379.504 3.797 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CC[C@@]3(C[NH2+]C[C@@H]3c3ccccc3)C1)CC2 ZINC001246673066 1037537273 /nfs/dbraw/zinc/53/72/73/1037537273.db2.gz NVCLSWCAJFUCOC-GMKZXUHWSA-N 2 0 391.515 3.921 20 5 GHBDRP CC(C)(C)[NH2+]C[C@@H](O)CNc1cc2oc3cc(=[NH2+])ccc-3nc2c2ccccc12 ZINC001253402533 1039601825 /nfs/dbraw/zinc/60/18/25/1039601825.db2.gz HFSNELHHRGKTEU-HNNXBMFYSA-N 2 0 390.487 3.726 20 5 GHBDRP CC[C@H]([NH2+]Cc1cccc(CN2CC[NH+](C)CC2)c1)c1cccc([N+](=O)[O-])c1 ZINC001319764189 1055452453 /nfs/dbraw/zinc/45/24/53/1055452453.db2.gz YWROEWSVUCELSY-QFIPXVFZSA-N 2 0 382.508 3.583 20 5 GHBDRP COc1ccc(C[NH2+][C@H]2CCC[C@@H]([NH3+])C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414928052 838982579 /nfs/dbraw/zinc/98/25/79/838982579.db2.gz PUXXYRBMRHCOEK-MSOLQXFVSA-N 2 0 385.464 3.542 20 5 GHBDRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000303204667 861583309 /nfs/dbraw/zinc/58/33/09/861583309.db2.gz PGAPLLIVPROWSN-UHFFFAOYSA-N 2 0 383.492 3.818 20 5 GHBDRP COc1ccc(C[N@H+](Cc2ccsc2)[C@@H]2CC23CC[NH2+]CC3)cc1[N+](=O)[O-] ZINC000435428808 850511640 /nfs/dbraw/zinc/51/16/40/850511640.db2.gz SVXNRYSPMBBBPA-LJQANCHMSA-N 2 0 387.505 3.809 20 5 GHBDRP O=[N+]([O-])c1ccccc1OCC[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000536490797 856241877 /nfs/dbraw/zinc/24/18/77/856241877.db2.gz IIYSXZUGGQURQB-UHFFFAOYSA-N 2 0 395.503 3.962 20 5 GHBDRP O=[N+]([O-])c1ccc(OCC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000618571809 871737959 /nfs/dbraw/zinc/73/79/59/871737959.db2.gz ZZZCIVSCTVOEQU-ZKTXZKFHSA-N 2 0 381.476 3.759 20 5 GHBDRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000447554181 871844711 /nfs/dbraw/zinc/84/47/11/871844711.db2.gz ZGALIIACANFJQE-UXHICEINSA-N 2 0 385.512 3.905 20 5 GHBDRP C[C@@H]([NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788633838 878224875 /nfs/dbraw/zinc/22/48/75/878224875.db2.gz VGMCZMUCRXGWIK-SVQXRNPESA-N 2 0 382.508 3.984 20 5 GHBDRP O=[N+]([O-])c1cnn(C2CC([NH2+]Cc3cccc(C[NH+]4CCCCCC4)c3)C2)c1 ZINC000876991003 893423449 /nfs/dbraw/zinc/42/34/49/893423449.db2.gz QGFPQAQJUVAYJW-UHFFFAOYSA-N 2 0 383.496 3.661 20 5 GHBDRP COc1cc(C[NH+]2CCC(CC[NH3+])CC2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000565061597 895373905 /nfs/dbraw/zinc/37/39/05/895373905.db2.gz USXAACKKVIIDFD-UHFFFAOYSA-N 2 0 399.491 3.743 20 5 GHBDRP COc1ccc(CC2([NH3+])CC[NH+]([C@@H](C)Cc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC001173221090 906297531 /nfs/dbraw/zinc/29/75/31/906297531.db2.gz FOJPXAPKBSSZKJ-KRWDZBQOSA-N 2 0 383.492 3.570 20 5 GHBDRP O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[NH2+]C[C@@H]3CCCSC3)CC2)cc1 ZINC001182159810 911215302 /nfs/dbraw/zinc/21/53/02/911215302.db2.gz BVWVXENPWLLREP-IBGZPJMESA-N 2 0 377.554 3.582 20 5 GHBDRP O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]C2CC[NH+](CC3CCCCC3)CC2)n1 ZINC000774159856 911459954 /nfs/dbraw/zinc/45/99/54/911459954.db2.gz QNWFGMMUKZSPBF-UXHICEINSA-N 2 0 389.544 3.909 20 5 GHBDRP C[C@@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000284294822 911816748 /nfs/dbraw/zinc/81/67/48/911816748.db2.gz UNYIWBKMAQOQGP-OAHLLOKOSA-N 2 0 384.480 3.501 20 5 GHBDRP [NH3+]CCC[C@@H]([NH2+]Cc1ccc(Br)cc1[N+](=O)[O-])c1ccccc1 ZINC000925762548 931896391 /nfs/dbraw/zinc/89/63/91/931896391.db2.gz LFLWPEYCORCOJD-MRXNPFEDSA-N 2 0 378.270 3.927 20 5 GHBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1 ZINC000468644032 1015868244 /nfs/dbraw/zinc/86/82/44/1015868244.db2.gz WYKHEJAGMHNSLR-AQTBWJFISA-N 2 0 395.503 3.745 20 5 GHBDRP C[C@H]1CC[NH2+][C@@H](C(=O)Nc2cc3oc4cc(=[NH2+])ccc-4nc3c3ccccc23)C1 ZINC001219369301 1031383404 /nfs/dbraw/zinc/38/34/04/1031383404.db2.gz CHJVOMLCUFDSLQ-ORAYPTAESA-N 2 0 386.455 3.892 20 5 GHBDRP CN(Cc1c2ccccc2cc2ccccc21)C(=O)[C@@H]1CCC2(CC[NH2+]CC2)[NH2+]1 ZINC001160739814 1035050456 /nfs/dbraw/zinc/05/04/56/1035050456.db2.gz WVPYSFLUWOSWSU-QHCPKHFHSA-N 2 0 387.527 3.826 20 5 GHBDRP COc1ccc(C[C@@H](C)[NH2+][C@@H]2CC3(CC[NH2+]CC3)c3ccccc32)c([N+](=O)[O-])c1 ZINC001246259112 1037259260 /nfs/dbraw/zinc/25/92/60/1037259260.db2.gz ZFRNSKGRCWPLED-IIBYNOLFSA-N 2 0 395.503 3.890 20 5 GHBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC1(Cc2ccc(F)cc2)CC[NH2+]CC1 ZINC001246383136 1037342313 /nfs/dbraw/zinc/34/23/13/1037342313.db2.gz DKPSXLDSOHZDGQ-KRWDZBQOSA-N 2 0 385.483 3.867 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]C2(CC3CCC3)CC[NH2+]CC2)c1F ZINC001246446065 1037407830 /nfs/dbraw/zinc/40/78/30/1037407830.db2.gz KLQGGROUUXYTPO-AWEZNQCLSA-N 2 0 379.476 3.576 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CC[C@]3(C[NH2+]C[C@@H]3c3ccccc3)C1)CC2 ZINC001246684716 1037549056 /nfs/dbraw/zinc/54/90/56/1037549056.db2.gz NVCLSWCAJFUCOC-QTJGBDASSA-N 2 0 391.515 3.921 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@@H+](Cc1ccc(F)cc1)CC1CC[NH2+]CC1)C2 ZINC001246934863 1037736766 /nfs/dbraw/zinc/73/67/66/1037736766.db2.gz CIYULJZSFWXHEY-JOCHJYFZSA-N 2 0 383.467 3.703 20 5 GHBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH+]1CCC2(CC[N@H+](Cc3cccnc3)C2)CC1 ZINC001254558954 1040330027 /nfs/dbraw/zinc/33/00/27/1040330027.db2.gz WNUXMOCGJJQABC-LJQANCHMSA-N 2 0 394.519 3.909 20 5 GHBDRP O=C(C1CC[NH+](Cc2c3ccccc3cc3ccccc32)CC1)N1CC[NH2+]CC1 ZINC001235299025 1040771784 /nfs/dbraw/zinc/77/17/84/1040771784.db2.gz RSPRMOOOPMINJG-UHFFFAOYSA-N 2 0 387.527 3.637 20 5 GHBDRP C[NH+](C)[C@@H]1CC[C@H]2C[N@H+](Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)C[C@@H]2C1 ZINC001355372351 1057136009 /nfs/dbraw/zinc/13/60/09/1057136009.db2.gz BBLJRIAJQGPFQH-XYJFISCASA-N 2 0 386.521 3.880 20 5 GHBDRP Cc1ccc([C@H](C)[NH2+]Cc2cccc(CN3CC[NH+](C)CC3)c2)cc1[N+](=O)[O-] ZINC001340527389 1059964254 /nfs/dbraw/zinc/96/42/54/1059964254.db2.gz MHJXOFAPKRXACQ-SFHVURJKSA-N 2 0 382.508 3.501 20 5 GHBDRP COc1ccc(-c2ccc(C[N@@H+]3CCC[C@H]4C[NH+](C)CC[C@H]43)o2)c([N+](=O)[O-])c1 ZINC000583532988 834587181 /nfs/dbraw/zinc/58/71/81/834587181.db2.gz ZOEYVWBRSZKRPP-HNAYVOBHSA-N 2 0 385.464 3.780 20 5 GHBDRP [NH3+]C[C@@H]1CC[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)C1 ZINC000415042955 839109287 /nfs/dbraw/zinc/10/92/87/839109287.db2.gz RMZNZUZGXGZFFJ-NEPJUHHUSA-N 2 0 394.269 3.834 20 5 GHBDRP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000482140547 842032243 /nfs/dbraw/zinc/03/22/43/842032243.db2.gz WPZYJNWCZJNVNC-HKUYNNGSSA-N 2 0 390.528 3.722 20 5 GHBDRP C[C@H](c1ccccc1[N+](=O)[O-])[N@H+](C)CCC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000430956284 843252441 /nfs/dbraw/zinc/25/24/41/843252441.db2.gz NYKZDSUSZVZRQI-GOSISDBHSA-N 2 0 388.556 3.784 20 5 GHBDRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000056184761 861448217 /nfs/dbraw/zinc/44/82/17/861448217.db2.gz AFXZNEZQJGIIDE-QGZVFWFLSA-N 2 0 398.507 3.862 20 5 GHBDRP CCC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1)c1cccc([N+](=O)[O-])c1 ZINC000248432680 856173976 /nfs/dbraw/zinc/17/39/76/856173976.db2.gz CPDKOLPGKHKOKJ-YADHBBJMSA-N 2 0 383.492 3.792 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C[N@H+]3CC[C@@H](O)C3)cc1)CCCC2 ZINC000595066103 858369119 /nfs/dbraw/zinc/36/91/19/858369119.db2.gz BYGIPOOQYQWPQF-GGAORHGYSA-N 2 0 395.503 3.719 20 5 GHBDRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000575059036 858508706 /nfs/dbraw/zinc/50/87/06/858508706.db2.gz CPEDDFFAMLLOJX-HOTGVXAUSA-N 2 0 379.464 3.663 20 5 GHBDRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)CC1 ZINC000160353155 858827773 /nfs/dbraw/zinc/82/77/73/858827773.db2.gz NAISJWRQTWVUGK-LJQANCHMSA-N 2 0 396.535 3.892 20 5 GHBDRP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C2)C1 ZINC000593314718 859380664 /nfs/dbraw/zinc/38/06/64/859380664.db2.gz GKWHSECLDRJTPJ-GCKMJXCFSA-N 2 0 385.464 3.573 20 5 GHBDRP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000154889860 860313956 /nfs/dbraw/zinc/31/39/56/860313956.db2.gz GUGONDMEVOQREE-CVEARBPZSA-N 2 0 388.537 3.610 20 5 GHBDRP CCOc1ccc([C@H](C)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1[N+](=O)[O-] ZINC000595048333 869810744 /nfs/dbraw/zinc/81/07/44/869810744.db2.gz KGUGVQYCHGIVLW-INIZCTEOSA-N 2 0 391.512 3.535 20 5 GHBDRP Cc1ccc(C[NH+]2CCC(CC[NH+]3C[C@@H](C)O[C@H](C)C3)CC2)cc1[N+](=O)[O-] ZINC000539861823 869913485 /nfs/dbraw/zinc/91/34/85/869913485.db2.gz LPAXTDNCARCIRO-QZTJIDSGSA-N 2 0 375.513 3.615 20 5 GHBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000449311485 874718879 /nfs/dbraw/zinc/71/88/79/874718879.db2.gz MRKPVVVMJUBTMH-KRWDZBQOSA-N 2 0 383.492 3.789 20 5 GHBDRP CC(C)[NH+]1CCC(O)(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000532120061 881229284 /nfs/dbraw/zinc/22/92/84/881229284.db2.gz PRQKQWBGNPIJQZ-UHFFFAOYSA-N 2 0 389.521 3.648 20 5 GHBDRP O=[N+]([O-])c1cccc([C@@H](O)C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)c1 ZINC000762925852 887108034 /nfs/dbraw/zinc/10/80/34/887108034.db2.gz HSSPLRJHQCCJNB-QFIPXVFZSA-N 2 0 395.503 3.616 20 5 GHBDRP CC[NH+](CC)[C@H]1CC[C@H]([NH2+][C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])CC1 ZINC001173184184 906266252 /nfs/dbraw/zinc/26/62/52/906266252.db2.gz LUNYKQPNWLJNIT-JYJNAYRXSA-N 2 0 381.492 3.916 20 5 GHBDRP CC[NH+](CC)[C@H]1CC[C@@H]([NH2+][C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])CC1 ZINC001173184187 906266571 /nfs/dbraw/zinc/26/65/71/906266571.db2.gz LUNYKQPNWLJNIT-OAGGEKHMSA-N 2 0 381.492 3.916 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH+]2CCC(C3CC[NH+](C)CC3)CC2)c1F ZINC001173189851 906270831 /nfs/dbraw/zinc/27/08/31/906270831.db2.gz NGMOJEBMJCLIQG-HNNXBMFYSA-N 2 0 393.503 3.727 20 5 GHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H]2C[NH+](Cc3ccccc3)C[C@@H]2C1 ZINC001173233272 906318235 /nfs/dbraw/zinc/31/82/35/906318235.db2.gz VDMFDSXPARMPBE-BVYCBKJFSA-N 2 0 379.504 3.980 20 5 GHBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1 ZINC000271123867 910788720 /nfs/dbraw/zinc/78/87/20/910788720.db2.gz JZZXIZYHLZQJGQ-DLBZAZTESA-N 2 0 393.553 3.556 20 5 GHBDRP C[C@H]([NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1cccc(OCC[NH+](C)C)c1 ZINC000561785288 934452418 /nfs/dbraw/zinc/45/24/18/934452418.db2.gz PPCPBGMFWABGPO-INIZCTEOSA-N 2 0 396.491 3.910 20 5 GHBDRP CSCC[C@H](C)[N@H+](C)CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001461905914 1069865456 /nfs/dbraw/zinc/86/54/56/1069865456.db2.gz UEQHKNBNPMCTTJ-KRWDZBQOSA-N 2 0 379.570 3.923 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]CC2(CC3CCC3)CC[NH2+]CC2)c1F ZINC001246422291 1037378570 /nfs/dbraw/zinc/37/85/70/1037378570.db2.gz BZYLKNFKEULGNC-HNNXBMFYSA-N 2 0 393.503 3.823 20 5 GHBDRP COc1ccc(C[C@H](C)[N@H+](CC2CCC2)[C@H]2CC[C@H]([NH3+])CC2)c([N+](=O)[O-])c1 ZINC001246965316 1037787306 /nfs/dbraw/zinc/78/73/06/1037787306.db2.gz PMAQMLNKNZDUNR-SNRMKQJTSA-N 2 0 375.513 3.906 20 5 GHBDRP O=[N+]([O-])c1cccc(Br)c1C[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000849349801 1067816287 /nfs/dbraw/zinc/81/62/87/1067816287.db2.gz HFSHVORVHACRFT-AWEZNQCLSA-N 2 0 382.302 3.569 20 5 GHBDRP COc1ccc(C[NH2+][C@H]2CCC[C@H]([NH3+])C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414928066 838982136 /nfs/dbraw/zinc/98/21/36/838982136.db2.gz PUXXYRBMRHCOEK-ROUUACIJSA-N 2 0 385.464 3.542 20 5 GHBDRP [NH3+][C@@H]1CCO[C@@H](C2CC[NH+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)CC2)C1 ZINC000415126940 839237573 /nfs/dbraw/zinc/23/75/73/839237573.db2.gz QMQQUDKSJASNNJ-DYESRHJHSA-N 2 0 385.464 3.573 20 5 GHBDRP Cc1cc(N2CC[C@@H](OCC[NH+]3CCCCC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302087279 861202041 /nfs/dbraw/zinc/20/20/41/861202041.db2.gz NYJBLFIHTQGGMV-GOSISDBHSA-N 2 0 384.480 3.533 20 5 GHBDRP CCC(CC)N(CC(C)C)c1ccc(NC(=[NH2+])NCCCC[NH3+])cc1[N+](=O)[O-] ZINC001167883190 843207635 /nfs/dbraw/zinc/20/76/35/843207635.db2.gz CEDOZMWLRJDCFD-UHFFFAOYSA-N 2 0 392.548 3.921 20 5 GHBDRP COc1cc(C[NH+]2CCC([C@H](C)[NH3+])CC2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000435372871 850422014 /nfs/dbraw/zinc/42/20/14/850422014.db2.gz SUYLBEMGIJOUBX-INIZCTEOSA-N 2 0 399.491 3.742 20 5 GHBDRP CC[NH+]1CCN(Cc2ccccc2C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)CC1 ZINC000160353033 858826925 /nfs/dbraw/zinc/82/69/25/858826925.db2.gz NAISJWRQTWVUGK-IBGZPJMESA-N 2 0 396.535 3.892 20 5 GHBDRP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCCC[N@@H+]2Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000593316234 859388612 /nfs/dbraw/zinc/38/86/12/859388612.db2.gz BFXQDOJVQLVGEZ-MFMILTCTSA-N 2 0 385.464 3.716 20 5 GHBDRP Cc1ccc(C[NH+]2CC[C@H](Oc3ccnc(C[N@@H+](C)C(C)C)c3)C2)cc1[N+](=O)[O-] ZINC000856560570 881440583 /nfs/dbraw/zinc/44/05/83/881440583.db2.gz IYEQYRSATPTDMQ-NRFANRHFSA-N 2 0 398.507 3.792 20 5 GHBDRP Cc1cccc(N2CC[NH+](CCCC[NH2+]Cc3ccc(C)c([N+](=O)[O-])c3)CC2)c1 ZINC000603633457 860952647 /nfs/dbraw/zinc/95/26/47/860952647.db2.gz KTNVTZLLOSIOEG-UHFFFAOYSA-N 2 0 396.535 3.904 20 5 GHBDRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)CC(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000540174774 870662607 /nfs/dbraw/zinc/66/26/07/870662607.db2.gz ZEEKMDVRBMTSJM-KRWDZBQOSA-N 2 0 398.507 3.942 20 5 GHBDRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000447506772 871718755 /nfs/dbraw/zinc/71/87/55/871718755.db2.gz DZKFOAZREYSMAV-VQTJNVASSA-N 2 0 385.512 3.907 20 5 GHBDRP