smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@@H]1CCCC[N@H+]1C1CN(C(=O)NCC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000426369942 231209031 /nfs/dbraw/zinc/20/90/31/231209031.db2.gz MZVBLRUWKBXPAF-LJQANCHMSA-N 2 1 384.568 3.167 50 0 GGAAMP c1ccc(C[NH+]2CCOCCOCC[N@@H+](Cc3ccccc3)CCOCC2)cc1 ZINC000004257911 204036312 /nfs/dbraw/zinc/03/63/12/204036312.db2.gz XUNRUQFHVHCHDT-UHFFFAOYSA-N 2 1 398.547 3.054 50 0 GGAAMP c1ccc(C[NH+]2CCOCCOCC[N@H+](Cc3ccccc3)CCOCC2)cc1 ZINC000004257911 204036316 /nfs/dbraw/zinc/03/63/16/204036316.db2.gz XUNRUQFHVHCHDT-UHFFFAOYSA-N 2 1 398.547 3.054 50 0 GGAAMP CC[NH+](CC)CCn1cnc2cc([N-]S(=O)(=O)c3ccc(F)cc3)ccc21 ZINC000004707944 204066072 /nfs/dbraw/zinc/06/60/72/204066072.db2.gz DFABQUSTOKTHRD-UHFFFAOYSA-N 2 1 390.484 3.318 50 0 GGAAMP Fc1ccccc1C[NH+]1CCC(C[N@H+](Cc2cnc[nH]2)C[C@H]2CCCO2)CC1 ZINC000011661371 204347835 /nfs/dbraw/zinc/34/78/35/204347835.db2.gz OBKQBYHQGTVHHL-OAQYLSRUSA-N 2 1 386.515 3.442 50 0 GGAAMP COc1ccc(C[NH2+]Cc2ccccc2C)cc1OC[C@H](O)C[N@@H+](C)C(C)C ZINC000011997842 204366493 /nfs/dbraw/zinc/36/64/93/204366493.db2.gz NCBSEBNKWQPEOA-OAQYLSRUSA-N 2 1 386.536 3.373 50 0 GGAAMP CCOCCC[NH2+]Cc1ccccc1OC[C@@H](O)C[N@@H+](C)C1CCCCC1 ZINC000012052604 204368228 /nfs/dbraw/zinc/36/82/28/204368228.db2.gz VZHJYXDIACOAJT-NRFANRHFSA-N 2 1 378.557 3.207 50 0 GGAAMP C[N@@H+](C[C@@H](O)COc1ccccc1C[NH2+]CCc1cccnc1)C1CCCCC1 ZINC000012205424 204382439 /nfs/dbraw/zinc/38/24/39/204382439.db2.gz HWBLTWUAFKBBDG-HSZRJFAPSA-N 2 1 397.563 3.418 50 0 GGAAMP O=C(NC[C@H]1CCC[N@@H+](Cc2cc(C[NH+]3CCCC3)cs2)C1)c1cccnc1 ZINC000012201670 204382550 /nfs/dbraw/zinc/38/25/50/204382550.db2.gz XNKSGCMOXJRGTC-GOSISDBHSA-N 2 1 398.576 3.381 50 0 GGAAMP COc1ccc(C[NH2+]Cc2ccc(C)s2)cc1OC[C@@H](O)C[N@@H+](C)C(C)C ZINC000012210468 204384598 /nfs/dbraw/zinc/38/45/98/204384598.db2.gz HEIGSLIIMUVORG-SFHVURJKSA-N 2 1 392.565 3.435 50 0 GGAAMP CCN(CC1CC[NH+](C2CC[NH+](C)CC2)CC1)C(=O)c1ccc2[nH]c(C)nc2c1 ZINC000012301093 204390329 /nfs/dbraw/zinc/39/03/29/204390329.db2.gz VGYAMLXSIVEYKH-UHFFFAOYSA-N 2 1 397.567 3.140 50 0 GGAAMP O=C(NCc1ccccn1)[C@@H]1CCC[N@H+](C2CC[NH+](C3CCCCC3)CC2)C1 ZINC000012302067 204390612 /nfs/dbraw/zinc/39/06/12/204390612.db2.gz RRYKISZPMPCJHC-LJQANCHMSA-N 2 1 384.568 3.207 50 0 GGAAMP C[N@H+](Cc1ccccc1)C[C@@H](O)COc1ccc(C[NH2+]Cc2cccnc2)cc1 ZINC000012297317 204391839 /nfs/dbraw/zinc/39/18/39/204391839.db2.gz XDEBFMTYUAKLPR-HSZRJFAPSA-N 2 1 391.515 3.243 50 0 GGAAMP CC[N@H+]1CCC[C@H]1CNC(=O)CCC1CC[NH+](Cc2nc3ccccc3[nH]2)CC1 ZINC000012316997 204395792 /nfs/dbraw/zinc/39/57/92/204395792.db2.gz KXGNTTWTSLCGNB-IBGZPJMESA-N 2 1 397.567 3.156 50 0 GGAAMP Cc1[nH+]ccn1-c1ccc(C[NH2+]Cc2c(C)n(CC(N)=O)c3ccccc23)cc1 ZINC000055061225 205140796 /nfs/dbraw/zinc/14/07/96/205140796.db2.gz UNQGTWOSCCSZBY-UHFFFAOYSA-N 2 1 387.487 3.219 50 0 GGAAMP O=C(NCCC[N@H+]1CCc2ccccc2C1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000057169150 205154381 /nfs/dbraw/zinc/15/43/81/205154381.db2.gz WLHZYBNGXXBXLO-UHFFFAOYSA-N 2 1 391.559 3.463 50 0 GGAAMP Cc1c[nH+]ccc1N1CCC[N@H+](C2CCN(C(=O)c3ccccc3)CC2)CC1 ZINC000067490665 205248779 /nfs/dbraw/zinc/24/87/79/205248779.db2.gz VTIKXWSDWUXNMQ-UHFFFAOYSA-N 2 1 378.520 3.207 50 0 GGAAMP C[NH+]1CCC(NC(=O)C2CC[NH+](Cc3c(Cl)cccc3Cl)CC2)CC1 ZINC000067629612 205252061 /nfs/dbraw/zinc/25/20/61/205252061.db2.gz WYSMQLIYPLOEQE-UHFFFAOYSA-N 2 1 384.351 3.416 50 0 GGAAMP O=C(NC1CC1)[C@@H]1CCC[N@@H+](C2CC[NH+](Cc3cccc4ncccc34)CC2)C1 ZINC000067459792 205248467 /nfs/dbraw/zinc/24/84/67/205248467.db2.gz MNGYXZKMKLGLJR-LJQANCHMSA-N 2 1 392.547 3.190 50 0 GGAAMP O=C(NC1CC1)[C@@H]1CCC[N@H+](C2CC[NH+](Cc3cccc4ncccc34)CC2)C1 ZINC000067459792 205248471 /nfs/dbraw/zinc/24/84/71/205248471.db2.gz MNGYXZKMKLGLJR-LJQANCHMSA-N 2 1 392.547 3.190 50 0 GGAAMP CC(C)=CCC[NH+]1CCC([N@H+]2CCC[C@H](C(=O)NCc3ccccn3)C2)CC1 ZINC000071388568 205284416 /nfs/dbraw/zinc/28/44/16/205284416.db2.gz VRVQVDRLULAAAE-FQEVSTJZSA-N 2 1 384.568 3.231 50 0 GGAAMP O=C(NCc1ccco1)[C@H]1CCC[N@@H+](C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000071523658 205285582 /nfs/dbraw/zinc/28/55/82/205285582.db2.gz JNZKZXDYKDIVJU-NRFANRHFSA-N 2 1 395.547 3.315 50 0 GGAAMP O=C(NCc1ccco1)[C@H]1CCC[N@H+](C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000071523658 205285586 /nfs/dbraw/zinc/28/55/86/205285586.db2.gz JNZKZXDYKDIVJU-NRFANRHFSA-N 2 1 395.547 3.315 50 0 GGAAMP O=C([C@@H]1CCC[N@H+](C2CC[NH+](CCCc3ccccc3)CC2)C1)N1CCCC1 ZINC000071712238 205287921 /nfs/dbraw/zinc/28/79/21/205287921.db2.gz WNNWJMNFRCRJKE-JOCHJYFZSA-N 2 1 383.580 3.418 50 0 GGAAMP O=C(NC1CC=CC1)[C@H]1CCC[N@@H+](C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000071753627 205291888 /nfs/dbraw/zinc/29/18/88/205291888.db2.gz FUNCIGVBSACCKT-NRFANRHFSA-N 2 1 381.564 3.240 50 0 GGAAMP O=C(NC1CC=CC1)[C@H]1CCC[N@H+](C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000071753627 205291897 /nfs/dbraw/zinc/29/18/97/205291897.db2.gz FUNCIGVBSACCKT-NRFANRHFSA-N 2 1 381.564 3.240 50 0 GGAAMP O=C(NCc1ccoc1)[C@@H]1CCC[N@@H+](C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000071761455 205293537 /nfs/dbraw/zinc/29/35/37/205293537.db2.gz PWUYAMKZLDIFCD-JOCHJYFZSA-N 2 1 395.547 3.315 50 0 GGAAMP O=C(NCc1ccoc1)[C@@H]1CCC[N@H+](C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000071761455 205293540 /nfs/dbraw/zinc/29/35/40/205293540.db2.gz PWUYAMKZLDIFCD-JOCHJYFZSA-N 2 1 395.547 3.315 50 0 GGAAMP CCN(C(=O)[C@@H]1CCC[N@H+](C2CC[NH+](C3Cc4ccccc4C3)CC2)C1)C1CC1 ZINC000071776929 205297469 /nfs/dbraw/zinc/29/74/69/205297469.db2.gz YHHMSOARZQCYNN-OAQYLSRUSA-N 2 1 395.591 3.341 50 0 GGAAMP Cc1[nH+]ccn1CCC(=O)N1CCC[N@H+](Cc2ccc(F)cc2)[C@H](C(C)C)C1 ZINC000072120776 205305727 /nfs/dbraw/zinc/30/57/27/205305727.db2.gz BOJPTWOEFQVUOY-NRFANRHFSA-N 2 1 386.515 3.480 50 0 GGAAMP Cc1[nH+]ccn1CCC(=O)N1CCC[N@@H+](Cc2ccc(F)cc2)[C@H](C(C)C)C1 ZINC000072120776 205305733 /nfs/dbraw/zinc/30/57/33/205305733.db2.gz BOJPTWOEFQVUOY-NRFANRHFSA-N 2 1 386.515 3.480 50 0 GGAAMP CC(C)NC(=O)C[N@@H+]1CC[C@@H](C2CC[NH+](Cc3cccc(F)c3F)CC2)C1 ZINC000072148593 205311717 /nfs/dbraw/zinc/31/17/17/205311717.db2.gz YWHOTBPJFGKTDH-QGZVFWFLSA-N 2 1 379.495 3.023 50 0 GGAAMP CC(C)NC(=O)C[N@H+]1CC[C@@H](C2CC[NH+](Cc3cccc(F)c3F)CC2)C1 ZINC000072148593 205311720 /nfs/dbraw/zinc/31/17/20/205311720.db2.gz YWHOTBPJFGKTDH-QGZVFWFLSA-N 2 1 379.495 3.023 50 0 GGAAMP COC[C@@]12CC[C@@H]([NH+]3CCOCC3)C[C@H]1CC[N@@H+](Cc1ccc(C)s1)C2 ZINC000072163564 205315756 /nfs/dbraw/zinc/31/57/56/205315756.db2.gz PNPFFFYDXCQFLK-SBHAEUEKSA-N 2 1 378.582 3.396 50 0 GGAAMP CC(C)C[N@@H+](C)CCN1CC2(CC[NH+](Cc3cccc(F)c3)CC2)OC1=O ZINC000072473561 205354312 /nfs/dbraw/zinc/35/43/12/205354312.db2.gz WYDOJQCQSCEPPG-UHFFFAOYSA-N 2 1 377.504 3.200 50 0 GGAAMP Cn1c(C[NH+]2CCCCCC2)cc(=O)c(O)c1C[N@H+]1CC[C@H](c2ccccc2)C1 ZINC000079478955 205382199 /nfs/dbraw/zinc/38/21/99/205382199.db2.gz GICYDVWKBALANL-FQEVSTJZSA-N 2 1 395.547 3.456 50 0 GGAAMP CC(C)[C@H](C(=O)N1CCC[C@@H](C[NH+]2CCC(C)CC2)C1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000084699897 205399455 /nfs/dbraw/zinc/39/94/55/205399455.db2.gz BXIHDSGTNAGLAG-LNRXMEIDSA-N 2 1 393.616 3.091 50 0 GGAAMP CC(C)[C@H](C(=O)N1CCC[C@@H](C[NH+]2CCC(C)CC2)C1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000084699897 205399458 /nfs/dbraw/zinc/39/94/58/205399458.db2.gz BXIHDSGTNAGLAG-LNRXMEIDSA-N 2 1 393.616 3.091 50 0 GGAAMP Cc1cc(-c2ccccc2)nc(C[NH+]2CCC([C@H](C)[NH+]3CCOCC3)CC2)n1 ZINC000252509110 206142327 /nfs/dbraw/zinc/14/23/27/206142327.db2.gz YCQBZANWTHHAGA-IBGZPJMESA-N 2 1 380.536 3.385 50 0 GGAAMP COc1cccc(C[N@@H+]2CCC[C@@]3(CCN(c4[nH+]cnc5[nH]ccc54)C3)C2)c1 ZINC000426396458 533479342 /nfs/dbraw/zinc/47/93/42/533479342.db2.gz MMZZFQBQBQRZQN-JOCHJYFZSA-N 2 1 377.492 3.459 50 0 GGAAMP COc1cccc(C[N@H+]2CCC[C@@]3(CCN(c4[nH+]cnc5[nH]ccc54)C3)C2)c1 ZINC000426396458 533479349 /nfs/dbraw/zinc/47/93/49/533479349.db2.gz MMZZFQBQBQRZQN-JOCHJYFZSA-N 2 1 377.492 3.459 50 0 GGAAMP COc1cccc(C[N@@H+]2CCC[C@]3(CCN(c4[nH+]cnc5[nH]ccc54)C3)C2)c1 ZINC000426396459 533479849 /nfs/dbraw/zinc/47/98/49/533479849.db2.gz MMZZFQBQBQRZQN-QFIPXVFZSA-N 2 1 377.492 3.459 50 0 GGAAMP COc1cccc(C[N@H+]2CCC[C@]3(CCN(c4[nH+]cnc5[nH]ccc54)C3)C2)c1 ZINC000426396459 533479853 /nfs/dbraw/zinc/47/98/53/533479853.db2.gz MMZZFQBQBQRZQN-QFIPXVFZSA-N 2 1 377.492 3.459 50 0 GGAAMP Cc1ccc[nH+]c1N1CCN(C(=O)c2ccc(C[NH+]3CCCCC3)cc2)CC1 ZINC000065424516 136163890 /nfs/dbraw/zinc/16/38/90/136163890.db2.gz PMBHWVJKVHKVQD-UHFFFAOYSA-N 2 1 378.520 3.338 50 0 GGAAMP Cc1[nH+]ccn1CCC[N@@H+]1CCC[C@]2(CCC(=O)N(Cc3ccccc3)C2)C1 ZINC000072478638 222267611 /nfs/dbraw/zinc/26/76/11/222267611.db2.gz VNMSRDWYBYFZJY-QHCPKHFHSA-N 2 1 380.536 3.486 50 0 GGAAMP Cc1[nH+]ccn1CCC[N@H+]1CCC[C@]2(CCC(=O)N(Cc3ccccc3)C2)C1 ZINC000072478638 222267616 /nfs/dbraw/zinc/26/76/16/222267616.db2.gz VNMSRDWYBYFZJY-QHCPKHFHSA-N 2 1 380.536 3.486 50 0 GGAAMP Cc1ncsc1CC[N@@H+](C)Cc1cc2n(n1)CCCN(c1cc[nH+]cc1)C2 ZINC000072473852 222264473 /nfs/dbraw/zinc/26/44/73/222264473.db2.gz XDAJQPUBTWDNHM-UHFFFAOYSA-N 2 1 382.537 3.128 50 0 GGAAMP Cc1ncsc1CC[N@H+](C)Cc1cc2n(n1)CCCN(c1cc[nH+]cc1)C2 ZINC000072473852 222264475 /nfs/dbraw/zinc/26/44/75/222264475.db2.gz XDAJQPUBTWDNHM-UHFFFAOYSA-N 2 1 382.537 3.128 50 0 GGAAMP Cc1[nH+]ccn1Cc1nnc(C2CC[NH+](CCCc3ccccc3)CC2)n1C ZINC000096153481 570216218 /nfs/dbraw/zinc/21/62/18/570216218.db2.gz FUDOQHXRUFAPOS-UHFFFAOYSA-N 2 1 378.524 3.181 50 0 GGAAMP Cn1c(C[NH+]2CCCCCC2)nnc1C1CC[NH+](Cc2cccc(O)c2)CC1 ZINC000096163737 570217257 /nfs/dbraw/zinc/21/72/57/570217257.db2.gz IEDBKANHCMAQAJ-UHFFFAOYSA-N 2 1 383.540 3.276 50 0 GGAAMP CC(C)[NH+]1CCC(N2CC[N@H+](C3C4CC5CC(C4)CC3C5)C[C@@H]2CCO)CC1 ZINC000096441180 570229314 /nfs/dbraw/zinc/22/93/14/570229314.db2.gz JAGMYHSSYJFMMU-WFGSETELSA-N 2 1 389.628 3.053 50 0 GGAAMP Cc1ccc(C[NH+]2CCC3(CC2)CC[N@H+](C2CCOCC2)C[C@@H]3CO)s1 ZINC000097294845 570241164 /nfs/dbraw/zinc/24/11/64/570241164.db2.gz NHUKUOFJOGTQBJ-GOSISDBHSA-N 2 1 378.582 3.132 50 0 GGAAMP OC[C@@H]1C[N@@H+](Cc2cccnc2)CCC12CC[NH+](Cc1cccc(F)c1)CC2 ZINC000097360070 570242856 /nfs/dbraw/zinc/24/28/56/570242856.db2.gz ZMDQTMSCVQZIIH-NRFANRHFSA-N 2 1 383.511 3.317 50 0 GGAAMP OC[C@@H]1C[N@@H+](Cc2ccc(Cl)o2)CCC12CC[NH+](C1CCOCC1)CC2 ZINC000097437012 570243866 /nfs/dbraw/zinc/24/38/66/570243866.db2.gz SFFPGFHGOBNTSU-INIZCTEOSA-N 2 1 382.932 3.008 50 0 GGAAMP CC(C)(C)NC(=O)[C@H]1CCC[N@H+](C2CC[NH+](C3Cc4ccccc4C3)CC2)C1 ZINC000020209676 570248153 /nfs/dbraw/zinc/24/81/53/570248153.db2.gz NYANWAWWQJLGTA-FQEVSTJZSA-N 2 1 383.580 3.245 50 0 GGAAMP CCCn1ncc(C[N@H+](Cc2ccncc2)CC2CC[NH+](CCOC)CC2)c1C ZINC000020232291 570249507 /nfs/dbraw/zinc/24/95/07/570249507.db2.gz XIFCIPDUMIJPJH-UHFFFAOYSA-N 2 1 399.583 3.357 50 0 GGAAMP CC(C)CC[N@H+]1CCN(C2CC[NH+](CCc3ccccc3)CC2)C[C@H]1CCO ZINC000104629241 570260181 /nfs/dbraw/zinc/26/01/81/570260181.db2.gz UMKAKLZTCBLTPF-XMMPIXPASA-N 2 1 387.612 3.108 50 0 GGAAMP Cc1ccc(C)c(OCC[N@H+](C)[C@@H]2c3ccccc3C3(CC[NH2+]CC3)[C@H]2O)c1 ZINC000020600898 570269933 /nfs/dbraw/zinc/26/99/33/570269933.db2.gz BHGGPYJYFSHSLT-PKTZIBPZSA-N 2 1 380.532 3.351 50 0 GGAAMP C[NH+]1CCC(N2CC[N@@H+](Cc3ccc(C4CCCC4)s3)C[C@@H]2CCO)CC1 ZINC000020907810 570284077 /nfs/dbraw/zinc/28/40/77/570284077.db2.gz XIJFFEJSVYMXAV-FQEVSTJZSA-N 2 1 391.625 3.369 50 0 GGAAMP C[N@@H+](C[C@H]1[C@@H]2C[NH2+]C[C@H]12)CC1CC[NH+](CCc2cccc(C(F)(F)F)c2)CC1 ZINC000102389723 570288989 /nfs/dbraw/zinc/28/89/89/570288989.db2.gz UZRQKTFGGLTYDX-AERCQKQUSA-N 3 1 395.513 3.357 50 0 GGAAMP CCOC(=O)N1CCC([N@@H+](C)CC2CC[NH+](Cc3ccc(C)o3)CC2)CC1 ZINC000012372795 570648075 /nfs/dbraw/zinc/64/80/75/570648075.db2.gz RCORGCYKLBZNJS-UHFFFAOYSA-N 2 1 377.529 3.353 50 0 GGAAMP COc1ccccc1C[N@H+]1CCC[C@@H](CN(CC[NH+](C)C)C(=O)c2ccco2)C1 ZINC000012459583 570670662 /nfs/dbraw/zinc/67/06/62/570670662.db2.gz OCESGUICDMNVLH-LJQANCHMSA-N 2 1 399.535 3.204 50 0 GGAAMP COc1ccccc1C[N@H+]1CCC[C@H](CN(CC[NH+](C)C)C(=O)c2ccco2)C1 ZINC000012459584 570670775 /nfs/dbraw/zinc/67/07/75/570670775.db2.gz OCESGUICDMNVLH-IBGZPJMESA-N 2 1 399.535 3.204 50 0 GGAAMP CCCCNC(=O)[C@H]1CCC[N@H+](C2CC[NH+](C3Cc4ccccc4C3)CC2)C1 ZINC000012465600 570671582 /nfs/dbraw/zinc/67/15/82/570671582.db2.gz VGFCMMZZEZPTBP-NRFANRHFSA-N 2 1 383.580 3.247 50 0 GGAAMP C[C@H](COc1ccccc1)[N@H+]1CCOc2ccc(C[NH+]3CCC(O)CC3)cc2C1 ZINC000014997642 570870699 /nfs/dbraw/zinc/87/06/99/570870699.db2.gz RQARAWSOBRPRLV-LJQANCHMSA-N 2 1 396.531 3.305 50 0 GGAAMP C[NH+]1CCC([NH+]2CCC(CN(Cc3ccncc3)C(=O)c3ccco3)CC2)CC1 ZINC000015062488 570874834 /nfs/dbraw/zinc/87/48/34/570874834.db2.gz KVUQPGCZQJZWNN-UHFFFAOYSA-N 2 1 396.535 3.123 50 0 GGAAMP O=C(NC1CC1)C1CC[NH+](C2CC[NH+](Cc3c[nH]c4ccccc34)CC2)CC1 ZINC000015069992 570876658 /nfs/dbraw/zinc/87/66/58/570876658.db2.gz YGRZAXNTDYLPSX-UHFFFAOYSA-N 2 1 380.536 3.123 50 0 GGAAMP CC(C)[C@@H](C(=O)N1CCC[C@@H](C[NH+]2CCC(C)CC2)C1)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000107349688 570899409 /nfs/dbraw/zinc/89/94/09/570899409.db2.gz BXIHDSGTNAGLAG-CZYKHXBRSA-N 2 1 393.616 3.091 50 0 GGAAMP Cn1cc(CN(CC[NH+]2CCCCC2)C[C@@H]2CCC[N@H+](C3CCCC3)C2)cn1 ZINC000019224443 570964085 /nfs/dbraw/zinc/96/40/85/570964085.db2.gz SRKUVUXTFZJBJM-NRFANRHFSA-N 2 1 387.616 3.363 50 0 GGAAMP COCC[N@H+](C)C[C@@H]1C[NH+](Cc2cccc3c4ccccc4oc32)C[C@@H]1CO ZINC000091487000 571010989 /nfs/dbraw/zinc/01/09/89/571010989.db2.gz QKVPRESQNZDHCF-RTBURBONSA-N 2 1 382.504 3.205 50 0 GGAAMP COCC[N@@H+](C)C[C@@H]1C[NH+](Cc2cccc3c4ccccc4oc32)C[C@@H]1CO ZINC000091487000 571010992 /nfs/dbraw/zinc/01/09/92/571010992.db2.gz QKVPRESQNZDHCF-RTBURBONSA-N 2 1 382.504 3.205 50 0 GGAAMP COCC[NH+](C)C[C@@H]1C[N@H+](Cc2cccc3c4ccccc4oc32)C[C@@H]1CO ZINC000091487000 571010995 /nfs/dbraw/zinc/01/09/95/571010995.db2.gz QKVPRESQNZDHCF-RTBURBONSA-N 2 1 382.504 3.205 50 0 GGAAMP COCC[NH+](C)C[C@@H]1C[N@@H+](Cc2cccc3c4ccccc4oc32)C[C@@H]1CO ZINC000091487000 571010998 /nfs/dbraw/zinc/01/09/98/571010998.db2.gz QKVPRESQNZDHCF-RTBURBONSA-N 2 1 382.504 3.205 50 0 GGAAMP Cc1cc(C)c2[nH]c(C[N@@H+]3CCCC[C@H]3CCN3CC[NH+](C)CC3)cc(=O)c2c1 ZINC000091626424 571020300 /nfs/dbraw/zinc/02/03/00/571020300.db2.gz NCJXOKKMPJJEII-NRFANRHFSA-N 2 1 396.579 3.137 50 0 GGAAMP C[NH+]1CCC([NH+]2CCC3(CC2)C[C@@H](c2ccccc2)C(=O)N(C2CC2)C3)CC1 ZINC000091713567 571027464 /nfs/dbraw/zinc/02/74/64/571027464.db2.gz AXMSZAALQKVNTJ-QFIPXVFZSA-N 2 1 381.564 3.341 50 0 GGAAMP C[N@H+]1CC[C@H](N2CC3(CCC2=O)CC[NH+](Cc2ccccc2Cl)CC3)C1 ZINC000091914898 571036262 /nfs/dbraw/zinc/03/62/62/571036262.db2.gz MFMJQKPIYLKHLY-SFHVURJKSA-N 2 1 375.944 3.249 50 0 GGAAMP CCC[NH+]1CCC([N@@H+]2C[C@@H](c3ccc4c(c3)OCO4)[C@@H]3[C@H]2C2CCN3CC2)CC1 ZINC000095369637 571060346 /nfs/dbraw/zinc/06/03/46/571060346.db2.gz AOTVWDBMGJVQHU-TUACAJSNSA-N 2 1 397.563 3.152 50 0 GGAAMP CCC[NH+]1CCC([N@H+]2C[C@@H](c3ccc4c(c3)OCO4)[C@@H]3[C@H]2C2CCN3CC2)CC1 ZINC000095369637 571060349 /nfs/dbraw/zinc/06/03/49/571060349.db2.gz AOTVWDBMGJVQHU-TUACAJSNSA-N 2 1 397.563 3.152 50 0 GGAAMP O=C(C1CC[NH+](Cc2ccco2)CC1)N1CCC[N@@H+](Cc2cccc(F)c2)CC1 ZINC000095382038 571068279 /nfs/dbraw/zinc/06/82/79/571068279.db2.gz CIUWFJQAQAZWOC-UHFFFAOYSA-N 2 1 399.510 3.365 50 0 GGAAMP O=C(C1CC[NH+](Cc2ccco2)CC1)N1CCC[N@H+](Cc2cccc(F)c2)CC1 ZINC000095382038 571068281 /nfs/dbraw/zinc/06/82/81/571068281.db2.gz CIUWFJQAQAZWOC-UHFFFAOYSA-N 2 1 399.510 3.365 50 0 GGAAMP COc1ccc(/C=C/C[NH+]2CCC3(CCC(=O)N([C@@H]4CC[N@@H+](C)C4)C3)CC2)cc1 ZINC000095500499 571076115 /nfs/dbraw/zinc/07/61/15/571076115.db2.gz IPJUIBJDUIRYTB-YEFOHOTDSA-N 2 1 397.563 3.117 50 0 GGAAMP COc1cc(C[NH+]2CCC(F)(F)CC2)ccc1OC[C@@H](O)C[N@H+](C)C(C)C ZINC000095504590 571077894 /nfs/dbraw/zinc/07/78/94/571077894.db2.gz HDUCKWAYGORIAE-KRWDZBQOSA-N 2 1 386.483 3.006 50 0 GGAAMP COc1cc(C[NH+]2CCC(F)(F)CC2)ccc1OC[C@@H](O)C[N@@H+](C)C(C)C ZINC000095504590 571077895 /nfs/dbraw/zinc/07/78/95/571077895.db2.gz HDUCKWAYGORIAE-KRWDZBQOSA-N 2 1 386.483 3.006 50 0 GGAAMP O[C@@H](COc1cccc(C[NH+]2CCC(F)CC2)c1)C[N@H+]1CCc2ccccc2C1 ZINC000095510078 571081499 /nfs/dbraw/zinc/08/14/99/571081499.db2.gz SQSMICTUQJFAIW-HSZRJFAPSA-N 2 1 398.522 3.419 50 0 GGAAMP COc1cc(C[N@@H+](C)C2CCSCC2)ccc1OC[C@H](O)C[NH+](C)C(C)C ZINC000095522180 571087617 /nfs/dbraw/zinc/08/76/17/571087617.db2.gz SZLSEUMAEQQLFG-LJQANCHMSA-N 2 1 396.597 3.103 50 0 GGAAMP COc1cc(C[NH+](C)C2CCSCC2)ccc1OC[C@H](O)C[N@H+](C)C(C)C ZINC000095522180 571087620 /nfs/dbraw/zinc/08/76/20/571087620.db2.gz SZLSEUMAEQQLFG-LJQANCHMSA-N 2 1 396.597 3.103 50 0 GGAAMP COc1cc(C[NH+](C)C2CCSCC2)ccc1OC[C@H](O)C[N@@H+](C)C(C)C ZINC000095522180 571087625 /nfs/dbraw/zinc/08/76/25/571087625.db2.gz SZLSEUMAEQQLFG-LJQANCHMSA-N 2 1 396.597 3.103 50 0 GGAAMP COc1ccc(C[N@@H+](C)Cc2ccsc2)cc1OC[C@@H](O)C[NH+]1CCCC1 ZINC000095522438 571088143 /nfs/dbraw/zinc/08/81/43/571088143.db2.gz WIWKVNRJQDFQHQ-IBGZPJMESA-N 2 1 390.549 3.224 50 0 GGAAMP O[C@@H](COc1ccc(C[N@H+]2CCOC3(CCCC3)C2)cc1)C[NH+]1CCCCC1 ZINC000095524589 571089729 /nfs/dbraw/zinc/08/97/29/571089729.db2.gz YLILJOKUPHZXFS-OAQYLSRUSA-N 2 1 388.552 3.057 50 0 GGAAMP C[NH+](C)CCN(C[C@H]1CCC[N@@H+](Cc2ccccc2F)C1)C(=O)c1cc[nH]c1 ZINC000095524056 571089762 /nfs/dbraw/zinc/08/97/62/571089762.db2.gz HPZNIKKZOWTSIF-SFHVURJKSA-N 2 1 386.515 3.070 50 0 GGAAMP C[NH+](Cc1ccc(OC[C@H](O)C[N@H+](C)Cc2ccccc2)cc1)C1CCOCC1 ZINC000095528901 571092027 /nfs/dbraw/zinc/09/20/27/571092027.db2.gz DQZHNZHFVAJOQJ-HSZRJFAPSA-N 2 1 398.547 3.169 50 0 GGAAMP C[NH+](Cc1ccccc1)C[C@@H](O)COc1ccc(C[N@H+](C)C2CCOCC2)cc1 ZINC000095528901 571092028 /nfs/dbraw/zinc/09/20/28/571092028.db2.gz DQZHNZHFVAJOQJ-HSZRJFAPSA-N 2 1 398.547 3.169 50 0 GGAAMP C[NH+](Cc1ccccc1)C[C@@H](O)COc1ccc(C[N@@H+](C)C2CCOCC2)cc1 ZINC000095528901 571092029 /nfs/dbraw/zinc/09/20/29/571092029.db2.gz DQZHNZHFVAJOQJ-HSZRJFAPSA-N 2 1 398.547 3.169 50 0 GGAAMP COc1ccc(C[N@@H+](C)C2CCSCC2)cc1OC[C@@H](O)C[NH+](C)C(C)C ZINC000095529216 571092461 /nfs/dbraw/zinc/09/24/61/571092461.db2.gz MIBMRWRHAOUHBO-IBGZPJMESA-N 2 1 396.597 3.103 50 0 GGAAMP COc1ccc(C[NH+](C)C2CCSCC2)cc1OC[C@@H](O)C[N@H+](C)C(C)C ZINC000095529216 571092463 /nfs/dbraw/zinc/09/24/63/571092463.db2.gz MIBMRWRHAOUHBO-IBGZPJMESA-N 2 1 396.597 3.103 50 0 GGAAMP COc1ccc(C[NH+](C)C2CCSCC2)cc1OC[C@@H](O)C[N@@H+](C)C(C)C ZINC000095529216 571092465 /nfs/dbraw/zinc/09/24/65/571092465.db2.gz MIBMRWRHAOUHBO-IBGZPJMESA-N 2 1 396.597 3.103 50 0 GGAAMP C[NH+](C)CCN(C[C@@H]1CCC[N@@H+](Cc2ccccc2F)C1)C(=O)c1ccccn1 ZINC000095530642 571092711 /nfs/dbraw/zinc/09/27/11/571092711.db2.gz AIXUYKQWWKLMOJ-LJQANCHMSA-N 2 1 398.526 3.137 50 0 GGAAMP C[NH+](C)CCN(C[C@H]1CCC[N@@H+](Cc2ccccc2F)C1)C(=O)c1ccccn1 ZINC000095530643 571092795 /nfs/dbraw/zinc/09/27/95/571092795.db2.gz AIXUYKQWWKLMOJ-IBGZPJMESA-N 2 1 398.526 3.137 50 0 GGAAMP O=C(NCc1ccccn1)C1CC[NH+](C2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000011816876 1399013765 /nfs/dbraw/zinc/01/37/65/1399013765.db2.gz PDTHJMCLIZZSJB-UHFFFAOYSA-N 2 1 392.547 3.074 50 0 GGAAMP CSc1ncc(C[N@H+]2CC[C@@H](C3CC[NH+](Cc4cccnc4)CC3)C2)cn1 ZINC000011820853 1399014103 /nfs/dbraw/zinc/01/41/03/1399014103.db2.gz BMYLRMWZUYBKHL-HXUWFJFHSA-N 2 1 383.565 3.328 50 0 GGAAMP O=C(NC1CCCC1)[C@@H]1CCC[N@@H+](C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000011839397 1399015048 /nfs/dbraw/zinc/01/50/48/1399015048.db2.gz BPILOZFLHQZOCT-OAQYLSRUSA-N 2 1 383.580 3.464 50 0 GGAAMP O=C(NC1CCCC1)[C@@H]1CCC[N@H+](C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000011839397 1399015053 /nfs/dbraw/zinc/01/50/53/1399015053.db2.gz BPILOZFLHQZOCT-OAQYLSRUSA-N 2 1 383.580 3.464 50 0 GGAAMP C[N@H+](C[C@@H]1CCC[NH+](C)C1)[C@H]1CCC(=O)N(Cc2ccc(Cl)cc2)CC1 ZINC000011910630 1399017289 /nfs/dbraw/zinc/01/72/89/1399017289.db2.gz HAWACBYPMPHUHC-QUCCMNQESA-N 2 1 377.960 3.495 50 0 GGAAMP C[N@@H+](C[C@@H]1CCC[NH+](C)C1)[C@H]1CCC(=O)N(Cc2ccc(Cl)cc2)CC1 ZINC000011910630 1399017292 /nfs/dbraw/zinc/01/72/92/1399017292.db2.gz HAWACBYPMPHUHC-QUCCMNQESA-N 2 1 377.960 3.495 50 0 GGAAMP C[NH+](C[C@@H]1CCC[N@H+](C)C1)[C@H]1CCC(=O)N(Cc2ccc(Cl)cc2)CC1 ZINC000011910630 1399017295 /nfs/dbraw/zinc/01/72/95/1399017295.db2.gz HAWACBYPMPHUHC-QUCCMNQESA-N 2 1 377.960 3.495 50 0 GGAAMP C[NH+](C[C@@H]1CCC[N@@H+](C)C1)[C@H]1CCC(=O)N(Cc2ccc(Cl)cc2)CC1 ZINC000011910630 1399017299 /nfs/dbraw/zinc/01/72/99/1399017299.db2.gz HAWACBYPMPHUHC-QUCCMNQESA-N 2 1 377.960 3.495 50 0 GGAAMP COC1CC[NH+](Cc2ccccc2OC[C@H](O)C[N@@H+](C)C2CCCCC2)CC1 ZINC000012002251 1399023681 /nfs/dbraw/zinc/02/36/81/1399023681.db2.gz KRUBIYVZMVERSA-OAQYLSRUSA-N 2 1 390.568 3.302 50 0 GGAAMP CSCC(=O)N(CC[NH+]1CCCCC1)C[C@H]1CCC[N@H+](C2CCCC2)C1 ZINC000012092682 1399028229 /nfs/dbraw/zinc/02/82/29/1399028229.db2.gz KLKIRGZTNMMSMN-IBGZPJMESA-N 2 1 381.630 3.319 50 0 GGAAMP CCc1ccc(C[N@H+]2CCC[C@H](CCC(=O)N(C)C3CC[NH+](C)CC3)C2)o1 ZINC000012112012 1399030137 /nfs/dbraw/zinc/03/01/37/1399030137.db2.gz QJSIBTGBQYOQAE-GOSISDBHSA-N 2 1 375.557 3.387 50 0 GGAAMP COCC[N@@H+]1CCC[C@]2(CC[NH+](C3CCN(c4ccccc4OC)CC3)C2)C1 ZINC000012307517 1399038277 /nfs/dbraw/zinc/03/82/77/1399038277.db2.gz IYHISGIGMFLFCL-QHCPKHFHSA-N 2 1 387.568 3.098 50 0 GGAAMP COCC[N@H+]1CCC[C@]2(CC[NH+](C3CCN(c4ccccc4OC)CC3)C2)C1 ZINC000012307517 1399038283 /nfs/dbraw/zinc/03/82/83/1399038283.db2.gz IYHISGIGMFLFCL-QHCPKHFHSA-N 2 1 387.568 3.098 50 0 GGAAMP COCC[NH+]1CCC[C@]2(CC[N@@H+](C3CCN(c4ccccc4OC)CC3)C2)C1 ZINC000012307517 1399038286 /nfs/dbraw/zinc/03/82/86/1399038286.db2.gz IYHISGIGMFLFCL-QHCPKHFHSA-N 2 1 387.568 3.098 50 0 GGAAMP COCC[NH+]1CCC[C@]2(CC[N@H+](C3CCN(c4ccccc4OC)CC3)C2)C1 ZINC000012307517 1399038293 /nfs/dbraw/zinc/03/82/93/1399038293.db2.gz IYHISGIGMFLFCL-QHCPKHFHSA-N 2 1 387.568 3.098 50 0 GGAAMP CCOc1ccccc1C[N@@H+](C[C@H]1CCCO1)CC1CC[NH+](CCOC)CC1 ZINC000012576754 1399048224 /nfs/dbraw/zinc/04/82/24/1399048224.db2.gz IDRQWFLOSMKSLS-JOCHJYFZSA-N 2 1 390.568 3.425 50 0 GGAAMP C[NH+]1CCC(N2C[C@@H]3C[C@@H](c4cc5ccccc5o4)[N@H+]4CCC[C@@]34C2=O)CC1 ZINC000012597849 1399049672 /nfs/dbraw/zinc/04/96/72/1399049672.db2.gz DEUYYKSDHRMXSV-LTMIRXACSA-N 2 1 379.504 3.265 50 0 GGAAMP COC1CC[NH+](Cc2cccc(OC[C@@H](O)C[N@@H+](C)C3CCCCC3)c2)CC1 ZINC000012713363 1399055787 /nfs/dbraw/zinc/05/57/87/1399055787.db2.gz RJMLYXDNXPNUDV-NRFANRHFSA-N 2 1 390.568 3.302 50 0 GGAAMP CCn1cc(C[N@@H+](CCOC)CC2CC[NH+](Cc3ccccc3F)CC2)cn1 ZINC000014958368 1399128680 /nfs/dbraw/zinc/12/86/80/1399128680.db2.gz JAFJEBOQDVXZJM-UHFFFAOYSA-N 2 1 388.531 3.403 50 0 GGAAMP CC[N@H+](C[C@@H]1CCC[NH+](CCc2cccc(F)c2)C1)C1CCN(C(C)=O)CC1 ZINC000014972201 1399129560 /nfs/dbraw/zinc/12/95/60/1399129560.db2.gz LOTNCPGCPJQITN-OAQYLSRUSA-N 2 1 389.559 3.413 50 0 GGAAMP CC[N@@H+](C[C@@H]1CCC[NH+](CCc2cccc(F)c2)C1)C1CCN(C(C)=O)CC1 ZINC000014972201 1399129562 /nfs/dbraw/zinc/12/95/62/1399129562.db2.gz LOTNCPGCPJQITN-OAQYLSRUSA-N 2 1 389.559 3.413 50 0 GGAAMP CC[NH+](C[C@@H]1CCC[N@H+](CCc2cccc(F)c2)C1)C1CCN(C(C)=O)CC1 ZINC000014972201 1399129566 /nfs/dbraw/zinc/12/95/66/1399129566.db2.gz LOTNCPGCPJQITN-OAQYLSRUSA-N 2 1 389.559 3.413 50 0 GGAAMP CC[NH+](C[C@@H]1CCC[N@@H+](CCc2cccc(F)c2)C1)C1CCN(C(C)=O)CC1 ZINC000014972201 1399129570 /nfs/dbraw/zinc/12/95/70/1399129570.db2.gz LOTNCPGCPJQITN-OAQYLSRUSA-N 2 1 389.559 3.413 50 0 GGAAMP O[C@@H](COc1ccc(C[NH+]2CCCCC2)cc1)C[N@H+]1CCc2ccccc2C1 ZINC000014966140 1399129576 /nfs/dbraw/zinc/12/95/76/1399129576.db2.gz NQUQJHOLYFIEMP-HSZRJFAPSA-N 2 1 380.532 3.471 50 0 GGAAMP CC[N@H+](C[C@H]1CCC[NH+](CCc2cccc(F)c2)C1)C1CCN(C(C)=O)CC1 ZINC000014972204 1399129622 /nfs/dbraw/zinc/12/96/22/1399129622.db2.gz LOTNCPGCPJQITN-NRFANRHFSA-N 2 1 389.559 3.413 50 0 GGAAMP CC[N@@H+](C[C@H]1CCC[NH+](CCc2cccc(F)c2)C1)C1CCN(C(C)=O)CC1 ZINC000014972204 1399129628 /nfs/dbraw/zinc/12/96/28/1399129628.db2.gz LOTNCPGCPJQITN-NRFANRHFSA-N 2 1 389.559 3.413 50 0 GGAAMP CC[NH+](C[C@H]1CCC[N@H+](CCc2cccc(F)c2)C1)C1CCN(C(C)=O)CC1 ZINC000014972204 1399129633 /nfs/dbraw/zinc/12/96/33/1399129633.db2.gz LOTNCPGCPJQITN-NRFANRHFSA-N 2 1 389.559 3.413 50 0 GGAAMP CC[NH+](C[C@H]1CCC[N@@H+](CCc2cccc(F)c2)C1)C1CCN(C(C)=O)CC1 ZINC000014972204 1399129638 /nfs/dbraw/zinc/12/96/38/1399129638.db2.gz LOTNCPGCPJQITN-NRFANRHFSA-N 2 1 389.559 3.413 50 0 GGAAMP O[C@H](COc1ccc(C[NH+]2CCCCC2)cc1)C[N@H+]1CCc2ccccc2C1 ZINC000014966145 1399129680 /nfs/dbraw/zinc/12/96/80/1399129680.db2.gz NQUQJHOLYFIEMP-QHCPKHFHSA-N 2 1 380.532 3.471 50 0 GGAAMP CC[N@H+]1CCCC[C@@H]1C(=O)N(C)CC1CC[NH+](CCc2ccccc2F)CC1 ZINC000014980437 1399129823 /nfs/dbraw/zinc/12/98/23/1399129823.db2.gz QAWLUHYNTQPHMK-JOCHJYFZSA-N 2 1 389.559 3.413 50 0 GGAAMP Cc1cc(C)c(C[NH+]2CCC3(C[C@H]3C(=O)N3CCC[N@H+](C)CC3)CC2)cc1C ZINC000014988712 1399130348 /nfs/dbraw/zinc/13/03/48/1399130348.db2.gz HRFUHVJNEGRZEY-QFIPXVFZSA-N 2 1 383.580 3.378 50 0 GGAAMP C[N@@H+](C[C@H](O)COc1ccccc1C[NH2+]CC1CCOCC1)C1CCCCC1 ZINC000015069186 1399135592 /nfs/dbraw/zinc/13/55/92/1399135592.db2.gz CFQRLVALUDTLMN-QFIPXVFZSA-N 2 1 390.568 3.207 50 0 GGAAMP Cc1ncc2c(c1-c1noc([C@@H]3CCC[N@@H+](Cc4ccco4)C3)n1)CC[NH2+]C2 