C[C@H](CC[NH2+][C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)[N@H+](C)Cc1ccccc1 ZINC000447529829 871762431 /nfs/dbraw/zinc/76/24/31/871762431.db2.gz LCBHDMGDPJOSMH-MISYRCLQSA-N 2 0 385.512 3.775 20 5 GHBDRP CC(C)c1ccc(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)cc1[N+](=O)[O-] ZINC001201626841 875802085 /nfs/dbraw/zinc/80/20/85/875802085.db2.gz QEPCOERMNUZHNW-OAQYLSRUSA-N 2 0 397.519 3.965 20 5 GHBDRP COc1ccc(C[NH2+]CC2=CC[N@H+](C)CC2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000538446312 879504178 /nfs/dbraw/zinc/50/41/78/879504178.db2.gz XCJHYDSXYLPNJF-UHFFFAOYSA-N 2 0 397.475 3.534 20 5 GHBDRP C[NH+](C)CCOC1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000536676970 893520155 /nfs/dbraw/zinc/52/01/55/893520155.db2.gz UNMARCYQXIQMNZ-UHFFFAOYSA-N 2 0 389.521 3.866 20 5 GHBDRP CC1CC[NH+](Cc2ccccc2C[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000818958186 896296467 /nfs/dbraw/zinc/29/64/67/896296467.db2.gz YYPXZLCDAWEUSU-JOCHJYFZSA-N 2 0 383.492 3.650 20 5 GHBDRP COCC[NH2+]C1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000569814694 898966685 /nfs/dbraw/zinc/96/66/85/898966685.db2.gz IOQJFYOZPRLZOA-UHFFFAOYSA-N 2 0 375.494 3.524 20 5 GHBDRP C[NH+](C)CCOc1ccccc1C[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172901292 905923019 /nfs/dbraw/zinc/92/30/19/905923019.db2.gz HBPPEFZTIOVYTN-FQEVSTJZSA-N 2 0 383.492 3.572 20 5 GHBDRP CC1CC[NH+](CCC[NH2+]C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC1 ZINC001173006578 906080364 /nfs/dbraw/zinc/08/03/64/906080364.db2.gz WTGRAKWOWRXCLX-UHFFFAOYSA-N 2 0 396.482 3.553 20 5 GHBDRP CCC[NH+](CCC)CCCN1CC[NH+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173231183 906315974 /nfs/dbraw/zinc/31/59/74/906315974.db2.gz KHRFXDHFVCRWTE-FQEVSTJZSA-N 2 0 390.572 3.656 20 5 GHBDRP Cc1noc(C)c1C[N@H+](C)CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001180011458 909881948 /nfs/dbraw/zinc/88/19/48/909881948.db2.gz NFUQHBLMMMKOBA-UHFFFAOYSA-N 2 0 386.496 3.586 20 5 GHBDRP CC[NH+](CC)CCOC1CC[NH+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC1 ZINC000470176198 930433709 /nfs/dbraw/zinc/43/37/09/930433709.db2.gz JBCJJTURAWYPHU-OBGWFSINSA-N 2 0 375.513 3.821 20 5 GHBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000470185967 930440483 /nfs/dbraw/zinc/44/04/83/930440483.db2.gz NLXDRUGNGGJODM-PEJLPUCESA-N 2 0 387.524 3.819 20 5 GHBDRP C[C@@H]([NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccc(OCC[NH+](C)C)cc1 ZINC000558167019 931868067 /nfs/dbraw/zinc/86/80/67/931868067.db2.gz WEMUVGNCLDZUMD-MRXNPFEDSA-N 2 0 396.491 3.910 20 5 GHBDRP O=[N+]([O-])c1cc2c(cc1N[C@@H]1CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]13)C[NH2+]C2 ZINC001164492929 1026530392 /nfs/dbraw/zinc/53/03/92/1026530392.db2.gz PEFHPEKJYXWLQE-LSTHTHJFSA-N 2 0 378.476 3.521 20 5 GHBDRP [NH3+]C1CCC([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)CC1 ZINC000843103755 1029809774 /nfs/dbraw/zinc/80/97/74/1029809774.db2.gz BZMHXWVYPVKXSW-UHFFFAOYSA-N 2 0 394.269 3.977 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@H+](Cc1ccc(F)c(F)c1)C1CC[NH2+]CC1)C2 ZINC001246959714 1037776821 /nfs/dbraw/zinc/77/68/21/1037776821.db2.gz XULKGOBWZCYMFO-IBGZPJMESA-N 2 0 387.430 3.594 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH+]1CCC3(CC[N@H+](Cc4ccoc4)C3)CC1)C2 ZINC001254595004 1040367684 /nfs/dbraw/zinc/36/76/84/1040367684.db2.gz HWGZATSNIGXGQN-NRFANRHFSA-N 2 0 381.476 3.643 20 5 GHBDRP COc1ccc(C[NH2+][C@H]2CC[NH2+]CC2(C)C)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414967820 839020569 /nfs/dbraw/zinc/02/05/69/839020569.db2.gz HPQHDRICEHSFNZ-NRFANRHFSA-N 2 0 399.491 3.660 20 5 GHBDRP O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@H]4C[NH2+]C[C@H]4CC3)o2)c(Cl)c1 ZINC000574572390 858091972 /nfs/dbraw/zinc/09/19/72/858091972.db2.gz QVLBXCNYXZNXDF-OKILXGFUSA-N 2 0 375.856 3.940 20 5 GHBDRP O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CC2CC[NH+](C3CCOCC3)CC2)o1 ZINC000594952860 858344254 /nfs/dbraw/zinc/34/42/54/858344254.db2.gz DPVZWTNIAFLAPZ-UHFFFAOYSA-N 2 0 399.491 3.835 20 5 GHBDRP CC[NH+]1CCN(Cc2ccc(C[NH2+][C@H](C)c3cccc([N+](=O)[O-])c3C)cc2)CC1 ZINC000160320347 858809644 /nfs/dbraw/zinc/80/96/44/858809644.db2.gz WPZFTNQPGPEVRU-LJQANCHMSA-N 2 0 396.535 3.892 20 5 GHBDRP COc1cc([C@H](C)[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)cc([N+](=O)[O-])c1 ZINC000903167518 859524879 /nfs/dbraw/zinc/52/48/79/859524879.db2.gz ZSAGSFSVFGEMPT-INIZCTEOSA-N 2 0 399.491 3.927 20 5 GHBDRP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cn1nc(C)c2cc([N+](=O)[O-])ccc21 ZINC000764960783 859709570 /nfs/dbraw/zinc/70/95/70/859709570.db2.gz FJJANYUVKUICST-UHFFFAOYSA-N 2 0 381.480 3.794 20 5 GHBDRP CC[N@H+](C)Cc1cc(O[C@H]2CC[NH+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)ccn1 ZINC000856585371 881556969 /nfs/dbraw/zinc/55/69/69/881556969.db2.gz CSIIUGMQCQLRHL-UWJYYQICSA-N 2 0 398.507 3.964 20 5 GHBDRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CCOc1ccccc1[N+](=O)[O-] ZINC000460355512 872935041 /nfs/dbraw/zinc/93/50/41/872935041.db2.gz XNMRYWZFMPAQFG-OEWRPIJISA-N 2 0 383.492 3.720 20 5 GHBDRP O=[N+]([O-])c1sc(C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1Br ZINC001184315514 913122506 /nfs/dbraw/zinc/12/25/06/913122506.db2.gz WXVFZDHMUOMETE-UHFFFAOYSA-N 2 0 397.298 3.572 20 5 GHBDRP C[NH+](C)CCOc1ccc(C[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cc1 ZINC001172898717 905920184 /nfs/dbraw/zinc/92/01/84/905920184.db2.gz IUBYINJTGVRQMR-FQEVSTJZSA-N 2 0 383.492 3.572 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C1)CC2 ZINC001172913604 905983966 /nfs/dbraw/zinc/98/39/66/905983966.db2.gz SPVSCNCHVVJUKE-XPWALMASSA-N 2 0 391.515 3.906 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH2+]CC1(Cc3ccccc3Cl)CC[NH2+]CC1)C2 ZINC001246370404 1037328780 /nfs/dbraw/zinc/32/87/80/1037328780.db2.gz KGNDGYRKBFANGN-IBGZPJMESA-N 2 0 399.922 3.918 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CC1(c3ccccc3)CC[NH2+]CC1)CC2 ZINC001246376602 1037332507 /nfs/dbraw/zinc/33/25/07/1037332507.db2.gz WGTRWGYAQMMHHT-OAQYLSRUSA-N 2 0 379.504 3.753 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH2+][C@@H](CC1CC[NH2+]CC1)c1ccc(F)cc1)C2 ZINC001246454726 1037413567 /nfs/dbraw/zinc/41/35/67/1037413567.db2.gz WUILEXAXKIQQOW-UNMCSNQZSA-N 2 0 383.467 3.922 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH2+][C@H](CC1CC[NH2+]CC1)c1ccc(F)cc1)C2 ZINC001246454414 1037413810 /nfs/dbraw/zinc/41/38/10/1037413810.db2.gz WUILEXAXKIQQOW-IFMALSPDSA-N 2 0 383.467 3.922 20 5 GHBDRP COc1ccc(C[C@@H](C)[N@@H+]2CCCC[C@@]3(CCCC[NH2+]C3)C2)c([N+](=O)[O-])c1 