ZINC000019301116 1399329157 /nfs/dbraw/zinc/32/91/57/1399329157.db2.gz BNGWONYIOPJRRB-OAHLLOKOSA-N 2 1 379.464 3.058 50 0 GGAAMP O=C(NCC(F)(F)F)[C@H]1CCC[N@@H+](C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000020450907 1399346284 /nfs/dbraw/zinc/34/62/84/1399346284.db2.gz UVAZZGGGDPHMAZ-SFHVURJKSA-N 2 1 397.485 3.084 50 0 GGAAMP O=C(NCC(F)(F)F)[C@H]1CCC[N@H+](C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000020450907 1399346291 /nfs/dbraw/zinc/34/62/91/1399346291.db2.gz UVAZZGGGDPHMAZ-SFHVURJKSA-N 2 1 397.485 3.084 50 0 GGAAMP Cn1cccc1C[NH+]1CCC2(CC1)c1ccccc1[C@@H]([N@@H+]1CC=CCC1)[C@@H]2O ZINC000020450107 1399346481 /nfs/dbraw/zinc/34/64/81/1399346481.db2.gz VXHGQRKESPGLGM-PKTZIBPZSA-N 2 1 377.532 3.236 50 0 GGAAMP O[C@H](COc1ccccc1C[N@H+]1CCc2ccccc2C1)C[NH+]1CCSCC1 ZINC000020598741 1399349283 /nfs/dbraw/zinc/34/92/83/1399349283.db2.gz VVSIIOHASYGDEN-QFIPXVFZSA-N 2 1 398.572 3.033 50 0 GGAAMP CCC[N@@H+](Cc1cccc(-c2nc(CC[NH3+])cc(=O)[nH]2)c1)Cc1ccccn1 ZINC000023231842 1399542364 /nfs/dbraw/zinc/54/23/64/1399542364.db2.gz RMULDQPSQFVVKP-UHFFFAOYSA-N 2 1 377.492 3.158 50 0 GGAAMP CCC[N@@H+](CCc1ccccc1)Cc1cccc(-c2nc(C[NH3+])cc(=O)[nH]2)c1 ZINC000023337287 1399550213 /nfs/dbraw/zinc/55/02/13/1399550213.db2.gz RLXROFVURWUQGH-UHFFFAOYSA-N 2 1 376.504 3.350 50 0 GGAAMP CC(C)C[N@H+]1CCN(Cc2ccc(C[NH+]3CCCCC3)s2)C[C@H]1CCO ZINC000104533838 1410899132 /nfs/dbraw/zinc/89/91/32/1410899132.db2.gz QVTBXNXASSAIRN-LJQANCHMSA-N 2 1 379.614 3.259 50 0 GGAAMP COc1c2c(cc3c1[C@H](Cc1cc(=[NH2+])c4ccccc4n1C)[N@@H+](C)CC3)OCO2 ZINC000334157014 206252077 /nfs/dbraw/zinc/25/20/77/206252077.db2.gz XEPPVVCGCAFDLT-IBGZPJMESA-N 2 1 391.471 3.167 50 0 biogenic GGAAMP COc1c2c(cc3c1[C@@H](Cc1cc(=[NH2+])c4ccccc4n1C)[N@@H+](C)CC3)OCO2 ZINC000334157015 206252743 /nfs/dbraw/zinc/25/27/43/206252743.db2.gz XEPPVVCGCAFDLT-LJQANCHMSA-N 2 1 391.471 3.167 50 0 biogenic GGAAMP COc1ccc(C[N@H+]2CCc3ccccc3C2)cc1OC[C@@H](O)C[NH+](C)C(C)C ZINC000014948024 207033145 /nfs/dbraw/zinc/03/31/45/207033145.db2.gz YVPWTPUYGUCKGW-QFIPXVFZSA-N 2 1 398.547 3.333 50 0 GGAAMP COc1ccc(C[NH+]2CCc3ccccc3C2)cc1OC[C@@H](O)C[N@H+](C)C(C)C ZINC000014948024 207033148 /nfs/dbraw/zinc/03/31/48/207033148.db2.gz YVPWTPUYGUCKGW-QFIPXVFZSA-N 2 1 398.547 3.333 50 0 GGAAMP COc1ccc(C[NH+]2CCc3ccccc3C2)cc1OC[C@@H](O)C[N@@H+](C)C(C)C ZINC000014948024 207033151 /nfs/dbraw/zinc/03/31/51/207033151.db2.gz YVPWTPUYGUCKGW-QFIPXVFZSA-N 2 1 398.547 3.333 50 0 GGAAMP CCN(CC1CC[NH+](C2CC[NH+](C)CC2)CC1)C(=O)c1ccc(CSC)o1 ZINC000014954739 207033309 /nfs/dbraw/zinc/03/33/09/207033309.db2.gz QBNADIQWWGSYMD-UHFFFAOYSA-N 2 1 393.597 3.411 50 0 GGAAMP COc1ccc(C[NH2+]CC2CC2)cc1OC[C@H](O)C[N@@H+](C)Cc1ccccc1 ZINC000015072578 207044078 /nfs/dbraw/zinc/04/40/78/207044078.db2.gz YMBBXGALHPJVBB-OAQYLSRUSA-N 2 1 384.520 3.067 50 0 GGAAMP CSc1ccc(C[N@@H+]2CCN(C3CC[NH+](C(C)C)CC3)[C@@H](CCO)C2)cc1 ZINC000019225279 207110195 /nfs/dbraw/zinc/11/01/95/207110195.db2.gz LJPVWKNHGKJVHE-NRFANRHFSA-N 2 1 391.625 3.150 50 0 GGAAMP CSc1ccc(C[N@H+]2CCN(C3CC[NH+](C(C)C)CC3)[C@@H](CCO)C2)cc1 ZINC000019225279 207110200 /nfs/dbraw/zinc/11/02/00/207110200.db2.gz LJPVWKNHGKJVHE-NRFANRHFSA-N 2 1 391.625 3.150 50 0 GGAAMP Cc1ccc(C[N@@H+]2CCN(C3CC[NH+](Cc4ccccc4)CC3)C[C@@H]2CCO)o1 ZINC000019595283 207144101 /nfs/dbraw/zinc/14/41/01/207144101.db2.gz PMTSMFKRHVDVLB-QHCPKHFHSA-N 2 1 397.563 3.121 50 0 GGAAMP Cc1ccc(C[N@H+]2CCN(C3CC[NH+](Cc4ccccc4)CC3)C[C@@H]2CCO)o1 ZINC000019595283 207144105 /nfs/dbraw/zinc/14/41/05/207144105.db2.gz PMTSMFKRHVDVLB-QHCPKHFHSA-N 2 1 397.563 3.121 50 0 GGAAMP CC(C)CC[N@H+]1CCN(Cc2ccc(C[NH+]3CCCC3)s2)C[C@@H]1CCO ZINC000019744284 207157624 /nfs/dbraw/zinc/15/76/24/207157624.db2.gz RBMNDXYGGMWDPI-IBGZPJMESA-N 2 1 379.614 3.259 50 0 GGAAMP C[NH+]1CCN(C(=O)CC[C@@H]2CCC[N@H+](Cc3cccc(C(F)(F)F)c3)C2)CC1 ZINC000020543146 207202417 /nfs/dbraw/zinc/20/24/17/207202417.db2.gz VABSPAUUJAWYSA-KRWDZBQOSA-N 2 1 397.485 3.472 50 0 GGAAMP C[NH+]1CCN(C(=O)CC[C@@H]2CCC[N@@H+](Cc3cccc(C(F)(F)F)c3)C2)CC1 ZINC000020543146 207202420 /nfs/dbraw/zinc/20/24/20/207202420.db2.gz VABSPAUUJAWYSA-KRWDZBQOSA-N 2 1 397.485 3.472 50 0 GGAAMP Cc1ccccc1OCCC[N@H+](C)[C@@H]1c2ccccc2C2(CC[NH2+]CC2)[C@H]1O ZINC000020782963 207215232 /nfs/dbraw/zinc/21/52/32/207215232.db2.gz VKLZPQABKLUVHB-PKTZIBPZSA-N 2 1 380.532 3.433 50 0 GGAAMP C[N@@H+](Cc1ccco1)Cc1ccc(-c2nc([C@H]3CCC[NH2+]C3)cc(=O)[nH]2)cc1 ZINC000023130764 207269530 /nfs/dbraw/zinc/26/95/30/207269530.db2.gz PCEMEZMBTATEDA-SFHVURJKSA-N 2 1 378.476 3.129 50 0 GGAAMP CCC[N@H+]1CC2(C[C@@H]1C(=O)N(Cc1ccc(O)cc1)C1CC1)CC[NH+](C)CC2 ZINC000072411661 208018279 /nfs/dbraw/zinc/01/82/79/208018279.db2.gz XZQJYCJGEXBHKC-OAQYLSRUSA-N 2 1 385.552 3.080 50 0 GGAAMP c1cn(CC[N@H+]2CCC[C@@H](c3ccccc3)C2)c(-c2cc3n(n2)CCC[NH2+]C3)n1 ZINC000072424994 208023036 /nfs/dbraw/zinc/02/30/36/208023036.db2.gz KNFTUMZHPFTSAW-HXUWFJFHSA-N 2 1 390.535 3.120 50 0 GGAAMP CCC[N@H+]1CC2(C[C@@H]1C(=O)NC(C)(C)Cc1ccc(F)cc1)CC[NH+](C)CC2 ZINC000072473342 208029480 /nfs/dbraw/zinc/02/94/80/208029480.db2.gz ZLFFCLOQSZAFGX-HXUWFJFHSA-N 2 1 389.559 3.459 50 0 GGAAMP CCC[N@H+]1CC2(C[C@H]1C(=O)NC(C)(C)Cc1ccc(F)cc1)CC[NH+](C)CC2 ZINC000072473343 208029596 /nfs/dbraw/zinc/02/95/96/208029596.db2.gz ZLFFCLOQSZAFGX-FQEVSTJZSA-N 2 1 389.559 3.459 50 0 GGAAMP CCC[N@H+]1CC2(C[C@H]1C(=O)NCCc1ccc(Cl)cc1)CC[NH+](C)CC2 ZINC000072476171 208031631 /nfs/dbraw/zinc/03/16/31/208031631.db2.gz BVIOWIOAAXJWGX-IBGZPJMESA-N 2 1 377.960 3.195 50 0 GGAAMP CC(C)[C@H](C(=O)N1CCC[C@H](C[NH+]2CCC(C)CC2)C1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000084699899 208097626 /nfs/dbraw/zinc/09/76/26/208097626.db2.gz BXIHDSGTNAGLAG-CIAFKFPVSA-N 2 1 393.616 3.091 50 0 GGAAMP CC(C)[C@H](C(=O)N1CCC[C@H](C[NH+]2CCC(C)CC2)C1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000084699899 208097633 /nfs/dbraw/zinc/09/76/33/208097633.db2.gz BXIHDSGTNAGLAG-CIAFKFPVSA-N 2 1 393.616 3.091 50 0 GGAAMP CN(CC1CC1)C(=O)[C@@H]1CCC[N@H+](C2CC[NH+](C3Cc4ccccc4C3)CC2)C1 ZINC000091644008 208129095 /nfs/dbraw/zinc/12/90/95/208129095.db2.gz FXKQZVXFRALJGO-JOCHJYFZSA-N 2 1 395.591 3.199 50 0 GGAAMP C[NH+](C)CCN1C[C@]2(CCC[N@@H+](Cc3ccc(F)c(Cl)c3)C2)CCC1=O ZINC000091794468 208138048 /nfs/dbraw/zinc/13/80/48/208138048.db2.gz GPAYEQZTHOPPAK-HXUWFJFHSA-N 2 1 381.923 3.245 50 0 GGAAMP Cc1ccc([C@H](C(=O)NC2CC[NH+](C3CCSCC3)CC2)[NH+](C)C)cc1 ZINC000095353263 208158481 /nfs/dbraw/zinc/15/84/81/208158481.db2.gz YSURCHATPMEQCX-HXUWFJFHSA-N 2 1 375.582 3.074 50 0 GGAAMP CCC[NH+]1CCC([N@@H+]2C[C@@H](c3ccc(OC)cc3)[C@@H]3[C@H]2C2CCN3CC2)CC1 ZINC000095357520 208160791 /nfs/dbraw/zinc/16/07/91/208160791.db2.gz LZPHLYWZIFSSAB-RBZQAINGSA-N 2 1 383.580 3.432 50 0 GGAAMP CCC[NH+]1CCC([N@H+]2C[C@@H](c3ccc(OC)cc3)[C@@H]3[C@H]2C2CCN3CC2)CC1 ZINC000095357520 208160798 /nfs/dbraw/zinc/16/07/98/208160798.db2.gz LZPHLYWZIFSSAB-RBZQAINGSA-N 2 1 383.580 3.432 50 0 GGAAMP O=C(C[NH+]1CCCC1)N1CCC2(CC1)C[C@H](c1ccccc1)C[N@H+](C1CC1)C2 ZINC000095366408 208163773 /nfs/dbraw/zinc/16/37/73/208163773.db2.gz DBWJLDBMYXFZHZ-NRFANRHFSA-N 2 1 381.564 3.343 50 0 GGAAMP O=C(CC[NH+]1CCC2(CC1)C[C@H](c1ccccc1)C[N@H+](C1CC1)C2)NC1CC1 ZINC000095382089 208173104 /nfs/dbraw/zinc/17/31/04/208173104.db2.gz IQXUBUBFXPAZGD-FQEVSTJZSA-N 2 1 381.564 3.389 50 0 GGAAMP O=C(CC[NH+]1CCC2(CC1)C[C@@H](c1ccccc1)C[N@H+](C1CC1)C2)NC1CC1 ZINC000095382088 208173588 /nfs/dbraw/zinc/17/35/88/208173588.db2.gz IQXUBUBFXPAZGD-HXUWFJFHSA-N 2 1 381.564 3.389 50 0 GGAAMP C[N@H+]1CC[C@@H](N2CC3(CCC2=O)CC[NH+](Cc2ccccc2Cl)CC3)C1 ZINC000091914899 208141021 /nfs/dbraw/zinc/14/10/21/208141021.db2.gz MFMJQKPIYLKHLY-GOSISDBHSA-N 2 1 375.944 3.249 50 0 GGAAMP CC[N@@H+]1C[C@H](c2ccccc2)CC2(CCN(C(=O)Cn3cc[nH+]c3C)CC2)C1 ZINC000092002213 208148262 /nfs/dbraw/zinc/14/82/62/208148262.db2.gz URSPNHOGJGIOPN-OAQYLSRUSA-N 2 1 380.536 3.310 50 0 GGAAMP CC[N@H+]1C[C@H](c2ccccc2)CC2(CCN(C(=O)Cn3cc[nH+]c3C)CC2)C1 ZINC000092002213 208148270 /nfs/dbraw/zinc/14/82/70/208148270.db2.gz URSPNHOGJGIOPN-OAQYLSRUSA-N 2 1 380.536 3.310 50 0 GGAAMP C[N@@H+](CC(=O)N1C[C@@H](c2ccc(F)cc2)[C@@H]2[C@H]1C1CC[NH+]2CC1)C1CCCC1 ZINC000095507556 208207454 /nfs/dbraw/zinc/20/74/54/208207454.db2.gz JHSJUQFDDUFJPA-MDNUFGMLSA-N 2 1 385.527 3.089 50 0 GGAAMP COc1cc(C[N@@H+](C)CC2CC2)ccc1OC[C@H](O)C[NH+]1CCCCCC1 ZINC000095505641 208208839 /nfs/dbraw/zinc/20/88/39/208208839.db2.gz KOTIPGXHTJFXPM-HXUWFJFHSA-N 2 1 376.541 3.153 50 0 GGAAMP O=C(c1cnco1)N(CC[NH+]1CCCCC1)C[C@H]1CCC[N@H+](C2CCCC2)C1 ZINC000095510114 208209605 /nfs/dbraw/zinc/20/96/05/208209605.db2.gz CSQGFXZNDNAJSX-IBGZPJMESA-N 2 1 388.556 3.257 50 0 GGAAMP Cn1c(C[N@@H+]2CCc3ccccc3C2)cc(=O)c(O)c1C[NH+]1CCCCCC1 ZINC000095476198 208191975 /nfs/dbraw/zinc/19/19/75/208191975.db2.gz CSQPJQLHXNDGCF-UHFFFAOYSA-N 2 1 381.520 3.025 50 0 GGAAMP Cn1c(C[N@H+]2CCc3ccccc3C2)cc(=O)c(O)c1C[NH+]1CCCCCC1 ZINC000095476198 208191980 /nfs/dbraw/zinc/19/19/80/208191980.db2.gz CSQPJQLHXNDGCF-UHFFFAOYSA-N 2 1 381.520 3.025 50 0 GGAAMP COc1ccc(C[N@@H+](C)Cc2ccc(C)o2)cc1OC[C@@H](O)C[NH+]1CCCC1 ZINC000095504118 208205098 /nfs/dbraw/zinc/20/50/98/208205098.db2.gz HRLSIIPMWRABKO-IBGZPJMESA-N 2 1 388.508 3.064 50 0 GGAAMP C[NH+](C)CCN(C[C@@H]1CCC[N@@H+](Cc2ccccc2F)C1)C(=O)c1cc[nH]c1 ZINC000095524055 208223922 /nfs/dbraw/zinc/22/39/22/208223922.db2.gz HPZNIKKZOWTSIF-GOSISDBHSA-N 2 1 386.515 3.070 50 0 GGAAMP C[N@H+](C[C@@H](O)COc1ccccc1C[NH+]1CCOC(C)(C)C1)C1CCCCC1 ZINC000095524641 208224415 /nfs/dbraw/zinc/22/44/15/208224415.db2.gz RSBUCAVPTOYTJR-OAQYLSRUSA-N 2 1 390.568 3.302 50 0 GGAAMP C[N@@H+](C[C@@H](O)COc1ccccc1C[NH+]1CCOC(C)(C)C1)C1CCCCC1 ZINC000095524641 208224419 /nfs/dbraw/zinc/22/44/19/208224419.db2.gz RSBUCAVPTOYTJR-OAQYLSRUSA-N 2 1 390.568 3.302 50 0 GGAAMP C[NH+](C[C@@H](O)COc1ccccc1C[N@@H+]1CCOC(C)(C)C1)C1CCCCC1 ZINC000095524641 208224424 /nfs/dbraw/zinc/22/44/24/208224424.db2.gz RSBUCAVPTOYTJR-OAQYLSRUSA-N 2 1 390.568 3.302 50 0 GGAAMP C[NH+](C[C@@H](O)COc1ccccc1C[N@H+]1CCOC(C)(C)C1)C1CCCCC1 ZINC000095524641 208224429 /nfs/dbraw/zinc/22/44/29/208224429.db2.gz RSBUCAVPTOYTJR-OAQYLSRUSA-N 2 1 390.568 3.302 50 0 GGAAMP COc1ccc(C[N@@H+](C)C2CCSCC2)cc1OC[C@H](O)C[NH+](C)C(C)C ZINC000095529217 208228739 /nfs/dbraw/zinc/22/87/39/208228739.db2.gz MIBMRWRHAOUHBO-LJQANCHMSA-N 2 1 396.597 3.103 50 0 GGAAMP COc1ccc(C[NH+](C)C2CCSCC2)cc1OC[C@H](O)C[N@H+](C)C(C)C ZINC000095529217 208228741 /nfs/dbraw/zinc/22/87/41/208228741.db2.gz MIBMRWRHAOUHBO-LJQANCHMSA-N 2 1 396.597 3.103 50 0 GGAAMP COc1ccc(C[NH+](C)C2CCSCC2)cc1OC[C@H](O)C[N@@H+](C)C(C)C ZINC000095529217 208228743 /nfs/dbraw/zinc/22/87/43/208228743.db2.gz MIBMRWRHAOUHBO-LJQANCHMSA-N 2 1 396.597 3.103 50 0 GGAAMP Cc1n[nH]c(C[N@@H+]2CCC3(CC[NH+](C4CCCC4)CC3)[C@H](CO)C2)c1Cl ZINC000097173268 208343876 /nfs/dbraw/zinc/34/38/76/208343876.db2.gz UZVISKBNBRBNPZ-INIZCTEOSA-N 2 1 380.964 3.211 50 0 GGAAMP Cc1n[nH]c(C[N@H+]2CCC3(CC[NH+](C4CCCC4)CC3)[C@H](CO)C2)c1Cl ZINC000097173268 208343880 /nfs/dbraw/zinc/34/38/80/208343880.db2.gz UZVISKBNBRBNPZ-INIZCTEOSA-N 2 1 380.964 3.211 50 0 GGAAMP Cc1n[nH]c(C[N@@H+]2CCC3(CC[NH+](C4CCCC4)CC3)[C@@H](CO)C2)c1Cl ZINC000097173270 208344643 /nfs/dbraw/zinc/34/46/43/208344643.db2.gz UZVISKBNBRBNPZ-MRXNPFEDSA-N 2 1 380.964 3.211 50 0 GGAAMP Cc1n[nH]c(C[N@H+]2CCC3(CC[NH+](C4CCCC4)CC3)[C@@H](CO)C2)c1Cl ZINC000097173270 208344648 /nfs/dbraw/zinc/34/46/48/208344648.db2.gz UZVISKBNBRBNPZ-MRXNPFEDSA-N 2 1 380.964 3.211 50 0 GGAAMP O=C(c1ccc(C[NH+]2CCc3ccccc3C2)cc1)N1CC[N@H+]2CCC[C@H]2C1 ZINC000299776256 209087397 /nfs/dbraw/zinc/08/73/97/209087397.db2.gz MNTWVOUIMWZXRQ-QHCPKHFHSA-N 2 1 375.516 3.165 50 0 GGAAMP O=C(c1ccc(C[N@@H+]2CCc3ccccc3C2)cc1)N1CC[NH+]2CCC[C@H]2C1 ZINC000299776256 209087408 /nfs/dbraw/zinc/08/74/08/209087408.db2.gz MNTWVOUIMWZXRQ-QHCPKHFHSA-N 2 1 375.516 3.165 50 0 GGAAMP O=C(c1ccc(C[N@H+]2CCc3ccccc3C2)cc1)N1CC[NH+]2CCC[C@H]2C1 ZINC000299776256 209087412 /nfs/dbraw/zinc/08/74/12/209087412.db2.gz MNTWVOUIMWZXRQ-QHCPKHFHSA-N 2 1 375.516 3.165 50 0 GGAAMP Cc1cccc(C[N@H+]2CCN(c3cc(C)[nH+]c4ccccc43)C[C@@H]2CCO)n1 ZINC000072421720 136169756 /nfs/dbraw/zinc/16/97/56/136169756.db2.gz ZCCRWOYQUUJOBX-FQEVSTJZSA-N 2 1 376.504 3.320 50 0 GGAAMP C[NH+]1CCC(N2CC[N@@H+](Cc3ccc(C4CCCC4)s3)C[C@H]2CCO)CC1 ZINC000106693447 570261308 /nfs/dbraw/zinc/26/13/08/570261308.db2.gz XIJFFEJSVYMXAV-HXUWFJFHSA-N 2 1 391.625 3.369 50 0 GGAAMP C[NH+](C)C[C@H](O)c1cc2n(n1)CCC[N@H+](Cc1cccc(-c3ccco3)c1)C2 ZINC000220419604 570386318 /nfs/dbraw/zinc/38/63/18/570386318.db2.gz NUINRQLQWUTBTQ-NRFANRHFSA-N 2 1 380.492 3.144 50 0 GGAAMP C[NH+](C)C[C@H](O)c1cc2n(n1)CCC[N@@H+](Cc1cccc(-c3ccco3)c1)C2 ZINC000220419604 570386324 /nfs/dbraw/zinc/38/63/24/570386324.db2.gz NUINRQLQWUTBTQ-NRFANRHFSA-N 2 1 380.492 3.144 50 0 GGAAMP CC(C)Cc1ccc(C[N@@H+]2CCCn3nc([C@@H](O)C[NH+](C)C)cc3C2)s1 ZINC000223393525 570463582 /nfs/dbraw/zinc/46/35/82/570463582.db2.gz QNTKTONVIXMZOF-FQEVSTJZSA-N 2 1 376.570 3.144 50 0 GGAAMP CC(C)Cc1ccc(C[N@H+]2CCCn3nc([C@@H](O)C[NH+](C)C)cc3C2)s1 ZINC000223393525 570463585 /nfs/dbraw/zinc/46/35/85/570463585.db2.gz QNTKTONVIXMZOF-FQEVSTJZSA-N 2 1 376.570 3.144 50 0 GGAAMP CN(CC1CC[NH+](CCc2ccccc2F)CC1)C(=O)[C@@H]1CCCCC[N@H+]1C ZINC000011817085 570584357 /nfs/dbraw/zinc/58/43/57/570584357.db2.gz YRLCHNLMVVGFER-QFIPXVFZSA-N 2 1 389.559 3.413 50 0 GGAAMP C[NH+](C)CCCOc1cccc(C[N@H+]2CCC[C@H](CCC(=O)NC3CC3)C2)c1 ZINC000039552051 570593284 /nfs/dbraw/zinc/59/32/84/570593284.db2.gz LMLNCEFVAGSUOW-LJQANCHMSA-N 2 1 387.568 3.288 50 0 GGAAMP CCN(CC1CC[NH+](C2CC[NH+](C)CC2)CC1)C(=O)c1cn(C)c2ccccc12 ZINC000011938117 570594504 /nfs/dbraw/zinc/59/45/04/570594504.db2.gz IMHCMNRJQUUQPU-UHFFFAOYSA-N 2 1 396.579 3.447 50 0 GGAAMP COc1ccc(C[NH2+]Cc2ccccc2C)cc1OC[C@@H](O)C[N@@H+](C)C(C)C ZINC000011997838 570597460 /nfs/dbraw/zinc/59/74/60/570597460.db2.gz NCBSEBNKWQPEOA-NRFANRHFSA-N 2 1 386.536 3.373 50 0 GGAAMP C[N@@H+]1CCCN(C(=O)[C@H]2CC23CC[NH+](Cc2nc4ccccc4s2)CC3)CC1 ZINC000012047948 570600419 /nfs/dbraw/zinc/60/04/19/570600419.db2.gz JYDHEGSXRIHZBU-QGZVFWFLSA-N 2 1 398.576 3.063 50 0 GGAAMP C[N@H+]1CCCN(C(=O)[C@H]2CC23CC[NH+](Cc2nc4ccccc4s2)CC3)CC1 ZINC000012047948 570600420 /nfs/dbraw/zinc/60/04/20/570600420.db2.gz JYDHEGSXRIHZBU-QGZVFWFLSA-N 2 1 398.576 3.063 50 0 GGAAMP C[N@@H+]1CCCN(C(=O)[C@@H]2CC23CC[NH+](Cc2nc4ccccc4s2)CC3)CC1 ZINC000012047946 570600451 /nfs/dbraw/zinc/60/04/51/570600451.db2.gz JYDHEGSXRIHZBU-KRWDZBQOSA-N 2 1 398.576 3.063 50 0 GGAAMP C[N@H+]1CCCN(C(=O)[C@@H]2CC23CC[NH+](Cc2nc4ccccc4s2)CC3)CC1 ZINC000012047946 570600452 /nfs/dbraw/zinc/60/04/52/570600452.db2.gz JYDHEGSXRIHZBU-KRWDZBQOSA-N 2 1 398.576 3.063 50 0 GGAAMP C[NH+](C[C@H](O)COc1cccc(C[N@@H+](C)Cc2cnccn2)c1)C1CCCCC1 ZINC000012072495 570603965 /nfs/dbraw/zinc/60/39/65/570603965.db2.gz RCSPGTRTDZEDIG-QFIPXVFZSA-N 2 1 398.551 3.113 50 0 GGAAMP C[NH+](C[C@H](O)COc1cccc(C[N@H+](C)Cc2cnccn2)c1)C1CCCCC1 ZINC000012072495 570603970 /nfs/dbraw/zinc/60/39/70/570603970.db2.gz RCSPGTRTDZEDIG-QFIPXVFZSA-N 2 1 398.551 3.113 50 0 GGAAMP C[NH+](Cc1cccc(OC[C@@H](O)C[N@H+](C)C2CCCCC2)c1)Cc1cnccn1 ZINC000012072495 570603973 /nfs/dbraw/zinc/60/39/73/570603973.db2.gz RCSPGTRTDZEDIG-QFIPXVFZSA-N 2 1 398.551 3.113 50 0 GGAAMP C[NH+](Cc1cccc(OC[C@@H](O)C[N@@H+](C)C2CCCCC2)c1)Cc1cnccn1 ZINC000012072495 570603978 /nfs/dbraw/zinc/60/39/78/570603978.db2.gz RCSPGTRTDZEDIG-QFIPXVFZSA-N 2 1 398.551 3.113 50 0 GGAAMP COCC[NH+]1CCC(C[N@H+](Cc2cc(CC(C)C)n[nH]2)Cc2ccncc2)CC1 ZINC000012301085 570635756 /nfs/dbraw/zinc/63/57/56/570635756.db2.gz HIIJJFXCNFVEKW-UHFFFAOYSA-N 2 1 399.583 3.364 50 0 GGAAMP COCC[NH+]1CCC(C[N@@H+](Cc2cc(CC(C)C)n[nH]2)Cc2ccncc2)CC1 ZINC000012301085 570635758 /nfs/dbraw/zinc/63/57/58/570635758.db2.gz HIIJJFXCNFVEKW-UHFFFAOYSA-N 2 1 399.583 3.364 50 0 GGAAMP COc1ccc(C[NH2+]C2CCC2)cc1OC[C@H](O)C[N@@H+](C)Cc1ccccc1 ZINC000012442702 570664957 /nfs/dbraw/zinc/66/49/57/570664957.db2.gz JRKGCYZJKOFRML-OAQYLSRUSA-N 2 1 384.520 3.209 50 0 GGAAMP COc1ccc(C[NH2+]C2CCC2)cc1OC[C@@H](O)C[N@@H+](C)Cc1ccccc1 ZINC000012442700 570665061 /nfs/dbraw/zinc/66/50/61/570665061.db2.gz JRKGCYZJKOFRML-NRFANRHFSA-N 2 1 384.520 3.209 50 0 GGAAMP CCOCCC[NH2+]Cc1ccc(OC[C@H](O)C[N@@H+](C)Cc2ccccc2)cc1 ZINC000012457981 570669681 /nfs/dbraw/zinc/66/96/81/570669681.db2.gz VONAYUUDUFKBMZ-JOCHJYFZSA-N 2 1 386.536 3.075 50 0 GGAAMP COc1cc(C[NH2+]Cc2ccc(C)s2)ccc1OC[C@H](O)C[N@@H+](C)C(C)C ZINC000012477969 570674147 /nfs/dbraw/zinc/67/41/47/570674147.db2.gz OSYWHXWFYYHYNA-GOSISDBHSA-N 2 1 392.565 3.435 50 0 GGAAMP COCC[NH+]1CCC(C[N@@H+](Cc2ccncc2)Cc2cccc3c2OCO3)CC1 ZINC000055245223 570688842 /nfs/dbraw/zinc/68/88/42/570688842.db2.gz KJFAZQSAPBPOOW-UHFFFAOYSA-N 2 1 397.519 3.171 50 0 GGAAMP COc1ccc(C[N@@H+](C)CCC(C)C)cc1OC[C@@H](O)C[NH+]1CCCCC1 ZINC000012713867 570703703 /nfs/dbraw/zinc/70/37/03/570703703.db2.gz AXKWOBOLDZIHLP-FQEVSTJZSA-N 2 1 378.557 3.399 50 0 GGAAMP COc1ccc(C(=O)NCCC[N@H+](C)CCC[NH+](C)Cc2ccccc2)cc1 ZINC000059181906 570736879 /nfs/dbraw/zinc/73/68/79/570736879.db2.gz PWWWODXDZIFLEF-UHFFFAOYSA-N 2 1 383.536 3.269 50 0 GGAAMP COc1ccc(C(=O)NCCC[N@@H+](C)CCC[NH+](C)Cc2ccccc2)cc1 ZINC000059181906 570736884 /nfs/dbraw/zinc/73/68/84/570736884.db2.gz PWWWODXDZIFLEF-UHFFFAOYSA-N 2 1 383.536 3.269 50 0 GGAAMP COc1ccc(C(=O)NCCC[NH+](C)CCC[N@H+](C)Cc2ccccc2)cc1 ZINC000059181906 570736887 /nfs/dbraw/zinc/73/68/87/570736887.db2.gz PWWWODXDZIFLEF-UHFFFAOYSA-N 2 1 383.536 3.269 50 0 GGAAMP COc1ccc(C(=O)NCCC[NH+](C)CCC[N@@H+](C)Cc2ccccc2)cc1 ZINC000059181906 570736890 /nfs/dbraw/zinc/73/68/90/570736890.db2.gz PWWWODXDZIFLEF-UHFFFAOYSA-N 2 1 383.536 3.269 50 0 GGAAMP Cc1nn(-c2ccccc2)c(Cl)c1C[NH+]1CCC2(CC1)C[N@H+](C)CCN2C ZINC000067790310 570791318 /nfs/dbraw/zinc/79/13/18/570791318.db2.gz MKBDEBBTXPQNSB-UHFFFAOYSA-N 2 1 387.959 3.046 50 0 GGAAMP CCC1(NC(=O)[C@@H]2CCC[N@@H+](C3CC[NH+](CCc4ccccc4)CC3)C2)CC1 ZINC000071721643 570844121 /nfs/dbraw/zinc/84/41/21/570844121.db2.gz FFGCAVAKGSDHJG-OAQYLSRUSA-N 2 1 383.580 3.464 50 0 GGAAMP CCC1(NC(=O)[C@@H]2CCC[N@H+](C3CC[NH+](CCc4ccccc4)CC3)C2)CC1 ZINC000071721643 570844125 /nfs/dbraw/zinc/84/41/25/570844125.db2.gz FFGCAVAKGSDHJG-OAQYLSRUSA-N 2 1 383.580 3.464 50 0 GGAAMP CCCN(C)C(=O)[C@@H]1CCC[N@H+](C2CC[NH+](C3Cc4ccccc4C3)CC2)C1 ZINC000071721463 570844172 /nfs/dbraw/zinc/84/41/72/570844172.db2.gz YKAMYWXCEPFAOI-OAQYLSRUSA-N 2 1 383.580 3.199 50 0 GGAAMP O=C(NC1CC=CC1)[C@@H]1CCC[N@@H+](C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000071753628 570848148 /nfs/dbraw/zinc/84/81/48/570848148.db2.gz FUNCIGVBSACCKT-OAQYLSRUSA-N 2 1 381.564 3.240 50 0 GGAAMP O=C(NC1CC=CC1)[C@@H]1CCC[N@H+](C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000071753628 570848150 /nfs/dbraw/zinc/84/81/50/570848150.db2.gz FUNCIGVBSACCKT-OAQYLSRUSA-N 2 1 381.564 3.240 50 0 GGAAMP O=C(NCc1ccoc1)[C@H]1CCC[N@@H+](C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000071761453 570849760 /nfs/dbraw/zinc/84/97/60/570849760.db2.gz PWUYAMKZLDIFCD-QFIPXVFZSA-N 2 1 395.547 3.315 50 0 GGAAMP O=C(NCc1ccoc1)[C@H]1CCC[N@H+](C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000071761453 570849762 /nfs/dbraw/zinc/84/97/62/570849762.db2.gz PWUYAMKZLDIFCD-QFIPXVFZSA-N 2 1 395.547 3.315 50 0 GGAAMP CC(C)=CCC[NH+]1CCC([N@H+]2CCC[C@@H](C(=O)NCc3cccnc3)C2)CC1 ZINC000071763865 570850781 /nfs/dbraw/zinc/85/07/81/570850781.db2.gz KSUUNHQQWAPISX-OAQYLSRUSA-N 2 1 384.568 3.231 50 0 GGAAMP CCN(C(=O)[C@H]1CCC[N@H+](C2CC[NH+](C3Cc4ccccc4C3)CC2)C1)C1CC1 ZINC000071776931 570853403 /nfs/dbraw/zinc/85/34/03/570853403.db2.gz YHHMSOARZQCYNN-NRFANRHFSA-N 2 1 395.591 3.341 50 0 GGAAMP O=C(c1ccccc1[C@@H]1CC[NH2+]C1)N1CCC[N@H+](C2Cc3ccccc3C2)CC1 ZINC000072171359 570877478 /nfs/dbraw/zinc/87/74/78/570877478.db2.gz KUXQJUXSQIIICU-OAQYLSRUSA-N 2 1 389.543 3.079 50 0 GGAAMP Cc1cc(C(=O)N2CCC[C@@H]([N@@H+](C)CCC[NH+](C)C)C2)c2ccc(F)cc2n1 ZINC000072173725 570877556 /nfs/dbraw/zinc/87/75/56/570877556.db2.gz UNXBHIPNMMHKCI-GOSISDBHSA-N 2 1 386.515 3.170 50 0 GGAAMP Cc1cc(C(=O)N2CCC[C@@H]([N@H+](C)CCC[NH+](C)C)C2)c2ccc(F)cc2n1 ZINC000072173725 570877557 /nfs/dbraw/zinc/87/75/57/570877557.db2.gz UNXBHIPNMMHKCI-GOSISDBHSA-N 2 1 386.515 3.170 50 0 GGAAMP Cc1cc(C(=O)N2CCC[C@H]([N@@H+](C)CCC[NH+](C)C)C2)c2ccc(F)cc2n1 ZINC000072173724 570877578 /nfs/dbraw/zinc/87/75/78/570877578.db2.gz UNXBHIPNMMHKCI-SFHVURJKSA-N 2 1 386.515 3.170 50 0 GGAAMP Cc1cc(C(=O)N2CCC[C@H]([N@H+](C)CCC[NH+](C)C)C2)c2ccc(F)cc2n1 ZINC000072173724 570877579 /nfs/dbraw/zinc/87/75/79/570877579.db2.gz UNXBHIPNMMHKCI-SFHVURJKSA-N 2 1 386.515 3.170 50 0 GGAAMP COCC[N@@H+]1CCC[C@]2(CC[NH+](Cc3ccc(Oc4ncccn4)cc3)C2)C1 ZINC000055244040 1406910994 /nfs/dbraw/zinc/91/09/94/1406910994.db2.gz NGRXJRWJKHOGHZ-QFIPXVFZSA-N 2 1 382.508 3.203 50 0 GGAAMP COCC[N@H+]1CCC[C@]2(CC[NH+](Cc3ccc(Oc4ncccn4)cc3)C2)C1 ZINC000055244040 1406911001 /nfs/dbraw/zinc/91/10/01/1406911001.db2.gz NGRXJRWJKHOGHZ-QFIPXVFZSA-N 2 1 382.508 3.203 50 0 GGAAMP COCC[NH+]1CCC[C@]2(CC[N@H+](Cc3ccc(Oc4ncccn4)cc3)C2)C1 ZINC000055244040 1406911005 /nfs/dbraw/zinc/91/10/05/1406911005.db2.gz NGRXJRWJKHOGHZ-QFIPXVFZSA-N 2 1 382.508 3.203 50 0 GGAAMP COCC[NH+]1CCC[C@]2(CC[N@@H+](Cc3ccc(Oc4ncccn4)cc3)C2)C1 ZINC000055244040 1406911012 /nfs/dbraw/zinc/91/10/12/1406911012.db2.gz NGRXJRWJKHOGHZ-QFIPXVFZSA-N 2 1 382.508 3.203 50 0 GGAAMP CCn1nc(C)c(C[N@H+](Cc2ccncc2)CC2CC[NH+](CCOC)CC2)c1C ZINC000011668030 1399003718 /nfs/dbraw/zinc/00/37/18/1399003718.db2.gz WTLWLTTYPGDFFM-UHFFFAOYSA-N 2 1 399.583 3.275 50 0 GGAAMP COc1ccc(C[NH2+]C(C2CC2)C2CC2)cc1OC[C@H](O)C[N@@H+](C)C(C)C ZINC000011841483 1399015012 /nfs/dbraw/zinc/01/50/12/1399015012.db2.gz ASPAEZAFQQWRFS-LJQANCHMSA-N 2 1 376.541 3.053 50 0 GGAAMP COc1cc(C[NH2+]CC2CCCCC2)ccc1OC[C@@H](O)C[N@@H+](C)C(C)C ZINC000011999005 1399023171 /nfs/dbraw/zinc/02/31/71/1399023171.db2.gz WBVAKMHCTZBMPR-FQEVSTJZSA-N 2 1 378.557 3.445 50 0 GGAAMP CC(=O)CCC(=O)N(CC[NH+]1CCCCC1)C[C@@H]1CCC[N@H+](C2CCCC2)C1 ZINC000012074969 1399027224 /nfs/dbraw/zinc/02/72/24/1399027224.db2.gz DZRZZEWYPCEMST-OAQYLSRUSA-N 2 1 391.600 3.325 50 0 GGAAMP COCC[N@H+]1CCC[C@]2(CC[NH+](Cc3cccc(-n4nc(C)cc4C)c3)C2)C1 ZINC000012073376 1399027450 /nfs/dbraw/zinc/02/74/50/1399027450.db2.gz RZCRLUOXDCEXDT-QHCPKHFHSA-N 2 1 382.552 3.423 50 0 GGAAMP COCC[NH+]1CCC[C@]2(CC[N@H+](Cc3cccc(-n4nc(C)cc4C)c3)C2)C1 ZINC000012073376 1399027453 /nfs/dbraw/zinc/02/74/53/1399027453.db2.gz RZCRLUOXDCEXDT-QHCPKHFHSA-N 2 1 382.552 3.423 50 0 GGAAMP COCC[NH+]1CCC[C@]2(CC[N@@H+](Cc3cccc(-n4nc(C)cc4C)c3)C2)C1 ZINC000012073376 1399027455 /nfs/dbraw/zinc/02/74/55/1399027455.db2.gz RZCRLUOXDCEXDT-QHCPKHFHSA-N 2 1 382.552 3.423 50 0 GGAAMP OCc1ccc(C[N@@H+](C[C@H]2CCCO2)CC2CC[NH+](C3CCCC3)CC2)o1 ZINC000012298669 1399036618 /nfs/dbraw/zinc/03/66/18/1399036618.db2.gz NZFDUYQVLLQNIT-HXUWFJFHSA-N 2 1 376.541 3.408 50 0 GGAAMP O=C(NCc1cccnc1)[C@H]1CCC[N@H+](C2CC[NH+](CC3CCCC3)CC2)C1 ZINC000012435127 1399042346 /nfs/dbraw/zinc/04/23/46/1399042346.db2.gz XSSSUXWDTAAYFO-NRFANRHFSA-N 2 1 384.568 3.064 50 0 GGAAMP C[NH+](C[C@@H](O)COc1cccc(C[N@H+](C)Cc2ccno2)c1)C1CCCCC1 ZINC000012459042 1399043730 /nfs/dbraw/zinc/04/37/30/1399043730.db2.gz LWHQZFGCLNXUCZ-HXUWFJFHSA-N 2 1 387.524 3.311 50 0 GGAAMP C[NH+](C[C@@H](O)COc1cccc(C[N@@H+](C)Cc2ccno2)c1)C1CCCCC1 ZINC000012459042 1399043737 /nfs/dbraw/zinc/04/37/37/1399043737.db2.gz LWHQZFGCLNXUCZ-HXUWFJFHSA-N 2 1 387.524 3.311 50 0 GGAAMP C[NH+](Cc1ccno1)Cc1cccc(OC[C@H](O)C[N@H+](C)C2CCCCC2)c1 ZINC000012459042 1399043745 /nfs/dbraw/zinc/04/37/45/1399043745.db2.gz LWHQZFGCLNXUCZ-HXUWFJFHSA-N 2 1 387.524 3.311 50 0 GGAAMP C[NH+](Cc1ccno1)Cc1cccc(OC[C@H](O)C[N@@H+](C)C2CCCCC2)c1 ZINC000012459042 1399043751 /nfs/dbraw/zinc/04/37/51/1399043751.db2.gz LWHQZFGCLNXUCZ-HXUWFJFHSA-N 2 1 387.524 3.311 50 0 GGAAMP C[NH+](C[C@H](O)COc1cccc(C[N@H+](C)Cc2ccno2)c1)C1CCCCC1 ZINC000012459040 1399043927 /nfs/dbraw/zinc/04/39/27/1399043927.db2.gz LWHQZFGCLNXUCZ-FQEVSTJZSA-N 2 1 387.524 3.311 50 0 GGAAMP C[NH+](C[C@H](O)COc1cccc(C[N@@H+](C)Cc2ccno2)c1)C1CCCCC1 ZINC000012459040 1399043930 /nfs/dbraw/zinc/04/39/30/1399043930.db2.gz LWHQZFGCLNXUCZ-FQEVSTJZSA-N 2 1 387.524 3.311 50 0 GGAAMP C[NH+](Cc1ccno1)Cc1cccc(OC[C@@H](O)C[N@H+](C)C2CCCCC2)c1 ZINC000012459040 1399043932 /nfs/dbraw/zinc/04/39/32/1399043932.db2.gz LWHQZFGCLNXUCZ-FQEVSTJZSA-N 2 1 387.524 3.311 50 0 GGAAMP C[NH+](Cc1ccno1)Cc1cccc(OC[C@@H](O)C[N@@H+](C)C2CCCCC2)c1 ZINC000012459040 1399043941 /nfs/dbraw/zinc/04/39/41/1399043941.db2.gz LWHQZFGCLNXUCZ-FQEVSTJZSA-N 2 1 387.524 3.311 50 0 GGAAMP CC[NH+]1CCN(C(=O)CCC2CC[NH+](C/C=C/c3ccc(OC)cc3)CC2)CC1 ZINC000012580449 1399048166 /nfs/dbraw/zinc/04/81/66/1399048166.db2.gz UARCYFPRMGONJN-SNAWJCMRSA-N 2 1 399.579 3.365 50 0 GGAAMP CCOc1ccccc1C[N@@H+](C[C@@H]1CCCO1)CC1CC[NH+](CCOC)CC1 ZINC000012576749 1399048256 /nfs/dbraw/zinc/04/82/56/1399048256.db2.gz IDRQWFLOSMKSLS-QFIPXVFZSA-N 2 1 390.568 3.425 50 0 GGAAMP CC[NH+]1CCN(C(=O)CCC2CC[NH+](Cc3cccc4cnccc43)CC2)CC1 ZINC000012709911 1399054538 /nfs/dbraw/zinc/05/45/38/1399054538.db2.gz WKGDBVPIDAYWBM-UHFFFAOYSA-N 2 1 394.563 3.391 50 0 GGAAMP O=C(CCC1CC[NH+](C2CCOCC2)CC1)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000012763970 1399058338 /nfs/dbraw/zinc/05/83/38/1399058338.db2.gz RXERCABXMSOEOB-JOCHJYFZSA-N 2 1 399.579 3.048 50 0 GGAAMP COCC[N@H+]1CCC[C@@]2(CC[NH+](Cc3cc(C)cc(C)c3-n3cccn3)C2)C1 ZINC000014949658 1399128750 /nfs/dbraw/zinc/12/87/50/1399128750.db2.gz YOMGRXDKZMLKIY-HSZRJFAPSA-N 2 1 382.552 3.423 50 0 GGAAMP COCC[NH+]1CCC[C@@]2(CC[N@H+](Cc3cc(C)cc(C)c3-n3cccn3)C2)C1 ZINC000014949658 1399128753 /nfs/dbraw/zinc/12/87/53/1399128753.db2.gz YOMGRXDKZMLKIY-HSZRJFAPSA-N 2 1 382.552 3.423 50 0 GGAAMP COCC[NH+]1CCC[C@@]2(CC[N@@H+](Cc3cc(C)cc(C)c3-n3cccn3)C2)C1 ZINC000014949658 1399128756 /nfs/dbraw/zinc/12/87/56/1399128756.db2.gz YOMGRXDKZMLKIY-HSZRJFAPSA-N 2 1 382.552 3.423 50 0 GGAAMP CCN(CC1CC[NH+](C2CC[NH+](C)CC2)CC1)C(=O)C1(c2ccccc2)CC1 ZINC000019301074 1399329259 /nfs/dbraw/zinc/32/92/59/1399329259.db2.gz UAKIMILPUOGARZ-UHFFFAOYSA-N 2 1 383.580 3.373 50 0 GGAAMP COCC[N@@H+](CCCn1cccn1)C[C@@H]1CCC[NH+](C2Cc3ccccc3C2)C1 ZINC000020450967 1399346439 /nfs/dbraw/zinc/34/64/39/1399346439.db2.gz VXYLPTATPZOSOA-NRFANRHFSA-N 2 1 396.579 3.101 50 0 GGAAMP COCC[NH+](CCCn1cccn1)C[C@@H]1CCC[N@@H+](C2Cc3ccccc3C2)C1 ZINC000020450967 1399346443 /nfs/dbraw/zinc/34/64/43/1399346443.db2.gz VXYLPTATPZOSOA-NRFANRHFSA-N 2 1 396.579 3.101 50 0 GGAAMP COCC[NH+](CCCn1cccn1)C[C@@H]1CCC[N@H+](C2Cc3ccccc3C2)C1 ZINC000020450967 1399346448 /nfs/dbraw/zinc/34/64/48/1399346448.db2.gz VXYLPTATPZOSOA-NRFANRHFSA-N 2 1 396.579 3.101 50 0 GGAAMP O=C(NCC1([NH+]2CCOCC2)CCCCC1)c1ccc(C[NH+]2CCCCC2)cc1 ZINC000022411183 1399461542 /nfs/dbraw/zinc/46/15/42/1399461542.db2.gz PYCMBSQFCCQGRY-UHFFFAOYSA-N 2 1 399.579 3.437 50 0 GGAAMP COCC[N@H+](Cc1ccccn1)CC1CC[NH+](Cc2ccccc2OC)CC1 ZINC000067846669 1409243519 /nfs/dbraw/zinc/24/35/19/1409243519.db2.gz OJEJMFNHSLHMRZ-UHFFFAOYSA-N 2 1 383.536 3.451 50 0 GGAAMP Cc1[nH+]ccn1CCN(C)C(=O)NC[C@H](c1ccccc1)[NH+]1CCCCCC1 ZINC000426373890 231209867 /nfs/dbraw/zinc/20/98/67/231209867.db2.gz YIBGMVRFLWLLAI-OAQYLSRUSA-N 2 1 383.540 3.450 50 0 GGAAMP Cc1[nH+]ccn1CCN(C)C(=O)NC[C@@H](c1ccccc1)[NH+]1CCCCCC1 ZINC000426373889 231210209 /nfs/dbraw/zinc/21/02/09/231210209.db2.gz YIBGMVRFLWLLAI-NRFANRHFSA-N 2 1 383.540 3.450 50 0 GGAAMP CN(C(=O)c1cccc(-c2ccccc2OCC[NH+](C)C)c1)[C@H]1CC[N@@H+](C)C1 ZINC000426668519 231251014 /nfs/dbraw/zinc/25/10/14/231251014.db2.gz ZGZFAMYNZMHKOI-FQEVSTJZSA-N 2 1 381.520 3.070 50 0 GGAAMP Cc1c[nH+]ccc1N1CCCN(C(=O)NCC[C@H]2CCCC[N@@H+]2C(C)C)CC1 ZINC000426669129 231252383 /nfs/dbraw/zinc/25/23/83/231252383.db2.gz ONJWOPUGXLBWDW-HXUWFJFHSA-N 2 1 387.572 3.265 50 0 GGAAMP CSCCC[NH+]1CCC([N@@H+]2CCC[C@H](C(=O)NCc3ccccc3)C2)CC1 ZINC000019301024 210240599 /nfs/dbraw/zinc/24/05/99/210240599.db2.gz KVOIFPGYQSIIOO-FQEVSTJZSA-N 2 1 389.609 3.232 50 0 GGAAMP CSCCC[NH+]1CCC([N@H+]2CCC[C@H](C(=O)NCc3ccccc3)C2)CC1 ZINC000019301024 210240604 /nfs/dbraw/zinc/24/06/04/210240604.db2.gz KVOIFPGYQSIIOO-FQEVSTJZSA-N 2 1 389.609 3.232 50 0 GGAAMP CSCCC[NH+]1CCC([N@@H+]2CCC[C@@H](C(=O)NCc3ccccc3)C2)CC1 ZINC000019301023 210240151 /nfs/dbraw/zinc/24/01/51/210240151.db2.gz KVOIFPGYQSIIOO-HXUWFJFHSA-N 2 1 389.609 3.232 50 0 GGAAMP CSCCC[NH+]1CCC([N@H+]2CCC[C@@H](C(=O)NCc3ccccc3)C2)CC1 ZINC000019301023 210240153 /nfs/dbraw/zinc/24/01/53/210240153.db2.gz KVOIFPGYQSIIOO-HXUWFJFHSA-N 2 1 389.609 3.232 50 0 GGAAMP CNc1nc(N2CC[C@]3(C2)CCC[N@@H+](CCCc2ccccc2)C3)cc(C)[nH+]1 ZINC000426669012 529836310 /nfs/dbraw/zinc/83/63/10/529836310.db2.gz LUAHGWHBEPMSSM-HSZRJFAPSA-N 2 1 379.552 3.174 50 0 GGAAMP COCC[NH+]1CCC(C[N@H+](C)Cc2nc(-c3cccc(Cl)c3)no2)CC1 ZINC000015073183 210149778 /nfs/dbraw/zinc/14/97/78/210149778.db2.gz RLGVGRMZDWIAQX-UHFFFAOYSA-N 2 1 378.904 3.180 50 0 GGAAMP COCC[NH+]1CCC(C[N@@H+](C)Cc2nc(-c3cccc(Cl)c3)no2)CC1 ZINC000015073183 210149782 /nfs/dbraw/zinc/14/97/82/210149782.db2.gz RLGVGRMZDWIAQX-UHFFFAOYSA-N 2 1 378.904 3.180 50 0 GGAAMP CC[N@H+]1CCC[C@H]1CNC(=O)CCC1CC[NH+](C2Cc3ccccc3C2)CC1 ZINC000015062848 210144835 /nfs/dbraw/zinc/14/48/35/210144835.db2.gz OMMHGMZLDDVMPJ-QFIPXVFZSA-N 2 1 383.580 3.247 50 0 GGAAMP CCN(CC1CC[NH+](C2CC[NH+](C)CC2)CC1)C(=O)CCc1scnc1C ZINC000014958428 210133061 /nfs/dbraw/zinc/13/30/61/210133061.db2.gz VLWHXKOXNUVALG-UHFFFAOYSA-N 2 1 392.613 3.039 50 0 GGAAMP COc1ccc(C[N@H+]2CCc3ccccc3C2)cc1OC[C@H](O)C[NH+](C)C(C)C ZINC000014948027 210132203 /nfs/dbraw/zinc/13/22/03/210132203.db2.gz YVPWTPUYGUCKGW-JOCHJYFZSA-N 2 1 398.547 3.333 50 0 GGAAMP COc1ccc(C[NH+]2CCc3ccccc3C2)cc1OC[C@H](O)C[N@H+](C)C(C)C ZINC000014948027 210132206 /nfs/dbraw/zinc/13/22/06/210132206.db2.gz YVPWTPUYGUCKGW-JOCHJYFZSA-N 2 1 398.547 3.333 50 0 GGAAMP COc1ccc(C[NH+]2CCc3ccccc3C2)cc1OC[C@H](O)C[N@@H+](C)C(C)C ZINC000014948027 210132210 /nfs/dbraw/zinc/13/22/10/210132210.db2.gz YVPWTPUYGUCKGW-JOCHJYFZSA-N 2 1 398.547 3.333 50 0 GGAAMP CN(CC1CC[NH+](CCc2ccc(F)cc2)CC1)C(=O)[C@@H]1CCCC[N@H+]1C ZINC000012836609 210016124 /nfs/dbraw/zinc/01/61/24/210016124.db2.gz WEPQMVHOJBQJQP-NRFANRHFSA-N 2 1 375.532 3.023 50 0 GGAAMP CCN(CC1CC[NH+](C2CC[NH+](C)CC2)CC1)C(=O)Cc1ccccc1F ZINC000012756547 210003947 /nfs/dbraw/zinc/00/39/47/210003947.db2.gz ZDVWKXCLFXCSCJ-UHFFFAOYSA-N 2 1 375.532 3.023 50 0 GGAAMP Cc1cc(C)c(C[N@@H+]2CCN(C3CC[NH+](C(C)C)CC3)[C@H](CCO)C2)cc1C ZINC000039400236 212041460 /nfs/dbraw/zinc/04/14/60/212041460.db2.gz HBENQHRSJBYMBA-XMMPIXPASA-N 2 1 387.612 3.353 50 0 GGAAMP COc1ccc(/C=C/C[N@@H+]2CCOc3ccc([C@@](C)(O)C[NH+](C)C)cc3C2)cc1 ZINC000299788664 212038383 /nfs/dbraw/zinc/03/83/83/212038383.db2.gz WDGOVDRINLHFSG-ZFTMLNQLSA-N 2 1 396.531 3.372 50 0 GGAAMP COc1ccc(/C=C/C[N@H+]2CCOc3ccc([C@@](C)(O)C[NH+](C)C)cc3C2)cc1 ZINC000299788664 212038387 /nfs/dbraw/zinc/03/83/87/212038387.db2.gz WDGOVDRINLHFSG-ZFTMLNQLSA-N 2 1 396.531 3.372 50 0 GGAAMP CC(C)(C)C[N@H+]1CCN(Cc2ccc(C[NH+]3CCCC3)s2)C[C@@H]1CCO ZINC000023358483 209174638 /nfs/dbraw/zinc/17/46/38/209174638.db2.gz RTVIDEQEWKEZPF-SFHVURJKSA-N 2 1 379.614 3.259 50 0 GGAAMP COc1cc(C[N@H+]2CCC3(CC[NH+](CC4CC4)CC3)[C@@H](CO)C2)ccc1F ZINC000097217675 211361789 /nfs/dbraw/zinc/36/17/89/211361789.db2.gz QENFQFYHALZWJG-LJQANCHMSA-N 2 1 376.516 3.141 50 0 GGAAMP O[C@@H](COc1cccc(C[NH+]2CCCCC2)c1)C[N@H+]1CCc2ccccc2C1 ZINC000095518298 211263870 /nfs/dbraw/zinc/26/38/70/211263870.db2.gz SVIVRWZGPFZWJD-HSZRJFAPSA-N 2 1 380.532 3.471 50 0 GGAAMP C[N@@H+](Cc1ccccc1)C[C@H](O)COc1ccc(C[NH+]2CCOC(C)(C)C2)cc1 ZINC000095531270 211274986 /nfs/dbraw/zinc/27/49/86/211274986.db2.gz XDKDXRGTQZWGDM-QFIPXVFZSA-N 2 1 398.547 3.169 50 0 GGAAMP C[N@H+](Cc1ccccc1)C[C@H](O)COc1ccc(C[NH+]2CCOC(C)(C)C2)cc1 ZINC000095531270 211274988 /nfs/dbraw/zinc/27/49/88/211274988.db2.gz XDKDXRGTQZWGDM-QFIPXVFZSA-N 2 1 398.547 3.169 50 0 GGAAMP C[NH+](Cc1ccccc1)C[C@H](O)COc1ccc(C[N@@H+]2CCOC(C)(C)C2)cc1 ZINC000095531270 211274992 /nfs/dbraw/zinc/27/49/92/211274992.db2.gz XDKDXRGTQZWGDM-QFIPXVFZSA-N 2 1 398.547 3.169 50 0 GGAAMP C[NH+](Cc1ccccc1)C[C@H](O)COc1ccc(C[N@H+]2CCOC(C)(C)C2)cc1 ZINC000095531270 211274994 /nfs/dbraw/zinc/27/49/94/211274994.db2.gz XDKDXRGTQZWGDM-QFIPXVFZSA-N 2 1 398.547 3.169 50 0 GGAAMP C[NH+](C)CCN(C[C@@H]1CCC[N@@H+](Cc2ccccc2F)C1)C(=O)C1(C)CC1 ZINC000095525885 211273171 /nfs/dbraw/zinc/27/31/71/211273171.db2.gz CYBAXNJYZAIJEY-GOSISDBHSA-N 2 1 375.532 3.228 50 0 GGAAMP COCC[N@@H+](C)Cc1cc(Cl)ccc1OC[C@H](O)C[NH+]1CCCCCC1 ZINC000095524508 211271117 /nfs/dbraw/zinc/27/11/17/211271117.db2.gz WSQUNZUCOMBUJB-LJQANCHMSA-N 2 1 384.948 3.034 50 0 GGAAMP C[NH+](C)CCN(C[C@@H]1CCC[N@@H+](Cc2ccccc2F)C1)C(=O)c1ccncc1 ZINC000095524327 211270530 /nfs/dbraw/zinc/27/05/30/211270530.db2.gz LTFVQNBSABDWJY-LJQANCHMSA-N 2 1 398.526 3.137 50 0 GGAAMP O[C@H](COc1ccc(C[NH+]2CCC(F)CC2)cc1)C[N@H+]1CCc2ccccc2C1 ZINC000095524958 211269605 /nfs/dbraw/zinc/26/96/05/211269605.db2.gz GRTYHVFBFYVOAK-QHCPKHFHSA-N 2 1 398.522 3.419 50 0 GGAAMP O=C(c1ccnnc1)N(CC[NH+]1CCCCC1)C[C@H]1CCC[N@H+](C2CCCC2)C1 ZINC000095521783 211267877 /nfs/dbraw/zinc/26/78/77/211267877.db2.gz LBHPFENRFBPOSI-FQEVSTJZSA-N 2 1 399.583 3.059 50 0 GGAAMP COc1ccc(C[N@H+](C)Cc2ccco2)cc1OC[C@@H](O)C[NH+]1CCCCC1 ZINC000095497753 211251761 /nfs/dbraw/zinc/25/17/61/211251761.db2.gz JNDBMLFYODPMQN-IBGZPJMESA-N 2 1 388.508 3.146 50 0 GGAAMP COc1ccc(C[N@@H+](C)Cc2ccco2)cc1OC[C@@H](O)C[NH+]1CCCCC1 ZINC000095497753 211251766 /nfs/dbraw/zinc/25/17/66/211251766.db2.gz JNDBMLFYODPMQN-IBGZPJMESA-N 2 1 388.508 3.146 50 0 GGAAMP CC[NH+](CC)C[C@H](O)COc1ccc(C[NH+]2CCC(F)(F)CC2)cc1OC ZINC000095496563 211250824 /nfs/dbraw/zinc/25/08/24/211250824.db2.gz XQLJIEXPOAKTDX-KRWDZBQOSA-N 2 1 386.483 3.008 50 0 GGAAMP COc1cc(C[NH+]2CCCCC23CC3)ccc1OC[C@@H](O)C[N@@H+](C)C(C)C ZINC000095510124 211259288 /nfs/dbraw/zinc/25/92/88/211259288.db2.gz HUTUNGWAKIPOQB-IBGZPJMESA-N 2 1 376.541 3.294 50 0 GGAAMP COc1cc(C[N@H+]2CCCCC23CC3)ccc1OC[C@@H](O)C[NH+](C)C(C)C ZINC000095510124 211259279 /nfs/dbraw/zinc/25/92/79/211259279.db2.gz HUTUNGWAKIPOQB-IBGZPJMESA-N 2 1 376.541 3.294 50 0 GGAAMP COc1cc(C[NH+]2CCCCC23CC3)ccc1OC[C@@H](O)C[N@H+](C)C(C)C ZINC000095510124 211259284 /nfs/dbraw/zinc/25/92/84/211259284.db2.gz HUTUNGWAKIPOQB-IBGZPJMESA-N 2 1 376.541 3.294 50 0 GGAAMP COc1ccc(C[N@H+]2CCc3ccccc3C2)cc1OC[C@@H](O)C[NH+]1CCCC1 ZINC000095507597 211258268 /nfs/dbraw/zinc/25/82/68/211258268.db2.gz WKYUTFKGCFDQNT-QFIPXVFZSA-N 2 1 396.531 3.089 50 0 GGAAMP COc1ccc(C[N@H+]2CCC3(CCCC3)C2)cc1OC[C@@H](O)C[NH+]1CCCC1 ZINC000095506157 211258285 /nfs/dbraw/zinc/25/82/85/211258285.db2.gz LWMGHJXZHCQIEC-FQEVSTJZSA-N 2 1 388.552 3.297 50 0 GGAAMP C[NH+](C)CCN(C[C@@H]1CCC[N@@H+](Cc2ccccc2F)C1)C(=O)c1ccco1 ZINC000095507698 211257131 /nfs/dbraw/zinc/25/71/31/211257131.db2.gz GCJXWBBSZKMEDT-GOSISDBHSA-N 2 1 387.499 3.335 50 0 GGAAMP Cc1[nH+]ccn1-c1ccccc1CNC(=O)[C@H]1CCC[N@H+](Cc2ccco2)C1 ZINC000095391497 211236393 /nfs/dbraw/zinc/23/63/93/211236393.db2.gz XWRSRLYHFGPKLD-IBGZPJMESA-N 2 1 378.476 3.302 50 0 GGAAMP Cc1[nH+]ccn1-c1ccccc1CNC(=O)[C@H]1CCC[N@@H+](Cc2ccco2)C1 ZINC000095391497 211236398 /nfs/dbraw/zinc/23/63/98/211236398.db2.gz XWRSRLYHFGPKLD-IBGZPJMESA-N 2 1 378.476 3.302 50 0 GGAAMP O=C1CCCN1CC[NH+]1CCC2(CC1)C[C@H](c1ccccc1)C[N@H+](C1CC1)C2 ZINC000095375399 211230546 /nfs/dbraw/zinc/23/05/46/211230546.db2.gz OXHKQURPDHUOGS-NRFANRHFSA-N 2 1 381.564 3.343 50 0 GGAAMP Cc1cc(C)c(C[NH+]2CCC(C)CC2)cc1C[N@@H+]1C[C@H](CO)[C@H](C[NH+](C)C)C1 ZINC000092027968 211213856 /nfs/dbraw/zinc/21/38/56/211213856.db2.gz JJCAMCOBVQJPKE-DNQXCXABSA-N 3 1 387.612 3.137 50 0 GGAAMP Cc1cc(C)c(C[NH+]2CCC(C)CC2)cc1C[N@H+]1C[C@H](CO)[C@H](C[NH+](C)C)C1 ZINC000092027968 211213861 /nfs/dbraw/zinc/21/38/61/211213861.db2.gz JJCAMCOBVQJPKE-DNQXCXABSA-N 3 1 387.612 3.137 50 0 GGAAMP Cc1cc(C)c(C[NH+]2CCC(C)CC2)cc1C[N@@H+]1C[C@H](CO)[C@H](CN(C)C)C1 ZINC000092027968 211213863 /nfs/dbraw/zinc/21/38/63/211213863.db2.gz JJCAMCOBVQJPKE-DNQXCXABSA-N 2 1 387.612 3.137 50 0 GGAAMP Cc1cc(C)c(C[NH+]2CCC(C)CC2)cc1C[N@H+]1C[C@H](CO)[C@H](CN(C)C)C1 ZINC000092027968 211213867 /nfs/dbraw/zinc/21/38/67/211213867.db2.gz JJCAMCOBVQJPKE-DNQXCXABSA-N 2 1 387.612 3.137 50 0 GGAAMP COCc1ncc(C[NH+]2CCC3(CC2)C[C@H](c2ccccc2)C[N@@H+](C)C3)cn1 ZINC000091657352 211201964 /nfs/dbraw/zinc/20/19/64/211201964.db2.gz BPXASQQGXYWNGX-NRFANRHFSA-N 2 1 380.536 3.325 50 0 GGAAMP CC(C)[C@@H](C(=O)N1CCC[C@H](C[NH+]2CCC(C)CC2)C1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000084699902 211174477 /nfs/dbraw/zinc/17/44/77/211174477.db2.gz BXIHDSGTNAGLAG-MBDNFAEBSA-N 2 1 393.616 3.091 50 0 GGAAMP CC(C)[C@@H](C(=O)N1CCC[C@H](C[NH+]2CCC(C)CC2)C1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000084699902 211174480 /nfs/dbraw/zinc/17/44/80/211174480.db2.gz BXIHDSGTNAGLAG-MBDNFAEBSA-N 2 1 393.616 3.091 50 0 GGAAMP Cc1[nH+]ccn1CCC[NH+]1CCC2(CN(CCc3ccccc3)C(=O)O2)CC1 ZINC000077525656 211136798 /nfs/dbraw/zinc/13/67/98/211136798.db2.gz MLRVTJCPBZICHH-UHFFFAOYSA-N 2 1 382.508 3.111 50 0 GGAAMP C[N@@H+](CCCN1CC2(CC[NH+]([C@H]3CCCOC3)CC2)OC1=O)C1CCCCC1 ZINC000072411647 211114310 /nfs/dbraw/zinc/11/43/10/211114310.db2.gz RRJZQBKPLADMAQ-FQEVSTJZSA-N 2 1 393.572 3.107 50 0 GGAAMP C[N@@H+](CCCN1CC2(CC[NH+]([C@@H]3CCCOC3)CC2)OC1=O)C1CCCCC1 ZINC000072411646 211113581 /nfs/dbraw/zinc/11/35/81/211113581.db2.gz RRJZQBKPLADMAQ-HXUWFJFHSA-N 2 1 393.572 3.107 50 0 GGAAMP COC[C@@]12CC[C@@H]([NH+]3CCOCC3)C[C@H]1CC[N@@H+](Cc1cccc(F)c1)C2 ZINC000072152410 211078747 /nfs/dbraw/zinc/07/87/47/211078747.db2.gz VKJBNUQBDBRJFA-FCEUIQTBSA-N 2 1 376.516 3.165 50 0 GGAAMP CCc1[nH+]ccn1CC(=O)N1CCC[N@H+](Cc2ccc(F)cc2)[C@H](C(C)C)C1 ZINC000071765457 211060571 /nfs/dbraw/zinc/06/05/71/211060571.db2.gz QKEIWSKJBSDPSD-FQEVSTJZSA-N 2 1 386.515 3.344 50 0 GGAAMP CCc1[nH+]ccn1CC(=O)N1CCC[N@@H+](Cc2ccc(F)cc2)[C@H](C(C)C)C1 ZINC000071765457 211060573 /nfs/dbraw/zinc/06/05/73/211060573.db2.gz QKEIWSKJBSDPSD-FQEVSTJZSA-N 2 1 386.515 3.344 50 0 GGAAMP CCOc1ccc(C[N@@H+]2CCN(C)C3(CC[NH+](C)CC3)C2)c(OCC)c1C ZINC000067975261 211030800 /nfs/dbraw/zinc/03/08/00/211030800.db2.gz OJUHWDSAQAFYBN-UHFFFAOYSA-N 2 1 375.557 3.004 50 0 GGAAMP CCOc1ccc(C[N@H+]2CCN(C)C3(CC[NH+](C)CC3)C2)c(OCC)c1C ZINC000067975261 211030805 /nfs/dbraw/zinc/03/08/05/211030805.db2.gz OJUHWDSAQAFYBN-UHFFFAOYSA-N 2 1 375.557 3.004 50 0 GGAAMP O=C(NC1CC1)[C@@H]1CCC[N@@H+](C2CC[NH+](Cc3ccnc4ccccc34)CC2)C1 ZINC000067805632 211022400 /nfs/dbraw/zinc/02/24/00/211022400.db2.gz IHPWKGNBBYEUBI-LJQANCHMSA-N 2 1 392.547 3.190 50 0 GGAAMP O=C(NC1CC1)[C@@H]1CCC[N@H+](C2CC[NH+](Cc3ccnc4ccccc34)CC2)C1 ZINC000067805632 211022403 /nfs/dbraw/zinc/02/24/03/211022403.db2.gz IHPWKGNBBYEUBI-LJQANCHMSA-N 2 1 392.547 3.190 50 0 GGAAMP CC(C)(C)NC(=O)[C@@H]1CCC[N@H+](C2CC[NH+](C3Cc4ccccc4C3)CC2)C1 ZINC000020209673 210322788 /nfs/dbraw/zinc/32/27/88/210322788.db2.gz NYANWAWWQJLGTA-HXUWFJFHSA-N 2 1 383.580 3.245 50 0 GGAAMP Cc1cc(C(F)(F)F)cc(N2CCC(Cn3cc(C(C)(C)[NH3+])nn3)CC2)[nH+]1 ZINC000020209881 210322185 /nfs/dbraw/zinc/32/21/85/210322185.db2.gz LKNDQOVDWCKQFM-UHFFFAOYSA-N 2 1 382.434 3.111 50 0 GGAAMP CCN(CC)C(=O)[C@H]1CCC[N@H+](C2CC[NH+](C3Cc4ccccc4C3)CC2)C1 ZINC000020206686 210320974 /nfs/dbraw/zinc/32/09/74/210320974.db2.gz DBAXKAUFADUOOV-NRFANRHFSA-N 2 1 383.580 3.199 50 0 GGAAMP Cc1cccc(-c2ncc(C[N@@H+]3CCC[C@@H](N(C)CCC[NH+](C)C)C3)cn2)c1 ZINC000019633743 210277431 /nfs/dbraw/zinc/27/74/31/210277431.db2.gz GCRDYFDJQTWLKJ-JOCHJYFZSA-N 2 1 381.568 3.300 50 0 GGAAMP COCC[NH+]1CCC(C[N@@H+](Cc2cnn(C(C)C)c2)Cc2ccncc2)CC1 ZINC000011821610 221129163 /nfs/dbraw/zinc/12/91/63/221129163.db2.gz PAPYYCOCUXNNLH-UHFFFAOYSA-N 2 1 385.556 3.220 50 0 GGAAMP CCC[NH+]1CCC2(CC1)CC[N@H+](C1CCN(c3ccccc3)CC1)C[C@H]2CO ZINC000097347007 136188432 /nfs/dbraw/zinc/18/84/32/136188432.db2.gz BTKRBTDWFVYHST-NRFANRHFSA-N 2 1 385.596 3.462 50 0 GGAAMP Cc1cc(C)n(-c2cccc(C[N@@H+]3CCCN(C)C4(CC[NH+](C)CC4)C3)c2)n1 ZINC000067588912 222149282 /nfs/dbraw/zinc/14/92/82/222149282.db2.gz MPUQNWZMOOTXQY-UHFFFAOYSA-N 2 1 381.568 3.091 50 0 GGAAMP CC(C)[NH+]1CCC(N2CC[N@@H+](Cc3cc4ccccc4o3)C[C@H]2CCO)CC1 ZINC000104448356 570258392 /nfs/dbraw/zinc/25/83/92/570258392.db2.gz NZPFQBMQTPPIFH-OAQYLSRUSA-N 2 1 385.552 3.174 50 0 GGAAMP CSc1cccc(C[N@@H+]2CCN(C3CC[NH+](C(C)C)CC3)[C@H](CCO)C2)c1 ZINC000104476353 570259367 /nfs/dbraw/zinc/25/93/67/570259367.db2.gz AHWZDAZJYKFEJA-OAQYLSRUSA-N 2 1 391.625 3.150 50 0 GGAAMP CSc1cccc(C[N@H+]2CCN(C3CC[NH+](C(C)C)CC3)[C@H](CCO)C2)c1 ZINC000104476353 570259369 /nfs/dbraw/zinc/25/93/69/570259369.db2.gz AHWZDAZJYKFEJA-OAQYLSRUSA-N 2 1 391.625 3.150 50 0 GGAAMP C[N@@H+](Cc1cccnc1)Cc1cccc(OC[C@H](O)C[NH+]2CCCCCC2)c1 ZINC000012318934 570307466 /nfs/dbraw/zinc/30/74/66/570307466.db2.gz CKGRQOJGCSYFCV-JOCHJYFZSA-N 2 1 383.536 3.329 50 0 GGAAMP Cc1[nH+]ccn1CCC(=O)N(C)CC1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC000023251561 570352846 /nfs/dbraw/zinc/35/28/46/570352846.db2.gz LKAOIYNLJOCRQJ-UHFFFAOYSA-N 2 1 386.515 3.134 50 0 GGAAMP CCc1ccccc1OCC[N@@H+](C)[C@@H]1c2ccccc2C2(CC[NH2+]CC2)[C@H]1O ZINC000023429828 570362389 /nfs/dbraw/zinc/36/23/89/570362389.db2.gz MRPGAYDPUCSYDN-PKTZIBPZSA-N 2 1 380.532 3.297 50 0 GGAAMP C[N@@H+](CCc1ccccc1)C1(C(=O)N[C@H]2CC[C@@H]([NH3+])CC2)Cc2ccccc2C1 ZINC000244840253 570433841 /nfs/dbraw/zinc/43/38/41/570433841.db2.gz UJUQMWKQPUKITD-ZRZAMGCNSA-N 2 1 391.559 3.085 50 0 GGAAMP Fc1ccccc1C[NH+]1CCC(C[N@H+](Cc2cnc[nH]2)C[C@@H]2CCCO2)CC1 ZINC000011661370 570576943 /nfs/dbraw/zinc/57/69/43/570576943.db2.gz OBKQBYHQGTVHHL-NRFANRHFSA-N 2 1 386.515 3.442 50 0 GGAAMP O=C(NCc1ccncc1)[C@H]1CCC[N@@H+](C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000011665020 570578792 /nfs/dbraw/zinc/57/87/92/570578792.db2.gz ZYWFOHLMCZLRPS-QFIPXVFZSA-N 2 1 392.547 3.074 50 0 GGAAMP O=C(NCc1ccncc1)[C@H]1CCC[N@H+](C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000011665020 570578795 /nfs/dbraw/zinc/57/87/95/570578795.db2.gz ZYWFOHLMCZLRPS-QFIPXVFZSA-N 2 1 392.547 3.074 50 0 GGAAMP O=C(NCc1ccccn1)[C@@H]1CCC[N@H+](C2CC[NH+](CC3CCCC3)CC2)C1 ZINC000011664983 570578861 /nfs/dbraw/zinc/57/88/61/570578861.db2.gz XEQOSKOABJBWML-HXUWFJFHSA-N 2 1 384.568 3.064 50 0 GGAAMP C[N@@H+](C[C@H](O)COc1ccccc1C[NH2+]Cc1cccnc1)C1CCCCC1 ZINC000011873002 570589216 /nfs/dbraw/zinc/58/92/16/570589216.db2.gz ZIDOQSKDPUZKNH-QFIPXVFZSA-N 2 1 383.536 3.376 50 0 GGAAMP C[NH+]1CCC(C(=O)N2CC[C@]3(C2)CCC[N@@H+](CC2CC2)C3)(c2ccccc2)CC1 ZINC000011951386 570595814 /nfs/dbraw/zinc/59/58/14/570595814.db2.gz YUVSDJJAHNXZMB-XMMPIXPASA-N 2 1 395.591 3.375 50 0 GGAAMP CC(C)CN(C)C(=O)[C@@H]1CCC[N@H+](C2CC[NH+](C3Cc4ccccc4C3)CC2)C1 ZINC000011996811 570597277 /nfs/dbraw/zinc/59/72/77/570597277.db2.gz OOXJGQFOKSOYIK-JOCHJYFZSA-N 2 1 397.607 3.445 50 0 GGAAMP CCCC[NH2+]Cc1ccc(OC)c(OC[C@H](O)C[N@@H+](C)Cc2ccccc2)c1 ZINC000012075349 570605026 /nfs/dbraw/zinc/60/50/26/570605026.db2.gz OBSZZEINFWONHC-OAQYLSRUSA-N 2 1 386.536 3.457 50 0 GGAAMP C[N@H+](Cc1ccccc1)C[C@H](O)COc1ccc(C[NH2+]CC2CCOCC2)cc1 ZINC000012300446 570635699 /nfs/dbraw/zinc/63/56/99/570635699.db2.gz HEQUFHPHWHMJRJ-QHCPKHFHSA-N 2 1 398.547 3.075 50 0 GGAAMP COCC[N@H+](Cc1cnc(C)[nH]1)CC1CC[NH+](Cc2ccccc2OC)CC1 ZINC000012307246 570639488 /nfs/dbraw/zinc/63/94/88/570639488.db2.gz OIKGVBWPOHSPIL-UHFFFAOYSA-N 2 1 386.540 3.087 50 0 GGAAMP COCC[N@@H+](Cc1c[nH]c(C)n1)CC1CC[NH+](Cc2ccccc2OC)CC1 ZINC000012307246 570639491 /nfs/dbraw/zinc/63/94/91/570639491.db2.gz OIKGVBWPOHSPIL-UHFFFAOYSA-N 2 1 386.540 3.087 50 0 GGAAMP COCC[N@H+](Cc1c[nH]c(C)n1)CC1CC[NH+](Cc2ccccc2OC)CC1 ZINC000012307246 570639493 /nfs/dbraw/zinc/63/94/93/570639493.db2.gz OIKGVBWPOHSPIL-UHFFFAOYSA-N 2 1 386.540 3.087 50 0 GGAAMP CCN(C[C@H]1CCC[N@@H+](CCc2cccc(F)c2)C1)C(=O)C1CC[NH+](C)CC1 ZINC000012432076 570660138 /nfs/dbraw/zinc/66/01/38/570660138.db2.gz HPDCKAMYYZXVNI-FQEVSTJZSA-N 2 1 389.559 3.271 50 0 GGAAMP CCOc1cccc(C[N@@H+]2CCOc3ccc([C@@](C)(O)C[NH+](C)C)cc3C2)c1 ZINC000055053364 570680635 /nfs/dbraw/zinc/68/06/35/570680635.db2.gz RONCRQGRFZZEOL-QHCPKHFHSA-N 2 1 384.520 3.249 50 0 GGAAMP CCOc1cccc(C[N@H+]2CCOc3ccc([C@@](C)(O)C[NH+](C)C)cc3C2)c1 ZINC000055053364 570680637 /nfs/dbraw/zinc/68/06/37/570680637.db2.gz RONCRQGRFZZEOL-QHCPKHFHSA-N 2 1 384.520 3.249 50 0 GGAAMP CCOc1cccc(C[N@@H+]2CCOc3ccc([C@](C)(O)C[NH+](C)C)cc3C2)c1 ZINC000055053361 570680660 /nfs/dbraw/zinc/68/06/60/570680660.db2.gz RONCRQGRFZZEOL-HSZRJFAPSA-N 2 1 384.520 3.249 50 0 GGAAMP CCOc1cccc(C[N@H+]2CCOc3ccc([C@](C)(O)C[NH+](C)C)cc3C2)c1 ZINC000055053361 570680662 /nfs/dbraw/zinc/68/06/62/570680662.db2.gz RONCRQGRFZZEOL-HSZRJFAPSA-N 2 1 384.520 3.249 50 0 GGAAMP C[NH+]1CCC([N@H+](CCc2ccccc2)Cc2ccc(-n3cncn3)cc2)CC1 ZINC000055393218 570694445 /nfs/dbraw/zinc/69/44/45/570694445.db2.gz BQWIXRLNMWPDST-UHFFFAOYSA-N 2 1 375.520 3.406 50 0 GGAAMP C[NH+]1CCC([N@@H+](CCc2ccccc2)Cc2ccc(-n3cncn3)cc2)CC1 ZINC000055393218 570694446 /nfs/dbraw/zinc/69/44/46/570694446.db2.gz BQWIXRLNMWPDST-UHFFFAOYSA-N 2 1 375.520 3.406 50 0 GGAAMP O=C(C1CC[NH+](Cc2ccc(F)cc2)CC1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000004725543 570878196 /nfs/dbraw/zinc/87/81/96/570878196.db2.gz UCEFFVOOOWSIIH-UHFFFAOYSA-N 2 1 395.522 3.382 50 0 GGAAMP O=C(NCCc1ccco1)[C@H]1CCC[N@@H+](C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000015075426 570878296 /nfs/dbraw/zinc/87/82/96/570878296.db2.gz SYJKSDKYSNPOLC-NRFANRHFSA-N 2 1 395.547 3.315 50 0 GGAAMP O=C(NCCc1ccco1)[C@H]1CCC[N@H+](C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000015075426 570878301 /nfs/dbraw/zinc/87/83/01/570878301.db2.gz SYJKSDKYSNPOLC-NRFANRHFSA-N 2 1 395.547 3.315 50 0 GGAAMP C[N@@H+](Cc1ccccc1)C[C@@H](C[NH+]1CCC(NC(N)=O)CC1)c1ccccc1 ZINC000585138625 570951307 /nfs/dbraw/zinc/95/13/07/570951307.db2.gz RGWJTGGXYSLACW-NRFANRHFSA-N 2 1 380.536 3.035 50 0 GGAAMP C[N@H+](Cc1ccccc1)C[C@@H](C[NH+]1CCC(NC(N)=O)CC1)c1ccccc1 ZINC000585138625 570951308 /nfs/dbraw/zinc/95/13/08/570951308.db2.gz RGWJTGGXYSLACW-NRFANRHFSA-N 2 1 380.536 3.035 50 0 GGAAMP COCC[NH+]1CCC(C[N@H+](Cc2ccc(F)c(OC)c2)C[C@H]2CCCO2)CC1 ZINC000012076285 570958053 /nfs/dbraw/zinc/95/80/53/570958053.db2.gz LAGUJGFTVKXEPY-HXUWFJFHSA-N 2 1 394.531 3.174 50 0 GGAAMP CN(CC1CC1)C(=O)[C@@H]1CCC[N@@H+](C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000091645478 571021867 /nfs/dbraw/zinc/02/18/67/571021867.db2.gz WOZYXUCWIFJOKW-JOCHJYFZSA-N 2 1 383.580 3.274 50 0 GGAAMP CN(CC1CC1)C(=O)[C@@H]1CCC[N@H+](C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000091645478 571021868 /nfs/dbraw/zinc/02/18/68/571021868.db2.gz WOZYXUCWIFJOKW-JOCHJYFZSA-N 2 1 383.580 3.274 50 0 GGAAMP C[N@H+](Cc1ccccc1)C[C@@H](O)COc1ccc(C[NH+]2CCC(F)CC2)cc1 ZINC000095517979 571084997 /nfs/dbraw/zinc/08/49/97/571084997.db2.gz QDJDNQMMDQZITL-JOCHJYFZSA-N 2 1 386.511 3.492 50 0 GGAAMP c1c[nH]c(C[N@H+](C[C@@H]2CCCO2)CC2CC[NH+](C3Cc4ccccc4C3)CC2)n1 ZINC000011819466 1399014437 /nfs/dbraw/zinc/01/44/37/1399014437.db2.gz GPRZYPKFNTZLIY-QHCPKHFHSA-N 2 1 394.563 3.270 50 0 GGAAMP c1c[nH]c(C[N@@H+](C[C@@H]2CCCO2)CC2CC[NH+](C3Cc4ccccc4C3)CC2)n1 ZINC000011819466 1399014443 /nfs/dbraw/zinc/01/44/43/1399014443.db2.gz GPRZYPKFNTZLIY-QHCPKHFHSA-N 2 1 394.563 3.270 50 0 GGAAMP O=C(NC1CCCC1)[C@H]1CCC[N@@H+](C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000011839398 1399015222 /nfs/dbraw/zinc/01/52/22/1399015222.db2.gz BPILOZFLHQZOCT-NRFANRHFSA-N 2 1 383.580 3.464 50 0 GGAAMP O=C(NC1CCCC1)[C@H]1CCC[N@H+](C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000011839398 1399015227 /nfs/dbraw/zinc/01/52/27/1399015227.db2.gz BPILOZFLHQZOCT-NRFANRHFSA-N 2 1 383.580 3.464 50 0 GGAAMP CC1(C)[C@@H]2C[C@H]1C(C[NH+]1CCC([NH+]3CCC(C(=O)NC4CC4)CC3)CC1)=CC2 ZINC000011874379 1399016035 /nfs/dbraw/zinc/01/60/35/1399016035.db2.gz KKGGMQUAMCEUGA-UGKGYDQZSA-N 2 1 385.596 3.434 50 0 GGAAMP CSCC(=O)N(CC[NH+]1CCCCC1)C[C@@H]1CCC[N@H+](C2CCCC2)C1 ZINC000012092677 1399027807 /nfs/dbraw/zinc/02/78/07/1399027807.db2.gz KLKIRGZTNMMSMN-LJQANCHMSA-N 2 1 381.630 3.319 50 0 GGAAMP O=C(NCc1ccccn1)[C@H]1CCC[N@H+](C2CC[NH+](C3CCCCC3)CC2)C1 ZINC000012302068 1399037473 /nfs/dbraw/zinc/03/74/73/1399037473.db2.gz RRYKISZPMPCJHC-IBGZPJMESA-N 2 1 384.568 3.207 50 0 GGAAMP COCC[N@@H+]1CCC[C@@]2(CC[NH+](C3CCN(c4ccccc4OC)CC3)C2)C1 ZINC000012307516 1399038619 /nfs/dbraw/zinc/03/86/19/1399038619.db2.gz IYHISGIGMFLFCL-HSZRJFAPSA-N 2 1 387.568 3.098 50 0 GGAAMP COCC[N@H+]1CCC[C@@]2(CC[NH+](C3CCN(c4ccccc4OC)CC3)C2)C1 ZINC000012307516 1399038626 /nfs/dbraw/zinc/03/86/26/1399038626.db2.gz IYHISGIGMFLFCL-HSZRJFAPSA-N 2 1 387.568 3.098 50 0 GGAAMP COCC[NH+]1CCC[C@@]2(CC[N@@H+](C3CCN(c4ccccc4OC)CC3)C2)C1 ZINC000012307516 1399038633 /nfs/dbraw/zinc/03/86/33/1399038633.db2.gz IYHISGIGMFLFCL-HSZRJFAPSA-N 2 1 387.568 3.098 50 0 GGAAMP COCC[NH+]1CCC[C@@]2(CC[N@H+](C3CCN(c4ccccc4OC)CC3)C2)C1 ZINC000012307516 1399038638 /nfs/dbraw/zinc/03/86/38/1399038638.db2.gz IYHISGIGMFLFCL-HSZRJFAPSA-N 2 1 387.568 3.098 50 0 GGAAMP O=C(NCc1cccnc1)[C@@H]1CCC[N@H+](C2CC[NH+](CC3CCCC3)CC2)C1 ZINC000012435126 1399042095 /nfs/dbraw/zinc/04/20/95/1399042095.db2.gz XSSSUXWDTAAYFO-OAQYLSRUSA-N 2 1 384.568 3.064 50 0 GGAAMP CC(C)n1cc(C[N@H+]2CCC[C@H](CCC(=O)N(C)C3CC[NH+](C)CC3)C2)cn1 ZINC000012437438 1399042854 /nfs/dbraw/zinc/04/28/54/1399042854.db2.gz GNNUKLUWEMVFBT-LJQANCHMSA-N 2 1 389.588 3.009 50 0 GGAAMP CC(C)n1cc(C[N@H+]2CCC[C@@H](CCC(=O)N(C)C3CC[NH+](C)CC3)C2)cn1 ZINC000012437437 1399043198 /nfs/dbraw/zinc/04/31/98/1399043198.db2.gz GNNUKLUWEMVFBT-IBGZPJMESA-N 2 1 389.588 3.009 50 0 GGAAMP O=C(c1cnccn1)N(CC[NH+]1CCCCC1)C[C@@H]1CCC[N@H+](C2CCCC2)C1 ZINC000012701298 1399053997 /nfs/dbraw/zinc/05/39/97/1399053997.db2.gz OGJFLQUIFPEFQR-HXUWFJFHSA-N 2 1 399.583 3.059 50 0 GGAAMP CSCCC[NH2+]Cc1ccc(OC[C@H](O)C[N@@H+](C)Cc2ccccc2)cc1 ZINC000012745933 1399057617 /nfs/dbraw/zinc/05/76/17/1399057617.db2.gz ZLSRPBLADGFZEK-OAQYLSRUSA-N 2 1 388.577 3.401 50 0 GGAAMP O=C([C@@H]1C[C@H](C[NH+]2CCCC2)C[N@@H+](CCc2ccccc2)C1)N1CCCCC1 ZINC000014754297 1399118251 /nfs/dbraw/zinc/11/82/51/1399118251.db2.gz UIQRAICMCXYYET-DHIUTWEWSA-N 2 1 383.580 3.276 50 0 GGAAMP COCC[N@H+]1CCC[C@]2(CC[NH+](Cc3cc(C)cc(C)c3-n3cccn3)C2)C1 ZINC000014949661 1399128944 /nfs/dbraw/zinc/12/89/44/1399128944.db2.gz YOMGRXDKZMLKIY-QHCPKHFHSA-N 2 1 382.552 3.423 50 0 GGAAMP COCC[NH+]1CCC[C@]2(CC[N@H+](Cc3cc(C)cc(C)c3-n3cccn3)C2)C1 ZINC000014949661 1399128946 /nfs/dbraw/zinc/12/89/46/1399128946.db2.gz YOMGRXDKZMLKIY-QHCPKHFHSA-N 2 1 382.552 3.423 50 0 GGAAMP COCC[NH+]1CCC[C@]2(CC[N@@H+](Cc3cc(C)cc(C)c3-n3cccn3)C2)C1 ZINC000014949661 1399128949 /nfs/dbraw/zinc/12/89/49/1399128949.db2.gz YOMGRXDKZMLKIY-QHCPKHFHSA-N 2 1 382.552 3.423 50 0 GGAAMP Cc1cc(C)c(C[NH+]2CCC3(C[C@@H]3C(=O)N3CCC[N@H+](C)CC3)CC2)cc1C ZINC000014988714 1399130211 /nfs/dbraw/zinc/13/02/11/1399130211.db2.gz HRFUHVJNEGRZEY-JOCHJYFZSA-N 2 1 383.580 3.378 50 0 GGAAMP C[NH+]1CCN(C(=O)CC[C@@H]2CCC[N@H+](Cc3cccc4cnccc43)C2)CC1 ZINC000019225283 1399328824 /nfs/dbraw/zinc/32/88/24/1399328824.db2.gz PWMMYRBLEZDTBE-IBGZPJMESA-N 2 1 380.536 3.001 50 0 GGAAMP C[NH+]1CCN(C(=O)CC[C@@H]2CCC[N@@H+](Cc3cccc4cnccc43)C2)CC1 ZINC000019225283 1399328829 /nfs/dbraw/zinc/32/88/29/1399328829.db2.gz PWMMYRBLEZDTBE-IBGZPJMESA-N 2 1 380.536 3.001 50 0 GGAAMP O=C(NCC(F)(F)F)[C@@H]1CCC[N@@H+](C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000020450905 1399346732 /nfs/dbraw/zinc/34/67/32/1399346732.db2.gz UVAZZGGGDPHMAZ-GOSISDBHSA-N 2 1 397.485 3.084 50 0 GGAAMP O=C(NCC(F)(F)F)[C@@H]1CCC[N@H+](C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000020450905 1399346738 /nfs/dbraw/zinc/34/67/38/1399346738.db2.gz UVAZZGGGDPHMAZ-GOSISDBHSA-N 2 1 397.485 3.084 50 0 GGAAMP CC(C)(CO)CN(CC[NH+]1CCCCC1)C[C@@H]1CCC[N@H+](C2CCCC2)C1 ZINC000020455770 1399347433 /nfs/dbraw/zinc/34/74/33/1399347433.db2.gz HBQFSXBFAGXEPK-NRFANRHFSA-N 2 1 379.633 3.447 50 0 GGAAMP Cc1ccc(OCC[N@H+](C)[C@@H]2c3ccccc3C3(CC[NH2+]CC3)[C@H]2O)c(C)c1 ZINC000020600093 1399349650 /nfs/dbraw/zinc/34/96/50/1399349650.db2.gz AVKOETYZEROKRI-PKTZIBPZSA-N 2 1 380.532 3.351 50 0 GGAAMP Cc1[nH+]ccn1-c1ccc(N2CCC([NH2+]CCc3nc(C(C)C)no3)CC2)cc1 ZINC000023214870 1399541158 /nfs/dbraw/zinc/54/11/58/1399541158.db2.gz AJYLRXMKAWHTHI-UHFFFAOYSA-N 2 1 394.523 3.488 50 0 GGAAMP C[NH+]1CCC([NH+]2CCC(CN(Cc3ccncc3)C(=O)c3ccoc3)CC2)CC1 ZINC000067868584 1409246869 /nfs/dbraw/zinc/24/68/69/1409246869.db2.gz FXEMDNHZLXOWTH-UHFFFAOYSA-N 2 1 396.535 3.123 50 0 GGAAMP CN(C[C@@H]1Cc2ccccc2C[N@H+]1C)C(=O)c1ccc(-c2c[nH+]ccc2N)cc1 ZINC000426511601 529958034 /nfs/dbraw/zinc/95/80/34/529958034.db2.gz HNWHGRMCNKRNMH-NRFANRHFSA-N 2 1 386.499 3.290 50 0 GGAAMP COc1cc(C[NH2+]C2CCC2)ccc1OC[C@@H](O)C[N@@H+](C)C1CCCCC1 ZINC000011764559 221124487 /nfs/dbraw/zinc/12/44/87/221124487.db2.gz ICIMFDHNFSQBBU-FQEVSTJZSA-N 2 1 376.541 3.342 50 0 GGAAMP COc1cc(C[NH+]2CCCC2)ccc1OC[C@@H](O)C[N@@H+](C)C1CCCCC1 ZINC000011817161 221127392 /nfs/dbraw/zinc/12/73/92/221127392.db2.gz ZUONQBWSNIFSCF-FQEVSTJZSA-N 2 1 376.541 3.295 50 0 GGAAMP COc1cc(C[NH+]2CCCC2)ccc1OC[C@H](O)C[N@@H+](C)C1CCCCC1 ZINC000011817162 221128393 /nfs/dbraw/zinc/12/83/93/221128393.db2.gz ZUONQBWSNIFSCF-HXUWFJFHSA-N 2 1 376.541 3.295 50 0 GGAAMP CCN(C[C@@H]1CCC[N@H+](CCc2cccc(OC)c2)C1)C(=O)Cn1cc[nH+]c1C ZINC000011819293 221129796 /nfs/dbraw/zinc/12/97/96/221129796.db2.gz TVMPRZBNEKVOCN-OAQYLSRUSA-N 2 1 398.551 3.003 50 0 GGAAMP CCN(C[C@@H]1CCC[N@@H+](CCc2cccc(OC)c2)C1)C(=O)Cn1cc[nH+]c1C ZINC000011819293 221129797 /nfs/dbraw/zinc/12/97/97/221129797.db2.gz TVMPRZBNEKVOCN-OAQYLSRUSA-N 2 1 398.551 3.003 50 0 GGAAMP CC(C)[NH+]1CCC([N@H+]2CCC[C@H](C(=O)NCCc3ccccc3F)C2)CC1 ZINC000011873118 221133032 /nfs/dbraw/zinc/13/30/32/221133032.db2.gz QSXKBRZYURBISY-IBGZPJMESA-N 2 1 375.532 3.069 50 0 GGAAMP CC[N@H+]1CCC[C@@H]1CN(CC1CC[NH+](CCOC)CC1)C(=O)c1cccs1 ZINC000011874424 221134709 /nfs/dbraw/zinc/13/47/09/221134709.db2.gz XHKVZLGXOQMDBG-LJQANCHMSA-N 2 1 393.597 3.033 50 0 GGAAMP COc1ccc(C[NH2+]Cc2ccccc2F)cc1OC[C@H](O)C[N@@H+](C)C(C)C ZINC000011699161 221122401 /nfs/dbraw/zinc/12/24/01/221122401.db2.gz OOQBYZVYXQRNIH-LJQANCHMSA-N 2 1 390.499 3.204 50 0 GGAAMP COc1ccc(C[NH2+]Cc2ccccc2F)cc1OC[C@@H](O)C[N@@H+](C)C(C)C ZINC000011699154 221122882 /nfs/dbraw/zinc/12/28/82/221122882.db2.gz OOQBYZVYXQRNIH-IBGZPJMESA-N 2 1 390.499 3.204 50 0 GGAAMP O=C(NCc1ccccn1)[C@@H]1CCC[N@H+](C2CC[NH+](CC3CCCCC3)CC2)C1 ZINC000011938045 221138783 /nfs/dbraw/zinc/13/87/83/221138783.db2.gz MTMLEPYTSCIXEB-OAQYLSRUSA-N 2 1 398.595 3.455 50 0 GGAAMP Cn1cc(C[N@H+]2CCOc3ccc([C@](C)(O)C[NH+](C)C)cc3C2)c2ccccc21 ZINC000011976134 221141360 /nfs/dbraw/zinc/14/13/60/221141360.db2.gz DRQLKKFQEOFQCU-XMMPIXPASA-N 2 1 393.531 3.342 50 0 GGAAMP CC[N@H+]1CCC[C@H]1CN(CC1CC[NH+](CCOC)CC1)C(=O)CCC1(C)CC1 ZINC000012002041 221142668 /nfs/dbraw/zinc/14/26/68/221142668.db2.gz NKHAVEVPKAGEHO-NRFANRHFSA-N 2 1 393.616 3.238 50 0 GGAAMP COCC[NH+]1CCC(C[N@H+](Cc2ccc(F)c(OC)c2)C[C@@H]2CCCO2)CC1 ZINC000012076283 221148011 /nfs/dbraw/zinc/14/80/11/221148011.db2.gz LAGUJGFTVKXEPY-FQEVSTJZSA-N 2 1 394.531 3.174 50 0 GGAAMP CC(=O)CCC(=O)N(CC[NH+]1CCCCC1)C[C@H]1CCC[N@H+](C2CCCC2)C1 ZINC000012074973 221148678 /nfs/dbraw/zinc/14/86/78/221148678.db2.gz DZRZZEWYPCEMST-NRFANRHFSA-N 2 1 391.600 3.325 50 0 GGAAMP C[N@@H+](C[C@@H](O)COc1cccc(C[NH2+]Cc2cccnc2)c1)C1CCCCC1 ZINC000012304811 221177106 /nfs/dbraw/zinc/17/71/06/221177106.db2.gz NPBSKIZHLFYBTB-JOCHJYFZSA-N 2 1 383.536 3.376 50 0 GGAAMP CC(C)[NH+]1CCC([N@H+]2CCC[C@@H](C(=O)NCc3ccc(F)c(F)c3)C2)CC1 ZINC000012432891 221193094 /nfs/dbraw/zinc/19/30/94/221193094.db2.gz YXTWXHBHZPTRRI-QGZVFWFLSA-N 2 1 379.495 3.166 50 0 GGAAMP c1ncc(C[N@@H+](C[C@H]2CCCO2)CC2CC[NH+](C3Cc4ccccc4C3)CC2)[nH]1 ZINC000012445096 221197000 /nfs/dbraw/zinc/19/70/00/221197000.db2.gz ASBKYTDUEQZPPG-XMMPIXPASA-N 2 1 394.563 3.270 50 0 GGAAMP c1nc(C[N@H+](C[C@H]2CCCO2)CC2CC[NH+](C3Cc4ccccc4C3)CC2)c[nH]1 ZINC000012445096 221197001 /nfs/dbraw/zinc/19/70/01/221197001.db2.gz ASBKYTDUEQZPPG-XMMPIXPASA-N 2 1 394.563 3.270 50 0 GGAAMP c1nc(C[N@@H+](C[C@H]2CCCO2)CC2CC[NH+](C3Cc4ccccc4C3)CC2)c[nH]1 ZINC000012445096 221197003 /nfs/dbraw/zinc/19/70/03/221197003.db2.gz ASBKYTDUEQZPPG-XMMPIXPASA-N 2 1 394.563 3.270 50 0 GGAAMP CCCCNC(=O)[C@@H]1CCC[N@H+](C2CC[NH+](C3Cc4ccccc4C3)CC2)C1 ZINC000012465597 221198356 /nfs/dbraw/zinc/19/83/56/221198356.db2.gz VGFCMMZZEZPTBP-OAQYLSRUSA-N 2 1 383.580 3.247 50 0 GGAAMP COc1ccc(C[NH2+]Cc2cccc(C)c2)cc1OC[C@@H](O)C[N@@H+](C)C(C)C ZINC000012459095 221198864 /nfs/dbraw/zinc/19/88/64/221198864.db2.gz LQBRGOQHWJTWMX-NRFANRHFSA-N 2 1 386.536 3.373 50 0 GGAAMP CC(=O)N1CCC([N@H+](C)C[C@@H]2CCC[NH+](CCc3ccccc3F)C2)CC1 ZINC000012594564 221212639 /nfs/dbraw/zinc/21/26/39/221212639.db2.gz XWIPAHUYDXIGHS-IBGZPJMESA-N 2 1 375.532 3.023 50 0 GGAAMP CC(=O)N1CCC([N@@H+](C)C[C@@H]2CCC[NH+](CCc3ccccc3F)C2)CC1 ZINC000012594564 221212641 /nfs/dbraw/zinc/21/26/41/221212641.db2.gz XWIPAHUYDXIGHS-IBGZPJMESA-N 2 1 375.532 3.023 50 0 GGAAMP CC(=O)N1CCC([NH+](C)C[C@@H]2CCC[N@H+](CCc3ccccc3F)C2)CC1 ZINC000012594564 221212643 /nfs/dbraw/zinc/21/26/43/221212643.db2.gz XWIPAHUYDXIGHS-IBGZPJMESA-N 2 1 375.532 3.023 50 0 GGAAMP CC(=O)N1CCC([NH+](C)C[C@@H]2CCC[N@@H+](CCc3ccccc3F)C2)CC1 ZINC000012594564 221212645 /nfs/dbraw/zinc/21/26/45/221212645.db2.gz XWIPAHUYDXIGHS-IBGZPJMESA-N 2 1 375.532 3.023 50 0 GGAAMP CC(C)[NH+]1CCC([N@H+]2CCC[C@H](C(=O)NCCc3cccc(F)c3)C2)CC1 ZINC000012708945 221219251 /nfs/dbraw/zinc/21/92/51/221219251.db2.gz ONMAXKQTOBDCLJ-IBGZPJMESA-N 2 1 375.532 3.069 50 0 GGAAMP CSCCCNC(=O)[C@@H]1CCC[N@@H+](C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000014968533 221321478 /nfs/dbraw/zinc/32/14/78/221321478.db2.gz USENRHNXKHBTNE-HXUWFJFHSA-N 2 1 389.609 3.232 50 0 GGAAMP CSCCCNC(=O)[C@@H]1CCC[N@H+](C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000014968533 221321480 /nfs/dbraw/zinc/32/14/80/221321480.db2.gz USENRHNXKHBTNE-HXUWFJFHSA-N 2 1 389.609 3.232 50 0 GGAAMP O=C(NCC(F)(F)F)[C@@H]1CCC[N@@H+](C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000014975154 221323035 /nfs/dbraw/zinc/32/30/35/221323035.db2.gz YOKSFLQAKCILKV-QGZVFWFLSA-N 2 1 383.458 3.042 50 0 GGAAMP O=C(NCC(F)(F)F)[C@@H]1CCC[N@H+](C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000014975154 221323038 /nfs/dbraw/zinc/32/30/38/221323038.db2.gz YOKSFLQAKCILKV-QGZVFWFLSA-N 2 1 383.458 3.042 50 0 GGAAMP CC[N@H+]1CCC[C@@H]1CNC(=O)CCC1CC[NH+](CCCC(F)(F)F)CC1 ZINC000015079651 221333108 /nfs/dbraw/zinc/33/31/08/221333108.db2.gz WVJYPGPJOSLSTR-QGZVFWFLSA-N 2 1 377.495 3.422 50 0 GGAAMP c1cc([C@H]2CCC[N@H+](C3CCOCC3)C2)nc(SCC[NH+]2CCCC2)n1 ZINC000015001910 221326511 /nfs/dbraw/zinc/32/65/11/221326511.db2.gz SIGRKKNVKZBRCI-KRWDZBQOSA-N 2 1 376.570 3.023 50 0 GGAAMP CC[N@H+]1CCC[C@@H]1CNC(=O)CCC1CC[NH+](C2Cc3ccccc3C2)CC1 ZINC000015062846 221327444 /nfs/dbraw/zinc/32/74/44/221327444.db2.gz OMMHGMZLDDVMPJ-JOCHJYFZSA-N 2 1 383.580 3.247 50 0 GGAAMP C[N@@H+](C[C@@H](O)COc1ccccc1C[NH2+]CC1CCOCC1)C1CCCCC1 ZINC000015069184 221330016 /nfs/dbraw/zinc/33/00/16/221330016.db2.gz CFQRLVALUDTLMN-JOCHJYFZSA-N 2 1 390.568 3.207 50 0 GGAAMP Cc1nnc(N2CCC[C@@H](c3[nH+]ccn3CCC[NH+](C)C)C2)c2ccccc12 ZINC000095497831 136179708 /nfs/dbraw/zinc/17/97/08/136179708.db2.gz PDKZGABFNKWQOL-GOSISDBHSA-N 2 1 378.524 3.470 50 0 GGAAMP CCC[NH+]1CCC2(CC1)CC[N@H+](C1CCN(c3ccccc3)CC1)C[C@@H]2CO ZINC000097347004 136188481 /nfs/dbraw/zinc/18/84/81/136188481.db2.gz BTKRBTDWFVYHST-OAQYLSRUSA-N 2 1 385.596 3.462 50 0 GGAAMP Cc1ccc(C2(C[N@H+]3CCC[C@@H](C(=O)c4cccnc4)C3)CC[NH2+]CC2)nc1 ZINC000065461037 222130157 /nfs/dbraw/zinc/13/01/57/222130157.db2.gz RRLVRNRFVPWKQU-HXUWFJFHSA-N 2 1 378.520 3.001 50 0 GGAAMP O=C(NC1CC1)[C@H]1CCC[N@@H+](C2CC[NH+](Cc3cccc4cccnc43)CC2)C1 ZINC000071315631 222179777 /nfs/dbraw/zinc/17/97/77/222179777.db2.gz WCQVZHSUOWHXBB-FQEVSTJZSA-N 2 1 392.547 3.190 50 0 GGAAMP O=C(NC1CC1)[C@H]1CCC[N@H+](C2CC[NH+](Cc3cccc4cccnc43)CC2)C1 ZINC000071315631 222179779 /nfs/dbraw/zinc/17/97/79/222179779.db2.gz WCQVZHSUOWHXBB-FQEVSTJZSA-N 2 1 392.547 3.190 50 0 GGAAMP CC(C)=CCC[NH+]1CCC([N@H+]2CCC[C@@H](C(=O)NCc3ccccn3)C2)CC1 ZINC000071388569 222183977 /nfs/dbraw/zinc/18/39/77/222183977.db2.gz VRVQVDRLULAAAE-HXUWFJFHSA-N 2 1 384.568 3.231 50 0 GGAAMP CC(C)CCC[NH+]1CCC([N@H+]2CCC[C@@H](C(=O)NCc3cccnc3)C2)CC1 ZINC000071551868 222185897 /nfs/dbraw/zinc/18/58/97/222185897.db2.gz OKTKEMDTUKOIED-OAQYLSRUSA-N 2 1 386.584 3.310 50 0 GGAAMP C[NH+]1CCC([N@@H+]2CCC[C@H](C(=O)N(C/C=C/c3ccccc3)C3CC3)C2)CC1 ZINC000071752806 222192818 /nfs/dbraw/zinc/19/28/18/222192818.db2.gz SSTPJSHWZPXEMP-OWLMGLOSSA-N 2 1 381.564 3.497 50 0 GGAAMP C[NH+]1CCC([N@H+]2CCC[C@H](C(=O)N(C/C=C/c3ccccc3)C3CC3)C2)CC1 ZINC000071752806 222192822 /nfs/dbraw/zinc/19/28/22/222192822.db2.gz SSTPJSHWZPXEMP-OWLMGLOSSA-N 2 1 381.564 3.497 50 0 GGAAMP Cc1[nH+]ccn1CCC[N@@H+]1CCC[C@@]2(CCC(=O)N(Cc3ccccc3)C2)C1 ZINC000072478639 222266355 /nfs/dbraw/zinc/26/63/55/222266355.db2.gz VNMSRDWYBYFZJY-HSZRJFAPSA-N 2 1 380.536 3.486 50 0 GGAAMP Cc1[nH+]ccn1CCC[N@H+]1CCC[C@@]2(CCC(=O)N(Cc3ccccc3)C2)C1 ZINC000072478639 222266359 /nfs/dbraw/zinc/26/63/59/222266359.db2.gz VNMSRDWYBYFZJY-HSZRJFAPSA-N 2 1 380.536 3.486 50 0 GGAAMP Cc1cccc2cc(C(=O)N3CCC[C@H]([N@@H+](C)CCC[NH+](C)C)C3)c(C)nc12 ZINC000072153823 222212576 /nfs/dbraw/zinc/21/25/76/222212576.db2.gz OJJOUDOCVVLUPF-FQEVSTJZSA-N 2 1 382.552 3.340 50 0 GGAAMP Cc1cccc2cc(C(=O)N3CCC[C@H]([N@H+](C)CCC[NH+](C)C)C3)c(C)nc12 ZINC000072153823 222212579 /nfs/dbraw/zinc/21/25/79/222212579.db2.gz OJJOUDOCVVLUPF-FQEVSTJZSA-N 2 1 382.552 3.340 50 0 GGAAMP CCC[N@H+]1CC2(C[C@H]1C(=O)N(Cc1cccc(O)c1)C1CC1)CC[NH+](C)CC2 ZINC000072478324 222266655 /nfs/dbraw/zinc/26/66/55/222266655.db2.gz KCTASHWBZOLWAE-NRFANRHFSA-N 2 1 385.552 3.080 50 0 GGAAMP CCC[N@H+]1CC2(C[C@@H]1C(=O)N(Cc1cccc(O)c1)C1CC1)CC[NH+](C)CC2 ZINC000072478323 222267475 /nfs/dbraw/zinc/26/74/75/222267475.db2.gz KCTASHWBZOLWAE-OAQYLSRUSA-N 2 1 385.552 3.080 50 0 GGAAMP C[N@H+]1CC[C@H](CNc2nccc(C3(c4ccccc4Cl)CC[NH2+]CC3)n2)C1 ZINC000072411531 222256632 /nfs/dbraw/zinc/25/66/32/222256632.db2.gz JSOITIGURDKIHX-MRXNPFEDSA-N 2 1 385.943 3.163 50 0 GGAAMP CC(C)CN(Cc1ccccc1Cl)C(=O)[C@H]1CC2(C[N@H+]1C)CC[NH2+]CC2 ZINC000072456933 222262627 /nfs/dbraw/zinc/26/26/27/222262627.db2.gz QJFHAGOPOXUQNS-LJQANCHMSA-N 2 1 377.960 3.399 50 0 GGAAMP C[NH+](C)CCN(C[C@H]1CCC[N@@H+](Cc2ccccc2F)C1)C(=O)C1CC=CC1 ZINC000095518291 222345229 /nfs/dbraw/zinc/34/52/29/222345229.db2.gz DSKQFNZWPFJABY-IBGZPJMESA-N 2 1 387.543 3.394 50 0 GGAAMP CC[NH+](CC)C[C@@H](O)COc1cc(C[NH+]2CCC(F)(F)CC2)ccc1OC ZINC000095499793 222334562 /nfs/dbraw/zinc/33/45/62/222334562.db2.gz BWSPYEBDTVIUCT-QGZVFWFLSA-N 2 1 386.483 3.008 50 0 GGAAMP COc1cc(C[NH+]2CCC(F)(F)CC2)ccc1OC[C@H](O)C[N@H+](C)C(C)C ZINC000095504591 222336032 /nfs/dbraw/zinc/33/60/32/222336032.db2.gz HDUCKWAYGORIAE-QGZVFWFLSA-N 2 1 386.483 3.006 50 0 GGAAMP COc1cc(C[NH+]2CCC(F)(F)CC2)ccc1OC[C@H](O)C[N@@H+](C)C(C)C ZINC000095504591 222336037 /nfs/dbraw/zinc/33/60/37/222336037.db2.gz HDUCKWAYGORIAE-QGZVFWFLSA-N 2 1 386.483 3.006 50 0 GGAAMP COc1ccc(C[N@@H+](C)Cc2ccc(C)o2)cc1OC[C@H](O)C[NH+]1CCCC1 ZINC000095504117 222336296 /nfs/dbraw/zinc/33/62/96/222336296.db2.gz HRLSIIPMWRABKO-LJQANCHMSA-N 2 1 388.508 3.064 50 0 GGAAMP C[NH+](C)CCN(C[C@H]1CCC[N@@H+](Cc2ccccc2F)C1)C(=O)C1CCC1 ZINC000095505928 222338202 /nfs/dbraw/zinc/33/82/02/222338202.db2.gz QBVQXZWMTKSOSZ-SFHVURJKSA-N 2 1 375.532 3.228 50 0 GGAAMP C[NH+](C)CCN(C[C@@H]1CCC[N@@H+](Cc2ccccc2F)C1)C(=O)c1ccc[nH]1 ZINC000095505332 222339642 /nfs/dbraw/zinc/33/96/42/222339642.db2.gz XEZAKLRQDJWHPE-GOSISDBHSA-N 2 1 386.515 3.070 50 0 GGAAMP O[C@H](COc1ccccc1C[N@@H+]1CCOC2(CCCC2)C1)C[NH+]1CCCCC1 ZINC000095508706 222340343 /nfs/dbraw/zinc/34/03/43/222340343.db2.gz UNQFDXGNAXOPOW-NRFANRHFSA-N 2 1 388.552 3.057 50 0 GGAAMP O[C@H](COc1ccccc1C[N@H+]1CCOC2(CCCC2)C1)C[NH+]1CCCCC1 ZINC000095508706 222340347 /nfs/dbraw/zinc/34/03/47/222340347.db2.gz UNQFDXGNAXOPOW-NRFANRHFSA-N 2 1 388.552 3.057 50 0 GGAAMP CC(C)[C@@H](C(=O)N1CCC[C@@H](C[NH+]2CCC(C)CC2)C1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000084699901 222320523 /nfs/dbraw/zinc/32/05/23/222320523.db2.gz BXIHDSGTNAGLAG-LRSLUSHPSA-N 2 1 393.616 3.091 50 0 GGAAMP CC(C)[C@@H](C(=O)N1CCC[C@@H](C[NH+]2CCC(C)CC2)C1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000084699901 222320525 /nfs/dbraw/zinc/32/05/25/222320525.db2.gz BXIHDSGTNAGLAG-LRSLUSHPSA-N 2 1 393.616 3.091 50 0 GGAAMP COc1ccc(C[N@H+](C)Cc2ccoc2)cc1OC[C@H](O)C[NH+]1CCCCC1 ZINC000095522669 222348279 /nfs/dbraw/zinc/34/82/79/222348279.db2.gz ZJBSHNPJCQLMPD-HXUWFJFHSA-N 2 1 388.508 3.146 50 0 GGAAMP COc1ccc(C[N@@H+](C)Cc2ccoc2)cc1OC[C@H](O)C[NH+]1CCCCC1 ZINC000095522669 222348286 /nfs/dbraw/zinc/34/82/86/222348286.db2.gz ZJBSHNPJCQLMPD-HXUWFJFHSA-N 2 1 388.508 3.146 50 0 GGAAMP C[N@H+](C[C@H](O)COc1ccccc1C[NH+]1CCOC(C)(C)C1)C1CCCCC1 ZINC000095524642 222348774 /nfs/dbraw/zinc/34/87/74/222348774.db2.gz RSBUCAVPTOYTJR-NRFANRHFSA-N 2 1 390.568 3.302 50 0 GGAAMP C[N@@H+](C[C@H](O)COc1ccccc1C[NH+]1CCOC(C)(C)C1)C1CCCCC1 ZINC000095524642 222348776 /nfs/dbraw/zinc/34/87/76/222348776.db2.gz RSBUCAVPTOYTJR-NRFANRHFSA-N 2 1 390.568 3.302 50 0 GGAAMP C[NH+](C[C@H](O)COc1ccccc1C[N@@H+]1CCOC(C)(C)C1)C1CCCCC1 ZINC000095524642 222348779 /nfs/dbraw/zinc/34/87/79/222348779.db2.gz RSBUCAVPTOYTJR-NRFANRHFSA-N 2 1 390.568 3.302 50 0 GGAAMP C[NH+](C[C@H](O)COc1ccccc1C[N@H+]1CCOC(C)(C)C1)C1CCCCC1 ZINC000095524642 222348782 /nfs/dbraw/zinc/34/87/82/222348782.db2.gz RSBUCAVPTOYTJR-NRFANRHFSA-N 2 1 390.568 3.302 50 0 GGAAMP COCC[N@@H+](C)Cc1cc(Cl)ccc1OC[C@@H](O)C[NH+]1CCCCCC1 ZINC000095524509 222348855 /nfs/dbraw/zinc/34/88/55/222348855.db2.gz WSQUNZUCOMBUJB-IBGZPJMESA-N 2 1 384.948 3.034 50 0 GGAAMP COc1cc(C[N@@H+]2CC=C(C)CC2)ccc1OC[C@H](O)C[NH+]1CCCCCC1 ZINC000095526690 222350601 /nfs/dbraw/zinc/35/06/01/222350601.db2.gz KWSTVXHDZXRLHH-OAQYLSRUSA-N 2 1 388.552 3.463 50 0 GGAAMP C[NH+](C)CCN(C[C@H]1CCC[N@@H+](Cc2ccccc2F)C1)C(=O)c1ccoc1 ZINC000095529985 222353594 /nfs/dbraw/zinc/35/35/94/222353594.db2.gz XMEMOJOAZCAZDL-SFHVURJKSA-N 2 1 387.499 3.335 50 0 GGAAMP CCn1c(Cn2cc[nH+]c2C)nnc1C1CC[NH+](CCCC(F)(F)F)CC1 ZINC000096133729 222386675 /nfs/dbraw/zinc/38/66/75/222386675.db2.gz YQQBCRMCCXEGAJ-UHFFFAOYSA-N 2 1 384.450 3.373 50 0 GGAAMP O=C(c1ccnnc1)N(CC[NH+]1CCCCC1)C[C@@H]1CCC[N@H+](C2CCCC2)C1 ZINC000095521782 222345978 /nfs/dbraw/zinc/34/59/78/222345978.db2.gz LBHPFENRFBPOSI-HXUWFJFHSA-N 2 1 399.583 3.059 50 0 GGAAMP CCc1cc(N2CCC([NH+]3CCC(F)(F)CC3)CC2)nc(N2CCCC2)[nH+]1 ZINC000095531642 536144354 /nfs/dbraw/zinc/14/43/54/536144354.db2.gz IWYNRTPFAKOIKH-UHFFFAOYSA-N 2 1 379.499 3.339 50 0 GGAAMP CSCCC[N@H+]1CCC2(CC[NH+](Cc3cccc(F)c3)CC2)[C@H](CO)C1 ZINC000097346765 570242893 /nfs/dbraw/zinc/24/28/93/570242893.db2.gz VFIVBIUDECDBBF-IBGZPJMESA-N 2 1 380.573 3.475 50 0 GGAAMP CSCCC[N@H+]1CCC2(CC[NH+](Cc3cccc(F)c3)CC2)[C@@H](CO)C1 ZINC000097346767 570242993 /nfs/dbraw/zinc/24/29/93/570242993.db2.gz VFIVBIUDECDBBF-LJQANCHMSA-N 2 1 380.573 3.475 50 0 GGAAMP Cc1n[nH]c(C)c1C[N@H+]1CCC2(CC[NH+](Cc3ccccc3)CC2)[C@H](CO)C1 ZINC000097436967 570243785 /nfs/dbraw/zinc/24/37/85/570243785.db2.gz JBRBZLLNPHZZKV-NRFANRHFSA-N 2 1 382.552 3.123 50 0 GGAAMP Cc1nc(CCNC(=O)[C@H]2CCC[N@H+](C3CC[NH+](C(C)C)CC3)C2)sc1C ZINC000020210281 570248278 /nfs/dbraw/zinc/24/82/78/570248278.db2.gz MHWZLDHRCDMCHH-SFHVURJKSA-N 2 1 392.613 3.003 50 0 GGAAMP CC[NH+]1CCN(C(=O)CCC2CC[NH+](C/C=C/c3ccccc3OC)CC2)CC1 ZINC000020212536 570248689 /nfs/dbraw/zinc/24/86/89/570248689.db2.gz VOLNIKMGASSCEU-SOFGYWHQSA-N 2 1 399.579 3.365 50 0 GGAAMP CSc1ccc(C[N@@H+]2CCN(C3CC[NH+](C(C)C)CC3)[C@H](CCO)C2)cc1 ZINC000104428135 570258309 /nfs/dbraw/zinc/25/83/09/570258309.db2.gz LJPVWKNHGKJVHE-OAQYLSRUSA-N 2 1 391.625 3.150 50 0 GGAAMP CSc1ccc(C[N@H+]2CCN(C3CC[NH+](C(C)C)CC3)[C@H](CCO)C2)cc1 ZINC000104428135 570258312 /nfs/dbraw/zinc/25/83/12/570258312.db2.gz LJPVWKNHGKJVHE-OAQYLSRUSA-N 2 1 391.625 3.150 50 0 GGAAMP C[NH+]1CCN(C(=O)CCCc2cn(C[NH+]3CCCCC3)c3ccccc23)CC1 ZINC000020663614 570274446 /nfs/dbraw/zinc/27/44/46/570274446.db2.gz VDDRTGJJWMAAQQ-UHFFFAOYSA-N 2 1 382.552 3.181 50 0 GGAAMP C[NH+]1CCN(CC[C@H]2CCCC[N@H+]2Cc2cnn(-c3ccc(F)cc3)c2)CC1 ZINC000215962253 570293938 /nfs/dbraw/zinc/29/39/38/570293938.db2.gz IDNJIKWFCAVGGQ-OAQYLSRUSA-N 2 1 385.531 3.003 50 0 GGAAMP C[N@@H+](C[C@@H](O)COc1ccccc1C[NH2+]CCc1ccncc1)C1CCCCC1 ZINC000023338599 570355358 /nfs/dbraw/zinc/35/53/58/570355358.db2.gz NTXLPTMUWSEERL-HSZRJFAPSA-N 2 1 397.563 3.418 50 0 GGAAMP O=C(NC1CCCC1)[C@H]1CCC[N@H+](C2CC[NH+](C3Cc4ccccc4C3)CC2)C1 ZINC000023340141 570355884 /nfs/dbraw/zinc/35/58/84/570355884.db2.gz WEVVMQJXNUVDNL-NRFANRHFSA-N 2 1 395.591 3.389 50 0 GGAAMP C[NH+](C)C[C@@H](O)c1cc2n(n1)CCC[N@H+](Cc1cccc(-c3ccco3)c1)C2 ZINC000220419550 570386381 /nfs/dbraw/zinc/38/63/81/570386381.db2.gz NUINRQLQWUTBTQ-OAQYLSRUSA-N 2 1 380.492 3.144 50 0 GGAAMP C[NH+](C)C[C@@H](O)c1cc2n(n1)CCC[N@@H+](Cc1cccc(-c3ccco3)c1)C2 ZINC000220419550 570386386 /nfs/dbraw/zinc/38/63/86/570386386.db2.gz NUINRQLQWUTBTQ-OAQYLSRUSA-N 2 1 380.492 3.144 50 0 GGAAMP Cc1c2cc(C)ccc2oc1C[N@H+]1CCCn2nc([C@@H](O)C[NH+](C)C)cc2C1 ZINC000221208235 570391849 /nfs/dbraw/zinc/39/18/49/570391849.db2.gz IDXVAPQRGRGGQK-FQEVSTJZSA-N 2 1 382.508 3.247 50 0 GGAAMP Cc1c2cc(C)ccc2oc1C[N@@H+]1CCCn2nc([C@@H](O)C[NH+](C)C)cc2C1 ZINC000221208235 570391853 /nfs/dbraw/zinc/39/18/53/570391853.db2.gz IDXVAPQRGRGGQK-FQEVSTJZSA-N 2 1 382.508 3.247 50 0 GGAAMP Cn1c2ccc(C[NH2+]CCNc3cc[nH+]c4cc(Cl)ccc34)cc2n(C)c1=O ZINC000004993718 570422284 /nfs/dbraw/zinc/42/22/84/570422284.db2.gz NPWXHTXMBIOHKI-UHFFFAOYSA-N 2 1 395.894 3.280 50 0 GGAAMP Cc1ccc(C[NH+]2CCC(C(=O)N3CC[NH+](Cc4ccccc4)CC3)CC2)o1 ZINC000015856058 570536290 /nfs/dbraw/zinc/53/62/90/570536290.db2.gz GUHJQSSWPYOSEY-UHFFFAOYSA-N 2 1 381.520 3.144 50 0 GGAAMP Cc1cc([C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2nnc([C@H]3C[C@H]([NH3+])C3)n2C)ccc1F ZINC000244852920 570697120 /nfs/dbraw/zinc/69/71/20/570697120.db2.gz VBSTXKZSCGCDQG-YCEIQTCASA-N 2 1 383.515 3.378 50 0 GGAAMP Cc1cc([C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2nnc([C@H]3C[C@H]([NH3+])C3)n2C)ccc1F ZINC000244852920 570697123 /nfs/dbraw/zinc/69/71/23/570697123.db2.gz VBSTXKZSCGCDQG-YCEIQTCASA-N 2 1 383.515 3.378 50 0 GGAAMP C[N@@H+](Cc1ccccc1)C[C@H](C[NH+]1CCC(NC(N)=O)CC1)c1ccccc1 ZINC000585138626 570951299 /nfs/dbraw/zinc/95/12/99/570951299.db2.gz RGWJTGGXYSLACW-OAQYLSRUSA-N 2 1 380.536 3.035 50 0 GGAAMP C[N@H+](Cc1ccccc1)C[C@H](C[NH+]1CCC(NC(N)=O)CC1)c1ccccc1 ZINC000585138626 570951302 /nfs/dbraw/zinc/95/13/02/570951302.db2.gz RGWJTGGXYSLACW-OAQYLSRUSA-N 2 1 380.536 3.035 50 0 GGAAMP CN(CC1CC1)C(=O)[C@H]1CCC[N@H+](C2CC[NH+](C3Cc4ccccc4C3)CC2)C1 ZINC000091644009 571021399 /nfs/dbraw/zinc/02/13/99/571021399.db2.gz FXKQZVXFRALJGO-QFIPXVFZSA-N 2 1 395.591 3.199 50 0 GGAAMP CN(CC1CC1)C(=O)[C@H]1CCC[N@@H+](C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000091645479 571021948 /nfs/dbraw/zinc/02/19/48/571021948.db2.gz WOZYXUCWIFJOKW-QFIPXVFZSA-N 2 1 383.580 3.274 50 0 GGAAMP CN(CC1CC1)C(=O)[C@H]1CCC[N@H+](C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000091645479 571021951 /nfs/dbraw/zinc/02/19/51/571021951.db2.gz WOZYXUCWIFJOKW-QFIPXVFZSA-N 2 1 383.580 3.274 50 0 GGAAMP Cc1[nH+]ccn1CCC[NH+]1CCC2(CC1)C[C@H](c1ccccc1)C(=O)N(C)C2 ZINC000091793520 571031140 /nfs/dbraw/zinc/03/11/40/571031140.db2.gz QATTYOLPSJNFRU-OAQYLSRUSA-N 2 1 380.536 3.310 50 0 GGAAMP C[N@H+]1C[C@@H](c2ccccc2)CC2(CC[NH+](Cc3ccc(C(N)=O)cc3)CC2)C1 ZINC000092037891 571042066 /nfs/dbraw/zinc/04/20/66/571042066.db2.gz PCHDNJIYHJBNKZ-QFIPXVFZSA-N 2 1 377.532 3.487 50 0 GGAAMP Cc1ccc([C@@H](C(=O)NC2CC[NH+](C3CCSCC3)CC2)[NH+](C)C)cc1 ZINC000095353262 571050542 /nfs/dbraw/zinc/05/05/42/571050542.db2.gz YSURCHATPMEQCX-FQEVSTJZSA-N 2 1 375.582 3.074 50 0 GGAAMP O=C(NCC[N@H+]1CC[C@@H](c2ccccc2)C1)C1CC[NH+](Cc2ccco2)CC1 ZINC000095376211 571064837 /nfs/dbraw/zinc/06/48/37/571064837.db2.gz SBBLXMLFUADDDX-OAQYLSRUSA-N 2 1 381.520 3.097 50 0 GGAAMP CCc1nc(C[N@@H+]2CC[C@@H]3C[C@H]([NH+]4CCOCC4)CC[C@@]3(COC)C2)cs1 ZINC000095380146 571067154 /nfs/dbraw/zinc/06/71/54/571067154.db2.gz BEXARIXUXIVQOX-QFUCXCTJSA-N 2 1 393.597 3.045 50 0 GGAAMP CCc1nc(C[N@H+]2CC[C@@H]3C[C@H]([NH+]4CCOCC4)CC[C@@]3(COC)C2)cs1 ZINC000095380146 571067157 /nfs/dbraw/zinc/06/71/57/571067157.db2.gz BEXARIXUXIVQOX-QFUCXCTJSA-N 2 1 393.597 3.045 50 0 GGAAMP CCc1[nH+]ccn1CCC(=O)N1C[C@@H](c2ccc(F)cc2)[C@@H]2[C@H]1C1CC[NH+]2CC1 ZINC000095385123 571069915 /nfs/dbraw/zinc/06/99/15/571069915.db2.gz NTACRZWVDGHBRE-WWPVKYPJSA-N 2 1 396.510 3.064 50 0 GGAAMP C[NH+]1CCN(C(=O)CC[C@H]2CCC[N@H+](Cc3ccc4cc(F)ccc4n3)C2)CC1 ZINC000011664898 1399003308 /nfs/dbraw/zinc/00/33/08/1399003308.db2.gz PLYJYEIYSFQMSN-GOSISDBHSA-N 2 1 398.526 3.140 50 0 GGAAMP C[NH+]1CCN(C(=O)CC[C@H]2CCC[N@@H+](Cc3ccc4cc(F)ccc4n3)C2)CC1 ZINC000011664898 1399003313 /nfs/dbraw/zinc/00/33/13/1399003313.db2.gz PLYJYEIYSFQMSN-GOSISDBHSA-N 2 1 398.526 3.140 50 0 GGAAMP CSCCNC(=O)C1CC[NH+](C2CC[NH+](Cc3ccccc3C)CC2)CC1 ZINC000011753601 1399010319 /nfs/dbraw/zinc/01/03/19/1399010319.db2.gz OSDLZPJOJBHEKX-UHFFFAOYSA-N 2 1 389.609 3.151 50 0 GGAAMP COCC[NH+]1CCC(C[N@@H+](Cc2ccncc2)Cc2ccccc2OC)CC1 ZINC000011817060 1399013737 /nfs/dbraw/zinc/01/37/37/1399013737.db2.gz FPOOGZMANSUZCK-UHFFFAOYSA-N 2 1 383.536 3.451 50 0 GGAAMP CC[N@H+]1CCC[C@H]1CN(CC1CC[NH+](CCOC)CC1)C(=O)CC1CCCC1 ZINC000012058498 1399025990 /nfs/dbraw/zinc/02/59/90/1399025990.db2.gz NCWWNRZNKNIFJF-QFIPXVFZSA-N 2 1 393.616 3.238 50 0 GGAAMP COCC[N@H+]1CCC[C@@]2(CC[NH+](Cc3cccc(-n4nc(C)cc4C)c3)C2)C1 ZINC000012073373 1399027191 /nfs/dbraw/zinc/02/71/91/1399027191.db2.gz RZCRLUOXDCEXDT-HSZRJFAPSA-N 2 1 382.552 3.423 50 0 GGAAMP COCC[NH+]1CCC[C@@]2(CC[N@H+](Cc3cccc(-n4nc(C)cc4C)c3)C2)C1 ZINC000012073373 1399027197 /nfs/dbraw/zinc/02/71/97/1399027197.db2.gz RZCRLUOXDCEXDT-HSZRJFAPSA-N 2 1 382.552 3.423 50 0 GGAAMP COCC[NH+]1CCC[C@@]2(CC[N@@H+](Cc3cccc(-n4nc(C)cc4C)c3)C2)C1 ZINC000012073373 1399027200 /nfs/dbraw/zinc/02/72/00/1399027200.db2.gz RZCRLUOXDCEXDT-HSZRJFAPSA-N 2 1 382.552 3.423 50 0 GGAAMP CC(=O)N1CCC([N@@H+](C)CC2CC[NH+](CCc3ccccc3F)CC2)CC1 ZINC000012076140 1399027332 /nfs/dbraw/zinc/02/73/32/1399027332.db2.gz QJQOFWIXDMGJSD-UHFFFAOYSA-N 2 1 375.532 3.023 50 0 GGAAMP O=C1CC[N@@H+](Cc2cccc(-c3ccco3)c2)CCN1CC[NH+]1CCCCC1 ZINC000012077906 1399027378 /nfs/dbraw/zinc/02/73/78/1399027378.db2.gz IOEFVSSZTDXHST-UHFFFAOYSA-N 2 1 381.520 3.467 50 0 GGAAMP CCN(CC1CC[NH+](C2CC[NH+](C)CC2)CC1)C(=O)c1csc(C(C)=O)c1 ZINC000012708179 1399054958 /nfs/dbraw/zinc/05/49/58/1399054958.db2.gz TUGYIAVJDPFLIV-UHFFFAOYSA-N 2 1 391.581 3.219 50 0 GGAAMP COc1cc(C[NH2+]CCSC)ccc1OC[C@H](O)C[N@@H+](C)C1CCCCC1 ZINC000014970363 1399129843 /nfs/dbraw/zinc/12/98/43/1399129843.db2.gz IHOJGGFVUNBPNO-LJQANCHMSA-N 2 1 396.597 3.152 50 0 GGAAMP COCC[NH+]1CCC(C[N@@H+](Cc2ccncc2)C2CSCCSC2)CC1 ZINC000020389534 