ZINC001246601007 1037495203 /nfs/dbraw/zinc/49/52/03/1037495203.db2.gz FTLVCFPUGFIGSS-DYESRHJHSA-N 2 0 375.513 3.780 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH+]1CCC3(CC1)C[NH2+]Cc1ccccc13)CC2 ZINC001246636871 1037521214 /nfs/dbraw/zinc/52/12/14/1037521214.db2.gz GEKWYHJKXFRFCD-NRFANRHFSA-N 2 0 391.515 3.979 20 5 GHBDRP [NH3+]C1(Cc2cccc(Cl)c2)CC[NH+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254588452 1040363033 /nfs/dbraw/zinc/36/30/33/1040363033.db2.gz YVFFGXVBQBNBNB-HXUWFJFHSA-N 2 0 385.895 3.751 20 5 GHBDRP CC[NH+](CC)CCCC1CC[NH+](Cc2ccc(O)c(OC)c2[N+](=O)[O-])CC1 ZINC001308683995 1050059168 /nfs/dbraw/zinc/05/91/68/1050059168.db2.gz FAMIAIBLNNIBOH-UHFFFAOYSA-N 2 0 379.501 3.643 20 5 GHBDRP O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[NH2+]C3(CCO)CCCCC3)CC2)cc1 ZINC001308928424 1050183416 /nfs/dbraw/zinc/18/34/16/1050183416.db2.gz QCFGMOCYVCTNST-UHFFFAOYSA-N 2 0 389.540 3.524 20 5 GHBDRP Cc1ccc([C@@H](C)[NH2+]Cc2cccc(CN3CC[NH+](C)CC3)c2)cc1[N+](=O)[O-] ZINC001340527387 1059964180 /nfs/dbraw/zinc/96/41/80/1059964180.db2.gz MHJXOFAPKRXACQ-GOSISDBHSA-N 2 0 382.508 3.501 20 5 GHBDRP C[C@]1(C[NH3+])CC[N@H+](Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000261916973 839874116 /nfs/dbraw/zinc/87/41/16/839874116.db2.gz YGAQCUCIBYVXPF-JOCHJYFZSA-N 2 0 391.475 3.618 20 5 GHBDRP Cc1cc(NC2CC[NH+](Cc3ccccc3)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000891419164 841549699 /nfs/dbraw/zinc/54/96/99/841549699.db2.gz NDGLTNLDOMMMBT-UHFFFAOYSA-N 2 0 376.460 3.950 20 5 GHBDRP Cc1cc(NC2CC[NH+](Cc3ccccn3)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302132844 861216917 /nfs/dbraw/zinc/21/69/17/861216917.db2.gz CJDWFCDOYFWHTO-UHFFFAOYSA-N 2 0 377.448 3.923 20 5 GHBDRP CC(C)CC[NH+]1CCC(C[NH2+][C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)CC1 ZINC000515767345 851447313 /nfs/dbraw/zinc/44/73/13/851447313.db2.gz ASQCYHIIUHKOQN-RTBURBONSA-N 2 0 377.533 3.623 20 5 GHBDRP COc1ccc(C[C@@H](C)[NH2+]CC2CC[NH+](CC(C)(C)C)CC2)c([N+](=O)[O-])c1 ZINC001170319661 881353717 /nfs/dbraw/zinc/35/37/17/881353717.db2.gz YDVJSSTWIXANEB-MRXNPFEDSA-N 2 0 377.529 3.882 20 5 GHBDRP COc1ccc(C[C@H](C)[N@H+](Cc2cccnc2)[C@H]2CC[C@H]([NH3+])CC2)c([N+](=O)[O-])c1 ZINC001170322387 881358045 /nfs/dbraw/zinc/35/80/45/881358045.db2.gz FNAJXJBYFGINMB-VDGAXYAQSA-N 2 0 398.507 3.702 20 5 GHBDRP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C2)C1 ZINC000593314669 859380126 /nfs/dbraw/zinc/38/01/26/859380126.db2.gz DZSUCKQAYAFVIL-CBGDNZLLSA-N 2 0 385.464 3.573 20 5 GHBDRP O=[N+]([O-])c1cc(Br)ccc1C[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000895611104 859717008 /nfs/dbraw/zinc/71/70/08/859717008.db2.gz QBYXTDLEUYGJGR-UHFFFAOYSA-N 2 0 391.269 3.511 20 5 GHBDRP O=[N+]([O-])c1ccc2oc(C[NH2+]CC3CC[NH+](Cc4cccs4)CC3)nc2c1 ZINC000602529388 860099116 /nfs/dbraw/zinc/09/91/16/860099116.db2.gz BFYULKQQQTXPMV-UHFFFAOYSA-N 2 0 386.477 3.799 20 5 GHBDRP Cc1c(C[NH+]2CC[C@@H](Oc3ccnc(C[N@@H+](C)C(C)C)c3)C2)cccc1[N+](=O)[O-] ZINC000856598331 881571427 /nfs/dbraw/zinc/57/14/27/881571427.db2.gz HOYMWNXTRPBPMC-OAQYLSRUSA-N 2 0 398.507 3.792 20 5 GHBDRP C[N@H+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[NH+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C[C@H]21 ZINC001169021991 871122868 /nfs/dbraw/zinc/12/28/68/871122868.db2.gz MBBJRYCPHMFYMG-UNNPPQAFSA-N 2 0 377.554 3.726 20 5 GHBDRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000447522912 871746533 /nfs/dbraw/zinc/74/65/33/871746533.db2.gz ZUPSDJMKJFYRPN-UXHICEINSA-N 2 0 385.512 3.907 20 5 GHBDRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)C1 ZINC000447543801 871813501 /nfs/dbraw/zinc/81/35/01/871813501.db2.gz MLLUDHDGFBPZKT-FCGDIQPGSA-N 2 0 377.533 3.623 20 5 GHBDRP O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]C2CC[NH+](C3CCCCC3)CC2)n1 ZINC000447563087 871872013 /nfs/dbraw/zinc/87/20/13/871872013.db2.gz OBDQJQCTKMABMV-OALUTQOASA-N 2 0 375.517 3.662 20 5 GHBDRP O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCC3)c1 ZINC000853120661 878829104 /nfs/dbraw/zinc/82/91/04/878829104.db2.gz NWOZGNHTPQVNOT-UNMCSNQZSA-N 2 0 395.503 3.520 20 5 GHBDRP Cn1cc(C[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000809738612 887772282 /nfs/dbraw/zinc/77/22/82/887772282.db2.gz BOHPUDYXGHRCOO-UHFFFAOYSA-N 2 0 393.491 3.689 20 5 GHBDRP O=[N+]([O-])c1ccc([C@H](O)C[NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000819323612 896567646 /nfs/dbraw/zinc/56/76/46/896567646.db2.gz NMSCPUDHDKTVLB-SIKLNZKXSA-N 2 0 383.492 3.520 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc3ccccc3)C1)CC2 ZINC001172900673 905921852 /nfs/dbraw/zinc/92/18/52/905921852.db2.gz XTPNPUDRMZNOBM-UGKGYDQZSA-N 2 0 379.504 3.954 20 5 GHBDRP O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]C2CC[NH+](CC3CCCCC3)CC2)n1 ZINC000774159851 911459754 /nfs/dbraw/zinc/45/97/54/911459754.db2.gz QNWFGMMUKZSPBF-PMACEKPBSA-N 2 0 389.544 3.909 20 5 GHBDRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000775059020 914886885 /nfs/dbraw/zinc/88/68/85/914886885.db2.gz GMGGHJHXKPANEP-UHFFFAOYSA-N 2 0 399.451 3.637 20 5 GHBDRP COc1ccc(C[N@H+](C)C2CCC([NH3+])CC2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000843054725 1029788431 /nfs/dbraw/zinc/78/84/31/1029788431.db2.gz DGIJMQPAEAUDMJ-UHFFFAOYSA-N 2 0 399.491 3.884 20 5 GHBDRP [NH3+][C@@H](CNC(=O)[C@@H]([NH3+])Cc1c2ccccc2cc2ccccc21)c1ccccc1 ZINC001220501569 1031966856 /nfs/dbraw/zinc/96/68/56/1031966856.db2.gz QUYIULWYTCFBQE-ZEQRLZLVSA-N 2 0 383.495 3.679 20 5 GHBDRP C[C@@H]1[C@H](C)SCC[N@@H+]1CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001461961629 1069916809 /nfs/dbraw/zinc/91/68/09/1069916809.db2.gz SSLJHDQTHCWUGG-SJORKVTESA-N 2 0 377.554 3.675 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH2+][C@@H]1CC3(CC[NH2+]CC3)c3cc(F)ccc31)C2 ZINC001246186730 1037227332 /nfs/dbraw/zinc/22/73/32/1037227332.db2.gz YZTLJDCLIUQGGL-DYESRHJHSA-N 2 0 381.451 3.557 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]C1(Cc3ccc(F)cc3)CC[NH2+]CC1)CC2 ZINC001246393045 1037354247 /nfs/dbraw/zinc/35/42/47/1037354247.db2.gz STQBBZHBWCUBDQ-OAQYLSRUSA-N 2 0 397.494 3.936 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH2+]C1(Cc3ccc(Cl)cc3)CC[NH2+]CC1)C2 ZINC001246395091 1037357209 /nfs/dbraw/zinc/35/72/09/1037357209.db2.gz VZEMXLJHXDYWSW-LJQANCHMSA-N 2 0 385.895 3.670 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH2+]CC1(Cc3ccc(Cl)cc3)CC[NH2+]CC1)C2 ZINC001246418025 1037375187 /nfs/dbraw/zinc/37/51/87/1037375187.db2.gz YLZHBAODJBPJCE-HXUWFJFHSA-N 2 0 399.922 3.918 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH2+][C@@H](CC1CC[NH2+]CC1)c1ccccc1F)C2 