1399345754 /nfs/dbraw/zinc/34/57/54/1399345754.db2.gz SEQJQCPQJRMIRC-UHFFFAOYSA-N 2 1 395.638 3.091 50 0 GGAAMP Cc1ccc(-c2ccccc2C[N@@H+]2CCN(C3CC[NH+](C)CC3)[C@@H](CCO)C2)o1 ZINC000020919947 1399357516 /nfs/dbraw/zinc/35/75/16/1399357516.db2.gz FMOSXFOWKJMAJY-QFIPXVFZSA-N 2 1 397.563 3.218 50 0 GGAAMP Cc1ccc(OCCC[N@H+](C)[C@@H]2c3ccccc3C3(CC[NH2+]CC3)[C@H]2O)cc1 ZINC000020917201 1399357648 /nfs/dbraw/zinc/35/76/48/1399357648.db2.gz ZJOFRVLBIHNZKX-PKTZIBPZSA-N 2 1 380.532 3.433 50 0 GGAAMP CC(C)(C)C[N@H+]1CCN(Cc2ccc(C[NH+]3CCCC3)s2)C[C@H]1CCO ZINC000104466266 1410897074 /nfs/dbraw/zinc/89/70/74/1410897074.db2.gz RTVIDEQEWKEZPF-GOSISDBHSA-N 2 1 379.614 3.259 50 0 GGAAMP CCc1[nH+]ccn1CCCNC(=O)N1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000426667441 529759700 /nfs/dbraw/zinc/75/97/00/529759700.db2.gz KKJWKBHHGOEZJX-UHFFFAOYSA-N 2 1 383.540 3.142 50 0 GGAAMP CCc1[nH+]ccn1CCCNC(=O)N1CCC([N@@H+](C)Cc2ccccc2)CC1 ZINC000426667441 529759701 /nfs/dbraw/zinc/75/97/01/529759701.db2.gz KKJWKBHHGOEZJX-UHFFFAOYSA-N 2 1 383.540 3.142 50 0 GGAAMP CN(CC1CC[NH+](CCc2ccccc2F)CC1)C(=O)[C@H]1CCCCC[N@H+]1C ZINC000011817084 204354130 /nfs/dbraw/zinc/35/41/30/204354130.db2.gz YRLCHNLMVVGFER-JOCHJYFZSA-N 2 1 389.559 3.413 50 0 GGAAMP COC1CC[NH+](Cc2ccc(OC[C@@H](O)C[N@@H+](C)Cc3ccccc3)cc2)CC1 ZINC000011839461 204356162 /nfs/dbraw/zinc/35/61/62/204356162.db2.gz KTYMQXAUHPKSCN-QFIPXVFZSA-N 2 1 398.547 3.169 50 0 GGAAMP Cc1ccc(C[NH+]2CCC(C[N@H+](C)Cc3ccc(N4CCNC4=O)cc3)CC2)o1 ZINC000011841574 204356789 /nfs/dbraw/zinc/35/67/89/204356789.db2.gz SPLFLLMLQZECFZ-UHFFFAOYSA-N 2 1 396.535 3.462 50 0 GGAAMP CCc1ccc(C[NH+]2CCC(CCC(=O)NC[C@H]3CCC[N@@H+]3CC)CC2)o1 ZINC000011842567 204356854 /nfs/dbraw/zinc/35/68/54/204356854.db2.gz TWRBFUUKXYGEKM-LJQANCHMSA-N 2 1 375.557 3.435 50 0 GGAAMP CCc1ccc(C[NH+]2CCC(CCC(=O)NC[C@@H]3CCC[N@@H+]3CC)CC2)o1 ZINC000011842566 204357574 /nfs/dbraw/zinc/35/75/74/204357574.db2.gz TWRBFUUKXYGEKM-IBGZPJMESA-N 2 1 375.557 3.435 50 0 GGAAMP CC(C)[NH+]1CCC([N@H+]2CCC[C@@H](C(=O)NCCc3ccccc3F)C2)CC1 ZINC000011873119 204360051 /nfs/dbraw/zinc/36/00/51/204360051.db2.gz QSXKBRZYURBISY-LJQANCHMSA-N 2 1 375.532 3.069 50 0 GGAAMP O=C(NCc1ccccn1)[C@H]1CCC[N@H+](C2CC[NH+](CC3CCCCC3)CC2)C1 ZINC000011938046 204365131 /nfs/dbraw/zinc/36/51/31/204365131.db2.gz MTMLEPYTSCIXEB-NRFANRHFSA-N 2 1 398.595 3.455 50 0 GGAAMP CC(C)CN(C)C(=O)[C@H]1CCC[N@H+](C2CC[NH+](C3Cc4ccccc4C3)CC2)C1 ZINC000011996812 204366462 /nfs/dbraw/zinc/36/64/62/204366462.db2.gz OOXJGQFOKSOYIK-QFIPXVFZSA-N 2 1 397.607 3.445 50 0 GGAAMP C[N@@H+](C[C@H](O)COc1ccccc1C[NH2+]CCc1cccnc1)C1CCCCC1 ZINC000012205431 204382743 /nfs/dbraw/zinc/38/27/43/204382743.db2.gz HWBLTWUAFKBBDG-QHCPKHFHSA-N 2 1 397.563 3.418 50 0 GGAAMP COc1ccc(C[NH2+]Cc2ccc(C)s2)cc1OC[C@H](O)C[N@@H+](C)C(C)C ZINC000012210472 204383625 /nfs/dbraw/zinc/38/36/25/204383625.db2.gz HEIGSLIIMUVORG-GOSISDBHSA-N 2 1 392.565 3.435 50 0 GGAAMP C[N@H+](Cc1ccccc1)C[C@@H](O)COc1ccc(C[NH2+]CC2CCOCC2)cc1 ZINC000012300444 204390631 /nfs/dbraw/zinc/39/06/31/204390631.db2.gz HEQUFHPHWHMJRJ-HSZRJFAPSA-N 2 1 398.547 3.075 50 0 GGAAMP OCc1ccc(C[N@@H+](C[C@@H]2CCCO2)CC2CC[NH+](C3CCCC3)CC2)o1 ZINC000012298668 204390676 /nfs/dbraw/zinc/39/06/76/204390676.db2.gz NZFDUYQVLLQNIT-FQEVSTJZSA-N 2 1 376.541 3.408 50 0 GGAAMP C/C=C(\C)C[NH+]1CCC([NH+]2CCC(C(=O)NCCc3ccccc3)CC2)CC1 ZINC000012303466 204392320 /nfs/dbraw/zinc/39/23/20/204392320.db2.gz UDVHFYXVXAUDEG-BIMFAAKUSA-N 2 1 383.580 3.488 50 0 GGAAMP Cc1[nH+]ccn1-c1ccc(NC(=O)[C@H]2CCC[N@H+](Cc3ccncc3)C2)cc1 ZINC000012305029 204393016 /nfs/dbraw/zinc/39/30/16/204393016.db2.gz RSMCHOBBAXBHDN-IBGZPJMESA-N 2 1 375.476 3.426 50 0 GGAAMP Cc1[nH+]ccn1-c1ccc(NC(=O)[C@H]2CCC[N@@H+](Cc3ccncc3)C2)cc1 ZINC000012305029 204393020 /nfs/dbraw/zinc/39/30/20/204393020.db2.gz RSMCHOBBAXBHDN-IBGZPJMESA-N 2 1 375.476 3.426 50 0 GGAAMP C[N@@H+](Cc1cccnc1)Cc1cccc(OC[C@@H](O)C[NH+]2CCCCCC2)c1 ZINC000012318931 204395206 /nfs/dbraw/zinc/39/52/06/204395206.db2.gz CKGRQOJGCSYFCV-QFIPXVFZSA-N 2 1 383.536 3.329 50 0 GGAAMP O=C(NC1CC1)[C@H]1CCC[N@@H+](C2CC[NH+](Cc3ccnc4ccccc34)CC2)C1 ZINC000067805631 205260730 /nfs/dbraw/zinc/26/07/30/205260730.db2.gz IHPWKGNBBYEUBI-IBGZPJMESA-N 2 1 392.547 3.190 50 0 GGAAMP O=C(NC1CC1)[C@H]1CCC[N@H+](C2CC[NH+](Cc3ccnc4ccccc34)CC2)C1 ZINC000067805631 205260732 /nfs/dbraw/zinc/26/07/32/205260732.db2.gz IHPWKGNBBYEUBI-IBGZPJMESA-N 2 1 392.547 3.190 50 0 GGAAMP CC(C)(C)CC[NH+]1CCC([N@H+]2CCC[C@H](C(=O)NCc3ccccn3)C2)CC1 ZINC000067818526 205263049 /nfs/dbraw/zinc/26/30/49/205263049.db2.gz QZIFCAPHPOFGKY-IBGZPJMESA-N 2 1 386.584 3.310 50 0 GGAAMP O=C(NC1CC1)[C@@H]1CCC[N@@H+](C2CC[NH+](Cc3cccc4cccnc43)CC2)C1 ZINC000071315633 205280694 /nfs/dbraw/zinc/28/06/94/205280694.db2.gz WCQVZHSUOWHXBB-HXUWFJFHSA-N 2 1 392.547 3.190 50 0 GGAAMP O=C(NC1CC1)[C@@H]1CCC[N@H+](C2CC[NH+](Cc3cccc4cccnc43)CC2)C1 ZINC000071315633 205280698 /nfs/dbraw/zinc/28/06/98/205280698.db2.gz WCQVZHSUOWHXBB-HXUWFJFHSA-N 2 1 392.547 3.190 50 0 GGAAMP O=C([C@H]1CCC[N@@H+](C2CC[NH+](CCc3ccccc3)CC2)C1)N1CCCCC1 ZINC000071738474 205286860 /nfs/dbraw/zinc/28/68/60/205286860.db2.gz QXCHYRBYTNSQKU-QFIPXVFZSA-N 2 1 383.580 3.418 50 0 GGAAMP O=C([C@H]1CCC[N@H+](C2CC[NH+](CCc3ccccc3)CC2)C1)N1CCCCC1 ZINC000071738474 205286862 /nfs/dbraw/zinc/28/68/62/205286862.db2.gz QXCHYRBYTNSQKU-QFIPXVFZSA-N 2 1 383.580 3.418 50 0 GGAAMP CCC1(NC(=O)[C@H]2CCC[N@@H+](C3CC[NH+](CCc4ccccc4)CC3)C2)CC1 ZINC000071721644 205287313 /nfs/dbraw/zinc/28/73/13/205287313.db2.gz FFGCAVAKGSDHJG-NRFANRHFSA-N 2 1 383.580 3.464 50 0 GGAAMP CCC1(NC(=O)[C@H]2CCC[N@H+](C3CC[NH+](CCc4ccccc4)CC3)C2)CC1 ZINC000071721644 205287318 /nfs/dbraw/zinc/28/73/18/205287318.db2.gz FFGCAVAKGSDHJG-NRFANRHFSA-N 2 1 383.580 3.464 50 0 GGAAMP O=C([C@@H]1CCC[N@@H+](C2CC[NH+](CCc3ccccc3)CC2)C1)N1CCCCC1 ZINC000071738475 205287786 /nfs/dbraw/zinc/28/77/86/205287786.db2.gz QXCHYRBYTNSQKU-JOCHJYFZSA-N 2 1 383.580 3.418 50 0 GGAAMP O=C([C@@H]1CCC[N@H+](C2CC[NH+](CCc3ccccc3)CC2)C1)N1CCCCC1 ZINC000071738475 205287791 /nfs/dbraw/zinc/28/77/91/205287791.db2.gz QXCHYRBYTNSQKU-JOCHJYFZSA-N 2 1 383.580 3.418 50 0 GGAAMP O=C([C@H]1CCC[N@H+](C2CC[NH+](CCCc3ccccc3)CC2)C1)N1CCCC1 ZINC000071712237 205288076 /nfs/dbraw/zinc/28/80/76/205288076.db2.gz WNNWJMNFRCRJKE-QFIPXVFZSA-N 2 1 383.580 3.418 50 0 GGAAMP O=C(NC1CC1)[C@@H]1CCC[N@H+](C2CCN(c3cc[nH+]c4ccccc43)CC2)C1 ZINC000071752902 205292143 /nfs/dbraw/zinc/29/21/43/205292143.db2.gz PQNNXBFUMUZRFN-QGZVFWFLSA-N 2 1 378.520 3.194 50 0 GGAAMP CC(C)[NH+]1CCC([N@H+]2CCC[C@H](C(=O)N(C)Cc3nc4ccccc4[nH]3)C2)CC1 ZINC000071762019 205293383 /nfs/dbraw/zinc/29/33/83/205293383.db2.gz HXANUSBHYBPGJB-SFHVURJKSA-N 2 1 397.567 3.106 50 0 GGAAMP Cc1[nH+]ccn1CCC[N@@H+]1CCC(=O)N(Cc2ccc(F)cc2)[C@H](C(C)C)C1 ZINC000071763446 205294451 /nfs/dbraw/zinc/29/44/51/205294451.db2.gz OALYPIGUPHTFKI-NRFANRHFSA-N 2 1 386.515 3.480 50 0 GGAAMP Cc1[nH+]ccn1CCC[N@H+]1CCC(=O)N(Cc2ccc(F)cc2)[C@H](C(C)C)C1 ZINC000071763446 205294454 /nfs/dbraw/zinc/29/44/54/205294454.db2.gz OALYPIGUPHTFKI-NRFANRHFSA-N 2 1 386.515 3.480 50 0 GGAAMP CC(C)=CCC[NH+]1CCC([N@H+]2CCC[C@H](C(=O)NCc3cccnc3)C2)CC1 ZINC000071763864 205294965 /nfs/dbraw/zinc/29/49/65/205294965.db2.gz KSUUNHQQWAPISX-NRFANRHFSA-N 2 1 384.568 3.231 50 0 GGAAMP CCc1[nH+]ccn1CC(=O)N1CCC[N@H+](Cc2ccc(F)cc2)[C@@H](C(C)C)C1 ZINC000071765458 205295161 /nfs/dbraw/zinc/29/51/61/205295161.db2.gz QKEIWSKJBSDPSD-HXUWFJFHSA-N 2 1 386.515 3.344 50 0 GGAAMP CCc1[nH+]ccn1CC(=O)N1CCC[N@@H+](Cc2ccc(F)cc2)[C@@H](C(C)C)C1 ZINC000071765458 205295164 /nfs/dbraw/zinc/29/51/64/205295164.db2.gz QKEIWSKJBSDPSD-HXUWFJFHSA-N 2 1 386.515 3.344 50 0 GGAAMP CC(C)NC(=O)C[N@@H+]1CC[C@H](C2CC[NH+](Cc3cccc(F)c3F)CC2)C1 ZINC000072148592 205310624 /nfs/dbraw/zinc/31/06/24/205310624.db2.gz YWHOTBPJFGKTDH-KRWDZBQOSA-N 2 1 379.495 3.023 50 0 GGAAMP CC(C)NC(=O)C[N@H+]1CC[C@H](C2CC[NH+](Cc3cccc(F)c3F)CC2)C1 ZINC000072148592 205310629 /nfs/dbraw/zinc/31/06/29/205310629.db2.gz YWHOTBPJFGKTDH-KRWDZBQOSA-N 2 1 379.495 3.023 50 0 GGAAMP Cc1cccc2cc(C(=O)N3CCC[C@@H]([N@@H+](C)CCC[NH+](C)C)C3)c(C)nc12 ZINC000072153824 205312523 /nfs/dbraw/zinc/31/25/23/205312523.db2.gz OJJOUDOCVVLUPF-HXUWFJFHSA-N 2 1 382.552 3.340 50 0 GGAAMP Cc1cccc2cc(C(=O)N3CCC[C@@H]([N@H+](C)CCC[NH+](C)C)C3)c(C)nc12 ZINC000072153824 205312527 /nfs/dbraw/zinc/31/25/27/205312527.db2.gz OJJOUDOCVVLUPF-HXUWFJFHSA-N 2 1 382.552 3.340 50 0 GGAAMP COc1ccc(F)c(C[N@H+]2CCC[C@@]3(CCN(c4cc(C)[nH+]c(N)n4)C3)C2)c1 ZINC000072163940 205314904 /nfs/dbraw/zinc/31/49/04/205314904.db2.gz OUFUNVANEVIGMY-OAQYLSRUSA-N 2 1 385.487 3.007 50 0 GGAAMP CC(C)CN(Cc1ccccc1Cl)C(=O)[C@@H]1CC2(C[N@H+]1C)CC[NH2+]CC2 ZINC000072456931 205352048 /nfs/dbraw/zinc/35/20/48/205352048.db2.gz QJFHAGOPOXUQNS-IBGZPJMESA-N 2 1 377.960 3.399 50 0 GGAAMP CC(C)(C)OC(=O)N1CCC2(C[C@@H]([NH+]3CCC([NH+]4CCCC4)CC3)CO2)CC1 ZINC000006747709 205782640 /nfs/dbraw/zinc/78/26/40/205782640.db2.gz HDNITZDLRASXTN-LJQANCHMSA-N 2 1 393.572 3.105 50 0 GGAAMP Clc1ccc2c(NCCN3CCN(CC[NH+]4CCCC4)CC3)cc[nH+]c2c1 ZINC000252496512 206139387 /nfs/dbraw/zinc/13/93/87/206139387.db2.gz PKFGEHYJQUOZRP-UHFFFAOYSA-N 2 1 387.959 3.014 50 0 GGAAMP COCC[NH+]1CCC(CN(C)C(=O)[C@H]2C[C@@H](c3ccccc3)[N@H+]3CCC[C@H]23)CC1 ZINC000299772435 206188068 /nfs/dbraw/zinc/18/80/68/206188068.db2.gz XTZKEUFPKGASBK-ZRBLBEILSA-N 2 1 399.579 3.029 50 0 GGAAMP O=C(c1ccc(C[NH+]2CCc3ccccc3C2)cc1)N1CC[N@H+]2CCC[C@@H]2C1 ZINC000299776254 206189116 /nfs/dbraw/zinc/18/91/16/206189116.db2.gz MNTWVOUIMWZXRQ-HSZRJFAPSA-N 2 1 375.516 3.165 50 0 GGAAMP O=C(c1ccc(C[N@@H+]2CCc3ccccc3C2)cc1)N1CC[NH+]2CCC[C@@H]2C1 ZINC000299776254 206189122 /nfs/dbraw/zinc/18/91/22/206189122.db2.gz MNTWVOUIMWZXRQ-HSZRJFAPSA-N 2 1 375.516 3.165 50 0 GGAAMP O=C(c1ccc(C[N@H+]2CCc3ccccc3C2)cc1)N1CC[NH+]2CCC[C@@H]2C1 ZINC000299776254 206189127 /nfs/dbraw/zinc/18/91/27/206189127.db2.gz MNTWVOUIMWZXRQ-HSZRJFAPSA-N 2 1 375.516 3.165 50 0 GGAAMP C[N@@H+](CCc1ccccn1)Cc1ccc2c(c1)CN(C1CC[NH+](C)CC1)CCO2 ZINC000299802630 206193544 /nfs/dbraw/zinc/19/35/44/206193544.db2.gz UCSSTZVFFRKTCH-UHFFFAOYSA-N 2 1 394.563 3.045 50 0 GGAAMP CN1CCC([N@@H+]2CCOc3ccc(C[NH+](C)CCc4ccccn4)cc3C2)CC1 ZINC000299802630 206193547 /nfs/dbraw/zinc/19/35/47/206193547.db2.gz UCSSTZVFFRKTCH-UHFFFAOYSA-N 2 1 394.563 3.045 50 0 GGAAMP CN1CCC([N@H+]2CCOc3ccc(C[NH+](C)CCc4ccccn4)cc3C2)CC1 ZINC000299802630 206193551 /nfs/dbraw/zinc/19/35/51/206193551.db2.gz UCSSTZVFFRKTCH-UHFFFAOYSA-N 2 1 394.563 3.045 50 0 GGAAMP CN1CCC([NH+]2CCOc3ccc(C[N@H+](C)CCc4ccccn4)cc3C2)CC1 ZINC000299802630 206193556 /nfs/dbraw/zinc/19/35/56/206193556.db2.gz UCSSTZVFFRKTCH-UHFFFAOYSA-N 2 1 394.563 3.045 50 0 GGAAMP CN1CCC([NH+]2CCOc3ccc(C[N@@H+](C)CCc4ccccn4)cc3C2)CC1 ZINC000299802630 206193560 /nfs/dbraw/zinc/19/35/60/206193560.db2.gz UCSSTZVFFRKTCH-UHFFFAOYSA-N 2 1 394.563 3.045 50 0 GGAAMP CN(CC1CC[NH+](CCc2ccccc2F)CC1)C(=O)[C@H]1CCCC[N@H+]1C ZINC000011814841 221127722 /nfs/dbraw/zinc/12/77/22/221127722.db2.gz IWTBCWRYMGONNF-OAQYLSRUSA-N 2 1 375.532 3.023 50 0 GGAAMP CN(CC1CC[NH+](CCc2ccccc2F)CC1)C(=O)[C@@H]1CCCC[N@H+]1C ZINC000011814842 221128374 /nfs/dbraw/zinc/12/83/74/221128374.db2.gz IWTBCWRYMGONNF-NRFANRHFSA-N 2 1 375.532 3.023 50 0 GGAAMP C[NH+](C[C@@H](O)COc1cccc(C[N@@H+](C)Cc2cnccn2)c1)C1CCCCC1 ZINC000012072496 221147277 /nfs/dbraw/zinc/14/72/77/221147277.db2.gz RCSPGTRTDZEDIG-JOCHJYFZSA-N 2 1 398.551 3.113 50 0 GGAAMP C[NH+](C[C@@H](O)COc1cccc(C[N@H+](C)Cc2cnccn2)c1)C1CCCCC1 ZINC000012072496 221147280 /nfs/dbraw/zinc/14/72/80/221147280.db2.gz RCSPGTRTDZEDIG-JOCHJYFZSA-N 2 1 398.551 3.113 50 0 GGAAMP C[NH+](Cc1cccc(OC[C@H](O)C[N@H+](C)C2CCCCC2)c1)Cc1cnccn1 ZINC000012072496 221147282 /nfs/dbraw/zinc/14/72/82/221147282.db2.gz RCSPGTRTDZEDIG-JOCHJYFZSA-N 2 1 398.551 3.113 50 0 GGAAMP C[NH+](Cc1cccc(OC[C@H](O)C[N@@H+](C)C2CCCCC2)c1)Cc1cnccn1 ZINC000012072496 221147285 /nfs/dbraw/zinc/14/72/85/221147285.db2.gz RCSPGTRTDZEDIG-JOCHJYFZSA-N 2 1 398.551 3.113 50 0 GGAAMP CCCC[NH2+]Cc1ccc(OC)c(OC[C@@H](O)C[N@@H+](C)Cc2ccccc2)c1 ZINC000012075346 221148842 /nfs/dbraw/zinc/14/88/42/221148842.db2.gz OBSZZEINFWONHC-NRFANRHFSA-N 2 1 386.536 3.457 50 0 GGAAMP c1cn(Cc2ccccn2)c(C2CCN(c3cc(N4CCCC4)cn[nH+]3)CC2)[nH+]1 ZINC000095529188 136181656 /nfs/dbraw/zinc/18/16/56/136181656.db2.gz JQVQVPGDQSYMIN-UHFFFAOYSA-N 2 1 389.507 3.101 50 0 GGAAMP Cc1[nH+]ccn1CC[C@H]([NH2+]C1CCN(c2ncccn2)CC1)c1ccccc1 ZINC000095528039 136181759 /nfs/dbraw/zinc/18/17/59/136181759.db2.gz XJDLYUHOLPUVLA-NRFANRHFSA-N 2 1 376.508 3.372 50 0 GGAAMP Cc1cccc(C[N@H+]2CCN(c3cc(C)[nH+]c4ccccc43)C[C@H]2CCO)n1 ZINC000106959354 136196983 /nfs/dbraw/zinc/19/69/83/136196983.db2.gz ZCCRWOYQUUJOBX-HXUWFJFHSA-N 2 1 376.504 3.320 50 0 GGAAMP CCC[N@H+]1CC2(C[C@@H]1C(=O)NCCc1ccc(Cl)cc1)CC[NH+](C)CC2 ZINC000072476170 222264184 /nfs/dbraw/zinc/26/41/84/222264184.db2.gz BVIOWIOAAXJWGX-LJQANCHMSA-N 2 1 377.960 3.195 50 0 GGAAMP Cc1[nH+]ccn1Cc1nnc(C2CC[NH+](Cc3cc(C)ccc3C)CC2)n1C ZINC000096131942 570211592 /nfs/dbraw/zinc/21/15/92/570211592.db2.gz HOHUETBFMHRDGZ-UHFFFAOYSA-N 2 1 378.524 3.365 50 0 GGAAMP CC[N@H+]1C[C@H](c2ccccc2)CC2(CC[NH+](Cc3cn(CCO)nc3C)CC2)C1 ZINC000096138836 570212704 /nfs/dbraw/zinc/21/27/04/570212704.db2.gz WJWHQDNFDRYXTQ-JOCHJYFZSA-N 2 1 396.579 3.275 50 0 GGAAMP CC[N@H+]1C[C@@H](c2ccccc2)CC2(CC[NH+](Cc3cn(CCO)nc3C)CC2)C1 ZINC000096138837 570212738 /nfs/dbraw/zinc/21/27/38/570212738.db2.gz WJWHQDNFDRYXTQ-QFIPXVFZSA-N 2 1 396.579 3.275 50 0 GGAAMP CCn1c(Cn2cc[nH+]c2C)nnc1C1CC[NH+](Cc2cccc(F)c2)CC1 ZINC000096167207 570218123 /nfs/dbraw/zinc/21/81/23/570218123.db2.gz DAFSZCNJGHBJDA-UHFFFAOYSA-N 2 1 382.487 3.370 50 0 GGAAMP COc1cc(C[N@H+]2CCC3(CC[NH+](CC4CC4)CC3)[C@H](CO)C2)ccc1F ZINC000097217674 570238866 /nfs/dbraw/zinc/23/88/66/570238866.db2.gz QENFQFYHALZWJG-IBGZPJMESA-N 2 1 376.516 3.141 50 0 GGAAMP OC[C@H]1C[N@H+](C/C=C/c2ccccc2)CCC12CC[NH+](Cc1ncc[nH]1)CC2 ZINC000097272516 570240584 /nfs/dbraw/zinc/24/05/84/570240584.db2.gz IGIIJSDJFUAYOV-HXRGIAOBSA-N 2 1 380.536 3.020 50 0 GGAAMP OC[C@H]1C[N@@H+](C/C=C/c2ccccc2)CCC12CC[NH+](Cc1ncc[nH]1)CC2 ZINC000097272516 570240589 /nfs/dbraw/zinc/24/05/89/570240589.db2.gz IGIIJSDJFUAYOV-HXRGIAOBSA-N 2 1 380.536 3.020 50 0 GGAAMP OC[C@@H]1C[N@H+](C/C=C/c2ccccc2)CCC12CC[NH+](Cc1ncc[nH]1)CC2 ZINC000097272515 570240646 /nfs/dbraw/zinc/24/06/46/570240646.db2.gz IGIIJSDJFUAYOV-XBGMYJNYSA-N 2 1 380.536 3.020 50 0 GGAAMP OC[C@@H]1C[N@@H+](C/C=C/c2ccccc2)CCC12CC[NH+](Cc1ncc[nH]1)CC2 ZINC000097272515 570240651 /nfs/dbraw/zinc/24/06/51/570240651.db2.gz IGIIJSDJFUAYOV-XBGMYJNYSA-N 2 1 380.536 3.020 50 0 GGAAMP OC[C@H]1C[N@@H+](Cc2ccc(Cl)o2)CCC12CC[NH+](C1CCOCC1)CC2 ZINC000097437013 570243959 /nfs/dbraw/zinc/24/39/59/570243959.db2.gz SFFPGFHGOBNTSU-MRXNPFEDSA-N 2 1 382.932 3.008 50 0 GGAAMP Cc1cccc(OCCC[N@H+](C)[C@@H]2c3ccccc3C3(CC[NH2+]CC3)[C@H]2O)c1 ZINC000020206429 570247942 /nfs/dbraw/zinc/24/79/42/570247942.db2.gz LRDXOKFWFDXEOQ-PKTZIBPZSA-N 2 1 380.532 3.433 50 0 GGAAMP Cc1ccc(C[N@@H+]2CCN(C3CC[NH+](Cc4ccccc4)CC3)C[C@H]2CCO)o1 ZINC000104635737 570255860 /nfs/dbraw/zinc/25/58/60/570255860.db2.gz PMTSMFKRHVDVLB-HSZRJFAPSA-N 2 1 397.563 3.121 50 0 GGAAMP Cc1ccc(C[N@H+]2CCN(C3CC[NH+](Cc4ccccc4)CC3)C[C@H]2CCO)o1 ZINC000104635737 570255861 /nfs/dbraw/zinc/25/58/61/570255861.db2.gz PMTSMFKRHVDVLB-HSZRJFAPSA-N 2 1 397.563 3.121 50 0 GGAAMP C[NH+]1CCN(CC[C@@H]2CCCC[N@H+]2Cc2cnn(-c3ccc(F)cc3)c2)CC1 ZINC000215962208 570293922 /nfs/dbraw/zinc/29/39/22/570293922.db2.gz IDNJIKWFCAVGGQ-NRFANRHFSA-N 2 1 385.531 3.003 50 0 GGAAMP Cc1c2cc(C)ccc2oc1C[N@H+]1CCCn2nc([C@H](O)C[NH+](C)C)cc2C1 ZINC000221208172 570391944 /nfs/dbraw/zinc/39/19/44/570391944.db2.gz IDXVAPQRGRGGQK-HXUWFJFHSA-N 2 1 382.508 3.247 50 0 GGAAMP Cc1c2cc(C)ccc2oc1C[N@@H+]1CCCn2nc([C@H](O)C[NH+](C)C)cc2C1 ZINC000221208172 570391946 /nfs/dbraw/zinc/39/19/46/570391946.db2.gz IDXVAPQRGRGGQK-HXUWFJFHSA-N 2 1 382.508 3.247 50 0 GGAAMP CC(C)[C@H]1C[N@@H+](C[C@H]2CC[C@@H]([NH3+])CC2)CCC(=O)N1Cc1ccc(F)cc1 ZINC000243893383 570432695 /nfs/dbraw/zinc/43/26/95/570432695.db2.gz AQSJBMKWRXQKQH-JRGCBEDISA-N 2 1 375.532 3.402 50 0 GGAAMP O=C(C1CC[NH+](C[C@@H]2CC=CCC2)CC1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000015856064 570536154 /nfs/dbraw/zinc/53/61/54/570536154.db2.gz BCODXABMZKKHEF-OAQYLSRUSA-N 2 1 381.564 3.399 50 0 GGAAMP CCN(C[C@@H]1CCC[N@@H+](CCc2cccc(F)c2)C1)C(=O)C1CC[NH+](C)CC1 ZINC000012432075 570660047 /nfs/dbraw/zinc/66/00/47/570660047.db2.gz HPDCKAMYYZXVNI-HXUWFJFHSA-N 2 1 389.559 3.271 50 0 GGAAMP CCOCCC[NH2+]Cc1ccc(OC[C@@H](O)C[N@@H+](C)Cc2ccccc2)cc1 ZINC000012457980 570669653 /nfs/dbraw/zinc/66/96/53/570669653.db2.gz VONAYUUDUFKBMZ-QFIPXVFZSA-N 2 1 386.536 3.075 50 0 GGAAMP C[NH+](C)CCN(C[C@@H]1CCC[N@@H+](Cc2ccccc2F)C1)C(=O)c1cccnc1 ZINC000012592533 570687629 /nfs/dbraw/zinc/68/76/29/570687629.db2.gz VCGOUFZUTFNKEH-LJQANCHMSA-N 2 1 398.526 3.137 50 0 GGAAMP CC(=O)N1CCC([N@H+](C)C[C@H]2CCC[NH+](CCc3ccccc3F)C2)CC1 ZINC000012594569 570688849 /nfs/dbraw/zinc/68/88/49/570688849.db2.gz XWIPAHUYDXIGHS-LJQANCHMSA-N 2 1 375.532 3.023 50 0 GGAAMP CC(=O)N1CCC([N@@H+](C)C[C@H]2CCC[NH+](CCc3ccccc3F)C2)CC1 ZINC000012594569 570688852 /nfs/dbraw/zinc/68/88/52/570688852.db2.gz XWIPAHUYDXIGHS-LJQANCHMSA-N 2 1 375.532 3.023 50 0 GGAAMP CC(=O)N1CCC([NH+](C)C[C@H]2CCC[N@H+](CCc3ccccc3F)C2)CC1 ZINC000012594569 570688856 /nfs/dbraw/zinc/68/88/56/570688856.db2.gz XWIPAHUYDXIGHS-LJQANCHMSA-N 2 1 375.532 3.023 50 0 GGAAMP CC(=O)N1CCC([NH+](C)C[C@H]2CCC[N@@H+](CCc3ccccc3F)C2)CC1 ZINC000012594569 570688863 /nfs/dbraw/zinc/68/88/63/570688863.db2.gz XWIPAHUYDXIGHS-LJQANCHMSA-N 2 1 375.532 3.023 50 0 GGAAMP CC(C)[NH+]1CCC([N@H+]2CCC[C@@H](C(=O)NCCc3cccc(F)c3)C2)CC1 ZINC000012708940 570701442 /nfs/dbraw/zinc/70/14/42/570701442.db2.gz ONMAXKQTOBDCLJ-LJQANCHMSA-N 2 1 375.532 3.069 50 0 GGAAMP O=C(C1CC[NH+](C2CC[NH+](Cc3c[nH]c4ccccc34)CC2)CC1)N1CCCC1 ZINC000012759459 570710754 /nfs/dbraw/zinc/71/07/54/570710754.db2.gz NHKOEZMOPHZQFZ-UHFFFAOYSA-N 2 1 394.563 3.467 50 0 GGAAMP CC[NH+]1CCN(C(=O)CCC2CC[NH+](Cc3cccc(C(C)=O)c3)CC2)CC1 ZINC000014959175 570866150 /nfs/dbraw/zinc/86/61/50/570866150.db2.gz OSNUQOJVRGXVLA-UHFFFAOYSA-N 2 1 385.552 3.046 50 0 GGAAMP CC[NH+](CC)Cc1ccc(OC)c(OC[C@@H](O)C[N@@H+](C)Cc2ccccc2)c1 ZINC000014970689 570867905 /nfs/dbraw/zinc/86/79/05/570867905.db2.gz ISYFTYHAXCRJSW-NRFANRHFSA-N 2 1 386.536 3.409 50 0 GGAAMP CC[NH+](CC)Cc1ccc(OC)c(OC[C@H](O)C[N@@H+](C)Cc2ccccc2)c1 ZINC000014970693 570867942 /nfs/dbraw/zinc/86/79/42/570867942.db2.gz ISYFTYHAXCRJSW-OAQYLSRUSA-N 2 1 386.536 3.409 50 0 GGAAMP CC(=O)c1cccc(C[N@@H+]2CCC[C@@H](CCC(=O)N(C)C3CC[NH+](C)CC3)C2)c1 ZINC000014970516 570868016 /nfs/dbraw/zinc/86/80/16/570868016.db2.gz OFTUKLMGIIKLGD-FQEVSTJZSA-N 2 1 399.579 3.434 50 0 GGAAMP O=C(NCCc1ccco1)[C@@H]1CCC[N@@H+](C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000015075424 570878552 /nfs/dbraw/zinc/87/85/52/570878552.db2.gz SYJKSDKYSNPOLC-OAQYLSRUSA-N 2 1 395.547 3.315 50 0 GGAAMP O=C(NCCc1ccco1)[C@@H]1CCC[N@H+](C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000015075424 570878556 /nfs/dbraw/zinc/87/85/56/570878556.db2.gz SYJKSDKYSNPOLC-OAQYLSRUSA-N 2 1 395.547 3.315 50 0 GGAAMP CC(C)N(C)C(=O)[C@@H]1CCC[N@H+](C2CC[NH+](C3Cc4ccccc4C3)CC2)C1 ZINC000019223310 570963161 /nfs/dbraw/zinc/96/31/61/570963161.db2.gz VMNOTYFZCHOOCG-OAQYLSRUSA-N 2 1 383.580 3.197 50 0 GGAAMP Cn1cc(CN(CC[NH+]2CCCCC2)C[C@H]2CCC[N@H+](C3CCCC3)C2)cn1 ZINC000019224447 570964168 /nfs/dbraw/zinc/96/41/68/570964168.db2.gz SRKUVUXTFZJBJM-OAQYLSRUSA-N 2 1 387.616 3.363 50 0 GGAAMP CC[N@H+](Cc1ccc2nsnc2c1)CC1CC[NH+](C2CCN(C)CC2)CC1 ZINC000019336659 570976458 /nfs/dbraw/zinc/97/64/58/570976458.db2.gz VHVBKRRVPWCTJY-UHFFFAOYSA-N 2 1 387.597 3.319 50 0 GGAAMP CC[N@@H+](Cc1ccc2nsnc2c1)CC1CC[NH+](C2CC[NH+](C)CC2)CC1 ZINC000019336659 570976460 /nfs/dbraw/zinc/97/64/60/570976460.db2.gz VHVBKRRVPWCTJY-UHFFFAOYSA-N 3 1 387.597 3.319 50 0 GGAAMP CC[N@H+](Cc1ccc2nsnc2c1)CC1CC[NH+](C2CC[NH+](C)CC2)CC1 ZINC000019336659 570976462 /nfs/dbraw/zinc/97/64/62/570976462.db2.gz VHVBKRRVPWCTJY-UHFFFAOYSA-N 3 1 387.597 3.319 50 0 GGAAMP COCc1ncc(C[NH+]2CCC3(CC2)C[C@@H](c2ccccc2)C[N@@H+](C)C3)cn1 ZINC000091657351 571023753 /nfs/dbraw/zinc/02/37/53/571023753.db2.gz BPXASQQGXYWNGX-OAQYLSRUSA-N 2 1 380.536 3.325 50 0 GGAAMP CC[N@@H+]1C[C@@H](c2ccccc2)CC2(CCN(C(=O)Cn3cc[nH+]c3C)CC2)C1 ZINC000092002218 571040208 /nfs/dbraw/zinc/04/02/08/571040208.db2.gz URSPNHOGJGIOPN-NRFANRHFSA-N 2 1 380.536 3.310 50 0 GGAAMP CC[N@H+]1C[C@@H](c2ccccc2)CC2(CCN(C(=O)Cn3cc[nH+]c3C)CC2)C1 ZINC000092002218 571040211 /nfs/dbraw/zinc/04/02/11/571040211.db2.gz URSPNHOGJGIOPN-NRFANRHFSA-N 2 1 380.536 3.310 50 0 GGAAMP O=C1CCCN1CC[NH+]1CCC2(CC1)C[C@@H](c1ccccc1)C[N@H+](C1CC1)C2 ZINC000095375398 571064114 /nfs/dbraw/zinc/06/41/14/571064114.db2.gz OXHKQURPDHUOGS-OAQYLSRUSA-N 2 1 381.564 3.343 50 0 GGAAMP Cc1[nH+]ccn1CCC(=O)N1C[C@H]2CC[C@@H]1C[N@H+](CCCc1ccccc1)C2 ZINC000095377388 571065181 /nfs/dbraw/zinc/06/51/81/571065181.db2.gz PHYKDNMIGXLIPU-FCHUYYIVSA-N 2 1 380.536 3.137 50 0 GGAAMP Cc1[nH+]ccn1CCC(=O)N1C[C@H]2CC[C@@H]1C[N@@H+](CCCc1ccccc1)C2 ZINC000095377388 571065184 /nfs/dbraw/zinc/06/51/84/571065184.db2.gz PHYKDNMIGXLIPU-FCHUYYIVSA-N 2 1 380.536 3.137 50 0 GGAAMP COC[C@@]12CC[C@@H]([NH+]3CCOCC3)C[C@H]1CC[N@@H+](Cc1sc(C)nc1C)C2 ZINC000095390952 571072642 /nfs/dbraw/zinc/07/26/42/571072642.db2.gz UVYUFNBUPVOJHN-SBHAEUEKSA-N 2 1 393.597 3.099 50 0 GGAAMP CCc1[nH+]ccn1CCC(=O)N1C[C@@H](c2ccc(C)cc2)[C@@H]2[C@H]1C1CC[NH+]2CC1 ZINC000095504178 571077489 /nfs/dbraw/zinc/07/74/89/571077489.db2.gz MYPZTAAFQPFHAI-TUACAJSNSA-N 2 1 392.547 3.233 50 0 GGAAMP C[NH+](C)CCN(C[C@H]1CCC[N@@H+](Cc2ccccc2F)C1)C(=O)c1ccc[nH]1 ZINC000095505333 571078524 /nfs/dbraw/zinc/07/85/24/571078524.db2.gz XEZAKLRQDJWHPE-SFHVURJKSA-N 2 1 386.515 3.070 50 0 GGAAMP O[C@@H](COc1ccccc1C[N@@H+]1CCOC2(CCCC2)C1)C[NH+]1CCCCC1 ZINC000095508705 571080345 /nfs/dbraw/zinc/08/03/45/571080345.db2.gz UNQFDXGNAXOPOW-OAQYLSRUSA-N 2 1 388.552 3.057 50 0 GGAAMP O[C@@H](COc1ccccc1C[N@H+]1CCOC2(CCCC2)C1)C[NH+]1CCCCC1 ZINC000095508705 571080346 /nfs/dbraw/zinc/08/03/46/571080346.db2.gz UNQFDXGNAXOPOW-OAQYLSRUSA-N 2 1 388.552 3.057 50 0 GGAAMP O[C@H](COc1cccc(C[NH+]2CCCCC2)c1)C[N@H+]1CCc2ccccc2C1 ZINC000095518297 571085357 /nfs/dbraw/zinc/08/53/57/571085357.db2.gz SVIVRWZGPFZWJD-QHCPKHFHSA-N 2 1 380.532 3.471 50 0 GGAAMP COc1ccc(C[N@H+](C)Cc2ccoc2)cc1OC[C@@H](O)C[NH+]1CCCCC1 ZINC000095522670 571088179 /nfs/dbraw/zinc/08/81/79/571088179.db2.gz ZJBSHNPJCQLMPD-FQEVSTJZSA-N 2 1 388.508 3.146 50 0 GGAAMP COc1ccc(C[N@@H+](C)Cc2ccoc2)cc1OC[C@@H](O)C[NH+]1CCCCC1 ZINC000095522670 571088182 /nfs/dbraw/zinc/08/81/82/571088182.db2.gz ZJBSHNPJCQLMPD-FQEVSTJZSA-N 2 1 388.508 3.146 50 0 GGAAMP COc1ccc(C[N@@H+](C)Cc2ccsc2)cc1OC[C@H](O)C[NH+]1CCCC1 ZINC000095522437 571088382 /nfs/dbraw/zinc/08/83/82/571088382.db2.gz WIWKVNRJQDFQHQ-LJQANCHMSA-N 2 1 390.549 3.224 50 0 GGAAMP C[NH+](C)CCN(C[C@H]1CCC[N@@H+](Cc2ccccc2F)C1)C(=O)c1ccncc1 ZINC000095524328 571089533 /nfs/dbraw/zinc/08/95/33/571089533.db2.gz LTFVQNBSABDWJY-IBGZPJMESA-N 2 1 398.526 3.137 50 0 GGAAMP O[C@H](COc1ccc(C[N@H+]2CCOC3(CCCC3)C2)cc1)C[NH+]1CCCCC1 ZINC000095524590 571089625 /nfs/dbraw/zinc/08/96/25/571089625.db2.gz YLILJOKUPHZXFS-NRFANRHFSA-N 2 1 388.552 3.057 50 0 GGAAMP COC1CC[NH+](Cc2ccccc2OC[C@@H](O)C[N@@H+](C)C2CCCCC2)CC1 ZINC000012002235 1399023704 /nfs/dbraw/zinc/02/37/04/1399023704.db2.gz KRUBIYVZMVERSA-NRFANRHFSA-N 2 1 390.568 3.302 50 0 GGAAMP C[NH+]1CCC([NH+]2CCC(CN(Cc3ccncc3)C(=O)C3=CCCC3)CC2)CC1 ZINC000012305062 1399037656 /nfs/dbraw/zinc/03/76/56/1399037656.db2.gz UYAFCOUTNJMHDZ-UHFFFAOYSA-N 2 1 396.579 3.327 50 0 GGAAMP Cc1cc(C[NH2+]Cc2cccc(OC[C@@H](O)C[N@@H+](C)C3CCCCC3)c2)on1 ZINC000012581056 1399048287 /nfs/dbraw/zinc/04/82/87/1399048287.db2.gz ZYROAWMZDDKYJX-FQEVSTJZSA-N 2 1 387.524 3.277 50 0 GGAAMP Cc1cc(C[NH2+]Cc2cccc(OC[C@@H](O)C[N@H+](C)C3CCCCC3)c2)on1 ZINC000012581056 1399048289 /nfs/dbraw/zinc/04/82/89/1399048289.db2.gz ZYROAWMZDDKYJX-FQEVSTJZSA-N 2 1 387.524 3.277 50 0 GGAAMP COCC[NH+]1CCC(C[N@H+](Cc2cccc(OC)c2)C[C@@H]2CCCO2)CC1 ZINC000012586235 1399049016 /nfs/dbraw/zinc/04/90/16/1399049016.db2.gz AOSSDIHVVNSNJK-QFIPXVFZSA-N 2 1 376.541 3.035 50 0 GGAAMP CC[NH+]1CCN(C(=O)CCC2CC[NH+](Cc3cccc(Cl)c3)CC2)CC1 ZINC000012709310 1399054748 /nfs/dbraw/zinc/05/47/48/1399054748.db2.gz VNFOYAJCYFTODW-UHFFFAOYSA-N 2 1 377.960 3.496 50 0 GGAAMP COc1ccc(C[NH2+]Cc2ccc(C)cc2)cc1OC[C@H](O)C[N@@H+](C)C(C)C ZINC000012703697 1399054844 /nfs/dbraw/zinc/05/48/44/1399054844.db2.gz IPIHLUPDZBKACM-OAQYLSRUSA-N 2 1 386.536 3.373 50 0 GGAAMP C[NH+]1CCC([N@@H+]2CCC[C@H](C(=O)NCCc3ccc4ccccc4c3)C2)CC1 ZINC000014950299 1399128807 /nfs/dbraw/zinc/12/88/07/1399128807.db2.gz YAOUKAZRTNCMNE-QFIPXVFZSA-N 2 1 379.548 3.305 50 0 GGAAMP C[NH+]1CCC([N@H+]2CCC[C@H](C(=O)NCCc3ccc4ccccc4c3)C2)CC1 ZINC000014950299 1399128811 /nfs/dbraw/zinc/12/88/11/1399128811.db2.gz YAOUKAZRTNCMNE-QFIPXVFZSA-N 2 1 379.548 3.305 50 0 GGAAMP COc1cc(C[NH2+]CCSC)ccc1OC[C@@H](O)C[N@@H+](C)C1CCCCC1 ZINC000014970359 1399129405 /nfs/dbraw/zinc/12/94/05/1399129405.db2.gz IHOJGGFVUNBPNO-IBGZPJMESA-N 2 1 396.597 3.152 50 0 GGAAMP CSCCCNC(=O)[C@H]1CCC[N@@H+](C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000014968537 1399129441 /nfs/dbraw/zinc/12/94/41/1399129441.db2.gz USENRHNXKHBTNE-FQEVSTJZSA-N 2 1 389.609 3.232 50 0 GGAAMP CSCCCNC(=O)[C@H]1CCC[N@H+](C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000014968537 1399129443 /nfs/dbraw/zinc/12/94/43/1399129443.db2.gz USENRHNXKHBTNE-FQEVSTJZSA-N 2 1 389.609 3.232 50 0 GGAAMP CCOCCC[NH2+]Cc1ccccc1OC[C@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000015077600 1399136567 /nfs/dbraw/zinc/13/65/67/1399136567.db2.gz QGSSNYIETXIJLY-HSZRJFAPSA-N 2 1 398.547 3.001 50 0 GGAAMP C[NH+]1CCN(C(=O)CC[C@H]2CCC[N@H+](Cc3cccc4cnccc43)C2)CC1 ZINC000019225286 1399328422 /nfs/dbraw/zinc/32/84/22/1399328422.db2.gz PWMMYRBLEZDTBE-LJQANCHMSA-N 2 1 380.536 3.001 50 0 GGAAMP C[NH+]1CCN(C(=O)CC[C@H]2CCC[N@@H+](Cc3cccc4cnccc43)C2)CC1 ZINC000019225286 1399328429 /nfs/dbraw/zinc/32/84/29/1399328429.db2.gz PWMMYRBLEZDTBE-LJQANCHMSA-N 2 1 380.536 3.001 50 0 GGAAMP OCC[C@@H]1CN(C2CC[NH+](CCc3ccccc3)CC2)CC[N@H+]1C1CCCC1 ZINC000019227700 1399328616 /nfs/dbraw/zinc/32/86/16/1399328616.db2.gz XCGYOAYIYBPZNC-XMMPIXPASA-N 2 1 385.596 3.005 50 0 GGAAMP OCC[C@H]1CN(C2CC[NH+](CCc3ccccc3)CC2)CC[N@H+]1C1CCCC1 ZINC000019227701 1399328758 /nfs/dbraw/zinc/32/87/58/1399328758.db2.gz XCGYOAYIYBPZNC-DEOSSOPVSA-N 2 1 385.596 3.005 50 0 GGAAMP Cc1cccc(-c2ncc(C[N@@H+]3CCC[C@H](N(C)CCC[NH+](C)C)C3)cn2)c1 ZINC000019633746 1399333297 /nfs/dbraw/zinc/33/32/97/1399333297.db2.gz GCRDYFDJQTWLKJ-QFIPXVFZSA-N 2 1 381.568 3.300 50 0 GGAAMP Cc1[nH]c2ccccc2c1C[N@@H+]1CCN(C2CC[NH+](C(C)C)CC2)[C@@H](CCO)C1 ZINC000019840553 1399338527 /nfs/dbraw/zinc/33/85/27/1399338527.db2.gz DDXBZGSBIDZSIC-NRFANRHFSA-N 2 1 398.595 3.218 50 0 GGAAMP CN1CCC([NH+]2CCC(C[N@@H+](Cc3ccncc3)Cc3ccccn3)CC2)CC1 ZINC000020208038 1399344609 /nfs/dbraw/zinc/34/46/09/1399344609.db2.gz BVFAUFIBLLMJQT-UHFFFAOYSA-N 2 1 393.579 3.285 50 0 GGAAMP C[N@@H+](C[C@H](O)COc1cccc(C[NH2+]CCc2cccnc2)c1)C1CCCCC1 ZINC000020455849 1399347462 /nfs/dbraw/zinc/34/74/62/1399347462.db2.gz IYWCRTZWRMYLSC-QHCPKHFHSA-N 2 1 397.563 3.418 50 0 GGAAMP CN(C(=O)c1cccc(-c2ccccc2OCC[NH+](C)C)c1)[C@@H]1CC[N@@H+](C)C1 ZINC000426668520 231250149 /nfs/dbraw/zinc/25/01/49/231250149.db2.gz ZGZFAMYNZMHKOI-HXUWFJFHSA-N 2 1 381.520 3.070 50 0 GGAAMP O=C(CCC1CC[NH+](C2CC[NH+](Cc3ccccc3)CC2)CC1)N1CCOCC1 ZINC000012718435 206927273 /nfs/dbraw/zinc/92/72/73/206927273.db2.gz HVJCHLTWLJSWQG-UHFFFAOYSA-N 2 1 399.579 3.002 50 0 GGAAMP C[C@@H](COc1ccccc1)[N@H+]1CCOc2ccc(C[NH+]3CCC(O)CC3)cc2C1 ZINC000014997639 207040807 /nfs/dbraw/zinc/04/08/07/207040807.db2.gz RQARAWSOBRPRLV-IBGZPJMESA-N 2 1 396.531 3.305 50 0 GGAAMP CC[N@H+]1CCC[C@@H]1CN(CC1CC[NH+](CCOC)CC1)C(=O)C1=CCCCC1 ZINC000015077933 207045692 /nfs/dbraw/zinc/04/56/92/207045692.db2.gz OGCKQGXULIGXDJ-JOCHJYFZSA-N 2 1 391.600 3.158 50 0 GGAAMP CCOCCC[NH2+]Cc1ccccc1OC[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000015077598 207045835 /nfs/dbraw/zinc/04/58/35/207045835.db2.gz QGSSNYIETXIJLY-QHCPKHFHSA-N 2 1 398.547 3.001 50 0 GGAAMP O=C(NCc1cccnc1)C1CC[NH+](C2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000015066119 207043040 /nfs/dbraw/zinc/04/30/40/207043040.db2.gz GKBNFBFOIFZKCN-UHFFFAOYSA-N 2 1 392.547 3.074 50 0 GGAAMP COc1ccc(C[NH2+]CC2CC2)cc1OC[C@@H](O)C[N@@H+](C)Cc1ccccc1 ZINC000015072576 207044280 /nfs/dbraw/zinc/04/42/80/207044280.db2.gz YMBBXGALHPJVBB-NRFANRHFSA-N 2 1 384.520 3.067 50 0 GGAAMP CCN(CC1CC[NH+](C2CC[NH+](C)CC2)CC1)C(=O)c1ccccc1N(C)C ZINC000019226679 207110049 /nfs/dbraw/zinc/11/00/49/207110049.db2.gz GCPSPEKLNNRKKB-UHFFFAOYSA-N 2 1 386.584 3.021 50 0 GGAAMP C[NH+]1CCN([C@@H]2CC[N@H+](Cc3cccc4c5ccccc5sc43)C[C@H]2O)CC1 ZINC000019742866 207157328 /nfs/dbraw/zinc/15/73/28/207157328.db2.gz OSXSRODUWYIUMN-NHCUHLMSSA-N 2 1 395.572 3.237 50 0 GGAAMP C[NH+]1CCN([C@@H]2CC[N@@H+](Cc3cccc4c5ccccc5sc43)C[C@H]2O)CC1 ZINC000019742866 207157333 /nfs/dbraw/zinc/15/73/33/207157333.db2.gz OSXSRODUWYIUMN-NHCUHLMSSA-N 2 1 395.572 3.237 50 0 GGAAMP CC(C)[NH+]1CCC(N2CC[N@H+](C/C=C/c3ccc(F)cc3)C[C@@H]2CCO)CC1 ZINC000019741783 207158165 /nfs/dbraw/zinc/15/81/65/207158165.db2.gz SEUOSQLNDFAJHS-CRTIWDKESA-N 2 1 389.559 3.080 50 0 GGAAMP CC(C)[NH+]1CCC(N2CC[N@@H+](C/C=C/c3ccc(F)cc3)C[C@@H]2CCO)CC1 ZINC000019741783 207158169 /nfs/dbraw/zinc/15/81/69/207158169.db2.gz SEUOSQLNDFAJHS-CRTIWDKESA-N 2 1 389.559 3.080 50 0 GGAAMP Cc1cc(C)cc(OCC[N@H+](C)[C@@H]2c3ccccc3C3(CC[NH2+]CC3)[C@H]2O)c1 ZINC000019866521 207167679 /nfs/dbraw/zinc/16/76/79/207167679.db2.gz SLVFURBPXFIZRP-PKTZIBPZSA-N 2 1 380.532 3.351 50 0 GGAAMP COc1ccc(C[NH+]2CCN(C3CC[NH+](Cc4ccccc4)CC3)CC2)cc1 ZINC000019831770 207165142 /nfs/dbraw/zinc/16/51/42/207165142.db2.gz XMWXKEGTVQBNAR-UHFFFAOYSA-N 2 1 379.548 3.477 50 0 GGAAMP CC(C)[NH+]1CCC([N@H+]2CCC[C@@H](C(=O)NCc3cccc4[nH]ccc43)C2)CC1 ZINC000020202651 207182190 /nfs/dbraw/zinc/18/21/90/207182190.db2.gz KBJBNRSDGRQODF-LJQANCHMSA-N 2 1 382.552 3.369 50 0 GGAAMP CCN(CC)C(=O)[C@@H]1CCC[N@H+](C2CC[NH+](C3Cc4ccccc4C3)CC2)C1 ZINC000020206683 207182678 /nfs/dbraw/zinc/18/26/78/207182678.db2.gz DBAXKAUFADUOOV-OAQYLSRUSA-N 2 1 383.580 3.199 50 0 GGAAMP C[NH+]1CCN(C(=O)CC[C@H]2CCC[N@H+](Cc3cccc4cccnc43)C2)CC1 ZINC000020449764 207193230 /nfs/dbraw/zinc/19/32/30/207193230.db2.gz XRSBENWZTQCRQV-LJQANCHMSA-N 2 1 380.536 3.001 50 0 GGAAMP C[NH+]1CCN(C(=O)CC[C@H]2CCC[N@@H+](Cc3cccc4cccnc43)C2)CC1 ZINC000020449764 207193233 /nfs/dbraw/zinc/19/32/33/207193233.db2.gz XRSBENWZTQCRQV-LJQANCHMSA-N 2 1 380.536 3.001 50 0 GGAAMP C[N@@H+](CCSc1ccccc1)Cc1cccc(-c2nc(C[NH3+])cc(=O)[nH]2)c1 ZINC000023250923 207271859 /nfs/dbraw/zinc/27/18/59/207271859.db2.gz JSFQCEMZNBGMMP-UHFFFAOYSA-N 2 1 380.517 3.120 50 0 GGAAMP Cn1cc[nH+]c1CCC[N@H+](C)C1CCN(c2cccc(-n3cccn3)c2)CC1 ZINC000023250953 207272675 /nfs/dbraw/zinc/27/26/75/207272675.db2.gz GGINQQSFMSPYNO-UHFFFAOYSA-N 2 1 378.524 3.139 50 0 GGAAMP Cn1cc[nH+]c1CCC[N@@H+](C)C1CCN(c2cccc(-n3cccn3)c2)CC1 ZINC000023250953 207272676 /nfs/dbraw/zinc/27/26/76/207272676.db2.gz GGINQQSFMSPYNO-UHFFFAOYSA-N 2 1 378.524 3.139 50 0 GGAAMP C[NH+]1CCC(NC(=O)c2ccc([C@@H]3CCC[N@@H+]3Cc3ccccn3)s2)CC1 ZINC000023311188 207273256 /nfs/dbraw/zinc/27/32/56/207273256.db2.gz AEQXROKLJVGBPO-SFHVURJKSA-N 2 1 384.549 3.304 50 0 GGAAMP C[NH+]1CCC(NC(=O)c2ccc([C@@H]3CCC[N@H+]3Cc3ccccn3)s2)CC1 ZINC000023311188 207273260 /nfs/dbraw/zinc/27/32/60/207273260.db2.gz AEQXROKLJVGBPO-SFHVURJKSA-N 2 1 384.549 3.304 50 0 GGAAMP C[NH+]1CCC(NC(=O)c2ccc([C@H]3CCC[N@@H+]3Cc3ccccn3)s2)CC1 ZINC000023311192 207273288 /nfs/dbraw/zinc/27/32/88/207273288.db2.gz AEQXROKLJVGBPO-GOSISDBHSA-N 2 1 384.549 3.304 50 0 GGAAMP C[NH+]1CCC(NC(=O)c2ccc([C@H]3CCC[N@H+]3Cc3ccccn3)s2)CC1 ZINC000023311192 207273292 /nfs/dbraw/zinc/27/32/92/207273292.db2.gz AEQXROKLJVGBPO-GOSISDBHSA-N 2 1 384.549 3.304 50 0 GGAAMP O=C(NC1CCCC1)[C@@H]1CCC[N@H+](C2CC[NH+](C3Cc4ccccc4C3)CC2)C1 ZINC000023340138 207274185 /nfs/dbraw/zinc/27/41/85/207274185.db2.gz WEVVMQJXNUVDNL-OAQYLSRUSA-N 2 1 395.591 3.389 50 0 GGAAMP OCC[C@H]1CN(C2CC[NH+](Cc3ccccc3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000023373116 207274526 /nfs/dbraw/zinc/27/45/26/207274526.db2.gz YWWKTFVQGJIDST-VWLOTQADSA-N 2 1 393.575 3.220 50 0 GGAAMP OCC[C@@H]1CN(C2CC[NH+](Cc3ccccc3)CC2)CC[N@H+]1Cc1ccccc1 ZINC000023373114 207275534 /nfs/dbraw/zinc/27/55/34/207275534.db2.gz YWWKTFVQGJIDST-RUZDIDTESA-N 2 1 393.575 3.220 50 0 GGAAMP C[N@H+]1CC[C@@H](CNc2nccc(C3(c4ccccc4Cl)CC[NH2+]CC3)n2)C1 ZINC000072411532 208019712 /nfs/dbraw/zinc/01/97/12/208019712.db2.gz JSOITIGURDKIHX-INIZCTEOSA-N 2 1 385.943 3.163 50 0 GGAAMP Cc1[nH+]ccn1CCC[NH+]1CCC2(CC1)C[C@@H](c1ccccc1)C(=O)N(C)C2 ZINC000091793521 208139609 /nfs/dbraw/zinc/13/96/09/208139609.db2.gz QATTYOLPSJNFRU-NRFANRHFSA-N 2 1 380.536 3.310 50 0 GGAAMP C[NH+]1CCC([NH+]2CCC3(CC2)C[C@H](c2ccccc2)C(=O)N(C2CC2)C3)CC1 ZINC000091713566 208136177 /nfs/dbraw/zinc/13/61/77/208136177.db2.gz AXMSZAALQKVNTJ-JOCHJYFZSA-N 2 1 381.564 3.341 50 0 GGAAMP CC(C)[NH+]1CCC([N@@H+]2C[C@@H](c3ccc4c(c3)OCO4)[C@@H]3[C@H]2C2CCN3CC2)CC1 ZINC000095362052 208160241 /nfs/dbraw/zinc/16/02/41/208160241.db2.gz CNMJFOIVCFOAHA-TUACAJSNSA-N 2 1 397.563 3.150 50 0 GGAAMP CC(C)[NH+]1CCC([N@H+]2C[C@@H](c3ccc4c(c3)OCO4)[C@@H]3[C@H]2C2CCN3CC2)CC1 ZINC000095362052 208160247 /nfs/dbraw/zinc/16/02/47/208160247.db2.gz CNMJFOIVCFOAHA-TUACAJSNSA-N 2 1 397.563 3.150 50 0 GGAAMP CCc1[nH+]ccn1CCC(=O)N1C[C@H]2CC[C@@H]1C[N@H+](Cc1ccc(F)cc1)C2 ZINC000095372844 208166051 /nfs/dbraw/zinc/16/60/51/208166051.db2.gz UOXDVAZAUYRFPJ-AZUAARDMSA-N 2 1 384.499 3.098 50 0 GGAAMP CCc1[nH+]ccn1CCC(=O)N1C[C@H]2CC[C@@H]1C[N@@H+](Cc1ccc(F)cc1)C2 ZINC000095372844 208166057 /nfs/dbraw/zinc/16/60/57/208166057.db2.gz UOXDVAZAUYRFPJ-AZUAARDMSA-N 2 1 384.499 3.098 50 0 GGAAMP COC[C@@]12CC[C@@H]([NH+]3CCOCC3)C[C@H]1CC[N@@H+](Cc1cc(C(C)C)no1)C2 ZINC000095377348 208170291 /nfs/dbraw/zinc/17/02/91/208170291.db2.gz PVLIBHHBAZIRAJ-KNKQGSTJSA-N 2 1 391.556 3.137 50 0 GGAAMP C[NH+](C)CCN(C[C@@H]1CCC[N@@H+](Cc2ccccc2F)C1)C(=O)C1CCC1 ZINC000095505927 208207500 /nfs/dbraw/zinc/20/75/00/208207500.db2.gz QBVQXZWMTKSOSZ-GOSISDBHSA-N 2 1 375.532 3.228 50 0 GGAAMP C[NH+](C)CCN(C[C@H]1CCC[N@@H+](Cc2ccccc2F)C1)C(=O)c1ccco1 ZINC000095507699 208207670 /nfs/dbraw/zinc/20/76/70/208207670.db2.gz GCJXWBBSZKMEDT-SFHVURJKSA-N 2 1 387.499 3.335 50 0 GGAAMP COc1ccc(/C=C/C[NH+]2CCC3(CCC(=O)N([C@H]4CC[N@@H+](C)C4)C3)CC2)cc1 ZINC000095500498 208201272 /nfs/dbraw/zinc/20/12/72/208201272.db2.gz IPJUIBJDUIRYTB-SHTLVRLNSA-N 2 1 397.563 3.117 50 0 GGAAMP CC[NH+](CC)C[C@H](O)COc1cc(C[NH+]2CCC(F)(F)CC2)ccc1OC ZINC000095499792 208202278 /nfs/dbraw/zinc/20/22/78/208202278.db2.gz BWSPYEBDTVIUCT-KRWDZBQOSA-N 2 1 386.483 3.008 50 0 GGAAMP COc1cc(C[N@H+]2CCCCC23CC3)ccc1OC[C@H](O)C[NH+](C)C(C)C ZINC000095510125 208211154 /nfs/dbraw/zinc/21/11/54/208211154.db2.gz HUTUNGWAKIPOQB-LJQANCHMSA-N 2 1 376.541 3.294 50 0 GGAAMP COc1cc(C[NH+]2CCCCC23CC3)ccc1OC[C@H](O)C[N@H+](C)C(C)C ZINC000095510125 208211161 /nfs/dbraw/zinc/21/11/61/208211161.db2.gz HUTUNGWAKIPOQB-LJQANCHMSA-N 2 1 376.541 3.294 50 0 GGAAMP COc1cc(C[NH+]2CCCCC23CC3)ccc1OC[C@H](O)C[N@@H+](C)C(C)C ZINC000095510125 208211169 /nfs/dbraw/zinc/21/11/69/208211169.db2.gz HUTUNGWAKIPOQB-LJQANCHMSA-N 2 1 376.541 3.294 50 0 GGAAMP C[N@H+](C[C@H](O)COc1cccc(C[NH+]2CCOC(C)(C)C2)c1)C1CCCCC1 ZINC000095517238 208216073 /nfs/dbraw/zinc/21/60/73/208216073.db2.gz DXJJNYPSCPVPDK-NRFANRHFSA-N 2 1 390.568 3.302 50 0 GGAAMP C[N@@H+](C[C@H](O)COc1cccc(C[NH+]2CCOC(C)(C)C2)c1)C1CCCCC1 ZINC000095517238 208216080 /nfs/dbraw/zinc/21/60/80/208216080.db2.gz DXJJNYPSCPVPDK-NRFANRHFSA-N 2 1 390.568 3.302 50 0 GGAAMP C[NH+](C[C@H](O)COc1cccc(C[N@@H+]2CCOC(C)(C)C2)c1)C1CCCCC1 ZINC000095517238 208216086 /nfs/dbraw/zinc/21/60/86/208216086.db2.gz DXJJNYPSCPVPDK-NRFANRHFSA-N 2 1 390.568 3.302 50 0 GGAAMP C[NH+](C[C@H](O)COc1cccc(C[N@H+]2CCOC(C)(C)C2)c1)C1CCCCC1 ZINC000095517238 208216089 /nfs/dbraw/zinc/21/60/89/208216089.db2.gz DXJJNYPSCPVPDK-NRFANRHFSA-N 2 1 390.568 3.302 50 0 GGAAMP COc1cc(C[N@@H+](C)C2CCSCC2)ccc1OC[C@@H](O)C[NH+](C)C(C)C ZINC000095522179 208219006 /nfs/dbraw/zinc/21/90/06/208219006.db2.gz SZLSEUMAEQQLFG-IBGZPJMESA-N 2 1 396.597 3.103 50 0 GGAAMP COc1cc(C[NH+](C)C2CCSCC2)ccc1OC[C@@H](O)C[N@H+](C)C(C)C ZINC000095522179 208219011 /nfs/dbraw/zinc/21/90/11/208219011.db2.gz SZLSEUMAEQQLFG-IBGZPJMESA-N 2 1 396.597 3.103 50 0 GGAAMP COc1cc(C[NH+](C)C2CCSCC2)ccc1OC[C@@H](O)C[N@@H+](C)C(C)C ZINC000095522179 208219019 /nfs/dbraw/zinc/21/90/19/208219019.db2.gz SZLSEUMAEQQLFG-IBGZPJMESA-N 2 1 396.597 3.103 50 0 GGAAMP COc1ccc(C[NH+]2CCC(F)(F)CC2)cc1OC[C@H](O)C[N@H+](C)C(C)C ZINC000095522648 208221733 /nfs/dbraw/zinc/22/17/33/208221733.db2.gz FQBDRJQRFNCLHM-QGZVFWFLSA-N 2 1 386.483 3.006 50 0 GGAAMP COc1ccc(C[NH+]2CCC(F)(F)CC2)cc1OC[C@H](O)C[N@@H+](C)C(C)C ZINC000095522648 208221740 /nfs/dbraw/zinc/22/17/40/208221740.db2.gz FQBDRJQRFNCLHM-QGZVFWFLSA-N 2 1 386.483 3.006 50 0 GGAAMP C[NH+](C)CCN(C[C@H]1CCC[N@@H+](Cc2ccccc2F)C1)C(=O)C1(C)CC1 ZINC000095525886 208222284 /nfs/dbraw/zinc/22/22/84/208222284.db2.gz CYBAXNJYZAIJEY-SFHVURJKSA-N 2 1 375.532 3.228 50 0 GGAAMP Cc1[nH+]cn(CC(=O)N(C)C[C@H]2CCC[N@H+](CCc3ccccc3C)C2)c1C ZINC000095530413 208228778 /nfs/dbraw/zinc/22/87/78/208228778.db2.gz DPYLHXNCIAPJPW-OAQYLSRUSA-N 2 1 382.552 3.221 50 0 GGAAMP Cc1[nH+]cn(CC(=O)N(C)C[C@H]2CCC[N@@H+](CCc3ccccc3C)C2)c1C ZINC000095530413 208228781 /nfs/dbraw/zinc/22/87/81/208228781.db2.gz DPYLHXNCIAPJPW-OAQYLSRUSA-N 2 1 382.552 3.221 50 0 GGAAMP C[N@@H+](Cc1ccccc1)C[C@@H](O)COc1ccc(C[NH+]2CCOC(C)(C)C2)cc1 ZINC000095531269 208230804 /nfs/dbraw/zinc/23/08/04/208230804.db2.gz XDKDXRGTQZWGDM-JOCHJYFZSA-N 2 1 398.547 3.169 50 0 GGAAMP C[N@H+](Cc1ccccc1)C[C@@H](O)COc1ccc(C[NH+]2CCOC(C)(C)C2)cc1 ZINC000095531269 208230806 /nfs/dbraw/zinc/23/08/06/208230806.db2.gz XDKDXRGTQZWGDM-JOCHJYFZSA-N 2 1 398.547 3.169 50 0 GGAAMP C[NH+](Cc1ccccc1)C[C@@H](O)COc1ccc(C[N@@H+]2CCOC(C)(C)C2)cc1 ZINC000095531269 208230811 /nfs/dbraw/zinc/23/08/11/208230811.db2.gz XDKDXRGTQZWGDM-JOCHJYFZSA-N 2 1 398.547 3.169 50 0 GGAAMP C[NH+](Cc1ccccc1)C[C@@H](O)COc1ccc(C[N@H+]2CCOC(C)(C)C2)cc1 ZINC000095531269 208230815 /nfs/dbraw/zinc/23/08/15/208230815.db2.gz XDKDXRGTQZWGDM-JOCHJYFZSA-N 2 1 398.547 3.169 50 0 GGAAMP Cc1[nH+]ccn1Cc1nnc(C2CC[NH+](Cc3cccc(Cl)c3)CC2)n1C ZINC000096148415 208273433 /nfs/dbraw/zinc/27/34/33/208273433.db2.gz KPTPGTUNXXUTCK-UHFFFAOYSA-N 2 1 384.915 3.401 50 0 GGAAMP Cc1[nH+]ccn1Cc1nnc(C2CC[NH+](Cc3ccc4[nH]ccc4c3)CC2)n1C ZINC000096162277 208281707 /nfs/dbraw/zinc/28/17/07/208281707.db2.gz QJSBLKNOMKCJGJ-UHFFFAOYSA-N 2 1 389.507 3.229 50 0 GGAAMP C/C(=C\c1ccccc1)C[N@@H+]1CCN(C2CC[NH+](C(C)C)CC2)[C@@H](CCO)C1 ZINC000096851486 208326091 /nfs/dbraw/zinc/32/60/91/208326091.db2.gz QSKZOQUYGOAFNE-QZPFXSPMSA-N 2 1 385.596 3.331 50 0 GGAAMP OC[C@H]1C[N@@H+](Cc2cccnc2)CCC12CC[NH+](Cc1cccc(F)c1)CC2 ZINC000097360069 208353912 /nfs/dbraw/zinc/35/39/12/208353912.db2.gz ZMDQTMSCVQZIIH-OAQYLSRUSA-N 2 1 383.511 3.317 50 0 GGAAMP OC[C@H]1C[N@@H+](Cc2ccc(Cl)cc2)CCC12CC[NH+](C1CCOCC1)CC2 ZINC000097785423 208364022 /nfs/dbraw/zinc/36/40/22/208364022.db2.gz FIDXHKXJMZMELL-LJQANCHMSA-N 2 1 392.971 3.415 50 0 GGAAMP CC(C)[C@@H](C(=O)N1CCC[C@@H](C[NH+]2CCC(C)CC2)C1)[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000230154178 209005871 /nfs/dbraw/zinc/00/58/71/209005871.db2.gz BXIHDSGTNAGLAG-CMOCDZPBSA-N 2 1 393.616 3.091 50 0 GGAAMP Cc1c[nH+]ccc1N1CCN(C(=O)[C@H]2C[C@@H](c3ccccc3)[N@H+]3CCC[C@H]23)CC1 ZINC000299801842 209093478 /nfs/dbraw/zinc/09/34/78/209093478.db2.gz YLECKTWAYFEVIM-WWNPGLIZSA-N 2 1 390.531 3.264 50 0 GGAAMP C[N@@H+](Cc1ccc(OCCN2CC[NH2+]CC2)cc1)Cc1ccc2ncccc2c1 ZINC000299788178 209089412 /nfs/dbraw/zinc/08/94/12/209089412.db2.gz XMCYLFFPFDKROQ-UHFFFAOYSA-N 2 1 390.531 3.151 50 0 GGAAMP C[NH+]1CCC(C[N@H+]2CCCC23CCN(c2cnc4ccccc4n2)CC3)CC1 ZINC000072406782 136169454 /nfs/dbraw/zinc/16/94/54/136169454.db2.gz KIOVMLHOHCVCAF-UHFFFAOYSA-N 2 1 379.552 3.406 50 0 GGAAMP CNc1nc(N2CCC([N@@H+](C)CCn3ccc4ccccc43)CC2)cc(C)[nH+]1 ZINC000095357676 136178128 /nfs/dbraw/zinc/17/81/28/136178128.db2.gz KHFKNYWRZANJJC-UHFFFAOYSA-N 2 1 378.524 3.382 50 0 GGAAMP Cc1ccc(N2CCC([NH2+]Cc3cc4n(n3)CC[N@H+](CC(C)C)C4)CC2)cc1 ZINC000095382030 136178693 /nfs/dbraw/zinc/17/86/93/136178693.db2.gz CWEOKEMYCWZCHI-UHFFFAOYSA-N 2 1 381.568 3.422 50 0 GGAAMP Cc1[nH+]ccn1CC[C@@H]([NH2+]C1CCN(c2ncccn2)CC1)c1ccccc1 ZINC000095528040 136181728 /nfs/dbraw/zinc/18/17/28/136181728.db2.gz XJDLYUHOLPUVLA-OAQYLSRUSA-N 2 1 376.508 3.372 50 0 GGAAMP Cc1cc(N2CCC[C@H](CCC(=O)N3CC[NH+](C)CC3)C2)c2ccccc2[nH+]1 ZINC000096139503 136184293 /nfs/dbraw/zinc/18/42/93/136184293.db2.gz BTQNBIVBHQIJRD-LJQANCHMSA-N 2 1 380.536 3.314 50 0 GGAAMP Cc1[nH+]ccn1-c1ccc(CNC(=O)c2ccc(C)cc2OCCC[NH3+])cc1 ZINC000299764047 209085575 /nfs/dbraw/zinc/08/55/75/209085575.db2.gz JRTMTSKALXOVRF-UHFFFAOYSA-N 2 1 378.476 3.147 50 0 GGAAMP C/C(=C\c1ccccc1)C[N@@H+]1CCN(C2CC[NH+](C(C)C)CC2)[C@H](CCO)C1 ZINC000105281521 570260810 /nfs/dbraw/zinc/26/08/10/570260810.db2.gz QSKZOQUYGOAFNE-FGNRIPBJSA-N 2 1 385.596 3.331 50 0 GGAAMP CC(C)[NH+]1CCC(N2CC[N@H+](C3C4CC5CC(C4)CC3C5)C[C@H]2CCO)CC1 ZINC000106740119 570260998 /nfs/dbraw/zinc/26/09/98/570260998.db2.gz JAGMYHSSYJFMMU-HLBYJKLHSA-N 2 1 389.628 3.053 50 0 GGAAMP CC(C)CNC(=O)[C@@H]1CCC[N@H+](C2CC[NH+](C3Cc4ccccc4C3)CC2)C1 ZINC000011753893 570581394 /nfs/dbraw/zinc/58/13/94/570581394.db2.gz SMCGLIQUNNXJEX-OAQYLSRUSA-N 2 1 383.580 3.102 50 0 GGAAMP COc1cc(C[NH2+]C2CCC2)ccc1OC[C@H](O)C[N@@H+](C)C1CCCCC1 ZINC000011764569 570582100 /nfs/dbraw/zinc/58/21/00/570582100.db2.gz ICIMFDHNFSQBBU-HXUWFJFHSA-N 2 1 376.541 3.342 50 0 GGAAMP CC[N@H+]1CCC[C@H]1CNC(=O)CCC1CC[NH+](Cc2cccc(C(C)=O)c2)CC1 ZINC000011815054 570583946 /nfs/dbraw/zinc/58/39/46/570583946.db2.gz OCLNALATZDDVCF-QHCPKHFHSA-N 2 1 399.579 3.482 50 0 GGAAMP COc1ccccc1CC[NH+]1CCC(CN(C)C(=O)CCn2cc[nH+]c2C)CC1 ZINC000011818899 570585438 /nfs/dbraw/zinc/58/54/38/570585438.db2.gz DBTWOUYEVVMZIO-UHFFFAOYSA-N 2 1 398.551 3.003 50 0 GGAAMP COC1CC[NH+](Cc2ccc(OC[C@H](O)C[N@@H+](C)Cc3ccccc3)cc2)CC1 ZINC000011839463 570586710 /nfs/dbraw/zinc/58/67/10/570586710.db2.gz KTYMQXAUHPKSCN-JOCHJYFZSA-N 2 1 398.547 3.169 50 0 GGAAMP CN(C(=O)CC[C@@H]1CCC[N@@H+](Cc2cccc(F)c2)C1)C1CC[NH+](C)CC1 ZINC000012026853 570599321 /nfs/dbraw/zinc/59/93/21/570599321.db2.gz XZEUBDSFLVVPGD-SFHVURJKSA-N 2 1 375.532 3.371 50 0 GGAAMP O=C1CC[N@H+](Cc2ccccc2C(F)(F)F)CCN1CC[NH+]1CCCCC1 ZINC000012201133 570624625 /nfs/dbraw/zinc/62/46/25/570624625.db2.gz CHNHRHMRNGCVHV-UHFFFAOYSA-N 2 1 383.458 3.226 50 0 GGAAMP O=C1CC[N@@H+](Cc2ccccc2C(F)(F)F)CCN1CC[NH+]1CCCCC1 ZINC000012201133 570624626 /nfs/dbraw/zinc/62/46/26/570624626.db2.gz CHNHRHMRNGCVHV-UHFFFAOYSA-N 2 1 383.458 3.226 50 0 GGAAMP O=C(NCc1cccnc1)[C@H]1CCC[N@@H+](C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000012306474 570639292 /nfs/dbraw/zinc/63/92/92/570639292.db2.gz PXIKQYIZHUHIEQ-QFIPXVFZSA-N 2 1 392.547 3.074 50 0 GGAAMP O=C(NCc1cccnc1)[C@H]1CCC[N@H+](C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000012306474 570639296 /nfs/dbraw/zinc/63/92/96/570639296.db2.gz PXIKQYIZHUHIEQ-QFIPXVFZSA-N 2 1 392.547 3.074 50 0 GGAAMP CCn1ccnc1C[N@H+](CCOC)CC1CC[NH+](Cc2ccccc2F)CC1 ZINC000012317618 570641650 /nfs/dbraw/zinc/64/16/50/570641650.db2.gz QJZMBKWREFJZFI-UHFFFAOYSA-N 2 1 388.531 3.403 50 0 GGAAMP CCn1ccnc1C[N@@H+](CCOC)CC1CC[NH+](Cc2ccccc2F)CC1 ZINC000012317618 570641655 /nfs/dbraw/zinc/64/16/55/570641655.db2.gz QJZMBKWREFJZFI-UHFFFAOYSA-N 2 1 388.531 3.403 50 0 GGAAMP Cc1[nH+]ccn1-c1ccc(NC(=O)[C@@H]2CCC[N@H+](CCCn3cccn3)C2)cc1 ZINC000012438738 570663020 /nfs/dbraw/zinc/66/30/20/570663020.db2.gz NSYYPNUMYLXUNS-LJQANCHMSA-N 2 1 392.507 3.118 50 0 GGAAMP Cc1[nH+]ccn1-c1ccc(NC(=O)[C@@H]2CCC[N@@H+](CCCn3cccn3)C2)cc1 ZINC000012438738 570663021 /nfs/dbraw/zinc/66/30/21/570663021.db2.gz NSYYPNUMYLXUNS-LJQANCHMSA-N 2 1 392.507 3.118 50 0 GGAAMP Cc1[nH+]ccn1-c1ccc(NC(=O)[C@H]2CCC[N@H+](CCCn3cccn3)C2)cc1 ZINC000012438739 570663042 /nfs/dbraw/zinc/66/30/42/570663042.db2.gz NSYYPNUMYLXUNS-IBGZPJMESA-N 2 1 392.507 3.118 50 0 GGAAMP Cc1[nH+]ccn1-c1ccc(NC(=O)[C@H]2CCC[N@@H+](CCCn3cccn3)C2)cc1 ZINC000012438739 570663043 /nfs/dbraw/zinc/66/30/43/570663043.db2.gz NSYYPNUMYLXUNS-IBGZPJMESA-N 2 1 392.507 3.118 50 0 GGAAMP C[NH+]1CCC([N@@H+]2CCC[C@@H](C(=O)NCC3(c4ccccc4)CCCC3)C2)CC1 ZINC000012466633 570671676 /nfs/dbraw/zinc/67/16/76/570671676.db2.gz SSWKATBVDDORCW-HXUWFJFHSA-N 2 1 383.580 3.421 50 0 GGAAMP C[NH+]1CCC([N@H+]2CCC[C@@H](C(=O)NCC3(c4ccccc4)CCCC3)C2)CC1 ZINC000012466633 570671680 /nfs/dbraw/zinc/67/16/80/570671680.db2.gz SSWKATBVDDORCW-HXUWFJFHSA-N 2 1 383.580 3.421 50 0 GGAAMP CCN(CC1CC[NH+](C2CC[NH+](C)CC2)CC1)C(=O)/C=C/c1cccs1 ZINC000012469549 570672292 /nfs/dbraw/zinc/67/22/92/570672292.db2.gz ICJCFPUQYYFAOJ-VOTSOKGWSA-N 2 1 375.582 3.416 50 0 GGAAMP COc1cc(C[NH2+]Cc2ccc(C)s2)ccc1OC[C@@H](O)C[N@@H+](C)C(C)C ZINC000012477962 570674314 /nfs/dbraw/zinc/67/43/14/570674314.db2.gz OSYWHXWFYYHYNA-SFHVURJKSA-N 2 1 392.565 3.435 50 0 GGAAMP CC(C)OCC[NH2+]Cc1ccc(OC[C@H](O)C[N@@H+](C)Cc2ccccc2)cc1 ZINC000012573418 570681752 /nfs/dbraw/zinc/68/17/52/570681752.db2.gz PWWYQJAZFWTJRD-JOCHJYFZSA-N 2 1 386.536 3.073 50 0 GGAAMP Cc1[nH+]ccn1-c1ccccc1C[NH2+]Cc1cn(CCC(N)=O)c2ccccc12 ZINC000055099885 570682846 /nfs/dbraw/zinc/68/28/46/570682846.db2.gz MVZJXARKSZLHJP-UHFFFAOYSA-N 2 1 387.487 3.301 50 0 GGAAMP O=C(NC1CC1)[C@@H]1CCC[N@@H+](C2CC[NH+](Cc3c[nH]c4ccccc34)CC2)C1 ZINC000012578734 570683509 /nfs/dbraw/zinc/68/35/09/570683509.db2.gz NWRUQNSWDPQWGW-QGZVFWFLSA-N 2 1 380.536 3.123 50 0 GGAAMP O=C(NC1CC1)[C@@H]1CCC[N@H+](C2CC[NH+](Cc3c[nH]c4ccccc34)CC2)C1 ZINC000012578734 570683511 /nfs/dbraw/zinc/68/35/11/570683511.db2.gz NWRUQNSWDPQWGW-QGZVFWFLSA-N 2 1 380.536 3.123 50 0 GGAAMP COc1ccccc1C[N@H+]1CCC[C@@H](CN(CC[NH+](C)C)C(=O)c2ccoc2)C1 ZINC000012709534 570701470 /nfs/dbraw/zinc/70/14/70/570701470.db2.gz FLZMTPARUKSRKB-LJQANCHMSA-N 2 1 399.535 3.204 50 0 GGAAMP O=C(CC[C@H]1CCC[N@@H+](C2CCOCC2)C1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000012711227 570702826 /nfs/dbraw/zinc/70/28/26/570702826.db2.gz MSXMIUHYXIRBFY-JOCHJYFZSA-N 2 1 399.579 3.002 50 0 GGAAMP O=C(CC[C@H]1CCC[N@H+](C2CCOCC2)C1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000012711227 570702828 /nfs/dbraw/zinc/70/28/28/570702828.db2.gz MSXMIUHYXIRBFY-JOCHJYFZSA-N 2 1 399.579 3.002 50 0 GGAAMP O=C(N[C@@H]1CCC[N@@H+](CCc2ccccc2)C1)C1CC[NH+](Cc2ccco2)CC1 ZINC000012761977 570711090 /nfs/dbraw/zinc/71/10/90/570711090.db2.gz PSWDTEXPIGEWLK-JOCHJYFZSA-N 2 1 395.547 3.315 50 0 GGAAMP O=C(NC1CC1)[C@H]1CCC[N@@H+](C2CC[NH+](Cc3cccc4ncccc34)CC2)C1 ZINC000067459790 570780458 /nfs/dbraw/zinc/78/04/58/570780458.db2.gz MNGYXZKMKLGLJR-IBGZPJMESA-N 2 1 392.547 3.190 50 0 GGAAMP O=C(NC1CC1)[C@H]1CCC[N@H+](C2CC[NH+](Cc3cccc4ncccc34)CC2)C1 ZINC000067459790 570780463 /nfs/dbraw/zinc/78/04/63/570780463.db2.gz MNGYXZKMKLGLJR-IBGZPJMESA-N 2 1 392.547 3.190 50 0 GGAAMP CC(C)(C)CC[NH+]1CCC([N@H+]2CCC[C@H](C(=O)NCc3cccnc3)C2)CC1 ZINC000071754764 570848598 /nfs/dbraw/zinc/84/85/98/570848598.db2.gz WQPNFRBBFHKNRZ-FQEVSTJZSA-N 2 1 386.584 3.310 50 0 GGAAMP CCN(C(=O)[C@@H]1CCC[N@@H+](C2CC[NH+](CCc3ccccc3)CC2)C1)C1CC1 ZINC000071763845 570851132 /nfs/dbraw/zinc/85/11/32/570851132.db2.gz FWDITPCXKTUQPH-OAQYLSRUSA-N 2 1 383.580 3.416 50 0 GGAAMP CCN(C(=O)[C@@H]1CCC[N@H+](C2CC[NH+](CCc3ccccc3)CC2)C1)C1CC1 ZINC000071763845 570851136 /nfs/dbraw/zinc/85/11/36/570851136.db2.gz FWDITPCXKTUQPH-OAQYLSRUSA-N 2 1 383.580 3.416 50 0 GGAAMP O=C(c1ccccc1[C@H]1CC[NH2+]C1)N1CCC[N@H+](C2Cc3ccccc3C2)CC1 ZINC000072171360 570877543 /nfs/dbraw/zinc/87/75/43/570877543.db2.gz KUXQJUXSQIIICU-NRFANRHFSA-N 2 1 389.543 3.079 50 0 GGAAMP c1c[nH]c(C[N@H+](C[C@H]2CCCO2)CC2CC[NH+](C3Cc4ccccc4C3)CC2)n1 ZINC000011819465 1399014596 /nfs/dbraw/zinc/01/45/96/1399014596.db2.gz GPRZYPKFNTZLIY-HSZRJFAPSA-N 2 1 394.563 3.270 50 0 GGAAMP c1c[nH]c(C[N@@H+](C[C@H]2CCCO2)CC2CC[NH+](C3Cc4ccccc4C3)CC2)n1 ZINC000011819465 1399014601 /nfs/dbraw/zinc/01/46/01/1399014601.db2.gz GPRZYPKFNTZLIY-HSZRJFAPSA-N 2 1 394.563 3.270 50 0 GGAAMP COc1ccc(C[NH2+]C(C2CC2)C2CC2)cc1OC[C@@H](O)C[N@@H+](C)C(C)C ZINC000011841480 1399015115 /nfs/dbraw/zinc/01/51/15/1399015115.db2.gz ASPAEZAFQQWRFS-IBGZPJMESA-N 2 1 376.541 3.053 50 0 GGAAMP CC[N@H+]1CCC[C@H]1CN(CC1CC[NH+](CCOC)CC1)C(=O)c1cccs1 ZINC000011874425 1399015891 /nfs/dbraw/zinc/01/58/91/1399015891.db2.gz XHKVZLGXOQMDBG-IBGZPJMESA-N 2 1 393.597 3.033 50 0 GGAAMP C[N@H+]1CCCN(C(=O)[C@H]2CC23CC[NH+](Cc2cc4ccccc4o2)CC3)CC1 ZINC000012048850 1399025515 /nfs/dbraw/zinc/02/55/15/1399025515.db2.gz RSVWBLSXJLZMDV-HXUWFJFHSA-N 2 1 381.520 3.199 50 0 GGAAMP CC[N@H+]1CCC[C@@H]1CN(CC1CC[NH+](CCOC)CC1)C(=O)CC1CCCC1 ZINC000012058496 1399026138 /nfs/dbraw/zinc/02/61/38/1399026138.db2.gz NCWWNRZNKNIFJF-JOCHJYFZSA-N 2 1 393.616 3.238 50 0 GGAAMP COCC[N@@H+](CC1CC[NH+](Cc2ccccc2F)CC1)C1CCN(C)CC1 ZINC000012072385 1399026472 /nfs/dbraw/zinc/02/64/72/1399026472.db2.gz DXSGCGDECMLQGC-UHFFFAOYSA-N 2 1 377.548 3.080 50 0 GGAAMP O=C(NC[C@@H]1CCC[N@@H+](Cc2cc(C[NH+]3CCCC3)cs2)C1)c1cccnc1 ZINC000012201657 1399033520 /nfs/dbraw/zinc/03/35/20/1399033520.db2.gz XNKSGCMOXJRGTC-SFHVURJKSA-N 2 1 398.576 3.381 50 0 GGAAMP C[N@@H+](C[C@H](O)COc1cccc(C[NH2+]Cc2cccnc2)c1)C1CCCCC1 ZINC000012304813 1399037256 /nfs/dbraw/zinc/03/72/56/1399037256.db2.gz NPBSKIZHLFYBTB-QFIPXVFZSA-N 2 1 383.536 3.376 50 0 GGAAMP CCN(CC1CC[NH+](C2CC[NH+](C)CC2)CC1)C(=O)CCc1cccc(F)c1 ZINC000012431236 1399041924 /nfs/dbraw/zinc/04/19/24/1399041924.db2.gz HDMCFQFIGHYNEA-UHFFFAOYSA-N 2 1 389.559 