ZINC001246442301 1037404126 /nfs/dbraw/zinc/40/41/26/1037404126.db2.gz JBDHCEXPNUBWAM-AVRDEDQJSA-N 2 0 383.467 3.922 20 5 GHBDRP O=[N+]([O-])c1ccc(N2CCC([N@H+](Cc3ccccc3)C3CC[NH2+]CC3)CC2)cc1 ZINC001246911166 1037721947 /nfs/dbraw/zinc/72/19/47/1037721947.db2.gz AARGDNFOHWUMHF-UHFFFAOYSA-N 2 0 394.519 3.818 20 5 GHBDRP O=[N+]([O-])c1ccc(N2CCC([NH+]3CCC(CC4CC[NH2+]CC4)CC3)CC2)cc1 ZINC001246980275 1037803828 /nfs/dbraw/zinc/80/38/28/1037803828.db2.gz RDDXMWCKUAUJKB-UHFFFAOYSA-N 2 0 386.540 3.665 20 5 GHBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]([C@@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001254561837 1040334424 /nfs/dbraw/zinc/33/44/24/1040334424.db2.gz MIRNBCRAIPXNBC-AEFFLSMTSA-N 2 0 375.513 3.537 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH2+]CCC1CC[NH+](Cc3ccccc3)CC1)C2 ZINC001254565715 1040342426 /nfs/dbraw/zinc/34/24/26/1040342426.db2.gz FYPTZCLTMNCLQM-QFIPXVFZSA-N 2 0 379.504 3.954 20 5 GHBDRP CCC[NH+](CCC)CCCN1CCN([C@@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC001254567974 1040343684 /nfs/dbraw/zinc/34/36/84/1040343684.db2.gz DMLSSNDKJSEECO-FQEVSTJZSA-N 2 0 390.572 3.656 20 5 GHBDRP C[C@@H](c1ccncc1)[N@H+](C)CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001308678742 1050056494 /nfs/dbraw/zinc/05/64/94/1050056494.db2.gz XSHBCBCZIDXJDB-SFHVURJKSA-N 2 0 382.508 3.937 20 5 GHBDRP O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[N@@H+]3CCSC[C@@H]3C3CC3)CC2)cc1 ZINC001308775171 1050089866 /nfs/dbraw/zinc/08/98/66/1050089866.db2.gz MKMKHDRPTXZWMT-OAQYLSRUSA-N 2 0 389.565 3.677 20 5 GHBDRP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CC[C@@H]3CC[NH2+]C3)o2)c(Br)c1 ZINC000414830220 838876894 /nfs/dbraw/zinc/87/68/94/838876894.db2.gz LUGFTWYSSNBGPT-LBPRGKRZSA-N 2 0 394.269 3.707 20 5 GHBDRP C[NH+](C)CCCOc1cnccc1C[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417349837 840748044 /nfs/dbraw/zinc/74/80/44/840748044.db2.gz MVFLBGRWKLOBID-OAQYLSRUSA-N 2 0 398.507 3.878 20 5 GHBDRP COc1ccc(C[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000513500097 845554188 /nfs/dbraw/zinc/55/41/88/845554188.db2.gz KOHOHUPCSFOWPY-FXAWDEMLSA-N 2 0 383.492 3.994 20 5 GHBDRP COc1ccc(C[N@H+](C)[C@@H]2CCC[NH2+]CC2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000435433168 850491019 /nfs/dbraw/zinc/49/10/19/850491019.db2.gz QNOKTGIRNLGXDB-LJQANCHMSA-N 2 0 399.491 3.756 20 5 GHBDRP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]C[C@@H]2CCC[N@@H+]2C2CCCCC2)n1 ZINC000436287978 851421923 /nfs/dbraw/zinc/42/19/23/851421923.db2.gz DKEBMRHDZIOESR-GBESFXJTSA-N 2 0 375.517 3.662 20 5 GHBDRP COc1ccc(C[C@H](C)[N@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001170352911 881390836 /nfs/dbraw/zinc/39/08/36/881390836.db2.gz UDTMFWLXPNTFIC-AZUAARDMSA-N 2 0 397.519 3.988 20 5 GHBDRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cn2ncc3cc([N+](=O)[O-])ccc32)CC1 ZINC000727423069 860088596 /nfs/dbraw/zinc/08/85/96/860088596.db2.gz KWZVFXNYEOETNT-UHFFFAOYSA-N 2 0 393.491 3.746 20 5 GHBDRP O=[N+]([O-])c1ccc(N2CCC([NH2+]C[C@@H]3CC[N@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000793206190 882031978 /nfs/dbraw/zinc/03/19/78/882031978.db2.gz CIWUYTRAGQVMNX-FQEVSTJZSA-N 2 0 394.519 3.675 20 5 GHBDRP O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]C2CC[NH+](C3CCCCC3)CC2)n1 ZINC000447563086 871871523 /nfs/dbraw/zinc/87/15/23/871871523.db2.gz OBDQJQCTKMABMV-MOPGFXCFSA-N 2 0 375.517 3.662 20 5 GHBDRP O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCC3)cc1 ZINC000853120778 878828654 /nfs/dbraw/zinc/82/86/54/878828654.db2.gz QFWMMWYUEFYWSA-IRLDBZIGSA-N 2 0 395.503 3.520 20 5 GHBDRP Cc1ccc2c(C[C@@H](C)[NH3+])cn(-c3ccc([N+](=O)[O-])c(OCC[NH+](C)C)c3)c2c1 ZINC001171169244 901937108 /nfs/dbraw/zinc/93/71/08/901937108.db2.gz ORSOQIPDGXVHMB-MRXNPFEDSA-N 2 0 396.491 3.677 20 5 GHBDRP [NH3+]C[C@H]1C[N@H+](Cc2c3[nH]c4ccccc4c3cc3[nH]c4ccccc4c32)C[C@H]1O ZINC001206469510 1033858763 /nfs/dbraw/zinc/85/87/63/1033858763.db2.gz QNANQPZVBSENCF-RCDICMHDSA-N 2 0 384.483 3.707 20 5 GHBDRP [NH3+]C[C@H]1C[N@H+](Cc2c3[nH]c4ccccc4c3cc3[nH]c4ccccc4c32)C[C@@H]1O ZINC001206520199 1033888630 /nfs/dbraw/zinc/88/86/30/1033888630.db2.gz QNANQPZVBSENCF-FPTDNZKUSA-N 2 0 384.483 3.707 20 5 GHBDRP COc1ccccc1CC1(C[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])CC[NH2+]CC1 ZINC001246419637 1037375094 /nfs/dbraw/zinc/37/50/94/1037375094.db2.gz HORBNUSHOGGLDJ-GOSISDBHSA-N 2 0 397.519 3.737 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]C1(Cc3cccc(F)c3)CC[NH2+]CC1)CC2 ZINC001246449633 1037410117 /nfs/dbraw/zinc/41/01/17/1037410117.db2.gz ANLIKSVEPUDJHW-OAQYLSRUSA-N 2 0 397.494 3.936 20 5 GHBDRP COc1ccc(C[C@H](C)N2CCC[C@]23C[NH2+]C[C@@H]3c2ccccc2)c([N+](=O)[O-])c1 ZINC001246670820 1037537217 /nfs/dbraw/zinc/53/72/17/1037537217.db2.gz GCYWEIVGNUBAOT-AMHTUMDSSA-N 2 0 395.503 3.756 20 5 GHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1cccc(CN2CC[NH+](C)CC2)c1 ZINC001326144767 1057422425 /nfs/dbraw/zinc/42/24/25/1057422425.db2.gz VGDBODFTNLMMMR-CPNJWEJPSA-N 2 0 394.519 3.535 20 5 GHBDRP CC[NH+]1CCN(CCCC[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000180110861 837392066 /nfs/dbraw/zinc/39/20/66/837392066.db2.gz PBPKUURAAKSDTA-QHCPKHFHSA-N 2 0 396.535 3.692 20 5 GHBDRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000583630661 834784894 /nfs/dbraw/zinc/78/48/94/834784894.db2.gz NHTPKURLTIMVLO-MNOVXSKESA-N 2 0 382.258 3.833 20 5 GHBDRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000583630660 834785127 /nfs/dbraw/zinc/78/51/27/834785127.db2.gz NHTPKURLTIMVLO-GHMZBOCLSA-N 2 0 382.258 3.833 20 5 GHBDRP CCOc1ccc([C@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1[N+](=O)[O-] ZINC000179469556 835733918 /nfs/dbraw/zinc/73/39/18/835733918.db2.gz RTRDHXHWUMBGRJ-INIZCTEOSA-N 2 0 384.480 3.956 20 5 GHBDRP O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]CC[C@H]2CC[NH2+]C2)cc1 ZINC000414833777 838870568 /nfs/dbraw/zinc/87/05/68/838870568.db2.gz QDJDABZRJWAUEI-QGZVFWFLSA-N 2 0 391.475 3.537 20 5 GHBDRP [NH3+][C@H]1CCO[C@H](C2CC[NH+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)CC2)C1 ZINC000415123108 839244411 /nfs/dbraw/zinc/24/44/11/839244411.db2.gz KYLVHSCPOALKSI-UWJYYQICSA-N 2 0 385.464 3.573 20 5 GHBDRP Cn1cc(C[NH2+]CCC[N@H+](C)Cc2ccccc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000237086315 844503367 /nfs/dbraw/zinc/50/33/67/844503367.db2.gz PDNJBWMUFAUTHY-UHFFFAOYSA-N 2 0 393.491 3.607 20 5 GHBDRP Cc1cc(NCc2ccc(CN3CCOCC3)cc2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302201719 861239030 /nfs/dbraw/zinc/23/90/30/861239030.db2.gz VKXLQZYVEURDJD-UHFFFAOYSA-N 2 0 392.459 3.896 20 5 GHBDRP Cc1ccc([C@@H](C)[NH2+]Cc2ccc(CN3CC[NH+](C)CC3)cc2)cc1[N+](=O)[O-] ZINC000126687896 841842217 /nfs/dbraw/zinc/84/22/17/841842217.db2.gz BLGBJJVAPLLNBO-GOSISDBHSA-N 2 0 382.508 3.501 20 5 GHBDRP COc1cccc([C@H](CNc2cc(C)[nH+]c3ccc([N+](=O)[O-])cc23)[NH+](C)C)c1 ZINC000891502412 842211072 /nfs/dbraw/zinc/21/10/72/842211072.db2.gz WMIGYOLMLBPEPZ-NRFANRHFSA-N 2 0 380.448 3.597 20 5 GHBDRP C[C@H]([NH2+]C[C@H](C)N1CC[NH+](C)CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000127315074 842252678 /nfs/dbraw/zinc/25/26/78/842252678.db2.gz XFTDQYZUBFXUTQ-HOTGVXAUSA-N 2 0 388.537 3.610 20 5 GHBDRP Cc1c(C[N@@H+](C)CCC2CC[NH+](C3CCN(C)CC3)CC2)cccc1[N+](=O)[O-] ZINC000430934302 843198586 /nfs/dbraw/zinc/19/85/86/843198586.db2.gz LPWAMUREHGDDOT-UHFFFAOYSA-N 2 0 388.556 3.531 20 5 GHBDRP O=[N+]([O-])c1cccc(OCC[N@H+](Cc2ccsc2)[C@@H]2CC23CC[NH2+]CC3)c1 ZINC000432668837 843381900 /nfs/dbraw/zinc/38/19/00/843381900.db2.gz KVLSAHRYWHOCMH-LJQANCHMSA-N 2 0 387.505 3.679 20 5 GHBDRP CC(C)c1ccc(C[NH+]2CCC(CC[NH+]3CCOCC3)CC2)cc1[N+](=O)[O-] ZINC000512467703 843911464 /nfs/dbraw/zinc/91/14/64/843911464.db2.gz FDBDROOAPXIAPZ-UHFFFAOYSA-N 2 0 375.513 3.653 20 5 GHBDRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000025702210 861485366 /nfs/dbraw/zinc/48/53/66/861485366.db2.gz CJVVVCUEFWSHMV-KRWDZBQOSA-N 2 0 396.491 3.698 20 5 GHBDRP COc1cc(C[NH2+]C[C@@]2(C)CCC[NH2+]C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000414899252 852841263 /nfs/dbraw/zinc/84/12/63/852841263.db2.gz CIWLAAGZEAGPKW-QFIPXVFZSA-N 2 0 399.491 3.662 20 5 GHBDRP C[C@@H]([NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000173389294 856902256 /nfs/dbraw/zinc/90/22/56/856902256.db2.gz NCYIXRQJHYZPJE-HZPDHXFCSA-N 2 0 386.471 3.898 20 5 GHBDRP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000113934334 857795131 /nfs/dbraw/zinc/79/51/31/857795131.db2.gz HRHOPULBMGMHIF-ZWKOTPCHSA-N 2 0 388.512 3.510 20 5 GHBDRP C[NH+](C)CCOc1ccc(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000611273945 859676664 /nfs/dbraw/zinc/67/66/64/859676664.db2.gz HFIXMSUXHHBSND-UHFFFAOYSA-N 2 0 399.491 3.579 20 5 GHBDRP CC[N@H+](CCC1CC[NH+](Cc2ccc([N+](=O)[O-])c(OC)c2)CC1)CC1CC1 ZINC000492937312 877808321 /nfs/dbraw/zinc/80/83/21/877808321.db2.gz RHFFNUUOMVPXMU-UHFFFAOYSA-N 2 0 375.513 3.937 20 5 GHBDRP [NH3+]C1CC[NH+](CCc2cn(-c3c(Cl)nccc3[N+](=O)[O-])c3ccccc23)CC1 ZINC001170524518 885446870 /nfs/dbraw/zinc/44/68/70/885446870.db2.gz AIZBBWRYNYGSHU-UHFFFAOYSA-N 2 0 399.882 3.553 20 5 GHBDRP CCC1(C[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC[NH+](Cc2ccccc2)CC1 ZINC000819189467 896458757 /nfs/dbraw/zinc/45/87/57/896458757.db2.gz GZMQNRKUTPVRGG-QFIPXVFZSA-N 2 0 397.519 3.910 20 5 GHBDRP CC1CC[NH+](C2CCC([NH2+][C@H]3CCCC[C@@H]3n3ccc([N+](=O)[O-])n3)CC2)CC1 ZINC000573015317 900342742 /nfs/dbraw/zinc/34/27/42/900342742.db2.gz DJYXPRJIDHIZSE-GUMHCPJTSA-N 2 0 389.544 3.908 20 5 GHBDRP Cc1c[nH+]ccc1N(C1CC[NH2+]CC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172911667 906020143 /nfs/dbraw/zinc/02/01/43/906020143.db2.gz DSXVYPQPWDUUEN-IBGZPJMESA-N 2 0 380.492 3.804 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)c1F ZINC001173176231 906251637 /nfs/dbraw/zinc/25/16/37/906251637.db2.gz GVAFTJPSQOZANY-AWEZNQCLSA-N 2 0 375.444 3.525 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]CC2CC[NH+](C3CCC3)CC2)c1F ZINC001173183373 906264478 /nfs/dbraw/zinc/26/44/78/906264478.db2.gz YYHAMWNZCUKNOU-AWEZNQCLSA-N 2 0 379.476 3.528 20 5 GHBDRP COc1ccccc1CC1([NH3+])CC[NH+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173223321 906303938 /nfs/dbraw/zinc/30/39/38/906303938.db2.gz ICRNMOADOHUUBE-QGZVFWFLSA-N 2 0 383.492 3.570 20 5 GHBDRP Cc1c([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H]2CO)cccc1[N+](=O)[O-] ZINC000182227871 907161544 /nfs/dbraw/zinc/16/15/44/907161544.db2.gz KJDPDVZSPSZENT-YLJYHZDGSA-N 2 0 383.492 3.711 20 5 GHBDRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC001177299266 908501745 /nfs/dbraw/zinc/50/17/45/908501745.db2.gz MXXATQSZSMNANE-AWEZNQCLSA-N 2 0 384.318 3.959 20 5 GHBDRP O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]C2CCC([NH+]3CCCCC3)CC2)n1 ZINC000774217195 911532129 /nfs/dbraw/zinc/53/21/29/911532129.db2.gz LAEOFVIWQYQNQD-WZOJCFFYSA-N 2 0 375.517 3.662 20 5 GHBDRP C[NH+](C)CC(C)(C)CNC(=O)[C@@H]([NH3+])Cc1c2ccccc2cc2ccccc21 ZINC001220253905 1031861791 /nfs/dbraw/zinc/86/17/91/1031861791.db2.gz GQZLWFHDPAGYIJ-QFIPXVFZSA-N 2 0 377.532 3.567 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH2+]CC1(c3cccc(Cl)c3)CC[NH2+]CC1)C2 ZINC001246428018 1037386690 /nfs/dbraw/zinc/38/66/90/1037386690.db2.gz OIFYXFKSCWILIW-IBGZPJMESA-N 2 0 385.895 3.626 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH2+][C@H](CC1CC[NH2+]CC1)c1cccc(F)c1)C2 ZINC001246446101 1037407684 /nfs/dbraw/zinc/40/76/84/1037407684.db2.gz BLEFYWDUSKLMDE-RBBKRZOGSA-N 2 0 383.467 3.922 20 5 GHBDRP COc1ccc2c(c1)C1(CC[NH2+]CC1)[N@@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001246632195 1037518308 /nfs/dbraw/zinc/51/83/08/1037518308.db2.gz UVZRGJAUHNMDBV-QGZVFWFLSA-N 2 0 395.503 3.671 20 5 GHBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCP(CCC[NH3+])c1ccccc1 ZINC001254549834 1040317661 /nfs/dbraw/zinc/31/76/61/1040317661.db2.gz XKOMUIDVRSVHOF-XZATXCMXSA-N 2 0 387.464 3.662 20 5 GHBDRP [NH3+]C1(Cc2ccc(Cl)cc2)CC[NH+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254586454 1040359399 /nfs/dbraw/zinc/35/93/99/1040359399.db2.gz JOYOJSZWSMQLDY-FQEVSTJZSA-N 2 0 385.895 3.751 20 5 GHBDRP Cc1cc(N2CC[NH+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)CC2)c2ccccc2[nH+]1 ZINC001254595434 1040369537 /nfs/dbraw/zinc/36/95/37/1040369537.db2.gz XFXZKUCDBYUERE-FQEVSTJZSA-N 2 0 388.471 3.741 20 5 GHBDRP O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[NH2+][C@@H]3CCCc4cccnc43)CC2)cc1 ZINC001308963358 1050224384 /nfs/dbraw/zinc/22/43/84/1050224384.db2.gz JRFNLWBEOIDIMV-JOCHJYFZSA-N 2 0 394.519 3.912 20 5 GHBDRP C[N@H+](CCOC(C)(C)C)CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001474314162 1074336640 /nfs/dbraw/zinc/33/66/40/1074336640.db2.gz LKMSMVSBGWSJOH-UHFFFAOYSA-N 2 0 377.529 3.596 20 5 GHBDRP COc1ccc([N+](=O)[O-])cc1C[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000179388237 835669187 /nfs/dbraw/zinc/66/91/87/835669187.db2.gz AMLRRYVFUBMAER-UHFFFAOYSA-N 2 0 384.480 3.737 20 5 GHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1 ZINC000468628545 838119657 /nfs/dbraw/zinc/11/96/57/838119657.db2.gz REYUWFNQGHDDJZ-XDJHFCHBSA-N 2 0 386.540 3.538 20 5 GHBDRP [NH3+]C[C@H]1CC[C@@H]([NH2+]Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000415041853 839107063 /nfs/dbraw/zinc/10/70/63/839107063.db2.gz QFVKTNNQXUGWAQ-QFBILLFUSA-N 2 0 391.475 3.665 20 5 GHBDRP [NH3+][C@@H]1CCCO[C@H]1C1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000415135453 839250828 /nfs/dbraw/zinc/25/08/28/839250828.db2.gz WRNDLNPBQOTDTP-NQIIRXRSSA-N 2 0 385.464 3.573 20 5 GHBDRP C[C@@H]([NH2+]CCc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000537095943 839748696 /nfs/dbraw/zinc/74/86/96/839748696.db2.gz YZOJJCWUQCBFRD-GOSISDBHSA-N 2 0 383.492 3.963 20 5 GHBDRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000120496089 843858225 /nfs/dbraw/zinc/85/82/25/843858225.db2.gz MJJZORZCUJNVKG-MRXNPFEDSA-N 2 0 384.480 3.553 20 5 GHBDRP C[C@@H]([NH2+]CCCN1CC[NH+](C)CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000162478414 849084493 /nfs/dbraw/zinc/08/44/93/849084493.db2.gz XVOXEHPAUQFRCZ-MRXNPFEDSA-N 2 0 388.537 3.611 20 5 GHBDRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000246327427 857349182 /nfs/dbraw/zinc/34/91/82/857349182.db2.gz HRHOPULBMGMHIF-MSOLQXFVSA-N 2 0 388.512 3.510 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C[N@H+]3CC[C@H](O)C3)cc1)CCCC2 ZINC000595066105 858369379 /nfs/dbraw/zinc/36/93/79/858369379.db2.gz BYGIPOOQYQWPQF-JTHBVZDNSA-N 2 0 395.503 3.719 20 5 GHBDRP CC[N@H+](C)Cc1cc(O[C@H]2CC[NH+](C/C=C/c3ccccc3[N+](=O)[O-])C2)ccn1 ZINC000856552961 881379239 /nfs/dbraw/zinc/37/92/39/881379239.db2.gz IZWMEJULVIYVLB-PVHVJQTOSA-N 2 0 396.491 3.608 20 5 GHBDRP C[C@@H]1C[NH+](Cc2ccc(C[NH2+][C@@H]3CCc4c3cccc4[N+](=O)[O-])cc2)C[C@@H](C)O1 ZINC000594489923 866782442 /nfs/dbraw/zinc/78/24/42/866782442.db2.gz HUPRYBACTCZTAK-DRSNIGMVSA-N 2 0 395.503 3.981 20 5 GHBDRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]C[C@@H](O)c3ccc([N+](=O)[O-])cc3)cc2)C1 ZINC000776276909 876146836 /nfs/dbraw/zinc/14/68/36/876146836.db2.gz LRYDQGKGTQHSKT-HTAPYJJXSA-N 2 0 383.492 3.650 20 5 GHBDRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815578361 894016143 /nfs/dbraw/zinc/01/61/43/894016143.db2.gz MTHRJCKPXAIMHW-MRXNPFEDSA-N 2 0 384.480 3.502 20 5 GHBDRP C[C@@H]([NH2+]CCc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815600984 894037191 /nfs/dbraw/zinc/03/71/91/894037191.db2.gz KKBGLQDXNVFKCK-QGZVFWFLSA-N 2 0 398.507 3.545 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]CC2CC[NH+](CC3CCC3)CC2)c1F ZINC001173177783 906254706 /nfs/dbraw/zinc/25/47/06/906254706.db2.gz DCNRCGKNJFVSAY-HNNXBMFYSA-N 2 0 393.503 3.775 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+](CC2CC2)[C@H]2CC[C@H]([NH3+])CC2)c1F ZINC001173181204 906259427 /nfs/dbraw/zinc/25/94/27/906259427.db2.gz OELPPDYTHDKWEM-FVQBIDKESA-N 2 0 379.476 3.655 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1C[C@]3(CC[NH2+]C3)Oc3ccccc31)CCC2 ZINC000902501179 922241148 /nfs/dbraw/zinc/24/11/48/922241148.db2.gz IXUAOAQVEAZLGK-SJBKTWHCSA-N 2 0 379.460 3.818 20 5 GHBDRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000749678435 927231499 /nfs/dbraw/zinc/23/14/99/927231499.db2.gz SAAKJXCASKGTBY-JTSKRJEESA-N 2 0 383.492 3.792 20 5 GHBDRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+]C[C@H](O)c3cccc([N+](=O)[O-])c3)cc2)C1 ZINC000749678406 927231882 /nfs/dbraw/zinc/23/18/82/927231882.db2.gz RTBOJLFJQNWLNA-IXFSTUDKSA-N 2 0 397.519 3.896 20 5 GHBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H]1CO ZINC000468597607 1015833499 /nfs/dbraw/zinc/83/34/99/1015833499.db2.gz DTADXDVGZJAGNL-QRKROWPFSA-N 2 0 395.503 3.745 20 5 GHBDRP C[NH+]1CCC(Oc2ccc(C[NH2+]C/C=C\c3ccccc3[N+](=O)[O-])cc2)CC1 ZINC000579384203 1020410492 /nfs/dbraw/zinc/41/04/92/1020410492.db2.gz FVDHAHIIJZQGFZ-XQRVVYSFSA-N 2 0 381.476 3.871 20 5 GHBDRP C[C@H]1SCC[N@H+](CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)[C@H]1C ZINC001461961621 1069916685 /nfs/dbraw/zinc/91/66/85/1069916685.db2.gz SSLJHDQTHCWUGG-DLBZAZTESA-N 2 0 377.554 3.675 20 5 GHBDRP COc1ccc2c(c1)C1(C[C@H]2[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])CC[NH2+]CC1 ZINC001246131305 1037208070 /nfs/dbraw/zinc/20/80/70/1037208070.db2.gz XHXZYMKWKXPHSI-IIBYNOLFSA-N 2 0 395.503 3.890 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH2+]CC1(c3ccc(Cl)cc3)CC[NH2+]CC1)C2 ZINC001246343027 1037303627 /nfs/dbraw/zinc/30/36/27/1037303627.db2.gz ULVSWBFWSADALJ-LJQANCHMSA-N 2 0 385.895 3.626 20 5 GHBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC1(Cc2cccc(F)c2)CC[NH2+]CC1 ZINC001246377953 1037335209 /nfs/dbraw/zinc/33/52/09/1037335209.db2.gz TVHOLRUEZXVONE-KRWDZBQOSA-N 2 0 385.483 3.867 20 5 GHBDRP CC[C@H]1C[C@H]([NH2+]CCCNC(=O)c2c3ccccc3nc3ccccc32)CC[NH2+]1 ZINC001246485489 1037432045 /nfs/dbraw/zinc/43/20/45/1037432045.db2.gz UUZGAYUHSKYKRD-ZWKOTPCHSA-N 2 0 390.531 3.628 20 5 GHBDRP CC[NH+](CC)CCC[C@H](C)[NH2+]C1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC001256087137 1041517700 /nfs/dbraw/zinc/51/77/00/1041517700.db2.gz PFPQJZMOCXZTPK-KRWDZBQOSA-N 2 0 392.544 3.672 20 5 GHBDRP C[NH2+][C@@H](C)CC[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC001325624380 1057346769 /nfs/dbraw/zinc/34/67/69/1057346769.db2.gz DROZXIVIZWYEAX-INIZCTEOSA-N 2 0 379.464 3.535 20 5 GHBDRP [NH3+]C[C@@H]1CC[C@@H]([NH2+]Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000415041856 839107260 /nfs/dbraw/zinc/10/72/60/839107260.db2.gz QFVKTNNQXUGWAQ-VQIMIIECSA-N 2 0 391.475 3.665 20 5 GHBDRP Cc1cc(N2CCC(CCC[NH+]3CCOCC3)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302099184 861204039 /nfs/dbraw/zinc/20/40/39/861204039.db2.gz UIIQCTCXBPDWCF-UHFFFAOYSA-N 2 0 398.507 3.780 20 5 GHBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCC[N@@H+]1CCCO[C@H](C)C1 ZINC000432413944 842423333 /nfs/dbraw/zinc/42/33/33/842423333.db2.gz PDKUGWQGHPGHDT-IAGOWNOFSA-N 2 0 381.542 3.556 20 5 GHBDRP Cc1cc(NC[C@H]2CC[N@H+](Cc3ccccc3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000893589532 843418017 /nfs/dbraw/zinc/41/80/17/843418017.db2.gz KBHOXJDXTNWUHI-GOSISDBHSA-N 2 0 376.460 3.807 20 5 GHBDRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000599660936 861493288 /nfs/dbraw/zinc/49/32/88/861493288.db2.gz QNKFLEUONRXRTL-MRXNPFEDSA-N 2 0 384.480 3.506 20 5 GHBDRP C[C@@H](C[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)C[NH+](C)C ZINC000491591524 861648507 /nfs/dbraw/zinc/64/85/07/861648507.db2.gz MCBRZTFNWJPFLJ-KRWDZBQOSA-N 2 0 393.491 3.735 20 5 GHBDRP [NH3+]CC1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)CC1 ZINC000435387819 846610351 /nfs/dbraw/zinc/61/03/51/846610351.db2.gz CFKZBMWPVRDHSU-UHFFFAOYSA-N 2 0 394.269 3.788 20 5 GHBDRP O=[N+]([O-])c1ccc(CCCC[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422922349 847891035 /nfs/dbraw/zinc/89/10/35/847891035.db2.gz QBHOSKYBRQEYAQ-UNMCSNQZSA-N 2 0 381.476 3.763 20 5 GHBDRP CCCC[N@H+](C)CC1CC[NH+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000134144713 856261140 /nfs/dbraw/zinc/26/11/40/856261140.db2.gz VCBMBYIYDGTRTO-UHFFFAOYSA-N 2 0 399.539 3.939 20 5 GHBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CC1CC[NH+](C3CCOCC3)CC1)CCCC2 ZINC000595048275 858379338 /nfs/dbraw/zinc/37/93/38/858379338.db2.gz JESHFQKYRGNPSH-QFIPXVFZSA-N 2 0 387.524 3.843 20 5 GHBDRP COc1cc(C[N@@H+]2CCC[C@@H](CC[NH3+])C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000442925683 869095601 /nfs/dbraw/zinc/09/56/01/869095601.db2.gz WDRBCVOQYSCMLD-KRWDZBQOSA-N 2 0 399.491 3.743 20 5 GHBDRP CC[C@H]([NH2+]C[C@H]1CN(Cc2ccccc2)CCCO1)c1cccc([N+](=O)[O-])c1 ZINC000617584283 870467032 /nfs/dbraw/zinc/46/70/32/870467032.db2.gz BMTRUIMWFMKHML-VXKWHMMOSA-N 2 0 383.492 3.927 20 5 GHBDRP C[C@H](CC[NH2+][C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)[N@H+](C)Cc1ccccc1 ZINC000447529831 871762781 /nfs/dbraw/zinc/76/27/81/871762781.db2.gz LCBHDMGDPJOSMH-RLLQIKCJSA-N 2 0 385.512 3.775 20 5 GHBDRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000237501773 872880361 /nfs/dbraw/zinc/88/03/61/872880361.db2.gz LIEJVFAHQJURTI-KRWDZBQOSA-N 2 0 385.512 3.740 20 5 GHBDRP C[C@H]1C[NH+](CCCC[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@H](C)O1 ZINC000237609699 877705949 /nfs/dbraw/zinc/70/59/49/877705949.db2.gz QLSUAGQBJYPEKO-IRXDYDNUSA-N 2 0 387.480 3.834 20 5 GHBDRP O=[N+]([O-])c1cccc([C@H](O)C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)c1 ZINC000762925850 887108972 /nfs/dbraw/zinc/10/89/72/887108972.db2.gz HSSPLRJHQCCJNB-JOCHJYFZSA-N 2 0 395.503 3.616 20 5 GHBDRP C[C@H]1CCC[N@H+](Cc2ccccc2C[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000818959278 896297961 /nfs/dbraw/zinc/29/79/61/896297961.db2.gz HIPZAFXJMRSWGT-JTSKRJEESA-N 2 0 383.492 3.650 20 5 GHBDRP C[NH+](C)CCOc1ccc(C[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cc1 ZINC001172898719 905920108 /nfs/dbraw/zinc/92/01/08/905920108.db2.gz IUBYINJTGVRQMR-HXUWFJFHSA-N 2 0 383.492 3.572 20 5 GHBDRP CC(C)[N@@H+](C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173011336 906088180 /nfs/dbraw/zinc/08/81/80/906088180.db2.gz AEGLATRMGJFMQR-SHTZXODSSA-N 2 0 396.482 3.822 20 5 GHBDRP C[C@@H]1CCCC[N@@H+]1CCC[NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173012101 906090356 /nfs/dbraw/zinc/09/03/56/906090356.db2.gz NWFRQAPXLYTABY-OAHLLOKOSA-N 2 0 396.482 3.696 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@@H]2CC(C)(C)C[C@](C)(C[NH3+])C2)c1F ZINC001173190180 906271771 /nfs/dbraw/zinc/27/17/71/906271771.db2.gz VFGYHQXOWIOKQU-LRDNONRASA-N 2 0 381.492 3.807 20 5 GHBDRP COc1ccc(CC2([NH3+])CC[NH+]([C@H](C)Cc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC001173221091 906298405 /nfs/dbraw/zinc/29/84/05/906298405.db2.gz FOJPXAPKBSSZKJ-QGZVFWFLSA-N 2 0 383.492 3.570 20 5 GHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)C[C@H]2C1 ZINC001173233279 906318746 /nfs/dbraw/zinc/31/87/46/906318746.db2.gz VDMFDSXPARMPBE-QIJUGHKUSA-N 2 0 379.504 3.980 20 5 GHBDRP CC[N@H+](CCC1CC[NH+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1)CC(C)C ZINC000773736244 908970233 /nfs/dbraw/zinc/97/02/33/908970233.db2.gz VISWIOJNFQSFCT-NRFANRHFSA-N 2 0 377.529 3.708 20 5 GHBDRP COc1ccc(C[NH2+][C@@H](CCCC[NH3+])c2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000902363189 922124564 /nfs/dbraw/zinc/12/45/64/922124564.db2.gz ZBRMQGBCGHHBPS-KRWDZBQOSA-N 2 0 379.407 3.842 20 5 GHBDRP [NH3+]Cc1ccccc1CNC(=O)[C@@H]([NH3+])Cc1c2ccccc2cc2ccccc21 ZINC001220854960 1032153524 /nfs/dbraw/zinc/15/35/24/1032153524.db2.gz FYCONGHWKKOTRN-DEOSSOPVSA-N 2 0 383.495 3.638 20 5 GHBDRP O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)ccc1Br ZINC000843127008 1029817783 /nfs/dbraw/zinc/81/77/83/1029817783.db2.gz NVOORRHTPRWNJW-LSDHHAIUSA-N 2 0 382.302 3.569 20 5 GHBDRP C[C@@H]1CC[NH2+][C@H](C(=O)Nc2cc3oc4cc(=[NH2+])ccc-4nc3c3ccccc23)C1 ZINC001219369302 1031383709 /nfs/dbraw/zinc/38/37/09/1031383709.db2.gz CHJVOMLCUFDSLQ-YJYMSZOUSA-N 2 0 386.455 3.892 20 5 GHBDRP C[NH+](C)CCCCCNC(=O)[C@@H]([NH3+])Cc1c2ccccc2cc2ccccc21 ZINC001219920209 1031695256 /nfs/dbraw/zinc/69/52/56/1031695256.db2.gz BJNNYYSNYYNJMH-QHCPKHFHSA-N 2 0 377.532 3.711 20 5 GHBDRP COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH+]2CCC([C@@H]3CCCC[NH2+]3)CC2)c1F ZINC001246663404 1037533594 /nfs/dbraw/zinc/53/35/94/1037533594.db2.gz JZZICYBYZHFYMC-PBHICJAKSA-N 2 0 379.476 3.528 20 5 GHBDRP COc1ccc(C[C@H](C)[N@H+](C[C@@H]2CCC[NH2+]C2)C2CCCC2)c([N+](=O)[O-])c1 ZINC001246936755 1037742972 /nfs/dbraw/zinc/74/29/72/1037742972.db2.gz JNIKNDPZRPLXAV-DLBZAZTESA-N 2 0 375.513 3.779 20 5 GHBDRP CC[C@@H]([NH2+]CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1)[C@H]1CCCCO1 ZINC001462384949 1070217156 /nfs/dbraw/zinc/21/71/56/1070217156.db2.gz VHLZQDXBJPYEFB-FGZHOGPDSA-N 2 0 389.540 3.787 20 5 GHBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]([C@@H]1COC2(C1)CC[NH2+]CC2)C(C)(C)C ZINC001254561840 1040334400 /nfs/dbraw/zinc/33/44/00/1040334400.db2.gz MIRNBCRAIPXNBC-WMZOPIPTSA-N 2 0 375.513 3.537 20 5 GHBDRP COc1ccccc1C[N@H+]([C@H]1Cc2ccc([N+](=O)[O-])cc2C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001254586961 1040361349 /nfs/dbraw/zinc/36/13/49/1040361349.db2.gz NNZVGNDERGIKMS-ONTIZHBOSA-N 2 0 395.503 3.843 20 5 GHBDRP CCOC(=O)[C@H]1C[N@H+](Cc2c3ccccc3cc3ccccc32)CCC12C[NH2+]C2 ZINC001237428732 1042204385 /nfs/dbraw/zinc/20/43/85/1042204385.db2.gz CKGXEPKGIOILLF-HSZRJFAPSA-N 2 0 388.511 3.968 20 5 GHBDRP COc1ccc(-c2ccc(C[N@@H+]3CCCC4(CC[NH2+]CC4)C3)o2)c([N+](=O)[O-])c1 ZINC001332358708 1051505693 /nfs/dbraw/zinc/50/56/93/1051505693.db2.gz KMWCXNPNDXRQPL-UHFFFAOYSA-N 2 0 385.464 3.829 20 5 GHBDRP O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[N@@H+]3CCc4ccsc4C3)CC2)cc1 ZINC001474734630 1055029411 /nfs/dbraw/zinc/02/94/11/1055029411.db2.gz AULDKSRPRVJDSR-UHFFFAOYSA-N 2 0 385.533 3.969 20 5 GHBDRP C[NH+]1CCN(c2ccccc2C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC001320958465 1056033335 /nfs/dbraw/zinc/03/33/35/1056033335.db2.gz JUFDESWYNIUNKH-NRFANRHFSA-N 2 0 394.519 3.859 20 5 GHBDRP C[NH+]1CCC(N2CCC([NH2+]Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)CC2)CC1 ZINC001473968050 1074220727 /nfs/dbraw/zinc/22/07/27/1074220727.db2.gz IJZCGCZIHUXGNI-UHFFFAOYSA-N 2 0 398.507 3.503 20 5 GHBDRP COC1CCC([N@H+](C)CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC001474375782 1074372059 /nfs/dbraw/zinc/37/20/59/1074372059.db2.gz FSAZNZWWKMAITO-UHFFFAOYSA-N 2 0 389.540 3.739 20 5 GHBDRP