3.413 50 0 GGAAMP c1ncc(C[N@@H+](C[C@@H]2CCCO2)CC2CC[NH+](C3Cc4ccccc4C3)CC2)[nH]1 ZINC000012445100 1399043177 /nfs/dbraw/zinc/04/31/77/1399043177.db2.gz ASBKYTDUEQZPPG-DEOSSOPVSA-N 2 1 394.563 3.270 50 0 GGAAMP c1nc(C[N@H+](C[C@@H]2CCCO2)CC2CC[NH+](C3Cc4ccccc4C3)CC2)c[nH]1 ZINC000012445100 1399043181 /nfs/dbraw/zinc/04/31/81/1399043181.db2.gz ASBKYTDUEQZPPG-DEOSSOPVSA-N 2 1 394.563 3.270 50 0 GGAAMP c1nc(C[N@@H+](C[C@@H]2CCCO2)CC2CC[NH+](C3Cc4ccccc4C3)CC2)c[nH]1 ZINC000012445100 1399043183 /nfs/dbraw/zinc/04/31/83/1399043183.db2.gz ASBKYTDUEQZPPG-DEOSSOPVSA-N 2 1 394.563 3.270 50 0 GGAAMP CC(=O)N1CCC([N@@H+](C)CC2CC[NH+](CCc3cccc(F)c3)CC2)CC1 ZINC000012579188 1399048170 /nfs/dbraw/zinc/04/81/70/1399048170.db2.gz QZUQJGZEZLPACK-UHFFFAOYSA-N 2 1 375.532 3.023 50 0 GGAAMP Cc1cc(C[NH2+]Cc2cccc(OC[C@H](O)C[N@@H+](C)C3CCCCC3)c2)on1 ZINC000012581048 1399048267 /nfs/dbraw/zinc/04/82/67/1399048267.db2.gz ZYROAWMZDDKYJX-HXUWFJFHSA-N 2 1 387.524 3.277 50 0 GGAAMP Cc1cc(C[NH2+]Cc2cccc(OC[C@H](O)C[N@H+](C)C3CCCCC3)c2)on1 ZINC000012581048 1399048270 /nfs/dbraw/zinc/04/82/70/1399048270.db2.gz ZYROAWMZDDKYJX-HXUWFJFHSA-N 2 1 387.524 3.277 50 0 GGAAMP COCC[NH+]1CCC(C[N@H+](Cc2cccc(OC)c2)C[C@H]2CCCO2)CC1 ZINC000012586241 1399048826 /nfs/dbraw/zinc/04/88/26/1399048826.db2.gz AOSSDIHVVNSNJK-JOCHJYFZSA-N 2 1 376.541 3.035 50 0 GGAAMP C[N@@H+](C[C@H](O)COc1cccc(C[NH+]2CCSCC2)c1)C1CCCCC1 ZINC000012581379 1399049084 /nfs/dbraw/zinc/04/90/84/1399049084.db2.gz VUPQGZPTENDVQR-FQEVSTJZSA-N 2 1 378.582 3.240 50 0 GGAAMP CCOC(=O)N1CCC([N@@H+](CCc2ccccc2)CC2CC[NH+](C)CC2)CC1 ZINC000012595245 1399049415 /nfs/dbraw/zinc/04/94/15/1399049415.db2.gz GTBWWXGGYLVLOS-UHFFFAOYSA-N 2 1 387.568 3.494 50 0 GGAAMP O=C(c1cnccn1)N(CC[NH+]1CCCCC1)C[C@H]1CCC[N@H+](C2CCCC2)C1 ZINC000012701303 1399053898 /nfs/dbraw/zinc/05/38/98/1399053898.db2.gz OGJFLQUIFPEFQR-FQEVSTJZSA-N 2 1 399.583 3.059 50 0 GGAAMP O=C(CCC1CC[NH+](C2CCOCC2)CC1)N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000012763976 1399058152 /nfs/dbraw/zinc/05/81/52/1399058152.db2.gz RXERCABXMSOEOB-QFIPXVFZSA-N 2 1 399.579 3.048 50 0 GGAAMP CC[N@H+]1CCCC[C@H]1C(=O)N(C)CC1CC[NH+](CCc2ccccc2F)CC1 ZINC000014980442 1399129384 /nfs/dbraw/zinc/12/93/84/1399129384.db2.gz QAWLUHYNTQPHMK-QFIPXVFZSA-N 2 1 389.559 3.413 50 0 GGAAMP COc1ccc(CC[C@H](C)[N@@H+]2CCC(=O)N(CC[NH+]3CCCCC3)CC2)cc1 ZINC000014991289 1399130201 /nfs/dbraw/zinc/13/02/01/1399130201.db2.gz RRPBGMZIZDQZRS-FQEVSTJZSA-N 2 1 387.568 3.037 50 0 GGAAMP Cc1[nH+]ccn1CCC[NH2+]C1CCN(c2ccc(N3C(=O)CC[C@@H]3C)cc2)CC1 ZINC000020908280 1399357127 /nfs/dbraw/zinc/35/71/27/1399357127.db2.gz BFIAEHMYYQIRRF-SFHVURJKSA-N 2 1 395.551 3.356 50 0 GGAAMP Cc1[nH+]ccn1-c1ccc(N2CCC([NH2+]CCc3nncn3C(C)C)CC2)cc1 ZINC000023543134 1399569415 /nfs/dbraw/zinc/56/94/15/1399569415.db2.gz XFNQSBCMTQUGLP-UHFFFAOYSA-N 2 1 393.539 3.154 50 0 GGAAMP CC(C)CC[N@H+]1CCN(Cc2ccc(C[NH+]3CCCC3)s2)C[C@H]1CCO ZINC000104626344 1410916948 /nfs/dbraw/zinc/91/69/48/1410916948.db2.gz RBMNDXYGGMWDPI-LJQANCHMSA-N 2 1 379.614 3.259 50 0 GGAAMP CC(C)Cc1ccc(C[N@@H+]2CCCn3nc([C@H](O)C[NH+](C)C)cc3C2)s1 ZINC000230576868 1433372913 /nfs/dbraw/zinc/37/29/13/1433372913.db2.gz QNTKTONVIXMZOF-HXUWFJFHSA-N 2 1 376.570 3.144 50 0 GGAAMP CC(C)Cc1ccc(C[N@H+]2CCCn3nc([C@H](O)C[NH+](C)C)cc3C2)s1 ZINC000230576868 1433372916 /nfs/dbraw/zinc/37/29/16/1433372916.db2.gz QNTKTONVIXMZOF-HXUWFJFHSA-N 2 1 376.570 3.144 50 0 GGAAMP COc1ccccc1C[NH+]1CCN(C2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000019359707 210243817 /nfs/dbraw/zinc/24/38/17/210243817.db2.gz QVDZSEMYPHHKQG-UHFFFAOYSA-N 2 1 379.548 3.477 50 0 GGAAMP C[C@H]1CCCC[N@H+]1C1CN(C(=O)NCC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000426369941 231208502 /nfs/dbraw/zinc/20/85/02/231208502.db2.gz MZVBLRUWKBXPAF-IBGZPJMESA-N 2 1 384.568 3.167 50 0 GGAAMP Cc1c[nH+]ccc1N1CCCN(C(=O)NCC[C@@H]2CCCC[N@@H+]2C(C)C)CC1 ZINC000426669128 231251347 /nfs/dbraw/zinc/25/13/47/231251347.db2.gz ONJWOPUGXLBWDW-FQEVSTJZSA-N 2 1 387.572 3.265 50 0 GGAAMP CC(C)N(C)C(=O)[C@H]1CCC[N@H+](C2CC[NH+](C3Cc4ccccc4C3)CC2)C1 ZINC000019223313 210232589 /nfs/dbraw/zinc/23/25/89/210232589.db2.gz VMNOTYFZCHOOCG-NRFANRHFSA-N 2 1 383.580 3.197 50 0 GGAAMP CNc1nc(N2CC[C@@]3(C2)CCC[N@@H+](CCCc2ccccc2)C3)cc(C)[nH+]1 ZINC000426669016 529836365 /nfs/dbraw/zinc/83/63/65/529836365.db2.gz LUAHGWHBEPMSSM-QHCPKHFHSA-N 2 1 379.552 3.174 50 0 GGAAMP CC[N@H+]1CCC[C@H]1CNC(=O)CCC1CC[NH+](CCCC(F)(F)F)CC1 ZINC000015079655 210151731 /nfs/dbraw/zinc/15/17/31/210151731.db2.gz WVJYPGPJOSLSTR-KRWDZBQOSA-N 2 1 377.495 3.422 50 0 GGAAMP CC[N@H+]1CCC[C@H]1CN(CC1CC[NH+](CCOC)CC1)C(=O)C1=CCCCC1 ZINC000015077935 210151345 /nfs/dbraw/zinc/15/13/45/210151345.db2.gz OGCKQGXULIGXDJ-QFIPXVFZSA-N 2 1 391.600 3.158 50 0 GGAAMP CC[N@H+]1CCC[C@@H]1CN(CC1CC[NH+](CCOC)CC1)C(=O)c1ccsc1 ZINC000015064361 210146564 /nfs/dbraw/zinc/14/65/64/210146564.db2.gz AEJARCLUBZFASQ-HXUWFJFHSA-N 2 1 393.597 3.033 50 0 GGAAMP O=C(NCc1cccnc1)[C@@H]1CCC[N@H+](C2CC[NH+](CC3CCCCC3)CC2)C1 ZINC000015065042 210145032 /nfs/dbraw/zinc/14/50/32/210145032.db2.gz YBBUTNNPHGABJB-JOCHJYFZSA-N 2 1 398.595 3.455 50 0 GGAAMP O=C(NCc1cccnc1)[C@H]1CCC[N@H+](C2CC[NH+](CC3CCCCC3)CC2)C1 ZINC000015065043 210145774 /nfs/dbraw/zinc/14/57/74/210145774.db2.gz YBBUTNNPHGABJB-QFIPXVFZSA-N 2 1 398.595 3.455 50 0 GGAAMP O=C(NCC(F)(F)F)[C@H]1CCC[N@@H+](C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000014975157 210139037 /nfs/dbraw/zinc/13/90/37/210139037.db2.gz YOKSFLQAKCILKV-KRWDZBQOSA-N 2 1 383.458 3.042 50 0 GGAAMP O=C(NCC(F)(F)F)[C@H]1CCC[N@H+](C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000014975157 210139050 /nfs/dbraw/zinc/13/90/50/210139050.db2.gz YOKSFLQAKCILKV-KRWDZBQOSA-N 2 1 383.458 3.042 50 0 GGAAMP CCN(CC1CC[NH+](C2CC[NH+](C)CC2)CC1)C(=O)c1csc(SC)n1 ZINC000014971361 210135837 /nfs/dbraw/zinc/13/58/37/210135837.db2.gz HDUCSMLKOSTORC-UHFFFAOYSA-N 2 1 396.626 3.133 50 0 GGAAMP C[N@@H+](CCC1CCOCC1)Cc1ccc(OC[C@H](O)C[NH+]2CCCCC2)cc1 ZINC000014964366 210135328 /nfs/dbraw/zinc/13/53/28/210135328.db2.gz YGFVBYXICWUXRH-JOCHJYFZSA-N 2 1 390.568 3.161 50 0 GGAAMP CC(=O)c1cccc(C[N@@H+]2CCC[C@H](CCC(=O)N(C)C3CC[NH+](C)CC3)C2)c1 ZINC000014970520 210135048 /nfs/dbraw/zinc/13/50/48/210135048.db2.gz OFTUKLMGIIKLGD-HXUWFJFHSA-N 2 1 399.579 3.434 50 0 GGAAMP CN(CC1CC[NH+](CCc2ccc(F)cc2)CC1)C(=O)[C@H]1CCCC[N@H+]1C ZINC000012836608 210017076 /nfs/dbraw/zinc/01/70/76/210017076.db2.gz WEPQMVHOJBQJQP-OAQYLSRUSA-N 2 1 375.532 3.023 50 0 GGAAMP O=C(N[C@H]1CCC[N@@H+](CCc2ccccc2)C1)C1CC[NH+](Cc2ccco2)CC1 ZINC000012761982 210003264 /nfs/dbraw/zinc/00/32/64/210003264.db2.gz PSWDTEXPIGEWLK-QFIPXVFZSA-N 2 1 395.547 3.315 50 0 GGAAMP C[NH+](CCc1ccccn1)Cc1ccc2c(c1)C[N@@H+](C1CCOCC1)CCO2 ZINC000299785741 212037739 /nfs/dbraw/zinc/03/77/39/212037739.db2.gz KGXUIBMJAPQTDM-UHFFFAOYSA-N 2 1 381.520 3.130 50 0 GGAAMP C[N@@H+](CCc1ccccn1)Cc1ccc2c(c1)C[NH+](C1CCOCC1)CCO2 ZINC000299785741 212037734 /nfs/dbraw/zinc/03/77/34/212037734.db2.gz KGXUIBMJAPQTDM-UHFFFAOYSA-N 2 1 381.520 3.130 50 0 GGAAMP C[NH+](CCc1ccccn1)Cc1ccc2c(c1)C[N@H+](C1CCOCC1)CCO2 ZINC000299785741 212037738 /nfs/dbraw/zinc/03/77/38/212037738.db2.gz KGXUIBMJAPQTDM-UHFFFAOYSA-N 2 1 381.520 3.130 50 0 GGAAMP OC[C@@H]1C[N@@H+](Cc2ccc(Cl)cc2)CCC12CC[NH+](C1CCOCC1)CC2 ZINC000097785422 211373183 /nfs/dbraw/zinc/37/31/83/211373183.db2.gz FIDXHKXJMZMELL-IBGZPJMESA-N 2 1 392.971 3.415 50 0 GGAAMP CCc1ccc(C[N@H+]2CCC3(CC[NH+](Cc4ccncc4)CC3)[C@@H](CO)C2)o1 ZINC000097698866 211372235 /nfs/dbraw/zinc/37/22/35/211372235.db2.gz XXZOAXWRWHBQCL-HXUWFJFHSA-N 2 1 383.536 3.334 50 0 GGAAMP CSCCC[N@H+]1CCC2(CC[NH+](Cc3cccc(O)c3)CC2)[C@H](CO)C1 ZINC000097742636 211371753 /nfs/dbraw/zinc/37/17/53/211371753.db2.gz VBYBDSJQACDUJS-IBGZPJMESA-N 2 1 378.582 3.042 50 0 GGAAMP C[NH+](C)CCN(C[C@@H]1CCC[N@@H+](Cc2ccccc2F)C1)C(=O)c1ccoc1 ZINC000095529984 211275333 /nfs/dbraw/zinc/27/53/33/211275333.db2.gz XMEMOJOAZCAZDL-GOSISDBHSA-N 2 1 387.499 3.335 50 0 GGAAMP C[N@H+]1CC[C@H](C[NH+]2CCC3(CC(=O)N(Cc4ccc(Cl)cc4)C3)CC2)C1 ZINC000095530260 211274842 /nfs/dbraw/zinc/27/48/42/211274842.db2.gz LKWXJPQFASEYOI-SFHVURJKSA-N 2 1 375.944 3.106 50 0 GGAAMP C[N@H+]1CC[C@@H](C[NH+]2CCC3(CC(=O)N(Cc4ccc(Cl)cc4)C3)CC2)C1 ZINC000095530261 211274685 /nfs/dbraw/zinc/27/46/85/211274685.db2.gz LKWXJPQFASEYOI-GOSISDBHSA-N 2 1 375.944 3.106 50 0 GGAAMP Cc1[nH+]cn(CC(=O)N(C)C[C@@H]2CCC[N@H+](CCc3ccccc3C)C2)c1C ZINC000095530414 211274734 /nfs/dbraw/zinc/27/47/34/211274734.db2.gz DPYLHXNCIAPJPW-NRFANRHFSA-N 2 1 382.552 3.221 50 0 GGAAMP Cc1[nH+]cn(CC(=O)N(C)C[C@@H]2CCC[N@@H+](CCc3ccccc3C)C2)c1C ZINC000095530414 211274737 /nfs/dbraw/zinc/27/47/37/211274737.db2.gz DPYLHXNCIAPJPW-NRFANRHFSA-N 2 1 382.552 3.221 50 0 GGAAMP O[C@@H](COc1ccc(C[NH+]2CCC(F)CC2)cc1)C[N@H+]1CCc2ccccc2C1 ZINC000095524959 211270180 /nfs/dbraw/zinc/27/01/80/211270180.db2.gz GRTYHVFBFYVOAK-HSZRJFAPSA-N 2 1 398.522 3.419 50 0 GGAAMP COc1ccc(C[NH+]2CCC(F)(F)CC2)cc1OC[C@@H](O)C[N@H+](C)C(C)C ZINC000095522647 211269418 /nfs/dbraw/zinc/26/94/18/211269418.db2.gz FQBDRJQRFNCLHM-KRWDZBQOSA-N 2 1 386.483 3.006 50 0 GGAAMP COc1ccc(C[NH+]2CCC(F)(F)CC2)cc1OC[C@@H](O)C[N@@H+](C)C(C)C ZINC000095522647 211269423 /nfs/dbraw/zinc/26/94/23/211269423.db2.gz FQBDRJQRFNCLHM-KRWDZBQOSA-N 2 1 386.483 3.006 50 0 GGAAMP CC[NH+](CC)C[C@@H](O)COc1ccc(C[NH+]2CCC(F)(F)CC2)cc1OC ZINC000095496564 211251700 /nfs/dbraw/zinc/25/17/00/211251700.db2.gz XQLJIEXPOAKTDX-QGZVFWFLSA-N 2 1 386.483 3.008 50 0 GGAAMP C[N@H+](C[C@@H](O)COc1cccc(C[NH+]2CCOC(C)(C)C2)c1)C1CCCCC1 ZINC000095517237 211263425 /nfs/dbraw/zinc/26/34/25/211263425.db2.gz DXJJNYPSCPVPDK-OAQYLSRUSA-N 2 1 390.568 3.302 50 0 GGAAMP C[N@@H+](C[C@@H](O)COc1cccc(C[NH+]2CCOC(C)(C)C2)c1)C1CCCCC1 ZINC000095517237 211263430 /nfs/dbraw/zinc/26/34/30/211263430.db2.gz DXJJNYPSCPVPDK-OAQYLSRUSA-N 2 1 390.568 3.302 50 0 GGAAMP C[NH+](C[C@@H](O)COc1cccc(C[N@@H+]2CCOC(C)(C)C2)c1)C1CCCCC1 ZINC000095517237 211263435 /nfs/dbraw/zinc/26/34/35/211263435.db2.gz DXJJNYPSCPVPDK-OAQYLSRUSA-N 2 1 390.568 3.302 50 0 GGAAMP C[NH+](C[C@@H](O)COc1cccc(C[N@H+]2CCOC(C)(C)C2)c1)C1CCCCC1 ZINC000095517237 211263442 /nfs/dbraw/zinc/26/34/42/211263442.db2.gz DXJJNYPSCPVPDK-OAQYLSRUSA-N 2 1 390.568 3.302 50 0 GGAAMP O[C@H](COc1cccc(C[NH+]2CCC(F)CC2)c1)C[N@H+]1CCc2ccccc2C1 ZINC000095510077 211260670 /nfs/dbraw/zinc/26/06/70/211260670.db2.gz SQSMICTUQJFAIW-QHCPKHFHSA-N 2 1 398.522 3.419 50 0 GGAAMP O=C(c1cnco1)N(CC[NH+]1CCCCC1)C[C@@H]1CCC[N@H+](C2CCCC2)C1 ZINC000095510113 211260233 /nfs/dbraw/zinc/26/02/33/211260233.db2.gz CSQGFXZNDNAJSX-LJQANCHMSA-N 2 1 388.556 3.257 50 0 GGAAMP COc1ccc(C[N@H+]2CCC3(CCCC3)C2)cc1OC[C@H](O)C[NH+]1CCCC1 ZINC000095506156 211258327 /nfs/dbraw/zinc/25/83/27/211258327.db2.gz LWMGHJXZHCQIEC-HXUWFJFHSA-N 2 1 388.552 3.297 50 0 GGAAMP COc1cc(C[N@@H+](C)CC2CC2)ccc1OC[C@@H](O)C[NH+]1CCCCCC1 ZINC000095505642 211258367 /nfs/dbraw/zinc/25/83/67/211258367.db2.gz KOTIPGXHTJFXPM-FQEVSTJZSA-N 2 1 376.541 3.153 50 0 GGAAMP COc1ccc(C[N@H+]2CCc3ccccc3C2)cc1OC[C@H](O)C[NH+]1CCCC1 ZINC000095507596 211257999 /nfs/dbraw/zinc/25/79/99/211257999.db2.gz WKYUTFKGCFDQNT-JOCHJYFZSA-N 2 1 396.531 3.089 50 0 GGAAMP C[NH+](C)CCN(C[C@H]1CCC[N@@H+](Cc2ccccc2F)C1)C(=O)C(C)(C)C ZINC000095507140 211256907 /nfs/dbraw/zinc/25/69/07/211256907.db2.gz BKALHNNAZWZHHV-SFHVURJKSA-N 2 1 377.548 3.474 50 0 GGAAMP COc1ccc(C[N@@H+](C)Cc2ccco2)cc1OC[C@H](O)C[NH+]1CCCCC1 ZINC000095497752 211250245 /nfs/dbraw/zinc/25/02/45/211250245.db2.gz JNDBMLFYODPMQN-LJQANCHMSA-N 2 1 388.508 3.146 50 0 GGAAMP COc1ccc(C[N@H+](C)Cc2ccco2)cc1OC[C@H](O)C[NH+]1CCCCC1 ZINC000095497752 211250240 /nfs/dbraw/zinc/25/02/40/211250240.db2.gz JNDBMLFYODPMQN-LJQANCHMSA-N 2 1 388.508 3.146 50 0 GGAAMP CCc1[nH+]ccn1CC(=O)N1CCC2(CC1)C[C@H](c1ccccc1)C[N@H+](C)C2 ZINC000095379612 211231957 /nfs/dbraw/zinc/23/19/57/211231957.db2.gz ADAGPMHLPULVEM-FQEVSTJZSA-N 2 1 380.536 3.174 50 0 GGAAMP CCc1[nH+]ccn1CC(=O)N1CCC2(CC1)C[C@H](c1ccccc1)C[N@@H+](C)C2 ZINC000095379612 211231959 /nfs/dbraw/zinc/23/19/59/211231959.db2.gz ADAGPMHLPULVEM-FQEVSTJZSA-N 2 1 380.536 3.174 50 0 GGAAMP O=C(NCC[N@H+]1CC[C@H](c2ccccc2)C1)C1CC[NH+](Cc2ccco2)CC1 ZINC000095376212 211229583 /nfs/dbraw/zinc/22/95/83/211229583.db2.gz SBBLXMLFUADDDX-NRFANRHFSA-N 2 1 381.520 3.097 50 0 GGAAMP Cc1c2cc(C)ccc2oc1C[N@@H+]1CC[C@H](N2CC[NH+](C)CC2)[C@H](CCCO)C1 ZINC000095363937 211225028 /nfs/dbraw/zinc/22/50/28/211225028.db2.gz YUHPLDWVQRVAPY-IRLDBZIGSA-N 2 1 399.579 3.260 50 0 GGAAMP C[NH+](C)C[C@@H]1C[N@@H+](Cc2ccc3ccn(Cc4ccccc4)c3c2)C[C@@H]1CO ZINC000091626324 211199185 /nfs/dbraw/zinc/19/91/85/211199185.db2.gz RZQLLHGAQJOUTP-DHIUTWEWSA-N 2 1 377.532 3.292 50 0 GGAAMP Cc1cc(C)c2[nH]c(C[N@@H+]3CCCC[C@@H]3CCN3CC[NH+](C)CC3)cc(=O)c2c1 ZINC000091626423 211198500 /nfs/dbraw/zinc/19/85/00/211198500.db2.gz NCJXOKKMPJJEII-OAQYLSRUSA-N 2 1 396.579 3.137 50 0 GGAAMP C[NH+](C)CCN1C[C@@]2(CCC[N@@H+](Cc3ccc(F)c(Cl)c3)C2)CCC1=O ZINC000091794466 211208193 /nfs/dbraw/zinc/20/81/93/211208193.db2.gz GPAYEQZTHOPPAK-FQEVSTJZSA-N 2 1 381.923 3.245 50 0 GGAAMP Cn1c(C[NH+]2CCCCCC2)cc(=O)c(O)c1C[N@H+]1CC[C@@H](c2ccccc2)C1 ZINC000079478959 211156368 /nfs/dbraw/zinc/15/63/68/211156368.db2.gz GICYDVWKBALANL-HXUWFJFHSA-N 2 1 395.547 3.456 50 0 GGAAMP CCOC(=O)[C@@]12CC[C@@H]([NH+]3CCOCC3)C[C@H]1CC[N@@H+](Cc1cccs1)C2 ZINC000072477100 211124531 /nfs/dbraw/zinc/12/45/31/211124531.db2.gz RGVOYUVGCTVBJH-DBXWQHBBSA-N 2 1 392.565 3.004 50 0 GGAAMP CCC[N@H+]1CC2(C[C@H]1C(=O)N(Cc1ccc(O)cc1)C1CC1)CC[NH+](C)CC2 ZINC000072411662 211113834 /nfs/dbraw/zinc/11/38/34/211113834.db2.gz XZQJYCJGEXBHKC-NRFANRHFSA-N 2 1 385.552 3.080 50 0 GGAAMP O[C@H]1[C@H]([NH2+]Cc2cc(-c3ccccc3)no2)c2ccccc2C12CC[NH2+]CC2 ZINC000072168743 211080188 /nfs/dbraw/zinc/08/01/88/211080188.db2.gz XHXUWQPIFNSCPG-YADHBBJMSA-N 2 1 375.472 3.168 50 0 GGAAMP COc1ccc(F)c(C[N@H+]2CCC[C@]3(CCN(c4cc(C)[nH+]c(N)n4)C3)C2)c1 ZINC000072163939 211079229 /nfs/dbraw/zinc/07/92/29/211079229.db2.gz OUFUNVANEVIGMY-NRFANRHFSA-N 2 1 385.487 3.007 50 0 GGAAMP Cc1[nH+]ccn1CCC(=O)N1CCC[N@H+](Cc2ccc(F)cc2)[C@@H](C(C)C)C1 ZINC000072120777 211071989 /nfs/dbraw/zinc/07/19/89/211071989.db2.gz BOJPTWOEFQVUOY-OAQYLSRUSA-N 2 1 386.515 3.480 50 0 GGAAMP Cc1[nH+]ccn1CCC(=O)N1CCC[N@@H+](Cc2ccc(F)cc2)[C@@H](C(C)C)C1 ZINC000072120777 211071994 /nfs/dbraw/zinc/07/19/94/211071994.db2.gz BOJPTWOEFQVUOY-OAQYLSRUSA-N 2 1 386.515 3.480 50 0 GGAAMP Fc1ccc(OCCC[NH+]2CCN(C[C@@H]3CCC[N@H+]4CCCC[C@H]34)CC2)cc1 ZINC000072125374 211071700 /nfs/dbraw/zinc/07/17/00/211071700.db2.gz ROMKXFOESYPWLN-NZQKXSOJSA-N 2 1 389.559 3.477 50 0 GGAAMP CC(C)(C)CC[NH+]1CCC([N@H+]2CCC[C@@H](C(=O)NCc3cccnc3)C2)CC1 ZINC000071754765 211057977 /nfs/dbraw/zinc/05/79/77/211057977.db2.gz WQPNFRBBFHKNRZ-HXUWFJFHSA-N 2 1 386.584 3.310 50 0 GGAAMP O=C(NC1CC1)[C@H]1CCC[N@H+](C2CCN(c3cc[nH+]c4ccccc43)CC2)C1 ZINC000071752901 211056485 /nfs/dbraw/zinc/05/64/85/211056485.db2.gz PQNNXBFUMUZRFN-KRWDZBQOSA-N 2 1 378.520 3.194 50 0 GGAAMP C[NH+]1CCC([N@@H+]2CCC[C@@H](C(=O)N(C/C=C/c3ccccc3)C3CC3)C2)CC1 ZINC000071752807 211055967 /nfs/dbraw/zinc/05/59/67/211055967.db2.gz SSTPJSHWZPXEMP-AEVNEEFTSA-N 2 1 381.564 3.497 50 0 GGAAMP C[NH+]1CCC([N@H+]2CCC[C@@H](C(=O)N(C/C=C/c3ccccc3)C3CC3)C2)CC1 ZINC000071752807 211055972 /nfs/dbraw/zinc/05/59/72/211055972.db2.gz SSTPJSHWZPXEMP-AEVNEEFTSA-N 2 1 381.564 3.497 50 0 GGAAMP CCC[N@@H+](C)Cc1c(C(=O)N2CC[NH+](C3CCCCC3)CC2)nc2ccccn21 ZINC000071479641 211049559 /nfs/dbraw/zinc/04/95/59/211049559.db2.gz NFAYCMDTZRITPA-UHFFFAOYSA-N 2 1 397.567 3.267 50 0 GGAAMP CC(C)(C)CC[NH+]1CCC([N@H+]2CCC[C@@H](C(=O)NCc3ccccn3)C2)CC1 ZINC000067818528 211023442 /nfs/dbraw/zinc/02/34/42/211023442.db2.gz QZIFCAPHPOFGKY-LJQANCHMSA-N 2 1 386.584 3.310 50 0 GGAAMP CC[C@@H](C)Oc1c(C[NH+]2CCC3(CC2)C[N@@H+](C)CCN3C)cccc1OC ZINC000067712691 211016327 /nfs/dbraw/zinc/01/63/27/211016327.db2.gz OMGPDCGQOFPQKP-GOSISDBHSA-N 2 1 375.557 3.084 50 0 GGAAMP CC(C)CC[N@H+]1CCN(C2CC[NH+](CCc3ccccc3)CC2)C[C@@H]1CCO ZINC000020599475 210349881 /nfs/dbraw/zinc/34/98/81/210349881.db2.gz UMKAKLZTCBLTPF-DEOSSOPVSA-N 2 1 387.612 3.108 50 0 GGAAMP C[NH+]1CCN(C(=O)CC[C@H]2CCC[N@H+](Cc3cccc(C(F)(F)F)c3)C2)CC1 ZINC000020543148 210346545 /nfs/dbraw/zinc/34/65/45/210346545.db2.gz VABSPAUUJAWYSA-QGZVFWFLSA-N 2 1 397.485 3.472 50 0 GGAAMP C[NH+]1CCN(C(=O)CC[C@H]2CCC[N@@H+](Cc3cccc(C(F)(F)F)c3)C2)CC1 ZINC000020543148 210346549 /nfs/dbraw/zinc/34/65/49/210346549.db2.gz VABSPAUUJAWYSA-QGZVFWFLSA-N 2 1 397.485 3.472 50 0 GGAAMP C[N@@H+](C[C@@H](O)COc1cccc(C[NH2+]CCc2cccnc2)c1)C1CCCCC1 ZINC000020455847 210338636 /nfs/dbraw/zinc/33/86/36/210338636.db2.gz IYWCRTZWRMYLSC-HSZRJFAPSA-N 2 1 397.563 3.418 50 0 GGAAMP CCN(CC1CC[NH+](C2CC[NH+](C)CC2)CC1)C(=O)c1ccc(C(C)=O)s1 ZINC000020206835 210320629 /nfs/dbraw/zinc/32/06/29/210320629.db2.gz DAYQMWYPHGTXQB-UHFFFAOYSA-N 2 1 391.581 3.219 50 0 GGAAMP Cc1nc(CCNC(=O)[C@@H]2CCC[N@H+](C3CC[NH+](C(C)C)CC3)C2)sc1C ZINC000020210276 210320547 /nfs/dbraw/zinc/32/05/47/210320547.db2.gz MHWZLDHRCDMCHH-GOSISDBHSA-N 2 1 392.613 3.003 50 0 GGAAMP CC(C)[NH+]1CCC(N2CC[N@@H+](Cc3cc4ccccc4o3)C[C@@H]2CCO)CC1 ZINC000019720412 210289056 /nfs/dbraw/zinc/28/90/56/210289056.db2.gz NZPFQBMQTPPIFH-NRFANRHFSA-N 2 1 385.552 3.174 50 0 GGAAMP Cc1cc(N2CCN(C(=O)[C@@H]3CCC[N@H+]3Cc3ccccc3)CC2)cc(C)[nH+]1 ZINC000222352570 136204737 /nfs/dbraw/zinc/20/47/37/136204737.db2.gz UMJSIFHMEJFIII-QFIPXVFZSA-N 2 1 378.520 3.012 50 0 GGAAMP C[NH2+]CCC[NH2+]Cc1cc(Br)c(OCc2cccnc2)c(OC)c1 ZINC000004856196 564208426 /nfs/dbraw/zinc/20/84/26/564208426.db2.gz HFRJBFPKWSLIFZ-UHFFFAOYSA-N 2 1 394.313 3.131 50 0 GGAAMP CSc1cccc(C[N@@H+]2CCN(C3CC[NH+](C(C)C)CC3)[C@@H](CCO)C2)c1 ZINC000023360008 570356769 /nfs/dbraw/zinc/35/67/69/570356769.db2.gz AHWZDAZJYKFEJA-NRFANRHFSA-N 2 1 391.625 3.150 50 0 GGAAMP CSc1cccc(C[N@H+]2CCN(C3CC[NH+](C(C)C)CC3)[C@@H](CCO)C2)c1 ZINC000023360008 570356770 /nfs/dbraw/zinc/35/67/70/570356770.db2.gz AHWZDAZJYKFEJA-NRFANRHFSA-N 2 1 391.625 3.150 50 0 GGAAMP CC(C)[C@@H]1C[N@@H+](C[C@H]2CC[C@@H]([NH3+])CC2)CCC(=O)N1Cc1ccc(F)cc1 ZINC000243893384 570432661 /nfs/dbraw/zinc/43/26/61/570432661.db2.gz AQSJBMKWRXQKQH-WMQCIHAUSA-N 2 1 375.532 3.402 50 0 GGAAMP O=C(C1CC[NH+](Cc2ccccc2)CC1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000005900252 570461215 /nfs/dbraw/zinc/46/12/15/570461215.db2.gz BQFZMNQESVHALH-UHFFFAOYSA-N 2 1 377.532 3.243 50 0 GGAAMP O=C(C1CC[NH+](C[C@H]2CC=CCC2)CC1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000015856061 570536389 /nfs/dbraw/zinc/53/63/89/570536389.db2.gz BCODXABMZKKHEF-NRFANRHFSA-N 2 1 381.564 3.399 50 0 GGAAMP O=C(NCc1ccncc1)[C@@H]1CCC[N@@H+](C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000011665021 570579086 /nfs/dbraw/zinc/57/90/86/570579086.db2.gz ZYWFOHLMCZLRPS-JOCHJYFZSA-N 2 1 392.547 3.074 50 0 GGAAMP O=C(NCc1ccncc1)[C@@H]1CCC[N@H+](C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000011665021 570579089 /nfs/dbraw/zinc/57/90/89/570579089.db2.gz ZYWFOHLMCZLRPS-JOCHJYFZSA-N 2 1 392.547 3.074 50 0 GGAAMP CC(C)CNC(=O)[C@H]1CCC[N@H+](C2CC[NH+](C3Cc4ccccc4C3)CC2)C1 ZINC000011753894 570581580 /nfs/dbraw/zinc/58/15/80/570581580.db2.gz SMCGLIQUNNXJEX-NRFANRHFSA-N 2 1 383.580 3.102 50 0 GGAAMP O=C(NCc1cccnc1)[C@@H]1CCC[N@@H+](C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000012306472 570639454 /nfs/dbraw/zinc/63/94/54/570639454.db2.gz PXIKQYIZHUHIEQ-JOCHJYFZSA-N 2 1 392.547 3.074 50 0 GGAAMP O=C(NCc1cccnc1)[C@@H]1CCC[N@H+](C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000012306472 570639455 /nfs/dbraw/zinc/63/94/55/570639455.db2.gz PXIKQYIZHUHIEQ-JOCHJYFZSA-N 2 1 392.547 3.074 50 0 GGAAMP COc1ccc(C[N@@H+](C)C(C)C)cc1OC[C@@H](O)C[NH+](C)Cc1ccccc1 ZINC000012386141 570650742 /nfs/dbraw/zinc/65/07/42/570650742.db2.gz MMRVHWHSGQIAGO-NRFANRHFSA-N 2 1 386.536 3.407 50 0 GGAAMP COc1ccc(C[NH+](C)C(C)C)cc1OC[C@@H](O)C[N@H+](C)Cc1ccccc1 ZINC000012386141 570650745 /nfs/dbraw/zinc/65/07/45/570650745.db2.gz MMRVHWHSGQIAGO-NRFANRHFSA-N 2 1 386.536 3.407 50 0 GGAAMP COc1ccc(C[NH+](C)C(C)C)cc1OC[C@@H](O)C[N@@H+](C)Cc1ccccc1 ZINC000012386141 570650747 /nfs/dbraw/zinc/65/07/47/570650747.db2.gz MMRVHWHSGQIAGO-NRFANRHFSA-N 2 1 386.536 3.407 50 0 GGAAMP COc1ccc(C[N@@H+](C)C(C)C)cc1OC[C@H](O)C[NH+](C)Cc1ccccc1 ZINC000012386142 570651005 /nfs/dbraw/zinc/65/10/05/570651005.db2.gz MMRVHWHSGQIAGO-OAQYLSRUSA-N 2 1 386.536 3.407 50 0 GGAAMP COc1ccc(C[NH+](C)C(C)C)cc1OC[C@H](O)C[N@H+](C)Cc1ccccc1 ZINC000012386142 570651009 /nfs/dbraw/zinc/65/10/09/570651009.db2.gz MMRVHWHSGQIAGO-OAQYLSRUSA-N 2 1 386.536 3.407 50 0 GGAAMP COc1ccc(C[NH+](C)C(C)C)cc1OC[C@H](O)C[N@@H+](C)Cc1ccccc1 ZINC000012386142 570651011 /nfs/dbraw/zinc/65/10/11/570651011.db2.gz MMRVHWHSGQIAGO-OAQYLSRUSA-N 2 1 386.536 3.407 50 0 GGAAMP COc1ccc(C[NH2+]Cc2cccc(C)c2)cc1OC[C@H](O)C[N@@H+](C)C(C)C ZINC000012459096 570670243 /nfs/dbraw/zinc/67/02/43/570670243.db2.gz LQBRGOQHWJTWMX-OAQYLSRUSA-N 2 1 386.536 3.373 50 0 GGAAMP CC(C)=CC(=O)N(CC[NH+](C)C)C[C@H]1CCC[N@@H+](Cc2ccccc2F)C1 ZINC000012459376 570670333 /nfs/dbraw/zinc/67/03/33/570670333.db2.gz MZCUISOPMXSSIH-IBGZPJMESA-N 2 1 375.532 3.394 50 0 GGAAMP CC(C)OCC[NH2+]Cc1ccc(OC[C@@H](O)C[N@@H+](C)Cc2ccccc2)cc1 ZINC000012573411 570681951 /nfs/dbraw/zinc/68/19/51/570681951.db2.gz PWWYQJAZFWTJRD-QFIPXVFZSA-N 2 1 386.536 3.073 50 0 GGAAMP COc1ccc(C[N@@H+](C)CCC(C)C)cc1OC[C@H](O)C[NH+]1CCCCC1 ZINC000012713871 570703886 /nfs/dbraw/zinc/70/38/86/570703886.db2.gz AXKWOBOLDZIHLP-HXUWFJFHSA-N 2 1 378.557 3.399 50 0 GGAAMP CCOc1cccc(C[NH+]2CCC(CCC(=O)N3CC[NH+](CC)CC3)CC2)c1 ZINC000012718573 570705246 /nfs/dbraw/zinc/70/52/46/570705246.db2.gz GTGJXZAOHHENTJ-UHFFFAOYSA-N 2 1 387.568 3.242 50 0 GGAAMP Cc1cc(-c2ccccc2)nc(C[NH+]2CCC([C@@H](C)[NH+]3CCOCC3)CC2)n1 ZINC000252509111 570729245 /nfs/dbraw/zinc/72/92/45/570729245.db2.gz YCQBZANWTHHAGA-LJQANCHMSA-N 2 1 380.536 3.385 50 0 GGAAMP Cc1ccc(C2(C[N@H+]3CCC[C@H](C(=O)c4cccnc4)C3)CC[NH2+]CC2)nc1 ZINC000065461035 570769776 /nfs/dbraw/zinc/76/97/76/570769776.db2.gz RRLVRNRFVPWKQU-FQEVSTJZSA-N 2 1 378.520 3.001 50 0 GGAAMP COc1cc(C[N@@H+](C)Cc2ccc(C)o2)ccc1OC[C@@H](O)C[NH+]1CCCC1 ZINC000012589760 570883238 /nfs/dbraw/zinc/88/32/38/570883238.db2.gz RHWGSACJLHIAGP-IBGZPJMESA-N 2 1 388.508 3.064 50 0 GGAAMP COCC[N@@H+]1CCC[C@@]2(CC[NH+](Cc3ccc(Oc4ncccn4)cc3)C2)C1 ZINC000055244045 1406910555 /nfs/dbraw/zinc/91/05/55/1406910555.db2.gz NGRXJRWJKHOGHZ-JOCHJYFZSA-N 2 1 382.508 3.203 50 0 GGAAMP COCC[N@H+]1CCC[C@@]2(CC[NH+](Cc3ccc(Oc4ncccn4)cc3)C2)C1 ZINC000055244045 1406910562 /nfs/dbraw/zinc/91/05/62/1406910562.db2.gz NGRXJRWJKHOGHZ-JOCHJYFZSA-N 2 1 382.508 3.203 50 0 GGAAMP COCC[NH+]1CCC[C@@]2(CC[N@H+](Cc3ccc(Oc4ncccn4)cc3)C2)C1 ZINC000055244045 1406910572 /nfs/dbraw/zinc/91/05/72/1406910572.db2.gz NGRXJRWJKHOGHZ-JOCHJYFZSA-N 2 1 382.508 3.203 50 0 GGAAMP COCC[NH+]1CCC[C@@]2(CC[N@@H+](Cc3ccc(Oc4ncccn4)cc3)C2)C1 ZINC000055244045 1406910579 /nfs/dbraw/zinc/91/05/79/1406910579.db2.gz NGRXJRWJKHOGHZ-JOCHJYFZSA-N 2 1 382.508 3.203 50 0 GGAAMP C[N@H+](C[C@H]1CCC[NH+](C)C1)[C@H]1CCC(=O)N(Cc2ccc(Cl)cc2)CC1 ZINC000011910631 1399017435 /nfs/dbraw/zinc/01/74/35/1399017435.db2.gz HAWACBYPMPHUHC-ICSRJNTNSA-N 2 1 377.960 3.495 50 0 GGAAMP C[N@@H+](C[C@H]1CCC[NH+](C)C1)[C@H]1CCC(=O)N(Cc2ccc(Cl)cc2)CC1 ZINC000011910631 1399017441 /nfs/dbraw/zinc/01/74/41/1399017441.db2.gz HAWACBYPMPHUHC-ICSRJNTNSA-N 2 1 377.960 3.495 50 0 GGAAMP C[NH+](C[C@H]1CCC[N@H+](C)C1)[C@H]1CCC(=O)N(Cc2ccc(Cl)cc2)CC1 ZINC000011910631 1399017446 /nfs/dbraw/zinc/01/74/46/1399017446.db2.gz HAWACBYPMPHUHC-ICSRJNTNSA-N 2 1 377.960 3.495 50 0 GGAAMP C[NH+](C[C@H]1CCC[N@@H+](C)C1)[C@H]1CCC(=O)N(Cc2ccc(Cl)cc2)CC1 ZINC000011910631 1399017451 /nfs/dbraw/zinc/01/74/51/1399017451.db2.gz HAWACBYPMPHUHC-ICSRJNTNSA-N 2 1 377.960 3.495 50 0 GGAAMP CCOc1cccc(C[N@@H+]2CCOc3ccc(C4(O)CC[NH+](C)CC4)cc3C2)c1 ZINC000011971893 1399021747 /nfs/dbraw/zinc/02/17/47/1399021747.db2.gz NTWWJLVSZJBSHL-UHFFFAOYSA-N 2 1 396.531 3.393 50 0 GGAAMP CCOc1cccc(C[N@H+]2CCOc3ccc(C4(O)CC[NH+](C)CC4)cc3C2)c1 ZINC000011971893 1399021750 /nfs/dbraw/zinc/02/17/50/1399021750.db2.gz NTWWJLVSZJBSHL-UHFFFAOYSA-N 2 1 396.531 3.393 50 0 GGAAMP Cn1cc(C[N@H+]2CCOc3ccc([C@@](C)(O)C[NH+](C)C)cc3C2)c2ccccc21 ZINC000011976137 1399022352 /nfs/dbraw/zinc/02/23/52/1399022352.db2.gz DRQLKKFQEOFQCU-DEOSSOPVSA-N 2 1 393.531 3.342 50 0 GGAAMP COc1cc(C[NH2+]CC2CCCCC2)ccc1OC[C@H](O)C[N@@H+](C)C(C)C ZINC000011999008 1399023161 /nfs/dbraw/zinc/02/31/61/1399023161.db2.gz WBVAKMHCTZBMPR-HXUWFJFHSA-N 2 1 378.557 3.445 50 0 GGAAMP CC[N@H+]1CCC[C@@H]1CN(CC1CC[NH+](CCOC)CC1)C(=O)CCC1(C)CC1 ZINC000012002034 1399023982 /nfs/dbraw/zinc/02/39/82/1399023982.db2.gz NKHAVEVPKAGEHO-OAQYLSRUSA-N 2 1 393.616 3.238 50 0 GGAAMP COc1cc(C[N@H+]2CCc3ccccc3C2)ccc1OC[C@@H](O)C[NH+]1CCCC1 ZINC000012029223 1399024436 /nfs/dbraw/zinc/02/44/36/1399024436.db2.gz HJILOWZAUIYZSL-QFIPXVFZSA-N 2 1 396.531 3.089 50 0 GGAAMP COc1cc(C[N@H+]2CCc3ccccc3C2)ccc1OC[C@H](O)C[NH+]1CCCC1 ZINC000012029231 1399024822 /nfs/dbraw/zinc/02/48/22/1399024822.db2.gz HJILOWZAUIYZSL-JOCHJYFZSA-N 2 1 396.531 3.089 50 0 GGAAMP C[N@H+]1CCCN(C(=O)[C@@H]2CC23CC[NH+](Cc2cc4ccccc4o2)CC3)CC1 ZINC000012048846 1399025196 /nfs/dbraw/zinc/02/51/96/1399025196.db2.gz RSVWBLSXJLZMDV-FQEVSTJZSA-N 2 1 381.520 3.199 50 0 GGAAMP COc1ccc(C[NH2+]Cc2ccc(C)cc2)cc1OC[C@@H](O)C[N@@H+](C)C(C)C ZINC000012703691 1399054502 /nfs/dbraw/zinc/05/45/02/1399054502.db2.gz IPIHLUPDZBKACM-NRFANRHFSA-N 2 1 386.536 3.373 50 0 GGAAMP CSCCC[NH2+]Cc1ccc(OC[C@@H](O)C[N@@H+](C)Cc2ccccc2)cc1 ZINC000012745928 1399057533 /nfs/dbraw/zinc/05/75/33/1399057533.db2.gz ZLSRPBLADGFZEK-NRFANRHFSA-N 2 1 388.577 3.401 50 0 GGAAMP C[NH+]1CCC(C[N@@H+](CCc2ccccc2)Cc2ccccc2OCCO)CC1 ZINC000012744710 1399057592 /nfs/dbraw/zinc/05/75/92/1399057592.db2.gz LMIIGOFQYGWGIF-UHFFFAOYSA-N 2 1 382.548 3.444 50 0 GGAAMP C[NH+]1CCC([N@@H+]2CCC[C@@H](C(=O)NCCc3ccc4ccccc4c3)C2)CC1 ZINC000014950296 1399128894 /nfs/dbraw/zinc/12/88/94/1399128894.db2.gz YAOUKAZRTNCMNE-JOCHJYFZSA-N 2 1 379.548 3.305 50 0 GGAAMP C[NH+]1CCC([N@H+]2CCC[C@@H](C(=O)NCCc3ccc4ccccc4c3)C2)CC1 ZINC000014950296 1399128896 /nfs/dbraw/zinc/12/88/96/1399128896.db2.gz YAOUKAZRTNCMNE-JOCHJYFZSA-N 2 1 379.548 3.305 50 0 GGAAMP COc1ccc(CC[C@@H](C)[N@@H+]2CCC(=O)N(CC[NH+]3CCCCC3)CC2)cc1 ZINC000014991287 1399130303 /nfs/dbraw/zinc/13/03/03/1399130303.db2.gz RRPBGMZIZDQZRS-HXUWFJFHSA-N 2 1 387.568 3.037 50 0 GGAAMP COCC[N@@H+](CCCn1cccn1)C[C@H]1CCC[NH+](C2Cc3ccccc3C2)C1 ZINC000020450969 1399346365 /nfs/dbraw/zinc/34/63/65/1399346365.db2.gz VXYLPTATPZOSOA-OAQYLSRUSA-N 2 1 396.579 3.101 50 0 GGAAMP COCC[NH+](CCCn1cccn1)C[C@H]1CCC[N@@H+](C2Cc3ccccc3C2)C1 ZINC000020450969 1399346371 /nfs/dbraw/zinc/34/63/71/1399346371.db2.gz VXYLPTATPZOSOA-OAQYLSRUSA-N 2 1 396.579 3.101 50 0 GGAAMP COCC[NH+](CCCn1cccn1)C[C@H]1CCC[N@H+](C2Cc3ccccc3C2)C1 ZINC000020450969 1399346376 /nfs/dbraw/zinc/34/63/76/1399346376.db2.gz VXYLPTATPZOSOA-OAQYLSRUSA-N 2 1 396.579 3.101 50 0 GGAAMP O[C@@H](COc1ccccc1C[N@H+]1CCc2ccccc2C1)C[NH+]1CCSCC1 ZINC000020598740 1399349716 /nfs/dbraw/zinc/34/97/16/1399349716.db2.gz VVSIIOHASYGDEN-JOCHJYFZSA-N 2 1 398.572 3.033 50 0 GGAAMP Cc1cc(C)c(C[N@@H+]2CCN(C3CC[NH+](C(C)C)CC3)[C@@H](CCO)C2)cc1C ZINC000020777651 1399353225 /nfs/dbraw/zinc/35/32/25/1399353225.db2.gz HBENQHRSJBYMBA-DEOSSOPVSA-N 2 1 387.612 3.353 50 0 GGAAMP CC(C)C[N@H+]1CCN(Cc2ccc(C[NH+]3CCCCC3)s2)C[C@@H]1CCO ZINC000022933000 1399518483 /nfs/dbraw/zinc/51/84/83/1399518483.db2.gz QVTBXNXASSAIRN-IBGZPJMESA-N 2 1 379.614 3.259 50 0 GGAAMP CN(C[C@H]1Cc2ccccc2C[N@H+]1C)C(=O)c1ccc(-c2c[nH+]ccc2N)cc1 ZINC000426511602 529972971 /nfs/dbraw/zinc/97/29/71/529972971.db2.gz HNWHGRMCNKRNMH-OAQYLSRUSA-N 2 1 386.499 3.290 50 0 GGAAMP CC[N@H+]1CCC[C@@H]1CNC(=O)CCC1CC[NH+](Cc2cccc(C(C)=O)c2)CC1 ZINC000011815052 221127510 /nfs/dbraw/zinc/12/75/10/221127510.db2.gz OCLNALATZDDVCF-HSZRJFAPSA-N 2 1 399.579 3.482 50 0 GGAAMP CCN(C[C@H]1CCC[N@H+](CCc2cccc(OC)c2)C1)C(=O)Cn1cc[nH+]c1C ZINC000011819294 221129357 /nfs/dbraw/zinc/12/93/57/221129357.db2.gz TVMPRZBNEKVOCN-NRFANRHFSA-N 2 1 398.551 3.003 50 0 GGAAMP CCN(C[C@H]1CCC[N@@H+](CCc2cccc(OC)c2)C1)C(=O)Cn1cc[nH+]c1C ZINC000011819294 221129360 /nfs/dbraw/zinc/12/93/60/221129360.db2.gz TVMPRZBNEKVOCN-NRFANRHFSA-N 2 1 398.551 3.003 50 0 GGAAMP O=C(C[NH+]1CCCCC1)N1CC[C@]2(C1)CCC[N@H+](Cc1ccc(F)c(F)c1)C2 ZINC000011843000 221131695 /nfs/dbraw/zinc/13/16/95/221131695.db2.gz HOQFAFFWTRZMMQ-JOCHJYFZSA-N 2 1 391.506 3.265 50 0 GGAAMP O=C(C[NH+]1CCCCC1)N1CC[C@@]2(C1)CCC[N@H+](Cc1ccc(F)c(F)c1)C2 ZINC000011842999 221132043 /nfs/dbraw/zinc/13/20/43/221132043.db2.gz HOQFAFFWTRZMMQ-QFIPXVFZSA-N 2 1 391.506 3.265 50 0 GGAAMP O=C(NCc1ccccn1)[C@H]1CCC[N@@H+](C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000011873811 221133104 /nfs/dbraw/zinc/13/31/04/221133104.db2.gz GIVGXPGZKMIKIL-NRFANRHFSA-N 2 1 392.547 3.074 50 0 GGAAMP O=C(NCc1ccccn1)[C@H]1CCC[N@H+](C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000011873811 221133105 /nfs/dbraw/zinc/13/31/05/221133105.db2.gz GIVGXPGZKMIKIL-NRFANRHFSA-N 2 1 392.547 3.074 50 0 GGAAMP O=C(NCc1ccccn1)[C@@H]1CCC[N@@H+](C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000011873812 221133353 /nfs/dbraw/zinc/13/33/53/221133353.db2.gz GIVGXPGZKMIKIL-OAQYLSRUSA-N 2 1 392.547 3.074 50 0 GGAAMP O=C(NCc1ccccn1)[C@@H]1CCC[N@H+](C2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000011873812 221133358 /nfs/dbraw/zinc/13/33/58/221133358.db2.gz GIVGXPGZKMIKIL-OAQYLSRUSA-N 2 1 392.547 3.074 50 0 GGAAMP C[N@@H+](C[C@@H](O)COc1ccccc1C[NH2+]Cc1cccnc1)C1CCCCC1 ZINC000011873003 221133557 /nfs/dbraw/zinc/13/35/57/221133557.db2.gz ZIDOQSKDPUZKNH-JOCHJYFZSA-N 2 1 383.536 3.376 50 0 GGAAMP O=C(NCc1ccccn1)[C@H]1CCC[N@H+](C2CC[NH+](CC3CCCC3)CC2)C1 ZINC000011664984 221120072 /nfs/dbraw/zinc/12/00/72/221120072.db2.gz XEQOSKOABJBWML-FQEVSTJZSA-N 2 1 384.568 3.064 50 0 GGAAMP C[NH+]1CCC(C(=O)N2CC[C@@]3(C2)CCC[N@@H+](CC2CC2)C3)(c2ccccc2)CC1 ZINC000011951392 221140166 /nfs/dbraw/zinc/14/01/66/221140166.db2.gz YUVSDJJAHNXZMB-DEOSSOPVSA-N 2 1 395.591 3.375 50 0 GGAAMP CC[NH+]1CCN(C(=O)CCC2CC[NH+](C/C=C/c3ccc(F)cc3)CC2)CC1 ZINC000012026621 221143305 /nfs/dbraw/zinc/14/33/05/221143305.db2.gz QRWDNTRDTUPMOD-ONEGZZNKSA-N 2 1 387.543 3.495 50 0 GGAAMP CN(C(=O)CC[C@H]1CCC[N@@H+](Cc2cccc(F)c2)C1)C1CC[NH+](C)CC1 ZINC000012026858 221143578 /nfs/dbraw/zinc/14/35/78/221143578.db2.gz XZEUBDSFLVVPGD-GOSISDBHSA-N 2 1 375.532 3.371 50 0 GGAAMP CCOCCC[NH2+]Cc1ccccc1OC[C@H](O)C[N@@H+](C)C1CCCCC1 ZINC000012052606 221144732 /nfs/dbraw/zinc/14/47/32/221144732.db2.gz VZHJYXDIACOAJT-OAQYLSRUSA-N 2 1 378.557 3.207 50 0 GGAAMP CN(C(=O)CC[C@H]1CCC[N@@H+](Cc2ccccc2F)C1)C1CC[NH+](C)CC1 ZINC000012093113 221150223 /nfs/dbraw/zinc/15/02/23/221150223.db2.gz GUYVKPNZTQZVRI-GOSISDBHSA-N 2 1 375.532 3.371 50 0 GGAAMP CN(CC1CC[NH+](CCc2cccc(F)c2)CC1)C(=O)[C@@H]1CCCC[N@H+]1C ZINC000012093082 221150539 /nfs/dbraw/zinc/15/05/39/221150539.db2.gz YFRKLROBEJUPEL-NRFANRHFSA-N 2 1 375.532 3.023 50 0 GGAAMP CN(C(=O)CC[C@@H]1CCC[N@@H+](Cc2ccccc2F)C1)C1CC[NH+](C)CC1 ZINC000012093111 221150701 /nfs/dbraw/zinc/15/07/01/221150701.db2.gz GUYVKPNZTQZVRI-SFHVURJKSA-N 2 1 375.532 3.371 50 0 GGAAMP CN(CC1CC[NH+](CCc2cccc(F)c2)CC1)C(=O)[C@H]1CCCC[N@H+]1C ZINC000012093079 221150800 /nfs/dbraw/zinc/15/08/00/221150800.db2.gz YFRKLROBEJUPEL-OAQYLSRUSA-N 2 1 375.532 3.023 50 0 GGAAMP C[N@H+](Cc1ccccc1)C[C@H](O)COc1ccc(C[NH2+]Cc2cccnc2)cc1 ZINC000012297318 221176062 /nfs/dbraw/zinc/17/60/62/221176062.db2.gz XDEBFMTYUAKLPR-QHCPKHFHSA-N 2 1 391.515 3.243 50 0 GGAAMP Cc1[nH+]ccn1-c1ccc(NC(=O)[C@@H]2CCC[N@H+](Cc3ccncc3)C2)cc1 ZINC000012305028 221177364 /nfs/dbraw/zinc/17/73/64/221177364.db2.gz RSMCHOBBAXBHDN-LJQANCHMSA-N 2 1 375.476 3.426 50 0 GGAAMP Cc1[nH+]ccn1-c1ccc(NC(=O)[C@@H]2CCC[N@@H+](Cc3ccncc3)C2)cc1 ZINC000012305028 221177367 /nfs/dbraw/zinc/17/73/67/221177367.db2.gz RSMCHOBBAXBHDN-LJQANCHMSA-N 2 1 375.476 3.426 50 0 GGAAMP CC[N@H+]1CCC[C@@H]1CNC(=O)CCC1CC[NH+](Cc2nc3ccccc3[nH]2)CC1 ZINC000012316996 221180898 /nfs/dbraw/zinc/18/08/98/221180898.db2.gz KXGNTTWTSLCGNB-LJQANCHMSA-N 2 1 397.567 3.156 50 0 GGAAMP COCC[NH+]1CCC(C[N@@H+](Cc2ccc(COC)o2)Cc2ccncc2)CC1 ZINC000012320787 221181024 /nfs/dbraw/zinc/18/10/24/221181024.db2.gz ONYJAEAHKMGIGL-UHFFFAOYSA-N 2 1 387.524 3.182 50 0 GGAAMP CC(C)[NH+]1CCC([N@H+]2CCC[C@H](C(=O)NCc3ccc(F)c(F)c3)C2)CC1 ZINC000012432892 221193375 /nfs/dbraw/zinc/19/33/75/221193375.db2.gz YXTWXHBHZPTRRI-KRWDZBQOSA-N 2 1 379.495 3.166 50 0 GGAAMP C[NH+]1CCC([N@@H+]2CCC[C@H](C(=O)NCC3(c4ccccc4)CCCC3)C2)CC1 ZINC000012466637 221197746 /nfs/dbraw/zinc/19/77/46/221197746.db2.gz SSWKATBVDDORCW-FQEVSTJZSA-N 2 1 383.580 3.421 50 0 GGAAMP C[NH+]1CCC([N@H+]2CCC[C@H](C(=O)NCC3(c4ccccc4)CCCC3)C2)CC1 ZINC000012466637 221197749 /nfs/dbraw/zinc/19/77/49/221197749.db2.gz SSWKATBVDDORCW-FQEVSTJZSA-N 2 1 383.580 3.421 50 0 GGAAMP CC(C)=CC(=O)N(CC[NH+](C)C)C[C@@H]1CCC[N@@H+](Cc2ccccc2F)C1 ZINC000012459375 221198895 /nfs/dbraw/zinc/19/88/95/221198895.db2.gz MZCUISOPMXSSIH-LJQANCHMSA-N 2 1 375.532 3.394 50 0 GGAAMP COc1cc(C[N@@H+](C)Cc2ccc(C)o2)ccc1OC[C@H](O)C[NH+]1CCCC1 ZINC000012589769 221211075 /nfs/dbraw/zinc/21/10/75/221211075.db2.gz RHWGSACJLHIAGP-LJQANCHMSA-N 2 1 388.508 3.064 50 0 GGAAMP O=C(NC1CC1)[C@H]1CCC[N@@H+](C2CC[NH+](Cc3c[nH]c4ccccc34)CC2)C1 ZINC000012578742 221210104 /nfs/dbraw/zinc/21/01/04/221210104.db2.gz NWRUQNSWDPQWGW-KRWDZBQOSA-N 2 1 380.536 3.123 50 0 GGAAMP O=C(NC1CC1)[C@H]1CCC[N@H+](C2CC[NH+](Cc3c[nH]c4ccccc34)CC2)C1 ZINC000012578742 221210107 /nfs/dbraw/zinc/21/01/07/221210107.db2.gz NWRUQNSWDPQWGW-KRWDZBQOSA-N 2 1 380.536 3.123 50 0 GGAAMP Cc1ccc(F)cc1CNC(=O)[C@@H]1CCC[N@H+](C2CC[NH+](C(C)C)CC2)C1 ZINC000012709082 221219292 /nfs/dbraw/zinc/21/92/92/221219292.db2.gz JZJIFWWUXXOWGN-GOSISDBHSA-N 2 1 375.532 3.335 50 0 GGAAMP COc1ccccc1C[N@H+]1CCC[C@H](CN(CC[NH+](C)C)C(=O)c2ccoc2)C1 ZINC000012709540 221219376 /nfs/dbraw/zinc/21/93/76/221219376.db2.gz FLZMTPARUKSRKB-IBGZPJMESA-N 2 1 399.535 3.204 50 0 GGAAMP Cc1ccc(F)cc1CNC(=O)[C@H]1CCC[N@H+](C2CC[NH+](C(C)C)CC2)C1 ZINC000012709089 221219880 /nfs/dbraw/zinc/21/98/80/221219880.db2.gz JZJIFWWUXXOWGN-SFHVURJKSA-N 2 1 375.532 3.335 50 0 GGAAMP O=C(CC[C@@H]1CCC[N@@H+](C2CCOCC2)C1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000012711225 221219991 /nfs/dbraw/zinc/21/99/91/221219991.db2.gz MSXMIUHYXIRBFY-QFIPXVFZSA-N 2 1 399.579 3.002 50 0 GGAAMP O=C(CC[C@@H]1CCC[N@H+](C2CCOCC2)C1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000012711225 221219994 /nfs/dbraw/zinc/21/99/94/221219994.db2.gz MSXMIUHYXIRBFY-QFIPXVFZSA-N 2 1 399.579 3.002 50 0 GGAAMP C[NH+](C)CCN(C[C@H]1CCC[N@@H+](Cc2ccccc2F)C1)C(=O)c1cccnc1 ZINC000012592538 221211446 /nfs/dbraw/zinc/21/14/46/221211446.db2.gz VCGOUFZUTFNKEH-IBGZPJMESA-N 2 1 398.526 3.137 50 0 GGAAMP CCN(CC1CC[NH+](C2CC[NH+](C)CC2)CC1)C(=O)c1cccc(F)c1F ZINC000012835824 221237643 /nfs/dbraw/zinc/23/76/43/221237643.db2.gz UJKSSZSKWRNPHP-UHFFFAOYSA-N 2 1 379.495 3.233 50 0 GGAAMP C[N@@H+](CCC1CCOCC1)Cc1ccc(OC[C@@H](O)C[NH+]2CCCCC2)cc1 ZINC000014964362 221321822 /nfs/dbraw/zinc/32/18/22/221321822.db2.gz YGFVBYXICWUXRH-QFIPXVFZSA-N 2 1 390.568 3.161 50 0 GGAAMP c1cc([C@@H]2CCC[N@H+](C3CCOCC3)C2)nc(SCC[NH+]2CCCC2)n1 ZINC000015001907 221326330 /nfs/dbraw/zinc/32/63/30/221326330.db2.gz SIGRKKNVKZBRCI-QGZVFWFLSA-N 2 1 376.570 3.023 50 0 GGAAMP CC[N@H+]1CCC[C@H]1CN(CC1CC[NH+](CCOC)CC1)C(=O)c1ccsc1 ZINC000015064362 221328054 /nfs/dbraw/zinc/32/80/54/221328054.db2.gz AEJARCLUBZFASQ-FQEVSTJZSA-N 2 1 393.597 3.033 50 0 GGAAMP Cc1cccc(N2CCC3(CCC[N@@H+]3Cc3ccc(OCCO)cc3)CC2)[nH+]1 ZINC000072447799 136170870 /nfs/dbraw/zinc/17/08/70/136170870.db2.gz BJZPBKQEDVPTMH-UHFFFAOYSA-N 2 1 381.520 3.396 50 0 GGAAMP Cc1cccc(N2CCC3(CCC[N@H+]3Cc3ccc(OCCO)cc3)CC2)[nH+]1 ZINC000072447799 136170871 /nfs/dbraw/zinc/17/08/71/136170871.db2.gz BJZPBKQEDVPTMH-UHFFFAOYSA-N 2 1 381.520 3.396 50 0 GGAAMP Cc1nnc(N2CCC[C@H](c3[nH+]ccn3CCC[NH+](C)C)C2)c2ccccc12 ZINC000095497830 136179634 /nfs/dbraw/zinc/17/96/34/136179634.db2.gz PDKZGABFNKWQOL-SFHVURJKSA-N 2 1 378.524 3.470 50 0 GGAAMP Cc1cc(N2CCC[C@@H](CCC(=O)N3CC[NH+](C)CC3)C2)c2ccccc2[nH+]1 ZINC000096139504 136184272 /nfs/dbraw/zinc/18/42/72/136184272.db2.gz BTQNBIVBHQIJRD-IBGZPJMESA-N 2 1 380.536 3.314 50 0 GGAAMP C[NH+]1CCC(NC(=O)C2CC[NH+](Cc3ccc(Cl)c(Cl)c3)CC2)CC1 ZINC000067622228 222152476 /nfs/dbraw/zinc/15/24/76/222152476.db2.gz MVCGDHRSZZSNFP-UHFFFAOYSA-N 2 1 384.351 3.416 50 0 GGAAMP CC[C@H](C)Oc1c(C[NH+]2CCC3(CC2)C[N@@H+](C)CCN3C)cccc1OC ZINC000067712692 222155262 /nfs/dbraw/zinc/15/52/62/222155262.db2.gz OMGPDCGQOFPQKP-SFHVURJKSA-N 2 1 375.557 3.084 50 0 GGAAMP O=C(NCc1ccco1)[C@@H]1CCC[N@@H+](C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000071523659 222185257 /nfs/dbraw/zinc/18/52/57/222185257.db2.gz JNZKZXDYKDIVJU-OAQYLSRUSA-N 2 1 395.547 3.315 50 0 GGAAMP O=C(NCc1ccco1)[C@@H]1CCC[N@H+](C2CC[NH+](CCc3ccccc3)CC2)C1 ZINC000071523659 222185260 /nfs/dbraw/zinc/18/52/60/222185260.db2.gz JNZKZXDYKDIVJU-OAQYLSRUSA-N 2 1 395.547 3.315 50 0 GGAAMP CC(C)CCC[NH+]1CCC([N@H+]2CCC[C@H](C(=O)NCc3cccnc3)C2)CC1 ZINC000071551867 222186298 /nfs/dbraw/zinc/18/62/98/222186298.db2.gz OKTKEMDTUKOIED-NRFANRHFSA-N 2 1 386.584 3.310 50 0 GGAAMP CCCN(C)C(=O)[C@H]1CCC[N@H+](C2CC[NH+](C3Cc4ccccc4C3)CC2)C1 ZINC000071721464 222188616 /nfs/dbraw/zinc/18/86/16/222188616.db2.gz YKAMYWXCEPFAOI-NRFANRHFSA-N 2 1 383.580 3.199 50 0 GGAAMP CC(C)[NH+]1CCC([N@H+]2CCC[C@@H](C(=O)N(C)Cc3nc4ccccc4[nH]3)C2)CC1 ZINC000071762020 222194105 /nfs/dbraw/zinc/19/41/05/222194105.db2.gz HXANUSBHYBPGJB-GOSISDBHSA-N 2 1 397.567 3.106 50 0 GGAAMP Cc1[nH+]ccn1CCC[N@@H+]1CCC(=O)N(Cc2ccc(F)cc2)[C@@H](C(C)C)C1 ZINC000071763447 222195224 /nfs/dbraw/zinc/19/52/24/222195224.db2.gz OALYPIGUPHTFKI-OAQYLSRUSA-N 2 1 386.515 3.480 50 0 GGAAMP Cc1[nH+]ccn1CCC[N@H+]1CCC(=O)N(Cc2ccc(F)cc2)[C@@H](C(C)C)C1 ZINC000071763447 222195228 /nfs/dbraw/zinc/19/52/28/222195228.db2.gz OALYPIGUPHTFKI-OAQYLSRUSA-N 2 1 386.515 3.480 50 0 GGAAMP CCN(C(=O)[C@H]1CCC[N@@H+](C2CC[NH+](CCc3ccccc3)CC2)C1)C1CC1 ZINC000071763846 222195402 /nfs/dbraw/zinc/19/54/02/222195402.db2.gz FWDITPCXKTUQPH-NRFANRHFSA-N 2 1 383.580 3.416 50 0 GGAAMP CCN(C(=O)[C@H]1CCC[N@H+](C2CC[NH+](CCc3ccccc3)CC2)C1)C1CC1 ZINC000071763846 222195406 /nfs/dbraw/zinc/19/54/06/222195406.db2.gz FWDITPCXKTUQPH-NRFANRHFSA-N 2 1 383.580 3.416 50 0 GGAAMP c1cn(CC[N@H+]2CCC[C@H](c3ccccc3)C2)c(-c2cc3n(n2)CCC[NH2+]C3)n1 ZINC000072424995 222259081 /nfs/dbraw/zinc/25/90/81/222259081.db2.gz KNFTUMZHPFTSAW-FQEVSTJZSA-N 2 1 390.535 3.120 50 0 GGAAMP C[NH+](C)CCN(C[C@@H]1CCC[N@@H+](Cc2ccccc2F)C1)C(=O)C(C)(C)C ZINC000095507139 222339546 /nfs/dbraw/zinc/33/95/46/222339546.db2.gz BKALHNNAZWZHHV-GOSISDBHSA-N 2 1 377.548 3.474 50 0 GGAAMP C[NH+](C)CCN(C[C@@H]1CCC[N@@H+](Cc2ccccc2F)C1)C(=O)C1CC=CC1 ZINC000095518290 222344196 /nfs/dbraw/zinc/34/41/96/222344196.db2.gz DSKQFNZWPFJABY-LJQANCHMSA-N 2 1 387.543 3.394 50 0 GGAAMP CC[NH+](CC)C[C@H](O)COc1ccc(C[N@H+]2CCCCC23CC3)cc1OC ZINC000095520310 222346312 /nfs/dbraw/zinc/34/63/12/222346312.db2.gz NLJAZDXEASWKDM-IBGZPJMESA-N 2 1 376.541 3.295 50 0 GGAAMP COc1cc(C[N@@H+]2CC=C(C)CC2)ccc1OC[C@@H](O)C[NH+]1CCCCCC1 ZINC000095526691 222351637 /nfs/dbraw/zinc/35/16/37/222351637.db2.gz KWSTVXHDZXRLHH-NRFANRHFSA-N 2 1 388.552 3.463 50 0 GGAAMP C[NH+](Cc1ccc(OC[C@@H](O)C[N@H+](C)Cc2ccccc2)cc1)C1CCOCC1 ZINC000095528900 222353638 /nfs/dbraw/zinc/35/36/38/222353638.db2.gz DQZHNZHFVAJOQJ-QHCPKHFHSA-N 2 1 398.547 3.169 50 0 GGAAMP C[NH+](Cc1ccccc1)C[C@H](O)COc1ccc(C[N@H+](C)C2CCOCC2)cc1 ZINC000095528900 222353640 /nfs/dbraw/zinc/35/36/40/222353640.db2.gz DQZHNZHFVAJOQJ-QHCPKHFHSA-N 2 1 398.547 3.169 50 0 GGAAMP C[NH+](Cc1ccccc1)C[C@H](O)COc1ccc(C[N@@H+](C)C2CCOCC2)cc1 ZINC000095528900 222353643 /nfs/dbraw/zinc/35/36/43/222353643.db2.gz DQZHNZHFVAJOQJ-QHCPKHFHSA-N 2 1 398.547 3.169 50 0 GGAAMP Cc1[nH+]ccn1Cc1nnc(C2CC[NH+](C/C=C/c3ccccc3)CC2)n1C ZINC000096149237 222389570 /nfs/dbraw/zinc/38/95/70/222389570.db2.gz XOEOGTKGNIRBBL-RMKNXTFCSA-N 2 1 376.508 3.261 50 0 GGAAMP Cc1cccc(C[NH+]2CCC(c3nnc(C[NH+]4CCCCCC4)n3C)CC2)n1 ZINC000096165240 222395511 /nfs/dbraw/zinc/39/55/11/222395511.db2.gz COMUJWWSDHRZSZ-UHFFFAOYSA-N 2 1 382.556 3.274 50 0 GGAAMP CC[NH+](CC)C[C@@H](O)COc1ccc(C[N@H+]2CCCCC23CC3)cc1OC ZINC000095520311 222345877 /nfs/dbraw/zinc/34/58/77/222345877.db2.gz NLJAZDXEASWKDM-LJQANCHMSA-N 2 1 376.541 3.295 50 0 GGAAMP CC(C)[NH+]1CCC(N2CC[N@H+](C/C=C/c3ccc(F)cc3)C[C@H]2CCO)CC1 ZINC000105266857 528993004 /nfs/dbraw/zinc/99/30/04/528993004.db2.gz SEUOSQLNDFAJHS-OSFWOZTASA-N 2 1 389.559 3.080 50 0 GGAAMP CC(C)[NH+]1CCC(N2CC[N@@H+](C/C=C/c3ccc(F)cc3)C[C@H]2CCO)CC1 ZINC000105266857 528993009 /nfs/dbraw/zinc/99/30/09/528993009.db2.gz SEUOSQLNDFAJHS-OSFWOZTASA-N 2 1 389.559 3.080 50 0 GGAAMP O=C(NCCCSc1ccc(Cl)cc1)[C@@H]1CCC[N@@H+]1C1CC[NH2+]CC1 ZINC000215240441 565896238 /nfs/dbraw/zinc/89/62/38/565896238.db2.gz AZCJRAARIZPVAY-SFHVURJKSA-N 2 1 381.973 3.155 50 0 GGAAMP O=C(NCCCSc1ccc(Cl)cc1)[C@@H]1CCC[N@H+]1C1CC[NH2+]CC1 ZINC000215240441 565896239 /nfs/dbraw/zinc/89/62/39/565896239.db2.gz AZCJRAARIZPVAY-SFHVURJKSA-N 2 1 381.973 3.155 50 0 GGAAMP OCC[C@@H]1CN(Cc2cc(C[NH+]3CCCC3)cs2)CC[N@H+]1C1CCCC1 ZINC000019720488 570211367 /nfs/dbraw/zinc/21/13/67/570211367.db2.gz ZLHVEECLSRPUHX-HXUWFJFHSA-N 2 1 377.598 3.155 50 0 GGAAMP OCC[C@H]1CN(Cc2cc(C[NH+]3CCCC3)cs2)CC[N@H+]1C1CCCC1 ZINC000019720489 570211485 /nfs/dbraw/zinc/21/14/85/570211485.db2.gz ZLHVEECLSRPUHX-FQEVSTJZSA-N 2 1 377.598 3.155 50 0 GGAAMP Cc1ccc(C[NH+]2CCC3(CC2)CC[N@H+](C2CCOCC2)C[C@H]3CO)s1 ZINC000097294847 570241117 /nfs/dbraw/zinc/24/11/17/570241117.db2.gz NHUKUOFJOGTQBJ-SFHVURJKSA-N 2 1 378.582 3.132 50 0 GGAAMP Cc1n[nH]c(C)c1C[N@H+]1CCC2(CC[NH+](Cc3ccccc3)CC2)[C@@H](CO)C1 ZINC000097436968 570243861 /nfs/dbraw/zinc/24/38/61/570243861.db2.gz JBRBZLLNPHZZKV-OAQYLSRUSA-N 2 1 382.552 3.123 50 0 GGAAMP Cc1cccc(C[NH+]2CCC3(CC2)CC[N@@H+](Cc2cccc(O)c2)C[C@@H]3CO)n1 ZINC000097579008 570247004 /nfs/dbraw/zinc/24/70/04/570247004.db2.gz METSPAUXVLQAEF-OAQYLSRUSA-N 2 1 395.547 3.192 50 0 GGAAMP Cc1cccc(C[NH+]2CCC3(CC2)CC[N@@H+](Cc2cccc(O)c2)C[C@H]3CO)n1 ZINC000097579010 570247123 /nfs/dbraw/zinc/24/71/23/570247123.db2.gz METSPAUXVLQAEF-NRFANRHFSA-N 2 1 395.547 3.192 50 0 GGAAMP CC(C)[NH+]1CCC([N@H+]2CCC[C@H](C(=O)NCc3cccc4[nH]ccc43)C2)CC1 ZINC000020202653 570247521 /nfs/dbraw/zinc/24/75/21/570247521.db2.gz KBJBNRSDGRQODF-IBGZPJMESA-N 2 1 382.552 3.369 50 0 GGAAMP CCc1ccc(C[N@H+]2CCC3(CC[NH+](Cc4ccncc4)CC3)[C@H](CO)C2)o1 ZINC000097698865 570249718 /nfs/dbraw/zinc/24/97/18/570249718.db2.gz XXZOAXWRWHBQCL-FQEVSTJZSA-N 2 1 383.536 3.334 50 0 GGAAMP CSCCC[N@H+]1CCC2(CC[NH+](Cc3cccc(O)c3)CC2)[C@@H](CO)C1 ZINC000097742637 570252638 /nfs/dbraw/zinc/25/26/38/570252638.db2.gz VBYBDSJQACDUJS-LJQANCHMSA-N 2 1 378.582 3.042 50 0 GGAAMP C[NH+]1CCN(C(=O)CC[C@@H]2CCC[N@H+](Cc3cccc4cccnc43)C2)CC1 ZINC000020449762 570256288 /nfs/dbraw/zinc/25/62/88/570256288.db2.gz XRSBENWZTQCRQV-IBGZPJMESA-N 2 1 380.536 3.001 50 0 GGAAMP C[NH+]1CCN(C(=O)CC[C@@H]2CCC[N@@H+](Cc3cccc4cccnc43)C2)CC1 ZINC000020449762 570256292 /nfs/dbraw/zinc/25/62/92/570256292.db2.gz XRSBENWZTQCRQV-IBGZPJMESA-N 2 1 380.536 3.001 50 0 GGAAMP C[N@@H+](C[C@H](O)COc1ccccc1C[NH2+]CCc1ccncc1)C1CCCCC1 ZINC000023338601 570355430 /nfs/dbraw/zinc/35/54/30/570355430.db2.gz NTXLPTMUWSEERL-QHCPKHFHSA-N 2 1 397.563 3.418 50 0 GGAAMP COc1cccc(C[NH+]2CCN(C3CC[NH+](Cc4ccccc4)CC3)CC2)c1 ZINC000022135412 570538328 /nfs/dbraw/zinc/53/83/28/570538328.db2.gz SMTVXAWCXUWOBE-UHFFFAOYSA-N 2 1 379.548 3.477 50 0 GGAAMP C[NH+](C)CCCOc1cccc(C[N@H+]2CCC[C@@H](CCC(=O)NC3CC3)C2)c1 ZINC000039552054 570593577 /nfs/dbraw/zinc/59/35/77/570593577.db2.gz LMLNCEFVAGSUOW-IBGZPJMESA-N 2 1 387.568 3.288 50 0 GGAAMP COC[C@@]12CC[C@@H]([NH+]3CCOCC3)C[C@H]1CC[N@@H+](Cc1cc(C)c(C)o1)C2 ZINC000072148400 570872503 /nfs/dbraw/zinc/87/25/03/570872503.db2.gz QUZBDVWJLYAQHW-SJBKTWHCSA-N 2 1 376.541 3.236 50 0 GGAAMP CC(C)(C)OC(=O)N1CCC2(C[C@H]([NH+]3CCC([NH+]4CCCC4)CC3)CO2)CC1 ZINC000006747707 570939240 /nfs/dbraw/zinc/93/92/40/570939240.db2.gz HDNITZDLRASXTN-IBGZPJMESA-N 2 1 393.572 3.105 50 0 GGAAMP C[NH+]1CCN([C@H]2CC[N@@H+](Cc3cc4ccccc4s3)C[C@H]2CCCO)CC1 ZINC000091643883 571020781 /nfs/dbraw/zinc/02/07/81/571020781.db2.gz OJKFKRFUHZYLDF-CTNGQTDRSA-N 2 1 387.593 3.112 50 0 GGAAMP C[N@@H+](CCO)C[C@@H]1C[NH+](Cc2cccc3c4ccccc4sc32)C[C@@H]1CO ZINC000091656182 571023263 /nfs/dbraw/zinc/02/32/63/571023263.db2.gz HNKWDAHASYECOU-QZTJIDSGSA-N 2 1 384.545 3.019 50 0 GGAAMP C[NH+](CCO)C[C@@H]1C[N@H+](Cc2cccc3c4ccccc4sc32)C[C@@H]1CO ZINC000091656182 571023265 /nfs/dbraw/zinc/02/32/65/571023265.db2.gz HNKWDAHASYECOU-QZTJIDSGSA-N 2 1 384.545 3.019 50 0 GGAAMP C[NH+](CCO)C[C@@H]1C[N@@H+](Cc2cccc3c4ccccc4sc32)C[C@@H]1CO ZINC000091656182 571023268 /nfs/dbraw/zinc/02/32/68/571023268.db2.gz HNKWDAHASYECOU-QZTJIDSGSA-N 2 1 384.545 3.019 50 0 GGAAMP C[N@H+]1C[C@H](c2ccccc2)CC2(CC[NH+](Cc3ccc(C(N)=O)cc3)CC2)C1 ZINC000092037888 571041938 /nfs/dbraw/zinc/04/19/38/571041938.db2.gz PCHDNJIYHJBNKZ-JOCHJYFZSA-N 2 1 377.532 3.487 50 0 GGAAMP O=C(C[NH+]1CCCC1)N1CCC2(CC1)C[C@@H](c1ccccc1)C[N@H+](C1CC1)C2 ZINC000095366407 571058414 /nfs/dbraw/zinc/05/84/14/571058414.db2.gz DBWJLDBMYXFZHZ-OAQYLSRUSA-N 2 1 381.564 3.343 50 0 GGAAMP CCc1[nH+]ccn1CC(=O)N1CCC2(CC1)C[C@@H](c1ccccc1)C[N@H+](C)C2 ZINC000095379613 571066674 /nfs/dbraw/zinc/06/66/74/571066674.db2.gz ADAGPMHLPULVEM-HXUWFJFHSA-N 2 1 380.536 3.174 50 0 GGAAMP CCc1[nH+]ccn1CC(=O)N1CCC2(CC1)C[C@@H](c1ccccc1)C[N@@H+](C)C2 ZINC000095379613 571066677 /nfs/dbraw/zinc/06/66/77/571066677.db2.gz ADAGPMHLPULVEM-HXUWFJFHSA-N 2 1 380.536 3.174 50 0 GGAAMP Cc1[nH+]ccn1-c1ccccc1CNC(=O)[C@@H]1CCC[N@H+](Cc2ccco2)C1 ZINC000095391496 571073065 /nfs/dbraw/zinc/07/30/65/571073065.db2.gz XWRSRLYHFGPKLD-LJQANCHMSA-N 2 1 378.476 3.302 50 0 GGAAMP Cc1[nH+]ccn1-c1ccccc1CNC(=O)[C@@H]1CCC[N@@H+](Cc2ccco2)C1 ZINC000095391496 571073067 /nfs/dbraw/zinc/07/30/67/571073067.db2.gz XWRSRLYHFGPKLD-LJQANCHMSA-N 2 1 378.476 3.302 50 0 GGAAMP C[N@H+](Cc1ccccc1)C[C@H](O)COc1ccc(C[NH+]2CCC(F)CC2)cc1 ZINC000095517978 571084961 /nfs/dbraw/zinc/08/49/61/571084961.db2.gz QDJDNQMMDQZITL-QFIPXVFZSA-N 2 1 386.511 3.492 50 0 GGAAMP C[NH+]1CCN(C(=O)CC[C@@H]2CCC[N@H+](Cc3ccc4cc(F)ccc4n3)C2)CC1 ZINC000011664897 1399003106 /nfs/dbraw/zinc/00/31/06/1399003106.db2.gz PLYJYEIYSFQMSN-SFHVURJKSA-N 2 1 398.526 3.140 50 0 GGAAMP C[NH+]1CCN(C(=O)CC[C@@H]2CCC[N@@H+](Cc3ccc4cc(F)ccc4n3)C2)CC1 ZINC000011664897 1399003108 /nfs/dbraw/zinc/00/31/08/1399003108.db2.gz PLYJYEIYSFQMSN-SFHVURJKSA-N 2 1 398.526 3.140 50 0 GGAAMP CSc1ncc(C[N@H+]2CC[C@H](C3CC[NH+](Cc4cccnc4)CC3)C2)cn1 ZINC000011820854 1399013989 /nfs/dbraw/zinc/01/39/89/1399013989.db2.gz BMYLRMWZUYBKHL-FQEVSTJZSA-N 2 1 383.565 3.328 50 0 GGAAMP C[NH+]1CCC(C[N@@H+](CCc2ccccc2)Cc2cccc(OCCO)c2)CC1 ZINC000012026722 1399024559 /nfs/dbraw/zinc/02/45/59/1399024559.db2.gz AKBWHNIJXCAWKO-UHFFFAOYSA-N 2 1 382.548 3.444 50 0 GGAAMP CCc1ccc(C[N@H+]2CCC[C@@H](CCC(=O)N(C)C3CC[NH+](C)CC3)C2)o1 ZINC000012112011 1399030250 /nfs/dbraw/zinc/03/02/50/1399030250.db2.gz QJSIBTGBQYOQAE-SFHVURJKSA-N 2 1 375.557 3.387 50 0 GGAAMP CCOCCC[NH2+]Cc1cccc(OC[C@H](O)C[N@@H+](C)C2CCCCC2)c1 ZINC000012303879 1399037232 /nfs/dbraw/zinc/03/72/32/1399037232.db2.gz XFTCUWBRLDIJQX-OAQYLSRUSA-N 2 1 378.557 3.207 50 0 GGAAMP CCOCCC[NH2+]Cc1cccc(OC[C@@H](O)C[N@@H+](C)C2CCCCC2)c1 ZINC000012303877 1399037353 /nfs/dbraw/zinc/03/73/53/1399037353.db2.gz XFTCUWBRLDIJQX-NRFANRHFSA-N 2 1 378.557 3.207 50 0 GGAAMP C[N@@H+](C[C@@H](O)COc1cccc(C[NH+]2CCSCC2)c1)C1CCCCC1 ZINC000012581370 1399048173 /nfs/dbraw/zinc/04/81/73/1399048173.db2.gz VUPQGZPTENDVQR-HXUWFJFHSA-N 2 1 378.582 3.240 50 0 GGAAMP COC1CC[NH+](Cc2cccc(OC[C@H](O)C[N@@H+](C)C3CCCCC3)c2)CC1 ZINC000012713368 1399055432 /nfs/dbraw/zinc/05/54/32/1399055432.db2.gz RJMLYXDNXPNUDV-OAQYLSRUSA-N 2 1 390.568 3.302 50 0 GGAAMP Cc1ncc2c(c1-c1noc([C@H]3CCC[N@@H+](Cc4ccco4)C3)n1)CC[NH2+]C2 ZINC000019301117 1399329302 /nfs/dbraw/zinc/32/93/02/1399329302.db2.gz BNGWONYIOPJRRB-HNNXBMFYSA-N 2 1 379.464 3.058 50 0 GGAAMP CC(C)(CO)CN(CC[NH+]1CCCCC1)C[C@H]1CCC[N@H+](C2CCCC2)C1 ZINC000020455772 1399347163 /nfs/dbraw/zinc/34/71/63/1399347163.db2.gz HBQFSXBFAGXEPK-OAQYLSRUSA-N 2 1 379.633 3.447 50 0 GGAAMP C[NH+](CCC[N@H+](C)CCCn1cnc2ccccc2c1=O)Cc1ccccc1 ZINC000020762416 1399352853 /nfs/dbraw/zinc/35/28/53/1399352853.db2.gz WBGNMKGEIHGTAE-UHFFFAOYSA-N 2 1 378.520 3.241 50 0 biogenic GGAAMP C[NH+](CCC[N@@H+](C)CCCn1cnc2ccccc2c1=O)Cc1ccccc1 ZINC000020762416 1399352860 /nfs/dbraw/zinc/35/28/60/1399352860.db2.gz WBGNMKGEIHGTAE-UHFFFAOYSA-N 2 1 378.520 3.241 50 0 biogenic GGAAMP C[NH+](CCCn1cnc2ccccc2c1=O)CCC[N@H+](C)Cc1ccccc1 ZINC000020762416 1399352868 /nfs/dbraw/zinc/35/28/68/1399352868.db2.gz WBGNMKGEIHGTAE-UHFFFAOYSA-N 2 1 378.520 3.241 50 0 biogenic GGAAMP C[NH+](CCCn1cnc2ccccc2c1=O)CCC[N@@H+](C)Cc1ccccc1 ZINC000020762416 1399352870 /nfs/dbraw/zinc/35/28/70/1399352870.db2.gz WBGNMKGEIHGTAE-UHFFFAOYSA-N 2 1 378.520 3.241 50 0 biogenic GGAAMP CCN(CC1CC[NH+](C2CC[NH+](C)CC2)CC1)C(=O)c1cc2ccccc2[nH]1 ZINC000020906222 1399356646 /nfs/dbraw/zinc/35/66/46/1399356646.db2.gz QAZXQNJDCXKHRN-UHFFFAOYSA-N 2 1 382.552 3.436 50 0 GGAAMP Cc1[nH+]ccn1CCC[NH2+]C1CCN(c2ccc(N3C(=O)CC[C@H]3C)cc2)CC1 ZINC000020908277 1399357099 /nfs/dbraw/zinc/35/70/99/1399357099.db2.gz BFIAEHMYYQIRRF-GOSISDBHSA-N 2 1 395.551 3.356 50 0 GGAAMP Cn1cc[nH+]c1CCC[N@H+](C)C1CCN(c2ccc(-c3cc[nH]n3)cc2)CC1 ZINC000104857467 1410981794 /nfs/dbraw/zinc/98/17/94/1410981794.db2.gz QRTSALXPUARBST-UHFFFAOYSA-N 2 1 378.524 3.344 50 0 GGAAMP Cn1cc[nH+]c1CCC[N@@H+](C)C1CCN(c2ccc(-c3cc[nH]n3)cc2)CC1 ZINC000104857467 1410981805 /nfs/dbraw/zinc/98/18/05/1410981805.db2.gz QRTSALXPUARBST-UHFFFAOYSA-N 2 1 378.524 3.344 50 0 GGAAMP